File: 3aba_final.cif

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data_3ABA
# 
_entry.id   3ABA 
# 
loop_
_audit_conform.dict_name 
_audit_conform.dict_version 
_audit_conform.dict_location 
mmcif_pdbx.dic     5.404 ?                                           
dssp-extension.dic 1.1.1 https://pdb-redo.eu/dssp/dssp-extension.dic 
# 
loop_
_entity.id 
_entity.type 
_entity.pdbx_description 
1 polymer     ? 
2 non-polymer ? 
3 non-polymer ? 
4 non-polymer ? 
5 water       ? 
6 non-polymer ? 
7 non-polymer ? 
# 
_symmetry.entry_id               3ABA 
_symmetry.space_group_name_H-M   'P 41 21 2' 
_symmetry.Int_Tables_number      92 
# 
_struct_conn_type.id   covale 
# 
loop_
_software.pdbx_ordinal 
_software.classification 
_software.name 
_software.version 
_software.date 
_software.description 
_software.contact_author 
_software.contact_author_email 
1 refinement         refmac '5.8.0431 (refmacat 0.4.123)' 2025-04-08           
'(un)restrained refinement or idealisation of macromolecular structures' 'Garib N. Murshudov' garib@mrc-lmb.cam.ac.uk 
2 'model annotation' dssp   4.5.3                         2025-05-29T09:16:25Z 
?                                                                        ?                    ?                       
# 
_refine.details                           'Hydrogens have been added in their riding positions' 
_refine.B_iso_mean                        20.242 
_refine.aniso_B[1][1]                     0.225 
_refine.aniso_B[2][2]                     0.225 
_refine.aniso_B[3][3]                     -0.451 
_refine.aniso_B[1][2]                     0.000 
_refine.aniso_B[1][3]                     -0.000 
_refine.aniso_B[2][3]                     -0.000 
_refine.solvent_model_details             'MASK BULK SOLVENT' 
_refine.pdbx_solvent_vdw_probe_radii      1.200 
_refine.pdbx_solvent_ion_probe_radii      0.900 
_refine.pdbx_solvent_shrinkage_radii      0.900 
_refine.pdbx_ls_cross_valid_method        THROUGHOUT 
_refine.pdbx_R_Free_selection_details     RANDOM 
_refine.ls_d_res_high                     1.801 
_refine.ls_d_res_low                      39.777 
_refine.ls_number_reflns_R_work           55867 
_refine.ls_number_reflns_R_free            2980 
_refine.ls_number_reflns_obs              58847 
_refine.ls_R_factor_R_work                0.2601 
_refine.ls_R_factor_R_free                0.2920 
_refine.ls_R_factor_all                   0.262 
_refine.ls_wR_factor_R_work               0.242 
_refine.ls_wR_factor_R_free               0.271 
_refine.ls_percent_reflns_obs             98.160 
_refine.ls_percent_reflns_R_free          5.064 
_refine.correlation_coeff_Fo_to_Fc        0.928 
_refine.correlation_coeff_Fo_to_Fc_free   0.909 
_refine.pdbx_overall_ESU_R                0.131 
_refine.pdbx_overall_ESU_R_Free           0.129 
_refine.overall_SU_ML                     0.094 
_refine.overall_SU_B                      6.399 
_refine.pdbx_average_fsc_overall              ? 
_refine.pdbx_average_fsc_work             0.9442 
_refine.pdbx_average_fsc_free             0.9359 
_refine.entry_id                          3ABA  
_refine.pdbx_refine_id                    'X-RAY DIFFRACTION' 
# 
_entity_poly.entity_id                  1 
_entity_poly.type                       polypeptide(L) 
_entity_poly.pdbx_strand_id             A 
_entity_poly.pdbx_seq_one_letter_code   
;MPEPTADAPTVPKARSCPFLPPDGIADIRAAAPVTRATFTSGHEAWLVTGYEEVRALLRDSSFSVQVPHALHTQDGVVTQKPGRGSLLWQDEPEHTSDRKLLAKEFTVRRMQALRPNIQRIVDEHLDAIEARGGPVDLVKTFANAVPSMVISDLFGVPVERRAEFQDIAEAMMRVDQDAAATEAAGMRLGGLLYQLVQERRANPGDDLISALITTEDPDGVVDDMFLMNAAGTLLIAAHDTTACMIGLGTALLLDSPDQLALLREDPSLVGNAVEELLRYLTIGQFGGERVATRDVELGGVRIAKGEQVVAHVLAADFDPAFVEEPERFDITRRPAPHLAFGFGAHQCIGQQLARIELQIVFETLFRRLPGLRLAKPVEELRFRHDMVFYGVHELPVTWHHHH
;
# 
_cell.entry_id      3ABA   
_cell.length_a      91.368 
_cell.length_b      91.368 
_cell.length_c      151.239 
_cell.angle_alpha       90 
_cell.angle_beta        90 
_cell.angle_gamma       90 
# 
_ccp4_reflns_twin.number_of_domains   1 
# 
_ccp4_refine_tls.details   'U values: with tls added' 
# 
_ccp4_refine_ls.jelly_body   no 
# 
_ccp4_form_factor.scat_method        'Sum of Gaussians' 
_ccp4_form_factor.scat_data_source   X-ray 
# 
loop_
_atom_type.symbol 
_atom_type.pdbx_scat_Z 
_atom_type.pdbx_N_electrons 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
N   7  7 12.2220  0.0057 3.1346  9.8933 2.0141 28.9975 1.1672  0.5826 -11.5379 
C   6  6  2.3103 20.8439 1.0201 10.2075 1.5888  0.5687 0.8651 51.6512   0.2156 
O   8  8  3.0487 13.2771 2.2870  5.7011 1.5464  0.3239 0.8671 32.9089   0.2508 
H   1  1  0.4930 10.5109 0.3229 26.1257 0.1402  3.1424 0.0408 57.7997   0.0030 
S  16 16  6.9054  1.4679 5.2035 22.2151 1.4379  0.2536 1.5863 56.1720   1.0555 
FE 26 26 11.7738  4.7611 7.3600  0.3072 3.5235 15.3535 2.3054 76.8805   1.2657 
# 
loop_
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.d_res_low 
_refine_ls_shell.d_res_high 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.R_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.pdbx_refine_id 
20 39.777 7.901  826  97.4576  765 0.217 0.217  40 0.211 0.259 0.977 0.984 'X-RAY DIFFRACTION' 
20  7.901 5.643 1335 100.0000 1252 0.208 0.211  83 0.252 0.231 0.975 0.965 'X-RAY DIFFRACTION' 
20  5.643 4.623 1669 100.0000 1596 0.197 0.199  73 0.253 0.217 0.983 0.978 'X-RAY DIFFRACTION' 
20  4.623 4.010 1947 100.0000 1843 0.172 0.174 104 0.207 0.189 0.985 0.980 'X-RAY DIFFRACTION' 
20  4.010 3.591 2181  99.2205 2057 0.216 0.217 107 0.233 0.217 0.975 0.968 'X-RAY DIFFRACTION' 
20  3.591 3.280 2396  99.9165 2266 0.245 0.247 128 0.279 0.245 0.966 0.956 'X-RAY DIFFRACTION' 
20  3.280 3.038 2590 100.0000 2452 0.275 0.278 138 0.322 0.264 0.951 0.938 'X-RAY DIFFRACTION' 
20  3.038 2.843 2761 100.0000 2632 0.280 0.281 129 0.306 0.263 0.950 0.931 'X-RAY DIFFRACTION' 
20  2.843 2.681 2923  99.9658 2782 0.268 0.271 140 0.322 0.246 0.954 0.935 'X-RAY DIFFRACTION' 
20  2.681 2.544 3095 100.0000 2937 0.253 0.255 158 0.297 0.225 0.961 0.953 'X-RAY DIFFRACTION' 
20  2.544 2.426 3241  99.9691 3075 0.252 0.253 165 0.279 0.222 0.963 0.953 'X-RAY DIFFRACTION' 
20  2.426 2.323 3374  99.9407 3211 0.246 0.248 161 0.303 0.216 0.963 0.948 'X-RAY DIFFRACTION' 
20  2.323 2.232 3517  94.3418 3143 0.396 0.396 175 0.384 0.332 0.888 0.893 'X-RAY DIFFRACTION' 
20  2.232 2.151 3664  93.2860 3247 0.345 0.346 171 0.361 0.273 0.931 0.925 'X-RAY DIFFRACTION' 
20  2.151 2.079 3755 100.0000 3574 0.265 0.267 181 0.304 0.229 0.959 0.947 'X-RAY DIFFRACTION' 
20  2.079 2.013 3908 100.0000 3713 0.276 0.277 195 0.302 0.239 0.954 0.943 'X-RAY DIFFRACTION' 
20  2.013 1.953 4006  99.9251 3808 0.283 0.284 195 0.312 0.240 0.953 0.945 'X-RAY DIFFRACTION' 
20  1.953 1.898 4126  90.0388 3523 0.511 0.510 192 0.490 0.443 0.818 0.830 'X-RAY DIFFRACTION' 
20  1.898 1.848 4260  96.1033 3873 0.342 0.344 221 0.380 0.278 0.930 0.917 'X-RAY DIFFRACTION' 
20  1.848 1.801 4349  99.8390 4118 0.260 0.261 224 0.287 0.221 0.957 0.951 'X-RAY DIFFRACTION' 
# 
loop_
_refine_ls_restr.type 
_refine_ls_restr.number 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.pdbx_refine_id 
r_bond_refined_d               3280  0.014  0.017 'X-RAY DIFFRACTION' 
r_bond_other_d                 3094  0.001  0.016 'X-RAY DIFFRACTION' 
r_angle_refined_deg            4461  1.376  1.822 'X-RAY DIFFRACTION' 
r_angle_other_deg              7108  0.525  1.561 'X-RAY DIFFRACTION' 
r_dihedral_angle_1_deg          428 13.501  5.374 'X-RAY DIFFRACTION' 
r_dihedral_angle_2_deg           20  9.019  5.000 'X-RAY DIFFRACTION' 
r_dihedral_angle_other_2_deg      2  1.641  5.000 'X-RAY DIFFRACTION' 
r_dihedral_angle_3_deg          508 14.674 10.000 'X-RAY DIFFRACTION' 
r_dihedral_angle_6_deg          151 16.102 10.000 'X-RAY DIFFRACTION' 
r_chiral_restr                  502  0.068  0.200 'X-RAY DIFFRACTION' 
r_gen_planes_refined           3907  0.007  0.020 'X-RAY DIFFRACTION' 
r_gen_planes_other              749  0.001  0.020 'X-RAY DIFFRACTION' 
r_nbd_refined                   653  0.221  0.200 'X-RAY DIFFRACTION' 
r_symmetry_nbd_other           2762  0.184  0.200 'X-RAY DIFFRACTION' 
r_nbtor_refined                1596  0.176  0.200 'X-RAY DIFFRACTION' 
r_symmetry_nbtor_other         1777  0.074  0.200 'X-RAY DIFFRACTION' 
r_xyhbond_nbd_refined            48  0.110  0.200 'X-RAY DIFFRACTION' 
r_symmetry_nbd_refined            8  0.192  0.200 'X-RAY DIFFRACTION' 
r_nbd_other                      49  0.202  0.200 'X-RAY DIFFRACTION' 
r_symmetry_xyhbond_nbd_refined    3  0.065  0.200 'X-RAY DIFFRACTION' 
r_mcbond_it                    1587  0.829  1.905 'X-RAY DIFFRACTION' 
r_mcbond_other                 1587  0.829  1.905 'X-RAY DIFFRACTION' 
r_mcangle_it                   1982  1.249  3.424 'X-RAY DIFFRACTION' 
r_mcangle_other                1983  1.249  3.423 'X-RAY DIFFRACTION' 
r_scbond_it                    1693  1.336  2.153 'X-RAY DIFFRACTION' 
r_scbond_other                 1694  1.336  2.154 'X-RAY DIFFRACTION' 
r_scangle_it                   2479  2.078  3.870 'X-RAY DIFFRACTION' 
r_scangle_other                2480  2.077  3.871 'X-RAY DIFFRACTION' 
r_lrange_it                    3468  2.663 17.973 'X-RAY DIFFRACTION' 
r_lrange_other                 3468  2.664 17.969 'X-RAY DIFFRACTION' 
# 
_pdbx_refine_tls.id         1      
_pdbx_refine_tls.details    .      
_pdbx_refine_tls.method     refined 
_pdbx_refine_tls.origin_x   5.3840 
_pdbx_refine_tls.origin_y   38.7390 
_pdbx_refine_tls.origin_z   16.9590 
_pdbx_refine_tls.T[1][1]    0.0122 
_pdbx_refine_tls.T[2][2]    0.0373 
_pdbx_refine_tls.T[3][3]    0.0523 
_pdbx_refine_tls.T[1][2]    -0.0102 
_pdbx_refine_tls.T[1][3]    0.0118 
_pdbx_refine_tls.T[2][3]    -0.0263 
_pdbx_refine_tls.L[1][1]    0.5399 
_pdbx_refine_tls.L[2][2]    0.7470 
_pdbx_refine_tls.L[3][3]    0.9182 
_pdbx_refine_tls.L[1][2]    -0.2146 
_pdbx_refine_tls.L[1][3]    -0.2288 
_pdbx_refine_tls.L[2][3]    0.2187 
_pdbx_refine_tls.S[1][1]    -0.0419 
_pdbx_refine_tls.S[2][2]    -0.0557 
_pdbx_refine_tls.S[3][3]    0.0976 
_pdbx_refine_tls.S[1][2]    0.0039 
_pdbx_refine_tls.S[1][3]    -0.0234 
_pdbx_refine_tls.S[2][3]    0.1566 
_pdbx_refine_tls.S[2][1]    0.0707 
_pdbx_refine_tls.S[3][1]    0.0213 
_pdbx_refine_tls.S[3][2]    -0.1369 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1   1 MET n 
1   2 PRO n 
1   3 GLU n 
1   4 PRO n 
1   5 THR n 
1   6 ALA n 
1   7 ASP n 
1   8 ALA n 
1   9 PRO n 
1  10 THR n 
1  11 VAL n 
1  12 PRO n 
1  13 LYS n 
1  14 ALA n 
1  15 ARG n 
1  16 SER n 
1  17 CYS n 
1  18 PRO n 
1  19 PHE n 
1  20 LEU n 
1  21 PRO n 
1  22 PRO n 
1  23 ASP n 
1  24 GLY n 
1  25 ILE n 
1  26 ALA n 
1  27 ASP n 
1  28 ILE n 
1  29 ARG n 
1  30 ALA n 
1  31 ALA n 
1  32 ALA n 
1  33 PRO n 
1  34 VAL n 
1  35 THR n 
1  36 ARG n 
1  37 ALA n 
1  38 THR n 
1  39 PHE n 
1  40 THR n 
1  41 SER n 
1  42 GLY n 
1  43 HIS n 
1  44 GLU n 
1  45 ALA n 
1  46 TRP n 
1  47 LEU n 
1  48 VAL n 
1  49 THR n 
1  50 GLY n 
1  51 TYR n 
1  52 GLU n 
1  53 GLU n 
1  54 VAL n 
1  55 ARG n 
1  56 ALA n 
1  57 LEU n 
1  58 LEU n 
1  59 ARG n 
1  60 ASP n 
1  61 SER n 
1  62 SER n 
1  63 PHE n 
1  64 SER n 
1  65 VAL n 
1  66 GLN n 
1  67 VAL n 
1  68 PRO n 
1  69 HIS n 
1  70 ALA n 
1  71 LEU n 
1  72 HIS n 
1  73 THR n 
1  74 GLN n 
1  75 ASP n 
1  76 GLY n 
1  77 VAL n 
1  78 VAL n 
1  79 THR n 
1  80 GLN n 
1  81 LYS n 
1  82 PRO n 
1  83 GLY n 
1  84 ARG n 
1  85 GLY n 
1  86 SER n 
1  87 LEU n 
1  88 LEU n 
1  89 TRP n 
1  90 GLN n 
1  91 ASP n 
1  92 GLU n 
1  93 PRO n 
1  94 GLU n 
1  95 HIS n 
1  96 THR n 
1  97 SER n 
1  98 ASP n 
1  99 ARG n 
1 100 LYS n 
1 101 LEU n 
1 102 LEU n 
1 103 ALA n 
1 104 LYS n 
1 105 GLU n 
1 106 PHE n 
1 107 THR n 
1 108 VAL n 
1 109 ARG n 
1 110 ARG n 
1 111 MET n 
1 112 GLN n 
1 113 ALA n 
1 114 LEU n 
1 115 ARG n 
1 116 PRO n 
1 117 ASN n 
1 118 ILE n 
1 119 GLN n 
1 120 ARG n 
1 121 ILE n 
1 122 VAL n 
1 123 ASP n 
1 124 GLU n 
1 125 HIS n 
1 126 LEU n 
1 127 ASP n 
1 128 ALA n 
1 129 ILE n 
1 130 GLU n 
1 131 ALA n 
1 132 ARG n 
1 133 GLY n 
1 134 GLY n 
1 135 PRO n 
1 136 VAL n 
1 137 ASP n 
1 138 LEU n 
1 139 VAL n 
1 140 LYS n 
1 141 THR n 
1 142 PHE n 
1 143 ALA n 
1 144 ASN n 
1 145 ALA n 
1 146 VAL n 
1 147 PRO n 
1 148 SER n 
1 149 MET n 
1 150 VAL n 
1 151 ILE n 
1 152 SER n 
1 153 ASP n 
1 154 LEU n 
1 155 PHE n 
1 156 GLY n 
1 157 VAL n 
1 158 PRO n 
1 159 VAL n 
1 160 GLU n 
1 161 ARG n 
1 162 ARG n 
1 163 ALA n 
1 164 GLU n 
1 165 PHE n 
1 166 GLN n 
1 167 ASP n 
1 168 ILE n 
1 169 ALA n 
1 170 GLU n 
1 171 ALA n 
1 172 MET n 
1 173 MET n 
1 174 ARG n 
1 175 VAL n 
1 176 ASP n 
1 177 GLN n 
1 178 ASP n 
1 179 ALA n 
1 180 ALA n 
1 181 ALA n 
1 182 THR n 
1 183 GLU n 
1 184 ALA n 
1 185 ALA n 
1 186 GLY n 
1 187 MET n 
1 188 ARG n 
1 189 LEU n 
1 190 GLY n 
1 191 GLY n 
1 192 LEU n 
1 193 LEU n 
1 194 TYR n 
1 195 GLN n 
1 196 LEU n 
1 197 VAL n 
1 198 GLN n 
1 199 GLU n 
1 200 ARG n 
1 201 ARG n 
1 202 ALA n 
1 203 ASN n 
1 204 PRO n 
1 205 GLY n 
1 206 ASP n 
1 207 ASP n 
1 208 LEU n 
1 209 ILE n 
1 210 SER n 
1 211 ALA n 
1 212 LEU n 
1 213 ILE n 
1 214 THR n 
1 215 THR n 
1 216 GLU n 
1 217 ASP n 
1 218 PRO n 
1 219 ASP n 
1 220 GLY n 
1 221 VAL n 
1 222 VAL n 
1 223 ASP n 
1 224 ASP n 
1 225 MET n 
1 226 PHE n 
1 227 LEU n 
1 228 MET n 
1 229 ASN n 
1 230 ALA n 
1 231 ALA n 
1 232 GLY n 
1 233 THR n 
1 234 LEU n 
1 235 LEU n 
1 236 ILE n 
1 237 ALA n 
1 238 ALA n 
1 239 HIS n 
1 240 ASP n 
1 241 THR n 
1 242 THR n 
1 243 ALA n 
1 244 CYS n 
1 245 MET n 
1 246 ILE n 
1 247 GLY n 
1 248 LEU n 
1 249 GLY n 
1 250 THR n 
1 251 ALA n 
1 252 LEU n 
1 253 LEU n 
1 254 LEU n 
1 255 ASP n 
1 256 SER n 
1 257 PRO n 
1 258 ASP n 
1 259 GLN n 
1 260 LEU n 
1 261 ALA n 
1 262 LEU n 
1 263 LEU n 
1 264 ARG n 
1 265 GLU n 
1 266 ASP n 
1 267 PRO n 
1 268 SER n 
1 269 LEU n 
1 270 VAL n 
1 271 GLY n 
1 272 ASN n 
1 273 ALA n 
1 274 VAL n 
1 275 GLU n 
1 276 GLU n 
1 277 LEU n 
1 278 LEU n 
1 279 ARG n 
1 280 TYR n 
1 281 LEU n 
1 282 THR n 
1 283 ILE n 
1 284 GLY n 
1 285 GLN n 
1 286 PHE n 
1 287 GLY n 
1 288 GLY n 
1 289 GLU n 
1 290 ARG n 
1 291 VAL n 
1 292 ALA n 
1 293 THR n 
1 294 ARG n 
1 295 ASP n 
1 296 VAL n 
1 297 GLU n 
1 298 LEU n 
1 299 GLY n 
1 300 GLY n 
1 301 VAL n 
1 302 ARG n 
1 303 ILE n 
1 304 ALA n 
1 305 LYS n 
1 306 GLY n 
1 307 GLU n 
1 308 GLN n 
1 309 VAL n 
1 310 VAL n 
1 311 ALA n 
1 312 HIS n 
1 313 VAL n 
1 314 LEU n 
1 315 ALA n 
1 316 ALA n 
1 317 ASP n 
1 318 PHE n 
1 319 ASP n 
1 320 PRO n 
1 321 ALA n 
1 322 PHE n 
1 323 VAL n 
1 324 GLU n 
1 325 GLU n 
1 326 PRO n 
1 327 GLU n 
1 328 ARG n 
1 329 PHE n 
1 330 ASP n 
1 331 ILE n 
1 332 THR n 
1 333 ARG n 
1 334 ARG n 
1 335 PRO n 
1 336 ALA n 
1 337 PRO n 
1 338 HIS n 
1 339 LEU n 
1 340 ALA n 
1 341 PHE n 
1 342 GLY n 
1 343 PHE n 
1 344 GLY n 
1 345 ALA n 
1 346 HIS n 
1 347 GLN n 
1 348 CYS n 
1 349 ILE n 
1 350 GLY n 
1 351 GLN n 
1 352 GLN n 
1 353 LEU n 
1 354 ALA n 
1 355 ARG n 
1 356 ILE n 
1 357 GLU n 
1 358 LEU n 
1 359 GLN n 
1 360 ILE n 
1 361 VAL n 
1 362 PHE n 
1 363 GLU n 
1 364 THR n 
1 365 LEU n 
1 366 PHE n 
1 367 ARG n 
1 368 ARG n 
1 369 LEU n 
1 370 PRO n 
1 371 GLY n 
1 372 LEU n 
1 373 ARG n 
1 374 LEU n 
1 375 ALA n 
1 376 LYS n 
1 377 PRO n 
1 378 VAL n 
1 379 GLU n 
1 380 GLU n 
1 381 LEU n 
1 382 ARG n 
1 383 PHE n 
1 384 ARG n 
1 385 HIS n 
1 386 ASP n 
1 387 MET n 
1 388 VAL n 
1 389 PHE n 
1 390 TYR n 
1 391 GLY n 
1 392 VAL n 
1 393 HIS n 
1 394 GLU n 
1 395 LEU n 
1 396 PRO n 
1 397 VAL n 
1 398 THR n 
1 399 TRP n 
1 400 HIS n 
1 401 HIS n 
1 402 HIS n 
1 403 HIS n 
# 
_pdbx_refine_tls_group.id                 1 
_pdbx_refine_tls_group.refine_tls_id      1 
_pdbx_refine_tls_group.pdbx_refine_id     'X-RAY DIFFRACTION' 
_pdbx_refine_tls_group.beg_auth_asym_id   A 
_pdbx_refine_tls_group.beg_auth_seq_id    1 
_pdbx_refine_tls_group.end_auth_asym_id   A 
_pdbx_refine_tls_group.end_auth_seq_id    403 
_pdbx_refine_tls_group.selection          ALL 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_atom_id 
_atom_site.auth_comp_id 
_atom_site.auth_seq_id 
_atom_site.auth_asym_id 
_atom_site.pdbx_PDB_model_num 
_atom_site.pdbx_tls_group_id 
ATOM   1    N  N   . ASP A 1   7 ? -15.382 27.529 40.284 1 54.6245 ? N   ASP 7    A 1 1 
ATOM   2    C  CA  . ASP A 1   7 ? -14.301 28.052 39.455 1 53.9166 ? CA  ASP 7    A 1 1 
ATOM   3    C  CB  . ASP A 1   7 ? -12.904 27.823 40.087 1 55.5534 ? CB  ASP 7    A 1 1 
ATOM   4    C  CG  . ASP A 1   7 ? -12.294 29.068 40.726 1  56.684 ? CG  ASP 7    A 1 1 
ATOM   5    O  OD1 . ASP A 1   7 ? -12.788 29.492 41.804 1 56.3629 ? OD1 ASP 7    A 1 1 
ATOM   6    O  OD2 . ASP A 1   7 ?  -11.33 29.639 40.128 1 58.0085 ? OD2 ASP 7    A 1 1 
ATOM   7    C  C   . ASP A 1   7 ? -14.319 27.442 38.058 1 51.0789 ? C   ASP 7    A 1 1 
ATOM   8    O  O   . ASP A 1   7 ? -14.397 26.227 37.902 1 50.5299 ? O   ASP 7    A 1 1 
ATOM   9    N  N   . ALA A 1   8 ? -14.218 28.322 37.054 1 48.5618 ? N   ALA 8    A 1 1 
ATOM   10   C  CA  . ALA A 1   8 ? -14.115 27.921 35.664 1 45.6123 ? CA  ALA 8    A 1 1 
ATOM   11   C  CB  . ALA A 1   8 ? -14.269 29.128 34.758 1 44.3748 ? CB  ALA 8    A 1 1 
ATOM   12   C  C   . ALA A 1   8 ? -12.767 27.245 35.437 1 43.4602 ? C   ALA 8    A 1 1 
ATOM   13   O  O   . ALA A 1   8 ? -11.765 27.667 36.012 1 42.6973 ? O   ALA 8    A 1 1 
ATOM   14   N  N   . PRO A 1   9 ? -12.695 26.203  34.58 1 41.6282 ? N   PRO 9    A 1 1 
ATOM   15   C  CA  . PRO A 1   9 ? -11.455 25.457 34.395 1 40.6801 ? CA  PRO 9    A 1 1 
ATOM   16   C  CB  . PRO A 1   9 ? -11.788 24.468 33.269 1 41.0365 ? CB  PRO 9    A 1 1 
ATOM   17   C  CG  . PRO A 1   9 ? -13.311  24.35  33.31 1 42.4114 ? CG  PRO 9    A 1 1 
ATOM   18   C  CD  . PRO A 1   9 ? -13.799 25.714 33.733 1 42.7384 ? CD  PRO 9    A 1 1 
ATOM   19   C  C   . PRO A 1   9 ? -10.283 26.344 33.981 1 38.3974 ? C   PRO 9    A 1 1 
ATOM   20   O  O   . PRO A 1   9 ? -10.462 27.304 33.239 1 37.1518 ? O   PRO 9    A 1 1 
ATOM   21   N  N   . THR A 1  10 ?  -9.085  26.01 34.459 1  37.577 ? N   THR 10   A 1 1 
ATOM   22   C  CA  . THR A 1  10 ?  -7.897 26.768 34.095 1 36.3087 ? CA  THR 10   A 1 1 
ATOM   23   C  CB  . THR A 1  10 ?  -6.709 26.335 34.982 1 37.1193 ? CB  THR 10   A 1 1 
ATOM   24   O  OG1 . THR A 1  10 ?  -6.431 24.938 34.796 1 37.7354 ? OG1 THR 10   A 1 1 
ATOM   25   C  CG2 . THR A 1  10 ?   -6.97 26.586 36.449 1 38.0937 ? CG2 THR 10   A 1 1 
ATOM   26   C  C   . THR A 1  10 ?  -7.641 26.594 32.595 1 35.4073 ? C   THR 10   A 1 1 
ATOM   27   O  O   . THR A 1  10 ?  -7.869  25.52 32.041 1 34.2443 ? O   THR 10   A 1 1 
ATOM   28   N  N   . VAL A 1  11 ?  -7.156 27.651  31.93 1 33.6385 ? N   VAL 11   A 1 1 
ATOM   29   C  CA  . VAL A 1  11 ?  -6.805 27.547 30.526 1 33.0011 ? CA  VAL 11   A 1 1 
ATOM   30   C  CB  . VAL A 1  11 ?  -6.375 28.936 29.951 1 31.4845 ? CB  VAL 11   A 1 1 
ATOM   31   C  CG1 . VAL A 1  11 ?  -5.816  28.84  28.51 1 31.4632 ? CG1 VAL 11   A 1 1 
ATOM   32   C  CG2 . VAL A 1  11 ?  -7.534 29.929 30.046 1 31.5353 ? CG2 VAL 11   A 1 1 
ATOM   33   C  C   . VAL A 1  11 ?  -5.696 26.507  30.39 1 33.3622 ? C   VAL 11   A 1 1 
ATOM   34   O  O   . VAL A 1  11 ?  -4.717 26.573 31.132 1 32.8075 ? O   VAL 11   A 1 1 
ATOM   35   N  N   . PRO A 1  12 ?  -5.804 25.529 29.455 1 33.4449 ? N   PRO 12   A 1 1 
ATOM   36   C  CA  . PRO A 1  12 ?  -4.711  24.59 29.215 1 33.8317 ? CA  PRO 12   A 1 1 
ATOM   37   C  CB  . PRO A 1  12 ?  -5.269 23.619 28.153 1 33.5523 ? CB  PRO 12   A 1 1 
ATOM   38   C  CG  . PRO A 1  12 ?  -6.776 23.819 28.196 1 34.2324 ? CG  PRO 12   A 1 1 
ATOM   39   C  CD  . PRO A 1  12 ?  -6.987 25.253 28.624 1 33.6571 ? CD  PRO 12   A 1 1 
ATOM   40   C  C   . PRO A 1  12 ?  -3.424 25.268  28.75 1 33.2248 ? C   PRO 12   A 1 1 
ATOM   41   O  O   . PRO A 1  12 ?  -3.449 26.135 27.877 1  32.264 ? O   PRO 12   A 1 1 
ATOM   42   N  N   . LYS A 1  13 ?  -2.304 24.846 29.348 1 35.2688 ? N   LYS 13   A 1 1 
ATOM   43   C  CA  . LYS A 1  13 ?  -0.995  25.41 29.069 1 37.0362 ? CA  LYS 13   A 1 1 
ATOM   44   C  CB  . LYS A 1  13 ?  -0.426 26.079  30.32 1 40.3543 ? CB  LYS 13   A 1 1 
ATOM   45   C  CG  . LYS A 1  13 ?  -1.153 27.355 30.725 1 44.8173 ? CG  LYS 13   A 1 1 
ATOM   46   C  CD  . LYS A 1  13 ?  -0.826 27.765 32.175 1  48.494 ? CD  LYS 13   A 1 1 
ATOM   47   C  CE  . LYS A 1  13 ?   0.661  27.96 32.374 1 51.4338 ? CE  LYS 13   A 1 1 
ATOM   48   N  NZ  . LYS A 1  13 ?    0.99 28.196 33.799 1  55.052 ? NZ  LYS 13   A 1 1 
ATOM   49   C  C   . LYS A 1  13 ?   0.024 24.379 28.598 1 35.0324 ? C   LYS 13   A 1 1 
ATOM   50   O  O   . LYS A 1  13 ?   0.922 24.717 27.833 1 34.1887 ? O   LYS 13   A 1 1 
ATOM   51   N  N   . ALA A 1  14 ?  -0.098 23.147 29.096 1 34.1442 ? N   ALA 14   A 1 1 
ATOM   52   C  CA  . ALA A 1  14 ?   0.888 22.112 28.823 1 34.5616 ? CA  ALA 14   A 1 1 
ATOM   53   C  CB  . ALA A 1  14 ?   0.703 20.955 29.787 1 35.0137 ? CB  ALA 14   A 1 1 
ATOM   54   C  C   . ALA A 1  14 ?   0.798 21.622 27.379 1 33.1845 ? C   ALA 14   A 1 1 
ATOM   55   O  O   . ALA A 1  14 ?  -0.287 21.328 26.886 1 33.0687 ? O   ALA 14   A 1 1 
ATOM   56   N  N   . ARG A 1  15 ?   1.961 21.535 26.729 1 31.8089 ? N   ARG 15   A 1 1 
ATOM   57   C  CA  . ARG A 1  15 ?    2.09 21.096 25.353 1 31.0856 ? CA  ARG 15   A 1 1 
ATOM   58   C  CB  . ARG A 1  15 ?   2.856 22.123 24.475 1 28.5919 ? CB  ARG 15   A 1 1 
ATOM   59   C  CG  . ARG A 1  15 ?   2.231 23.491 24.451 1 27.8915 ? CG  ARG 15   A 1 1 
ATOM   60   C  CD  . ARG A 1  15 ?   3.174 24.518 23.863 1 25.9454 ? CD  ARG 15   A 1 1 
ATOM   61   N  NE  . ARG A 1  15 ?   2.521 25.805 23.679 1 24.5274 ? NE  ARG 15   A 1 1 
ATOM   62   C  CZ  . ARG A 1  15 ?   2.566 26.517 22.558 1 23.7559 ? CZ  ARG 15   A 1 1 
ATOM   63   N  NH1 . ARG A 1  15 ?   2.605  25.94 21.365 1 24.6392 ? NH1 ARG 15   A 1 1 
ATOM   64   N  NH2 . ARG A 1  15 ?   2.603  27.84 22.634 1 22.6494 ? NH2 ARG 15   A 1 1 
ATOM   65   C  C   . ARG A 1  15 ?   2.892 19.807 25.405 1 32.5006 ? C   ARG 15   A 1 1 
ATOM   66   O  O   . ARG A 1  15 ?   4.056 19.825 25.796 1 32.8411 ? O   ARG 15   A 1 1 
ATOM   67   N  N   . SER A 1  16 ?    2.26   18.7 25.028 1 33.3629 ? N   SER 16   A 1 1 
ATOM   68   C  CA  . SER A 1  16 ?   2.957 17.434 24.958 1 35.6967 ? CA  SER 16   A 1 1 
ATOM   69   C  CB  . SER A 1  16 ?   1.977 16.264 24.965 1 36.7967 ? CB  SER 16   A 1 1 
ATOM   70   O  OG  . SER A 1  16 ?   1.374 16.138 23.692 1 37.0729 ? OG  SER 16   A 1 1 
ATOM   71   C  C   . SER A 1  16 ?   3.828 17.424 23.707 1 35.1414 ? C   SER 16   A 1 1 
ATOM   72   O  O   . SER A 1  16 ?   4.852 16.746 23.683 1 36.2088 ? O   SER 16   A 1 1 
ATOM   73   N  N   . CYS A 1  17 ?   3.394 18.161  22.67 1 35.6822 ? N   CYS 17   A 1 1 
ATOM   74   C  CA  . CYS A 1  17 ?   4.165 18.372 21.454 1  34.778 ? CA  CYS 17   A 1 1 
ATOM   75   C  CB  . CYS A 1  17 ?   3.414  17.91 20.213 1 37.4146 ? CB  CYS 17   A 1 1 
ATOM   76   S  SG  . CYS A 1  17 ?   2.778 16.206 20.334 1 45.0815 ? SG  CYS 17   A 1 1 
ATOM   77   C  C   . CYS A 1  17 ?   4.512 19.853 21.385 1 31.4501 ? C   CYS 17   A 1 1 
ATOM   78   O  O   . CYS A 1  17 ?   3.633  20.72 21.351 1 29.7033 ? O   CYS 17   A 1 1 
ATOM   79   N  N   . PRO A 1  18 ?   5.811  20.21 21.423 1 29.4443 ? N   PRO 18   A 1 1 
ATOM   80   C  CA  . PRO A 1  18 ?   6.174 21.608 21.639 1 27.5441 ? CA  PRO 18   A 1 1 
ATOM   81   C  CB  . PRO A 1  18 ?   7.664 21.549 21.926 1 27.4276 ? CB  PRO 18   A 1 1 
ATOM   82   C  CG  . PRO A 1  18 ?    8.14 20.243 21.196 1 27.9657 ? CG  PRO 18   A 1 1 
ATOM   83   C  CD  . PRO A 1  18 ?   6.958 19.295 21.293 1  28.842 ? CD  PRO 18   A 1 1 
ATOM   84   C  C   . PRO A 1  18 ?   5.826 22.521 20.466 1  26.047 ? C   PRO 18   A 1 1 
ATOM   85   O  O   . PRO A 1  18 ?   5.788 23.736 20.638 1 25.9055 ? O   PRO 18   A 1 1 
ATOM   86   N  N   . PHE A 1  19 ?   5.536  21.94 19.291 1 26.6095 ? N   PHE 19   A 1 1 
ATOM   87   C  CA  . PHE A 1  19 ?   5.183 22.719 18.114 1 26.1837 ? CA  PHE 19   A 1 1 
ATOM   88   C  CB  . PHE A 1  19 ?    5.85 22.153 16.855 1 25.2364 ? CB  PHE 19   A 1 1 
ATOM   89   C  CG  . PHE A 1  19 ?   7.349 22.165 16.873 1 24.8219 ? CG  PHE 19   A 1 1 
ATOM   90   C  CD1 . PHE A 1  19 ?   8.051 23.361  16.94 1 23.5816 ? CD1 PHE 19   A 1 1 
ATOM   91   C  CD2 . PHE A 1  19 ?   8.069 20.979 16.814 1 24.8658 ? CD2 PHE 19   A 1 1 
ATOM   92   C  CE1 . PHE A 1  19 ?    9.44 23.358 16.899 1  23.629 ? CE1 PHE 19   A 1 1 
ATOM   93   C  CE2 . PHE A 1  19 ?   9.439 20.988 16.812 1  24.627 ? CE2 PHE 19   A 1 1 
ATOM   94   C  CZ  . PHE A 1  19 ?  10.125 22.167 16.866 1 23.7299 ? CZ  PHE 19   A 1 1 
ATOM   95   C  C   . PHE A 1  19 ?   3.678 22.823 17.885 1  28.576 ? C   PHE 19   A 1 1 
ATOM   96   O  O   . PHE A 1  19 ?   3.237 23.425 16.905 1 28.9085 ? O   PHE 19   A 1 1 
ATOM   97   N  N   . LEU A 1  20 ?   2.901 22.245 18.804 1 29.1999 ? N   LEU 20   A 1 1 
ATOM   98   C  CA  . LEU A 1  20 ?   1.457 22.326 18.749 1 29.5731 ? CA  LEU 20   A 1 1 
ATOM   99   C  CB  . LEU A 1  20 ?   0.882   20.9 18.727 1 30.6849 ? CB  LEU 20   A 1 1 
ATOM   100  C  CG  . LEU A 1  20 ?   1.044 20.198  17.42 1  32.246 ? CG  LEU 20   A 1 1 
ATOM   101  C  CD1 . LEU A 1  20 ?   0.661 18.688 17.523 1 34.4965 ? CD1 LEU 20   A 1 1 
ATOM   102  C  CD2 . LEU A 1  20 ?   0.203 20.848 16.366 1 31.8324 ? CD2 LEU 20   A 1 1 
ATOM   103  C  C   . LEU A 1  20 ?   0.874 23.092 19.926 1 28.5619 ? C   LEU 20   A 1 1 
ATOM   104  O  O   . LEU A 1  20 ?   1.535 23.304 20.952 1 26.9475 ? O   LEU 20   A 1 1 
ATOM   105  N  N   . PRO A 1  21 ?  -0.396 23.529 19.808 1 29.1074 ? N   PRO 21   A 1 1 
ATOM   106  C  CA  . PRO A 1  21 ?  -1.082 24.166 20.931 1 29.0455 ? CA  PRO 21   A 1 1 
ATOM   107  C  CB  . PRO A 1  21 ?  -2.488 24.424  20.38 1 30.2489 ? CB  PRO 21   A 1 1 
ATOM   108  C  CG  . PRO A 1  21 ?  -2.313  24.43  18.88 1 30.3358 ? CG  PRO 21   A 1 1 
ATOM   109  C  CD  . PRO A 1  21 ?  -1.203  23.48 18.578 1 29.3869 ? CD  PRO 21   A 1 1 
ATOM   110  C  C   . PRO A 1  21 ?  -1.146 23.284 22.175 1  29.207 ? C   PRO 21   A 1 1 
ATOM   111  O  O   . PRO A 1  21 ?  -0.975 22.075 22.079 1 29.0783 ? O   PRO 21   A 1 1 
ATOM   112  N  N   . PRO A 1  22 ?  -1.408 23.854 23.371 1 30.5163 ? N   PRO 22   A 1 1 
ATOM   113  C  CA  . PRO A 1  22 ?   -1.67  23.04 24.555 1 31.7245 ? CA  PRO 22   A 1 1 
ATOM   114  C  CB  . PRO A 1  22 ?   -2.07 24.073 25.624 1 31.8839 ? CB  PRO 22   A 1 1 
ATOM   115  C  CG  . PRO A 1  22 ?  -1.381 25.377 25.178 1 29.9978 ? CG  PRO 22   A 1 1 
ATOM   116  C  CD  . PRO A 1  22 ?  -1.462 25.305 23.642 1 29.9817 ? CD  PRO 22   A 1 1 
ATOM   117  C  C   . PRO A 1  22 ?   -2.76 21.999  24.31 1 33.8446 ? C   PRO 22   A 1 1 
ATOM   118  O  O   . PRO A 1  22 ?  -3.775 22.283  23.67 1 33.0641 ? O   PRO 22   A 1 1 
ATOM   119  N  N   . ASP A 1  23 ?  -2.504 20.782 24.796 1 34.5165 ? N   ASP 23   A 1 1 
ATOM   120  C  CA  . ASP A 1  23 ?  -3.281 19.612 24.412 1 36.7049 ? CA  ASP 23   A 1 1 
ATOM   121  C  CB  . ASP A 1  23 ?  -2.747 18.381 25.176 1 37.3882 ? CB  ASP 23   A 1 1 
ATOM   122  C  CG  . ASP A 1  23 ?  -1.336 18.006 24.738 1 36.9505 ? CG  ASP 23   A 1 1 
ATOM   123  O  OD1 . ASP A 1  23 ?  -0.393 18.758 25.062 1 35.2311 ? OD1 ASP 23   A 1 1 
ATOM   124  O  OD2 . ASP A 1  23 ?  -1.189 16.999 24.032 1 38.0497 ? OD2 ASP 23   A 1 1 
ATOM   125  C  C   . ASP A 1  23 ?  -4.784 19.791 24.613 1 37.5415 ? C   ASP 23   A 1 1 
ATOM   126  O  O   . ASP A 1  23 ?  -5.577 19.425  23.74 1 38.1062 ? O   ASP 23   A 1 1 
ATOM   127  N  N   . GLY A 1  24 ?  -5.147 20.368 25.761 1 37.5043 ? N   GLY 24   A 1 1 
ATOM   128  C  CA  . GLY A 1  24 ?   -6.54 20.518 26.152 1 38.4309 ? CA  GLY 24   A 1 1 
ATOM   129  C  C   . GLY A 1  24 ?  -7.348 21.571 25.389 1 37.7004 ? C   GLY 24   A 1 1 
ATOM   130  O  O   . GLY A 1  24 ?   -8.57 21.628 25.541 1 35.9624 ? O   GLY 24   A 1 1 
ATOM   131  N  N   . ILE A 1  25 ?  -6.665 22.422 24.606 1 35.6204 ? N   ILE 25   A 1 1 
ATOM   132  C  CA  . ILE A 1  25 ?  -7.322 23.453 23.813 1 35.4944 ? CA  ILE 25   A 1 1 
ATOM   133  C  CB  . ILE A 1  25 ?  -6.241 24.319 23.112 1 35.1247 ? CB  ILE 25   A 1 1 
ATOM   134  C  CG1 . ILE A 1  25 ?  -5.577 25.232 24.156 1 35.5741 ? CG1 ILE 25   A 1 1 
ATOM   135  C  CG2 . ILE A 1  25 ?  -6.791 25.137  21.92 1 35.3147 ? CG2 ILE 25   A 1 1 
ATOM   136  C  CD1 . ILE A 1  25 ?  -6.486 26.412 24.692 1  35.422 ? CD1 ILE 25   A 1 1 
ATOM   137  C  C   . ILE A 1  25 ?  -8.345 22.926 22.805 1  35.467 ? C   ILE 25   A 1 1 
ATOM   138  O  O   . ILE A 1  25 ?   -9.43 23.491  22.68 1 35.9396 ? O   ILE 25   A 1 1 
ATOM   139  N  N   . ALA A 1  26 ?  -8.007 21.835 22.109 1 34.8534 ? N   ALA 26   A 1 1 
ATOM   140  C  CA  . ALA A 1  26 ?  -8.831 21.348 21.019 1 35.9183 ? CA  ALA 26   A 1 1 
ATOM   141  C  CB  . ALA A 1  26 ?  -8.188 20.115 20.417 1 36.7854 ? CB  ALA 26   A 1 1 
ATOM   142  C  C   . ALA A 1  26 ? -10.262 21.041 21.456 1 37.2579 ? C   ALA 26   A 1 1 
ATOM   143  O  O   . ALA A 1  26 ?  -11.22 21.438  20.79 1 37.7586 ? O   ALA 26   A 1 1 
ATOM   144  N  N   . ASP A 1  27 ? -10.402 20.319 22.575 1 37.0756 ? N   ASP 27   A 1 1 
ATOM   145  C  CA  . ASP A 1  27 ? -11.718  19.95 23.074 1 38.8027 ? CA  ASP 27   A 1 1 
ATOM   146  C  CB  . ASP A 1  27 ? -11.602 18.895 24.185 1  40.068 ? CB  ASP 27   A 1 1 
ATOM   147  C  CG  . ASP A 1  27 ? -11.076  17.57 23.724 1 41.0224 ? CG  ASP 27   A 1 1 
ATOM   148  O  OD1 . ASP A 1  27 ? -10.919 17.382 22.499 1 40.7269 ? OD1 ASP 27   A 1 1 
ATOM   149  O  OD2 . ASP A 1  27 ?   -10.8 16.735 24.574 1 42.9569 ? OD2 ASP 27   A 1 1 
ATOM   150  C  C   . ASP A 1  27 ? -12.543 21.128 23.595 1 37.7317 ? C   ASP 27   A 1 1 
ATOM   151  O  O   . ASP A 1  27 ? -13.767 21.115 23.507 1 38.3484 ? O   ASP 27   A 1 1 
ATOM   152  N  N   . ILE A 1  28 ? -11.876 22.143 24.151 1 36.2615 ? N   ILE 28   A 1 1 
ATOM   153  C  CA  . ILE A 1  28 ? -12.575  23.34 24.571 1  36.162 ? CA  ILE 28   A 1 1 
ATOM   154  C  CB  . ILE A 1  28 ? -11.682 24.248 25.424 1 35.6769 ? CB  ILE 28   A 1 1 
ATOM   155  C  CG1 . ILE A 1  28 ? -11.274 23.533 26.726 1  36.483 ? CG1 ILE 28   A 1 1 
ATOM   156  C  CG2 . ILE A 1  28 ? -12.382 25.557 25.711 1 35.7374 ? CG2 ILE 28   A 1 1 
ATOM   157  C  CD1 . ILE A 1  28 ? -10.126 24.247 27.528 1 35.0684 ? CD1 ILE 28   A 1 1 
ATOM   158  C  C   . ILE A 1  28 ? -13.122 24.057  23.34 1 35.8211 ? C   ILE 28   A 1 1 
ATOM   159  O  O   . ILE A 1  28 ? -14.301 24.412   23.3 1 36.0713 ? O   ILE 28   A 1 1 
ATOM   160  N  N   . ARG A 1  29 ? -12.243 24.281 22.355 1 35.1787 ? N   ARG 29   A 1 1 
ATOM   161  C  CA  . ARG A 1  29 ? -12.616 24.951 21.116 1 34.9947 ? CA  ARG 29   A 1 1 
ATOM   162  C  CB  . ARG A 1  29 ? -11.409 24.985  20.14 1 34.1862 ? CB  ARG 29   A 1 1 
ATOM   163  C  CG  . ARG A 1  29 ? -11.662 25.799 18.879 1 34.4704 ? CG  ARG 29   A 1 1 
ATOM   164  C  CD  . ARG A 1  29 ? -10.482 25.776 17.943 1 33.6173 ? CD  ARG 29   A 1 1 
ATOM   165  N  NE  . ARG A 1  29 ? -10.191 24.403 17.535 1 33.9408 ? NE  ARG 29   A 1 1 
ATOM   166  C  CZ  . ARG A 1  29 ?  -9.037 23.789 17.743 1 34.1327 ? CZ  ARG 29   A 1 1 
ATOM   167  N  NH1 . ARG A 1  29 ?  -7.912 24.469  17.94 1 33.3232 ? NH1 ARG 29   A 1 1 
ATOM   168  N  NH2 . ARG A 1  29 ?  -9.002 22.461  17.74 1 34.6406 ? NH2 ARG 29   A 1 1 
ATOM   169  C  C   . ARG A 1  29 ? -13.808 24.255 20.464 1 35.5553 ? C   ARG 29   A 1 1 
ATOM   170  O  O   . ARG A 1  29 ? -14.772 24.909 20.062 1 35.0717 ? O   ARG 29   A 1 1 
ATOM   171  N  N   . ALA A 1  30 ? -13.725 22.922 20.398 1 35.9896 ? N   ALA 30   A 1 1 
ATOM   172  C  CA  . ALA A 1  30 ? -14.784 22.099 19.833 1 37.6421 ? CA  ALA 30   A 1 1 
ATOM   173  C  CB  . ALA A 1  30 ? -14.346 20.644 19.805 1 38.4241 ? CB  ALA 30   A 1 1 
ATOM   174  C  C   . ALA A 1  30 ? -16.115 22.214 20.571 1 38.7139 ? C   ALA 30   A 1 1 
ATOM   175  O  O   . ALA A 1  30 ? -17.162  22.33 19.933 1 39.7101 ? O   ALA 30   A 1 1 
ATOM   176  N  N   . ALA A 1  31 ? -16.077 22.166  21.91 1 38.7657 ? N   ALA 31   A 1 1 
ATOM   177  C  CA  . ALA A 1  31 ? -17.289 22.198  22.72 1 39.9458 ? CA  ALA 31   A 1 1 
ATOM   178  C  CB  . ALA A 1  31 ? -17.026 21.535 24.065 1 40.2861 ? CB  ALA 31   A 1 1 
ATOM   179  C  C   . ALA A 1  31 ? -17.868 23.595 22.948 1 39.5721 ? C   ALA 31   A 1 1 
ATOM   180  O  O   . ALA A 1  31 ? -19.082 23.747 23.032 1 40.4411 ? O   ALA 31   A 1 1 
ATOM   181  N  N   . ALA A 1  32 ? -17.003 24.612 23.085 1 38.9904 ? N   ALA 32   A 1 1 
ATOM   182  C  CA  . ALA A 1  32 ? -17.436 25.946 23.491 1   38.58 ? CA  ALA 32   A 1 1 
ATOM   183  C  CB  . ALA A 1  32 ? -17.657 25.984 24.988 1 39.5807 ? CB  ALA 32   A 1 1 
ATOM   184  C  C   . ALA A 1  32 ?  -16.41 26.999 23.088 1 37.0256 ? C   ALA 32   A 1 1 
ATOM   185  O  O   . ALA A 1  32 ? -15.562  27.39 23.897 1 35.8564 ? O   ALA 32   A 1 1 
ATOM   186  N  N   . PRO A 1  33 ? -16.439 27.509 21.832 1 36.4951 ? N   PRO 33   A 1 1 
ATOM   187  C  CA  . PRO A 1  33 ? -15.388  28.42 21.381 1 34.9048 ? CA  PRO 33   A 1 1 
ATOM   188  C  CB  . PRO A 1  33 ? -15.644 28.549 19.873 1 34.9358 ? CB  PRO 33   A 1 1 
ATOM   189  C  CG  . PRO A 1  33 ? -17.134 28.234   19.7 1 36.6481 ? CG  PRO 33   A 1 1 
ATOM   190  C  CD  . PRO A 1  33 ?  -17.45 27.228 20.795 1 37.4488 ? CD  PRO 33   A 1 1 
ATOM   191  C  C   . PRO A 1  33 ? -15.408 29.777 22.081 1 34.3484 ? C   PRO 33   A 1 1 
ATOM   192  O  O   . PRO A 1  33 ? -14.477 30.574 21.914 1 32.8576 ? O   PRO 33   A 1 1 
ATOM   193  N  N   . VAL A 1  34 ? -16.504 30.034 22.815 1 35.4937 ? N   VAL 34   A 1 1 
ATOM   194  C  CA  . VAL A 1  34 ? -16.569 31.112  23.79 1 35.3672 ? CA  VAL 34   A 1 1 
ATOM   195  C  CB  . VAL A 1  34 ?  -17.56 32.211 23.368 1 36.2388 ? CB  VAL 34   A 1 1 
ATOM   196  C  CG1 . VAL A 1  34 ? -17.623 33.342 24.404 1 35.8311 ? CG1 VAL 34   A 1 1 
ATOM   197  C  CG2 . VAL A 1  34 ? -17.217 32.741 21.987 1 36.2944 ? CG2 VAL 34   A 1 1 
ATOM   198  C  C   . VAL A 1  34 ? -16.996 30.525 25.131 1   35.72 ? C   VAL 34   A 1 1 
ATOM   199  O  O   . VAL A 1  34 ? -18.124 30.057 25.272 1 36.1719 ? O   VAL 34   A 1 1 
ATOM   200  N  N   . THR A 1  35 ? -16.096 30.568 26.117 1 34.4668 ? N   THR 35   A 1 1 
ATOM   201  C  CA  . THR A 1  35 ?  -16.33 29.907 27.391 1 35.5794 ? CA  THR 35   A 1 1 
ATOM   202  C  CB  . THR A 1  35 ? -15.937  28.42 27.287 1 35.5529 ? CB  THR 35   A 1 1 
ATOM   203  O  OG1 . THR A 1  35 ? -16.642 27.694  28.28 1 36.1427 ? OG1 THR 35   A 1 1 
ATOM   204  C  CG2 . THR A 1  35 ? -14.409 28.201 27.431 1 34.7577 ? CG2 THR 35   A 1 1 
ATOM   205  C  C   . THR A 1  35 ? -15.595 30.618 28.528 1 35.4914 ? C   THR 35   A 1 1 
ATOM   206  O  O   . THR A 1  35 ?  -14.65 31.385 28.301 1 34.6398 ? O   THR 35   A 1 1 
ATOM   207  N  N   . ARG A 1  36 ? -16.066 30.362 29.757 1 35.6233 ? N   ARG 36   A 1 1 
ATOM   208  C  CA  . ARG A 1  36 ? -15.413 30.872 30.947 1 35.5655 ? CA  ARG 36   A 1 1 
ATOM   209  C  CB  . ARG A 1  36 ? -16.386 30.851  32.15 1 36.7117 ? CB  ARG 36   A 1 1 
ATOM   210  C  CG  . ARG A 1  36 ? -17.609 31.718 31.936 1 37.4009 ? CG  ARG 36   A 1 1 
ATOM   211  C  CD  . ARG A 1  36 ? -17.277 33.186 31.781 1 36.6124 ? CD  ARG 36   A 1 1 
ATOM   212  N  NE  . ARG A 1  36 ? -16.744  33.76 33.008 1 36.2629 ? NE  ARG 36   A 1 1 
ATOM   213  C  CZ  . ARG A 1  36 ? -16.304     35 33.127 1 35.6146 ? CZ  ARG 36   A 1 1 
ATOM   214  N  NH1 . ARG A 1  36 ?   -16.2 35.799  32.08 1 35.7063 ? NH1 ARG 36   A 1 1 
ATOM   215  N  NH2 . ARG A 1  36 ? -15.922 35.442 34.322 1 35.5842 ? NH2 ARG 36   A 1 1 
ATOM   216  C  C   . ARG A 1  36 ? -14.182 30.041 31.273 1 35.1036 ? C   ARG 36   A 1 1 
ATOM   217  O  O   . ARG A 1  36 ? -14.205 28.823 31.162 1 34.6362 ? O   ARG 36   A 1 1 
ATOM   218  N  N   . ALA A 1  37 ? -13.108 30.717 31.695 1 34.5004 ? N   ALA 37   A 1 1 
ATOM   219  C  CA  . ALA A 1  37 ? -11.906 30.016 32.097 1 34.5512 ? CA  ALA 37   A 1 1 
ATOM   220  C  CB  . ALA A 1  37 ?  -11.02 29.734 30.882 1 34.5461 ? CB  ALA 37   A 1 1 
ATOM   221  C  C   . ALA A 1  37 ? -11.159 30.841 33.136 1 34.8716 ? C   ALA 37   A 1 1 
ATOM   222  O  O   . ALA A 1  37 ? -11.451  32.03 33.332 1 34.5933 ? O   ALA 37   A 1 1 
ATOM   223  N  N   . THR A 1  38 ?  -10.25 30.158 33.845 1 35.0324 ? N   THR 38   A 1 1 
ATOM   224  C  CA  . THR A 1  38 ?    -9.4 30.797  34.83 1 34.2473 ? CA  THR 38   A 1 1 
ATOM   225  C  CB  . THR A 1  38 ?  -9.424 30.094 36.183 1 35.5918 ? CB  THR 38   A 1 1 
ATOM   226  O  OG1 . THR A 1  38 ? -10.769 30.067 36.695 1 36.3149 ? OG1 THR 38   A 1 1 
ATOM   227  C  CG2 . THR A 1  38 ?  -8.507 30.787 37.192 1 35.3542 ? CG2 THR 38   A 1 1 
ATOM   228  C  C   . THR A 1  38 ?  -8.014 30.872 34.205 1 33.5767 ? C   THR 38   A 1 1 
ATOM   229  O  O   . THR A 1  38 ?  -7.486 29.891  33.67 1 33.6024 ? O   THR 38   A 1 1 
ATOM   230  N  N   . PHE A 1  39 ?  -7.458 32.084 34.258 1 32.6436 ? N   PHE 39   A 1 1 
ATOM   231  C  CA  . PHE A 1  39 ?  -6.199 32.394  33.62 1 31.4659 ? CA  PHE 39   A 1 1 
ATOM   232  C  CB  . PHE A 1  39 ?  -6.327 33.747  32.89 1 30.4481 ? CB  PHE 39   A 1 1 
ATOM   233  C  CG  . PHE A 1  39 ?  -7.245   33.7 31.699 1 30.2563 ? CG  PHE 39   A 1 1 
ATOM   234  C  CD1 . PHE A 1  39 ?  -8.616 33.687  31.86 1  31.768 ? CD1 PHE 39   A 1 1 
ATOM   235  C  CD2 . PHE A 1  39 ?   -6.74 33.594 30.426 1 29.1097 ? CD2 PHE 39   A 1 1 
ATOM   236  C  CE1 . PHE A 1  39 ?  -9.465 33.626 30.758 1 31.4587 ? CE1 PHE 39   A 1 1 
ATOM   237  C  CE2 . PHE A 1  39 ?  -7.579 33.532 29.334 1 29.4919 ? CE2 PHE 39   A 1 1 
ATOM   238  C  CZ  . PHE A 1  39 ?  -8.947 33.537 29.505 1  30.594 ? CZ  PHE 39   A 1 1 
ATOM   239  C  C   . PHE A 1  39 ?  -5.067 32.412 34.646 1   31.29 ? C   PHE 39   A 1 1 
ATOM   240  O  O   . PHE A 1  39 ?  -5.295 32.249 35.844 1 31.0841 ? O   PHE 39   A 1 1 
ATOM   241  N  N   . THR A 1  40 ?  -3.839 32.589 34.142 1 30.9126 ? N   THR 40   A 1 1 
ATOM   242  C  CA  . THR A 1  40 ?  -2.649 32.587 34.979 1 30.7287 ? CA  THR 40   A 1 1 
ATOM   243  C  CB  . THR A 1  40 ?  -1.425 32.982 34.126 1 29.5568 ? CB  THR 40   A 1 1 
ATOM   244  O  OG1 . THR A 1  40 ?  -1.259 31.992 33.147 1 28.9707 ? OG1 THR 40   A 1 1 
ATOM   245  C  CG2 . THR A 1  40 ?  -0.143  33.13 34.942 1 29.1744 ? CG2 THR 40   A 1 1 
ATOM   246  C  C   . THR A 1  40 ?   -2.76 33.457 36.227 1 30.3758 ? C   THR 40   A 1 1 
ATOM   247  O  O   . THR A 1  40 ?  -2.287 33.073 37.287 1 31.0225 ? O   THR 40   A 1 1 
ATOM   248  N  N   . SER A 1  41 ?  -3.419 34.611 36.121 1 30.1411 ? N   SER 41   A 1 1 
ATOM   249  C  CA  . SER A 1  41 ?  -3.571 35.518 37.253 1 30.7754 ? CA  SER 41   A 1 1 
ATOM   250  C  CB  . SER A 1  41 ?  -4.002 36.891 36.742 1 30.6487 ? CB  SER 41   A 1 1 
ATOM   251  O  OG  . SER A 1  41 ?  -5.305 36.825 36.179 1 32.1227 ? OG  SER 41   A 1 1 
ATOM   252  C  C   . SER A 1  41 ?  -4.571 35.052 38.311 1 31.1396 ? C   SER 41   A 1 1 
ATOM   253  O  O   . SER A 1  41 ?  -4.629 35.617 39.404 1 32.3637 ? O   SER 41   A 1 1 
ATOM   254  N  N   . GLY A 1  42 ?  -5.413 34.076 37.949 1 31.1364 ? N   GLY 42   A 1 1 
ATOM   255  C  CA  . GLY A 1  42 ?   -6.43 33.555 38.849 1 32.2642 ? CA  GLY 42   A 1 1 
ATOM   256  C  C   . GLY A 1  42 ?  -7.776  34.25 38.666 1 33.3843 ? C   GLY 42   A 1 1 
ATOM   257  O  O   . GLY A 1  42 ?  -8.725 33.956 39.384 1 35.3872 ? O   GLY 42   A 1 1 
ATOM   258  N  N   . HIS A 1  43 ?  -7.839 35.209 37.733 1  33.033 ? N   HIS 43   A 1 1 
ATOM   259  C  CA  . HIS A 1  43 ?  -9.086 35.885 37.429 1 32.8724 ? CA  HIS 43   A 1 1 
ATOM   260  C  CB  . HIS A 1  43 ?   -8.86 37.264 36.809 1 32.8318 ? CB  HIS 43   A 1 1 
ATOM   261  C  CG  . HIS A 1  43 ?  -8.218 38.272 37.718 1 32.7377 ? CG  HIS 43   A 1 1 
ATOM   262  N  ND1 . HIS A 1  43 ?  -6.851 38.546 37.647 1  32.414 ? ND1 HIS 43   A 1 1 
ATOM   263  C  CE1 . HIS A 1  43 ?  -6.617 39.472 38.576 1 31.7284 ? CE1 HIS 43   A 1 1 
ATOM   264  N  NE2 . HIS A 1  43 ?  -7.735 39.803 39.224 1 33.0012 ? NE2 HIS 43   A 1 1 
ATOM   265  C  CD2 . HIS A 1  43 ?   -8.76 39.042 38.689 1 33.5744 ? CD2 HIS 43   A 1 1 
ATOM   266  C  C   . HIS A 1  43 ?   -9.81 34.958 36.459 1 33.6367 ? C   HIS 43   A 1 1 
ATOM   267  O  O   . HIS A 1  43 ?  -9.158 34.222 35.712 1 31.5734 ? O   HIS 43   A 1 1 
ATOM   268  N  N   . GLU A 1  44 ? -11.147 34.974 36.533 1  34.031 ? N   GLU 44   A 1 1 
ATOM   269  C  CA  . GLU A 1  44 ? -11.994 34.378 35.517 1 34.9128 ? CA  GLU 44   A 1 1 
ATOM   270  C  CB  . GLU A 1  44 ?  -13.29 33.877  36.12 1 37.6013 ? CB  GLU 44   A 1 1 
ATOM   271  C  CG  . GLU A 1  44 ? -13.218 32.477 36.683 1 40.2865 ? CG  GLU 44   A 1 1 
ATOM   272  C  CD  . GLU A 1  44 ? -14.569 31.978 37.181 1 43.5089 ? CD  GLU 44   A 1 1 
ATOM   273  O  OE1 . GLU A 1  44 ? -15.589 32.158 36.467 1  44.773 ? OE1 GLU 44   A 1 1 
ATOM   274  O  OE2 . GLU A 1  44 ? -14.591 31.378 38.277 1 45.8379 ? OE2 GLU 44   A 1 1 
ATOM   275  C  C   . GLU A 1  44 ? -12.343 35.385 34.429 1 33.6126 ? C   GLU 44   A 1 1 
ATOM   276  O  O   . GLU A 1  44 ? -12.635 36.541 34.729 1 34.0553 ? O   GLU 44   A 1 1 
ATOM   277  N  N   . ALA A 1  45 ? -12.323 34.939 33.168 1 31.8874 ? N   ALA 45   A 1 1 
ATOM   278  C  CA  . ALA A 1  45 ? -12.655 35.797 32.041 1 30.9071 ? CA  ALA 45   A 1 1 
ATOM   279  C  CB  . ALA A 1  45 ? -11.439 36.615 31.618 1 29.7788 ? CB  ALA 45   A 1 1 
ATOM   280  C  C   . ALA A 1  45 ? -13.176 34.915 30.911 1 31.2665 ? C   ALA 45   A 1 1 
ATOM   281  O  O   . ALA A 1  45 ? -13.315 33.709   31.1 1 31.7155 ? O   ALA 45   A 1 1 
ATOM   282  N  N   . TRP A 1  46 ? -13.497 35.521 29.763 1 30.6467 ? N   TRP 46   A 1 1 
ATOM   283  C  CA  . TRP A 1  46 ? -13.901 34.765 28.585 1 31.4344 ? CA  TRP 46   A 1 1 
ATOM   284  C  CB  . TRP A 1  46 ? -14.857 35.588 27.707 1 31.7876 ? CB  TRP 46   A 1 1 
ATOM   285  C  CG  . TRP A 1  46 ? -16.146 35.912 28.382 1 32.8272 ? CG  TRP 46   A 1 1 
ATOM   286  C  CD1 . TRP A 1  46 ? -16.507 37.105  28.93 1 32.9814 ? CD1 TRP 46   A 1 1 
ATOM   287  N  NE1 . TRP A 1  46 ? -17.777 37.017 29.457 1 34.4856 ? NE1 TRP 46   A 1 1 
ATOM   288  C  CE2 . TRP A 1  46 ? -18.255 35.749 29.252 1 34.8293 ? CE2 TRP 46   A 1 1 
ATOM   289  C  CZ2 . TRP A 1  46 ? -19.487  35.19 29.563 1 36.3746 ? CZ2 TRP 46   A 1 1 
ATOM   290  C  CH2 . TRP A 1  46 ? -19.697 33.886 29.202 1 36.8283 ? CH2 TRP 46   A 1 1 
ATOM   291  C  CZ3 . TRP A 1  46 ? -18.721 33.143 28.535 1 35.5456 ? CZ3 TRP 46   A 1 1 
ATOM   292  C  CE3 . TRP A 1  46 ? -17.507 33.706   28.2 1 34.1123 ? CE3 TRP 46   A 1 1 
ATOM   293  C  CD2 . TRP A 1  46 ? -17.262 35.034  28.55 1 34.0715 ? CD2 TRP 46   A 1 1 
ATOM   294  C  C   . TRP A 1  46 ? -12.698 34.331 27.748 1 30.0774 ? C   TRP 46   A 1 1 
ATOM   295  O  O   . TRP A 1  46 ? -11.873 35.152 27.367 1 30.7663 ? O   TRP 46   A 1 1 
ATOM   296  N  N   . LEU A 1  47 ? -12.627 33.032 27.462 1 30.4152 ? N   LEU 47   A 1 1 
ATOM   297  C  CA  . LEU A 1  47 ? -11.664 32.454 26.553 1 29.8965 ? CA  LEU 47   A 1 1 
ATOM   298  C  CB  . LEU A 1  47 ? -11.135 31.145  27.16 1 30.7142 ? CB  LEU 47   A 1 1 
ATOM   299  C  CG  . LEU A 1  47 ? -10.241 30.331 26.278 1  31.491 ? CG  LEU 47   A 1 1 
ATOM   300  C  CD1 . LEU A 1  47 ?  -8.886 31.037 26.104 1 30.1918 ? CD1 LEU 47   A 1 1 
ATOM   301  C  CD2 . LEU A 1  47 ? -10.061 28.937 26.802 1 32.7194 ? CD2 LEU 47   A 1 1 
ATOM   302  C  C   . LEU A 1  47 ? -12.351 32.248 25.201 1 30.1156 ? C   LEU 47   A 1 1 
ATOM   303  O  O   . LEU A 1  47 ?  -13.37 31.553 25.116 1 31.0884 ? O   LEU 47   A 1 1 
ATOM   304  N  N   . VAL A 1  48 ? -11.788 32.858 24.147 1 29.1751 ? N   VAL 48   A 1 1 
ATOM   305  C  CA  . VAL A 1  48 ? -12.305 32.686 22.795 1 29.4382 ? CA  VAL 48   A 1 1 
ATOM   306  C  CB  . VAL A 1  48 ? -12.788  34.03  22.21 1 29.5501 ? CB  VAL 48   A 1 1 
ATOM   307  C  CG1 . VAL A 1  48 ? -13.547 33.832 20.906 1 30.0457 ? CG1 VAL 48   A 1 1 
ATOM   308  C  CG2 . VAL A 1  48 ? -13.659 34.758 23.199 1 29.8498 ? CG2 VAL 48   A 1 1 
ATOM   309  C  C   . VAL A 1  48 ? -11.269 32.005 21.905 1  28.769 ? C   VAL 48   A 1 1 
ATOM   310  O  O   . VAL A 1  48 ? -10.209  32.57 21.642 1  28.101 ? O   VAL 48   A 1 1 
ATOM   311  N  N   . THR A 1  49 ? -11.599 30.767 21.501 1 29.3548 ? N   THR 49   A 1 1 
ATOM   312  C  CA  . THR A 1  49 ? -10.703 29.869 20.789 1 29.3434 ? CA  THR 49   A 1 1 
ATOM   313  C  CB  . THR A 1  49 ? -10.577  28.57 21.593 1 29.6068 ? CB  THR 49   A 1 1 
ATOM   314  O  OG1 . THR A 1  49 ? -11.876 28.027 21.862 1 29.2395 ? OG1 THR 49   A 1 1 
ATOM   315  C  CG2 . THR A 1  49 ?  -9.815 28.784 22.919 1 29.4695 ? CG2 THR 49   A 1 1 
ATOM   316  C  C   . THR A 1  49 ? -11.065 29.524 19.346 1 30.0878 ? C   THR 49   A 1 1 
ATOM   317  O  O   . THR A 1  49 ? -10.229     29 18.624 1 30.3727 ? O   THR 49   A 1 1 
ATOM   318  N  N   . GLY A 1  50 ? -12.312 29.772 18.946 1 31.9238 ? N   GLY 50   A 1 1 
ATOM   319  C  CA  . GLY A 1  50 ? -12.773  29.41 17.611 1  32.451 ? CA  GLY 50   A 1 1 
ATOM   320  C  C   . GLY A 1  50 ? -12.319 30.489 16.627 1 33.0473 ? C   GLY 50   A 1 1 
ATOM   321  O  O   . GLY A 1  50 ? -12.192 31.663 17.014 1 31.5776 ? O   GLY 50   A 1 1 
ATOM   322  N  N   . TYR A 1  51 ? -12.008 30.061 15.387 1 32.6666 ? N   TYR 51   A 1 1 
ATOM   323  C  CA  . TYR A 1  51 ?  -11.54 30.973 14.354 1 32.5696 ? CA  TYR 51   A 1 1 
ATOM   324  C  CB  . TYR A 1  51 ? -11.142 30.174 13.081 1 32.0896 ? CB  TYR 51   A 1 1 
ATOM   325  C  CG  . TYR A 1  51 ? -10.682 31.053 11.931 1 31.5814 ? CG  TYR 51   A 1 1 
ATOM   326  C  CD1 . TYR A 1  51 ?  -9.352 31.431 11.798 1 30.2825 ? CD1 TYR 51   A 1 1 
ATOM   327  C  CD2 . TYR A 1  51 ? -11.588 31.559 11.014 1 32.6912 ? CD2 TYR 51   A 1 1 
ATOM   328  C  CE1 . TYR A 1  51 ?   -8.94 32.257 10.753 1 29.8872 ? CE1 TYR 51   A 1 1 
ATOM   329  C  CE2 . TYR A 1  51 ? -11.183 32.377  9.966 1 31.9711 ? CE2 TYR 51   A 1 1 
ATOM   330  C  CZ  . TYR A 1  51 ?  -9.865 32.738  9.846 1 30.6214 ? CZ  TYR 51   A 1 1 
ATOM   331  O  OH  . TYR A 1  51 ?  -9.515 33.568  8.812 1 29.8346 ? OH  TYR 51   A 1 1 
ATOM   332  C  C   . TYR A 1  51 ?  -12.58 32.058 14.052 1 32.8977 ? C   TYR 51   A 1 1 
ATOM   333  O  O   . TYR A 1  51 ? -12.275 33.248 14.106 1 31.4994 ? O   TYR 51   A 1 1 
ATOM   334  N  N   . GLU A 1  52 ? -13.815 31.642 13.748 1 34.0957 ? N   GLU 52   A 1 1 
ATOM   335  C  CA  . GLU A 1  52 ? -14.869 32.578 13.409 1 35.0417 ? CA  GLU 52   A 1 1 
ATOM   336  C  CB  . GLU A 1  52 ? -16.134 31.792 13.003 1 38.7693 ? CB  GLU 52   A 1 1 
ATOM   337  C  CG  . GLU A 1  52 ? -17.413  32.63 12.914 1  42.043 ? CG  GLU 52   A 1 1 
ATOM   338  C  CD  . GLU A 1  52 ? -18.685 31.834 12.592 1 46.1087 ? CD  GLU 52   A 1 1 
ATOM   339  O  OE1 . GLU A 1  52 ? -18.629 30.584 12.516 1 48.4217 ? OE1 GLU 52   A 1 1 
ATOM   340  O  OE2 . GLU A 1  52 ? -19.747 32.467 12.416 1  49.798 ? OE2 GLU 52   A 1 1 
ATOM   341  C  C   . GLU A 1  52 ? -15.132  33.55 14.564 1 33.6015 ? C   GLU 52   A 1 1 
ATOM   342  O  O   . GLU A 1  52 ? -15.347 34.735 14.347 1 32.2953 ? O   GLU 52   A 1 1 
ATOM   343  N  N   . GLU A 1  53 ?  -15.07 33.048 15.802 1 32.8902 ? N   GLU 53   A 1 1 
ATOM   344  C  CA  . GLU A 1  53 ? -15.409 33.831 16.973 1 32.5872 ? CA  GLU 53   A 1 1 
ATOM   345  C  CB  . GLU A 1  53 ? -15.721  32.91 18.143 1  33.285 ? CB  GLU 53   A 1 1 
ATOM   346  C  CG  . GLU A 1  53 ? -16.976 32.076 17.934 1 35.1958 ? CG  GLU 53   A 1 1 
ATOM   347  C  CD  . GLU A 1  53 ? -16.865 30.877 17.021 1 36.0269 ? CD  GLU 53   A 1 1 
ATOM   348  O  OE1 . GLU A 1  53 ? -15.735 30.427 16.716 1 36.0556 ? OE1 GLU 53   A 1 1 
ATOM   349  O  OE2 . GLU A 1  53 ? -17.931 30.379 16.594 1 38.6105 ? OE2 GLU 53   A 1 1 
ATOM   350  C  C   . GLU A 1  53 ? -14.276 34.796 17.335 1 31.1265 ? C   GLU 53   A 1 1 
ATOM   351  O  O   . GLU A 1  53 ? -14.529 35.937 17.705 1 31.0155 ? O   GLU 53   A 1 1 
ATOM   352  N  N   . VAL A 1  54 ? -13.024 34.353 17.201 1 30.4142 ? N   VAL 54   A 1 1 
ATOM   353  C  CA  . VAL A 1  54 ? -11.899  35.25 17.426 1 29.0673 ? CA  VAL 54   A 1 1 
ATOM   354  C  CB  . VAL A 1  54 ? -10.558  34.51 17.445 1 28.1236 ? CB  VAL 54   A 1 1 
ATOM   355  C  CG1 . VAL A 1  54 ?  -9.392 35.493 17.407 1 27.0201 ? CG1 VAL 54   A 1 1 
ATOM   356  C  CG2 . VAL A 1  54 ? -10.454 33.624 18.671 1 28.5708 ? CG2 VAL 54   A 1 1 
ATOM   357  C  C   . VAL A 1  54 ? -11.933 36.396 16.415 1 29.4518 ? C   VAL 54   A 1 1 
ATOM   358  O  O   . VAL A 1  54 ? -11.736 37.555  16.78 1  27.707 ? O   VAL 54   A 1 1 
ATOM   359  N  N   . ARG A 1  55 ? -12.271 36.084 15.155 1 30.7837 ? N   ARG 55   A 1 1 
ATOM   360  C  CA  . ARG A 1  55 ? -12.327 37.129 14.144 1 32.1901 ? CA  ARG 55   A 1 1 
ATOM   361  C  CB  . ARG A 1  55 ? -12.549 36.552  12.76 1  34.776 ? CB  ARG 55   A 1 1 
ATOM   362  C  CG  . ARG A 1  55 ? -11.379 35.745 12.313 1 36.4756 ? CG  ARG 55   A 1 1 
ATOM   363  C  CD  . ARG A 1  55 ? -11.516 35.404 10.891 1 39.1448 ? CD  ARG 55   A 1 1 
ATOM   364  N  NE  . ARG A 1  55 ? -11.061  36.49 10.043 1 40.7754 ? NE  ARG 55   A 1 1 
ATOM   365  C  CZ  . ARG A 1  55 ? -11.231 36.514  8.731 1 40.3291 ? CZ  ARG 55   A 1 1 
ATOM   366  N  NH1 . ARG A 1  55 ? -12.358 36.118  8.177 1 42.7922 ? NH1 ARG 55   A 1 1 
ATOM   367  N  NH2 . ARG A 1  55 ? -10.258 36.983  7.963 1 39.7358 ? NH2 ARG 55   A 1 1 
ATOM   368  C  C   . ARG A 1  55 ? -13.408 38.158 14.451 1  31.997 ? C   ARG 55   A 1 1 
ATOM   369  O  O   . ARG A 1  55 ? -13.155 39.354 14.366 1 31.4957 ? O   ARG 55   A 1 1 
ATOM   370  N  N   . ALA A 1  56 ? -14.591 37.675  14.84 1 32.6408 ? N   ALA 56   A 1 1 
ATOM   371  C  CA  . ALA A 1  56 ? -15.694 38.553 15.183 1 33.5043 ? CA  ALA 56   A 1 1 
ATOM   372  C  CB  . ALA A 1  56 ? -16.987 37.755 15.368 1 35.2547 ? CB  ALA 56   A 1 1 
ATOM   373  C  C   . ALA A 1  56 ?  -15.34 39.361 16.431 1 32.6364 ? C   ALA 56   A 1 1 
ATOM   374  O  O   . ALA A 1  56 ? -15.643 40.549 16.517 1 31.9094 ? O   ALA 56   A 1 1 
ATOM   375  N  N   . LEU A 1  57 ? -14.692 38.725 17.409 1 32.2495 ? N   LEU 57   A 1 1 
ATOM   376  C  CA  . LEU A 1  57 ? -14.193 39.474  18.55 1 32.6526 ? CA  LEU 57   A 1 1 
ATOM   377  C  CB  . LEU A 1  57 ? -13.474 38.563 19.541 1  32.442 ? CB  LEU 57   A 1 1 
ATOM   378  C  CG  . LEU A 1  57 ? -12.659 39.243 20.639 1  32.488 ? CG  LEU 57   A 1 1 
ATOM   379  C  CD1 . LEU A 1  57 ? -13.525  40.18 21.518 1 33.7125 ? CD1 LEU 57   A 1 1 
ATOM   380  C  CD2 . LEU A 1  57 ? -12.001 38.184 21.525 1 32.5855 ? CD2 LEU 57   A 1 1 
ATOM   381  C  C   . LEU A 1  57 ? -13.288  40.62 18.096 1 31.5225 ? C   LEU 57   A 1 1 
ATOM   382  O  O   . LEU A 1  57 ? -13.516 41.765 18.461 1 31.1687 ? O   LEU 57   A 1 1 
ATOM   383  N  N   . LEU A 1  58 ? -12.258 40.318 17.298 1   31.36 ? N   LEU 58   A 1 1 
ATOM   384  C  CA  . LEU A 1  58 ? -11.227 41.305 17.018 1 30.4584 ? CA  LEU 58   A 1 1 
ATOM   385  C  CB  . LEU A 1  58 ?     -10 40.585 16.461 1 29.0346 ? CB  LEU 58   A 1 1 
ATOM   386  C  CG  . LEU A 1  58 ?  -9.232 39.741 17.532 1 28.3843 ? CG  LEU 58   A 1 1 
ATOM   387  C  CD1 . LEU A 1  58 ?   -8.05  39.02 16.964 1 27.0944 ? CD1 LEU 58   A 1 1 
ATOM   388  C  CD2 . LEU A 1  58 ?  -8.724 40.618 18.725 1 28.4949 ? CD2 LEU 58   A 1 1 
ATOM   389  C  C   . LEU A 1  58 ? -11.703 42.418 16.083 1 32.3486 ? C   LEU 58   A 1 1 
ATOM   390  O  O   . LEU A 1  58 ?  -11.14 43.512 16.079 1   31.99 ? O   LEU 58   A 1 1 
ATOM   391  N  N   . ARG A 1  59 ? -12.742 42.127 15.292 1 34.1738 ? N   ARG 59   A 1 1 
ATOM   392  C  CA  . ARG A 1  59 ? -13.278 43.079 14.337 1 36.5485 ? CA  ARG 59   A 1 1 
ATOM   393  C  CB  . ARG A 1  59 ?   -13.9 42.297 13.179 1 40.4074 ? CB  ARG 59   A 1 1 
ATOM   394  C  CG  . ARG A 1  59 ? -14.756 43.109 12.204 1 45.1125 ? CG  ARG 59   A 1 1 
ATOM   395  C  CD  . ARG A 1  59 ? -15.078 42.315 10.917 1 48.8833 ? CD  ARG 59   A 1 1 
ATOM   396  N  NE  . ARG A 1  59 ? -15.521 40.949   11.2 1 51.4128 ? NE  ARG 59   A 1 1 
ATOM   397  C  CZ  . ARG A 1  59 ? -15.186 39.864 10.501 1 53.8873 ? CZ  ARG 59   A 1 1 
ATOM   398  N  NH1 . ARG A 1  59 ? -14.736 39.948  9.256 1 54.1442 ? NH1 ARG 59   A 1 1 
ATOM   399  N  NH2 . ARG A 1  59 ? -15.347 38.662 11.054 1 55.0084 ? NH2 ARG 59   A 1 1 
ATOM   400  C  C   . ARG A 1  59 ? -14.303 44.023  14.96 1 36.4133 ? C   ARG 59   A 1 1 
ATOM   401  O  O   . ARG A 1  59 ? -14.628 45.044 14.369 1 37.3561 ? O   ARG 59   A 1 1 
ATOM   402  N  N   . ASP A 1  60 ? -14.822 43.672 16.143 1 35.4236 ? N   ASP 60   A 1 1 
ATOM   403  C  CA  . ASP A 1  60 ? -15.873 44.447 16.791 1 36.4488 ? CA  ASP 60   A 1 1 
ATOM   404  C  CB  . ASP A 1  60 ? -16.697 43.552   17.7 1 36.8644 ? CB  ASP 60   A 1 1 
ATOM   405  C  CG  . ASP A 1  60 ? -17.867  44.18  18.45 1 37.2731 ? CG  ASP 60   A 1 1 
ATOM   406  O  OD1 . ASP A 1  60 ? -17.928 45.431 18.545 1 36.4666 ? OD1 ASP 60   A 1 1 
ATOM   407  O  OD2 . ASP A 1  60 ? -18.666 43.436 18.973 1 36.8378 ? OD2 ASP 60   A 1 1 
ATOM   408  C  C   . ASP A 1  60 ? -15.305 45.589 17.624 1 36.5417 ? C   ASP 60   A 1 1 
ATOM   409  O  O   . ASP A 1  60 ? -14.652 45.366 18.641 1 34.7332 ? O   ASP 60   A 1 1 
ATOM   410  N  N   . SER A 1  61 ? -15.615  46.82 17.227 1 37.7939 ? N   SER 61   A 1 1 
ATOM   411  C  CA  . SER A 1  61 ? -14.946 47.953 17.834 1 38.4374 ? CA  SER 61   A 1 1 
ATOM   412  C  CB  . SER A 1  61 ? -14.917 49.122 16.862 1 38.9247 ? CB  SER 61   A 1 1 
ATOM   413  O  OG  . SER A 1  61 ?  -16.21  49.65 16.651 1 38.7952 ? OG  SER 61   A 1 1 
ATOM   414  C  C   . SER A 1  61 ? -15.562  48.33 19.181 1 39.7254 ? C   SER 61   A 1 1 
ATOM   415  O  O   . SER A 1  61 ? -15.086 49.244 19.848 1 40.7456 ? O   SER 61   A 1 1 
ATOM   416  N  N   . SER A 1  62 ? -16.587   47.6 19.625 1 40.6633 ? N   SER 62   A 1 1 
ATOM   417  C  CA  . SER A 1  62 ? -17.118 47.852 20.955 1 42.2438 ? CA  SER 62   A 1 1 
ATOM   418  C  CB  . SER A 1  62 ? -18.569 47.404 21.075 1 44.3229 ? CB  SER 62   A 1 1 
ATOM   419  O  OG  . SER A 1  62 ? -18.664 45.992  21.05 1 46.1558 ? OG  SER 62   A 1 1 
ATOM   420  C  C   . SER A 1  62 ? -16.262 47.202 22.044 1 40.9636 ? C   SER 62   A 1 1 
ATOM   421  O  O   . SER A 1  62 ? -16.583 47.335 23.223 1 42.9592 ? O   SER 62   A 1 1 
ATOM   422  N  N   . PHE A 1  63 ? -15.168 46.523 21.661 1 38.2318 ? N   PHE 63   A 1 1 
ATOM   423  C  CA  . PHE A 1  63 ? -14.168  46.08 22.627 1 36.2482 ? CA  PHE 63   A 1 1 
ATOM   424  C  CB  . PHE A 1  63 ? -13.606 44.675 22.277 1 36.2873 ? CB  PHE 63   A 1 1 
ATOM   425  C  CG  . PHE A 1  63 ? -14.614 43.572 22.528 1 37.4244 ? CG  PHE 63   A 1 1 
ATOM   426  C  CD1 . PHE A 1  63 ? -14.793 43.049 23.797 1 37.4423 ? CD1 PHE 63   A 1 1 
ATOM   427  C  CD2 . PHE A 1  63 ? -15.422 43.104 21.506 1 39.1732 ? CD2 PHE 63   A 1 1 
ATOM   428  C  CE1 . PHE A 1  63 ? -15.731  42.06 24.028 1 38.5236 ? CE1 PHE 63   A 1 1 
ATOM   429  C  CE2 . PHE A 1  63 ?  -16.36 42.118 21.739 1 39.6964 ? CE2 PHE 63   A 1 1 
ATOM   430  C  CZ  . PHE A 1  63 ?  -16.52 41.607 23.002 1 39.9552 ? CZ  PHE 63   A 1 1 
ATOM   431  C  C   . PHE A 1  63 ? -13.051 47.108 22.735 1 34.2449 ? C   PHE 63   A 1 1 
ATOM   432  O  O   . PHE A 1  63 ? -12.712 47.767 21.756 1 32.8718 ? O   PHE 63   A 1 1 
ATOM   433  N  N   . SER A 1  64 ? -12.509 47.239 23.951 1 32.3064 ? N   SER 64   A 1 1 
ATOM   434  C  CA  . SER A 1  64 ? -11.423 48.146 24.264 1 30.9008 ? CA  SER 64   A 1 1 
ATOM   435  C  CB  . SER A 1  64 ? -11.811 49.008 25.472 1  31.167 ? CB  SER 64   A 1 1 
ATOM   436  O  OG  . SER A 1  64 ? -10.736 49.785 25.976 1 30.1517 ? OG  SER 64   A 1 1 
ATOM   437  C  C   . SER A 1  64 ? -10.168 47.328 24.562 1 29.5979 ? C   SER 64   A 1 1 
ATOM   438  O  O   . SER A 1  64 ? -10.261 46.182 24.984 1 29.7856 ? O   SER 64   A 1 1 
ATOM   439  N  N   . VAL A 1  65 ?  -8.995 47.919 24.337 1 27.6763 ? N   VAL 65   A 1 1 
ATOM   440  C  CA  . VAL A 1  65 ?  -7.737 47.321 24.757 1 27.8716 ? CA  VAL 65   A 1 1 
ATOM   441  C  CB  . VAL A 1  65 ?  -6.604 47.636 23.747 1 26.7709 ? CB  VAL 65   A 1 1 
ATOM   442  C  CG1 . VAL A 1  65 ?  -6.842 46.945 22.436 1 26.8217 ? CG1 VAL 65   A 1 1 
ATOM   443  C  CG2 . VAL A 1  65 ?  -6.444 49.144 23.541 1 26.8592 ? CG2 VAL 65   A 1 1 
ATOM   444  C  C   . VAL A 1  65 ?  -7.319 47.798 26.151 1 28.8256 ? C   VAL 65   A 1 1 
ATOM   445  O  O   . VAL A 1  65 ?  -6.261 47.402 26.637 1 29.2368 ? O   VAL 65   A 1 1 
ATOM   446  N  N   . GLN A 1  66 ?   -8.12 48.682 26.765 1 29.5255 ? N   GLN 66   A 1 1 
ATOM   447  C  CA  . GLN A 1  66 ?  -7.777 49.246 28.063 1 30.8679 ? CA  GLN 66   A 1 1 
ATOM   448  C  CB  . GLN A 1  66 ?  -8.277 50.673 28.215 1 33.0019 ? CB  GLN 66   A 1 1 
ATOM   449  C  CG  . GLN A 1  66 ?  -7.484 51.672 27.389 1 34.6262 ? CG  GLN 66   A 1 1 
ATOM   450  C  CD  . GLN A 1  66 ?   -7.98 53.028 27.695 1 36.8347 ? CD  GLN 66   A 1 1 
ATOM   451  O  OE1 . GLN A 1  66 ?  -7.907 53.477 28.847 1 41.4789 ? OE1 GLN 66   A 1 1 
ATOM   452  N  NE2 . GLN A 1  66 ?  -8.593 53.682 26.733 1 37.5121 ? NE2 GLN 66   A 1 1 
ATOM   453  C  C   . GLN A 1  66 ?  -8.371 48.376 29.165 1 30.6746 ? C   GLN 66   A 1 1 
ATOM   454  O  O   . GLN A 1  66 ?  -9.341 48.751  29.82 1 31.6843 ? O   GLN 66   A 1 1 
ATOM   455  N  N   . VAL A 1  67 ?  -7.752 47.212 29.373 1 28.9849 ? N   VAL 67   A 1 1 
ATOM   456  C  CA  . VAL A 1  67 ?  -8.366 46.141 30.142 1 29.0111 ? CA  VAL 67   A 1 1 
ATOM   457  C  CB  . VAL A 1  67 ?  -7.916 44.763 29.583 1 28.3875 ? CB  VAL 67   A 1 1 
ATOM   458  C  CG1 . VAL A 1  67 ?  -8.349 44.601 28.119 1 27.8222 ? CG1 VAL 67   A 1 1 
ATOM   459  C  CG2 . VAL A 1  67 ?  -6.391 44.553 29.723 1 27.2437 ? CG2 VAL 67   A 1 1 
ATOM   460  C  C   . VAL A 1  67 ?  -8.017  46.28 31.618 1 28.6599 ? C   VAL 67   A 1 1 
ATOM   461  O  O   . VAL A 1  67 ?  -6.997  46.88 31.971 1 28.3067 ? O   VAL 67   A 1 1 
ATOM   462  N  N   . PRO A 1  68 ?   -8.86 45.731 32.511 1 29.0271 ? N   PRO 68   A 1 1 
ATOM   463  C  CA  . PRO A 1  68 ?  -8.652 45.853 33.953 1 29.4164 ? CA  PRO 68   A 1 1 
ATOM   464  C  CB  . PRO A 1  68 ? -10.053 45.568 34.501 1 30.4279 ? CB  PRO 68   A 1 1 
ATOM   465  C  CG  . PRO A 1  68 ? -10.705 44.702 33.517 1 30.4982 ? CG  PRO 68   A 1 1 
ATOM   466  C  CD  . PRO A 1  68 ? -10.151 45.116 32.166 1  29.333 ? CD  PRO 68   A 1 1 
ATOM   467  C  C   . PRO A 1  68 ?  -7.582 44.941 34.564 1 29.5549 ? C   PRO 68   A 1 1 
ATOM   468  O  O   . PRO A 1  68 ?  -7.036 45.266 35.627 1 29.6839 ? O   PRO 68   A 1 1 
ATOM   469  N  N   . HIS A 1  69 ?  -7.303   43.8  33.92 1 28.2842 ? N   HIS 69   A 1 1 
ATOM   470  C  CA  . HIS A 1  69 ?  -6.379  42.81 34.453 1 28.1405 ? CA  HIS 69   A 1 1 
ATOM   471  C  CB  . HIS A 1  69 ?  -7.124 41.544 34.857 1 28.7047 ? CB  HIS 69   A 1 1 
ATOM   472  C  CG  . HIS A 1  69 ?   -8.32 41.724 35.734 1  30.204 ? CG  HIS 69   A 1 1 
ATOM   473  N  ND1 . HIS A 1  69 ?  -8.227 42.281 37.003 1 31.0723 ? ND1 HIS 69   A 1 1 
ATOM   474  C  CE1 . HIS A 1  69 ?  -9.455 42.272 37.485 1 31.8384 ? CE1 HIS 69   A 1 1 
ATOM   475  N  NE2 . HIS A 1  69 ? -10.319 41.726 36.599 1 31.7855 ? NE2 HIS 69   A 1 1 
ATOM   476  C  CD2 . HIS A 1  69 ?   -9.61 41.386 35.498 1 31.1691 ? CD2 HIS 69   A 1 1 
ATOM   477  C  C   . HIS A 1  69 ?  -5.305 42.397 33.442 1 27.1373 ? C   HIS 69   A 1 1 
ATOM   478  O  O   . HIS A 1  69 ?  -5.513 42.482 32.226 1 26.0255 ? O   HIS 69   A 1 1 
ATOM   479  N  N   . ALA A 1  70 ?  -4.148 41.953 33.956 1 26.2296 ? N   ALA 70   A 1 1 
ATOM   480  C  CA  . ALA A 1  70 ?   -3.17 41.252 33.136 1 25.6268 ? CA  ALA 70   A 1 1 
ATOM   481  C  CB  . ALA A 1  70 ?  -1.753 41.719 33.423 1 25.4389 ? CB  ALA 70   A 1 1 
ATOM   482  C  C   . ALA A 1  70 ?  -3.348 39.763 33.419 1 25.8742 ? C   ALA 70   A 1 1 
ATOM   483  O  O   . ALA A 1  70 ?   -2.82  39.23 34.397 1 25.8734 ? O   ALA 70   A 1 1 
ATOM   484  N  N   . LEU A 1  71 ?  -4.131 39.105  32.56 1 26.3041 ? N   LEU 71   A 1 1 
ATOM   485  C  CA  . LEU A 1  71 ?   -4.58 37.745 32.823 1 26.6853 ? CA  LEU 71   A 1 1 
ATOM   486  C  CB  . LEU A 1  71 ?  -5.689 37.358 31.842 1 26.9737 ? CB  LEU 71   A 1 1 
ATOM   487  C  CG  . LEU A 1  71 ?  -6.988 38.108 31.938 1 28.0736 ? CG  LEU 71   A 1 1 
ATOM   488  C  CD1 . LEU A 1  71 ?  -8.003 37.593 30.854 1 28.3318 ? CD1 LEU 71   A 1 1 
ATOM   489  C  CD2 . LEU A 1  71 ?  -7.613 37.954  33.31 1 29.6777 ? CD2 LEU 71   A 1 1 
ATOM   490  C  C   . LEU A 1  71 ?  -3.432 36.745 32.705 1 26.1771 ? C   LEU 71   A 1 1 
ATOM   491  O  O   . LEU A 1  71 ?  -3.527 35.629 33.212 1  25.991 ? O   LEU 71   A 1 1 
ATOM   492  N  N   . HIS A 1  72 ?  -2.362 37.138 32.005 1 26.4192 ? N   HIS 72   A 1 1 
ATOM   493  C  CA  . HIS A 1  72 ?  -1.255 36.233 31.724 1 26.6699 ? CA  HIS 72   A 1 1 
ATOM   494  C  CB  . HIS A 1  72 ?  -0.777 36.418  30.27 1 25.7482 ? CB  HIS 72   A 1 1 
ATOM   495  C  CG  . HIS A 1  72 ?  -1.899 36.317  29.28 1 26.2707 ? CG  HIS 72   A 1 1 
ATOM   496  N  ND1 . HIS A 1  72 ?  -2.878 35.343 29.416 1 26.3954 ? ND1 HIS 72   A 1 1 
ATOM   497  C  CE1 . HIS A 1  72 ?  -3.751  35.57 28.454 1 26.3689 ? CE1 HIS 72   A 1 1 
ATOM   498  N  NE2 . HIS A 1  72 ?  -3.394 36.604 27.713 1 25.6136 ? NE2 HIS 72   A 1 1 
ATOM   499  C  CD2 . HIS A 1  72 ?  -2.218 37.104 28.225 1  25.973 ? CD2 HIS 72   A 1 1 
ATOM   500  C  C   . HIS A 1  72 ?  -0.052 36.335 32.673 1 27.9909 ? C   HIS 72   A 1 1 
ATOM   501  O  O   . HIS A 1  72 ?   0.912 35.582  32.51 1 27.3123 ? O   HIS 72   A 1 1 
ATOM   502  N  N   . THR A 1  73 ?   -0.14   37.2 33.694 1 29.0599 ? N   THR 73   A 1 1 
ATOM   503  C  CA  . THR A 1  73 ?   0.899 37.312 34.709 1 29.9763 ? CA  THR 73   A 1 1 
ATOM   504  C  CB  . THR A 1  73 ?   1.358 38.759 34.924 1 30.7629 ? CB  THR 73   A 1 1 
ATOM   505  O  OG1 . THR A 1  73 ?   0.322 39.505 35.561 1 31.8817 ? OG1 THR 73   A 1 1 
ATOM   506  C  CG2 . THR A 1  73 ?    1.76 39.421 33.615 1 29.9069 ? CG2 THR 73   A 1 1 
ATOM   507  C  C   . THR A 1  73 ?   0.341 36.742 36.004 1 31.0909 ? C   THR 73   A 1 1 
ATOM   508  O  O   . THR A 1  73 ?  -0.878 36.679 36.161 1  30.969 ? O   THR 73   A 1 1 
ATOM   509  N  N   . GLN A 1  74 ?   1.241 36.326 36.907 1 30.6684 ? N   GLN 74   A 1 1 
ATOM   510  C  CA  . GLN A 1  74 ?   0.805 35.685 38.133 1 33.4506 ? CA  GLN 74   A 1 1 
ATOM   511  C  CB  . GLN A 1  74 ?   1.949 35.044 38.872 1 37.0968 ? CB  GLN 74   A 1 1 
ATOM   512  C  CG  . GLN A 1  74 ?   2.531 33.852 38.108 1 40.8048 ? CG  GLN 74   A 1 1 
ATOM   513  C  CD  . GLN A 1  74 ?   3.103 32.816  39.04 1  45.519 ? CD  GLN 74   A 1 1 
ATOM   514  O  OE1 . GLN A 1  74 ?   3.526 31.738 38.595 1 51.2208 ? OE1 GLN 74   A 1 1 
ATOM   515  N  NE2 . GLN A 1  74 ?   3.106 33.091 40.355 1  47.495 ? NE2 GLN 74   A 1 1 
ATOM   516  C  C   . GLN A 1  74 ?    0.13 36.714 39.027 1 31.5763 ? C   GLN 74   A 1 1 
ATOM   517  O  O   . GLN A 1  74 ?  -0.892 36.439 39.654 1 30.2857 ? O   GLN 74   A 1 1 
ATOM   518  N  N   . ASP A 1  75 ?   0.701 37.923 39.059 1 28.9871 ? N   ASP 75   A 1 1 
ATOM   519  C  CA  . ASP A 1  75 ?   0.183 38.937 39.958 1 29.2946 ? CA  ASP 75   A 1 1 
ATOM   520  C  CB  . ASP A 1  75 ?   1.312 39.922 40.357 1 29.5495 ? CB  ASP 75   A 1 1 
ATOM   521  C  CG  . ASP A 1  75 ?   1.895 40.858 39.292 1 29.7692 ? CG  ASP 75   A 1 1 
ATOM   522  O  OD1 . ASP A 1  75 ?   1.436 40.808  38.09 1 28.5082 ? OD1 ASP 75   A 1 1 
ATOM   523  O  OD2 . ASP A 1  75 ?   2.822 41.634 39.633 1 28.9757 ? OD2 ASP 75   A 1 1 
ATOM   524  C  C   . ASP A 1  75 ?   -1.05 39.675 39.422 1 27.9914 ? C   ASP 75   A 1 1 
ATOM   525  O  O   . ASP A 1  75 ?  -1.729 40.379 40.172 1 26.3624 ? O   ASP 75   A 1 1 
ATOM   526  N  N   . GLY A 1  76 ?  -1.314 39.559 38.114 1 27.4805 ? N   GLY 76   A 1 1 
ATOM   527  C  CA  . GLY A 1  76 ?  -2.498  40.15   37.5 1 28.3272 ? CA  GLY 76   A 1 1 
ATOM   528  C  C   . GLY A 1  76 ?  -2.442 41.666 37.279 1 29.4144 ? C   GLY 76   A 1 1 
ATOM   529  O  O   . GLY A 1  76 ?  -3.436 42.275 36.866 1  28.955 ? O   GLY 76   A 1 1 
ATOM   530  N  N   . VAL A 1  77 ?  -1.256 42.253 37.508 1 29.0439 ? N   VAL 77   A 1 1 
ATOM   531  C  CA  . VAL A 1  77 ?  -1.108 43.697 37.582 1 29.4574 ? CA  VAL 77   A 1 1 
ATOM   532  C  CB  . VAL A 1  77 ?  -0.048 44.159  38.61 1 29.9765 ? CB  VAL 77   A 1 1 
ATOM   533  C  CG1 . VAL A 1  77 ?   0.195 45.677 38.512 1 29.4266 ? CG1 VAL 77   A 1 1 
ATOM   534  C  CG2 . VAL A 1  77 ?  -0.448 43.761 40.044 1 31.7292 ? CG2 VAL 77   A 1 1 
ATOM   535  C  C   . VAL A 1  77 ?  -0.811 44.215  36.18 1 28.2343 ? C   VAL 77   A 1 1 
ATOM   536  O  O   . VAL A 1  77 ?   0.136 43.784  35.51 1  25.497 ? O   VAL 77   A 1 1 
ATOM   537  N  N   . VAL A 1  78 ?  -1.682  45.11 35.721 1 28.1888 ? N   VAL 78   A 1 1 
ATOM   538  C  CA  . VAL A 1  78 ?  -1.495 45.775 34.441 1 27.9436 ? CA  VAL 78   A 1 1 
ATOM   539  C  CB  . VAL A 1  78 ?  -2.815 46.438 34.001 1 29.2636 ? CB  VAL 78   A 1 1 
ATOM   540  C  CG1 . VAL A 1  78 ?  -2.647 47.085 32.631 1 29.6001 ? CG1 VAL 78   A 1 1 
ATOM   541  C  CG2 . VAL A 1  78 ?   -3.96 45.425 34.022 1 29.5114 ? CG2 VAL 78   A 1 1 
ATOM   542  C  C   . VAL A 1  78 ?  -0.409 46.845 34.515 1 26.5542 ? C   VAL 78   A 1 1 
ATOM   543  O  O   . VAL A 1  78 ?  -0.578 47.896 35.152 1  27.341 ? O   VAL 78   A 1 1 
ATOM   544  N  N   . THR A 1  79 ?   0.702 46.581 33.833 1 26.9262 ? N   THR 79   A 1 1 
ATOM   545  C  CA  . THR A 1  79 ?   1.781 47.542 33.685 1 26.8787 ? CA  THR 79   A 1 1 
ATOM   546  C  CB  . THR A 1  79 ?   2.869  46.96 32.754 1 26.7354 ? CB  THR 79   A 1 1 
ATOM   547  O  OG1 . THR A 1  79 ?   2.255 46.514 31.543 1 25.2567 ? OG1 THR 79   A 1 1 
ATOM   548  C  CG2 . THR A 1  79 ?   3.623 45.772 33.363 1 27.4358 ? CG2 THR 79   A 1 1 
ATOM   549  C  C   . THR A 1  79 ?   1.243  48.85 33.113 1 27.8241 ? C   THR 79   A 1 1 
ATOM   550  O  O   . THR A 1  79 ?   0.351  48.83 32.272 1 29.0852 ? O   THR 79   A 1 1 
ATOM   551  N  N   . GLN A 1  80 ?   1.808 49.974 33.547 1 28.6469 ? N   GLN 80   A 1 1 
ATOM   552  C  CA  . GLN A 1  80 ?   1.496 51.265 32.961 1 30.7144 ? CA  GLN 80   A 1 1 
ATOM   553  C  CB  . GLN A 1  80 ?    2.22 52.383 33.738 1 32.4762 ? CB  GLN 80   A 1 1 
ATOM   554  C  CG  . GLN A 1  80 ?   1.696 53.754 33.399 1  35.116 ? CG  GLN 80   A 1 1 
ATOM   555  C  CD  . GLN A 1  80 ?   2.352 54.795 34.265 1 36.6425 ? CD  GLN 80   A 1 1 
ATOM   556  O  OE1 . GLN A 1  80 ?   2.418 54.685 35.511 1 37.6536 ? OE1 GLN 80   A 1 1 
ATOM   557  N  NE2 . GLN A 1  80 ?   2.883 55.822 33.595 1 38.9412 ? NE2 GLN 80   A 1 1 
ATOM   558  C  C   . GLN A 1  80 ?   1.944 51.317 31.503 1 28.9307 ? C   GLN 80   A 1 1 
ATOM   559  O  O   . GLN A 1  80 ?   3.127 51.282 31.236 1 28.1335 ? O   GLN 80   A 1 1 
ATOM   560  N  N   . LYS A 1  81 ?   0.984  51.43 30.586 1 29.1764 ? N   LYS 81   A 1 1 
ATOM   561  C  CA  . LYS A 1  81 ?   1.251 51.405 29.162 1 29.4101 ? CA  LYS 81   A 1 1 
ATOM   562  C  CB  . LYS A 1  81 ?   0.056 50.832 28.401 1 29.3462 ? CB  LYS 81   A 1 1 
ATOM   563  C  CG  . LYS A 1  81 ?  -0.337 49.435  28.84 1 28.6299 ? CG  LYS 81   A 1 1 
ATOM   564  C  CD  . LYS A 1  81 ?   0.791 48.441 28.736 1 27.3586 ? CD  LYS 81   A 1 1 
ATOM   565  C  CE  . LYS A 1  81 ?   0.331 47.053 28.963 1 26.9525 ? CE  LYS 81   A 1 1 
ATOM   566  N  NZ  . LYS A 1  81 ?  -0.383 46.951 30.231 1 26.2363 ? NZ  LYS 81   A 1 1 
ATOM   567  C  C   . LYS A 1  81 ?    1.53 52.798 28.617 1 29.5306 ? C   LYS 81   A 1 1 
ATOM   568  O  O   . LYS A 1  81 ?   0.966 53.778 29.098 1 32.0352 ? O   LYS 81   A 1 1 
ATOM   569  N  N   . PRO A 1  82 ?   2.367  52.92 27.571 1 29.8225 ? N   PRO 82   A 1 1 
ATOM   570  C  CA  . PRO A 1  82 ?   2.554 54.207 26.923 1 30.2842 ? CA  PRO 82   A 1 1 
ATOM   571  C  CB  . PRO A 1  82 ?   3.675 53.922 25.924 1 29.4379 ? CB  PRO 82   A 1 1 
ATOM   572  C  CG  . PRO A 1  82 ?   3.601 52.501 25.646 1 29.7415 ? CG  PRO 82   A 1 1 
ATOM   573  C  CD  . PRO A 1  82 ?   3.089 51.827 26.892 1  29.051 ? CD  PRO 82   A 1 1 
ATOM   574  C  C   . PRO A 1  82 ?   1.267 54.673 26.257 1 29.4902 ? C   PRO 82   A 1 1 
ATOM   575  O  O   . PRO A 1  82 ?   0.362 53.862 26.024 1 28.2756 ? O   PRO 82   A 1 1 
ATOM   576  N  N   . GLY A 1  83 ?    1.19 55.989 26.003 1 30.1368 ? N   GLY 83   A 1 1 
ATOM   577  C  CA  . GLY A 1  83 ?   0.021  56.61 25.409 1 29.3085 ? CA  GLY 83   A 1 1 
ATOM   578  C  C   . GLY A 1  83 ?   0.117 56.765 23.893 1 28.1786 ? C   GLY 83   A 1 1 
ATOM   579  O  O   . GLY A 1  83 ?   0.546 55.845 23.167 1 27.4777 ? O   GLY 83   A 1 1 
ATOM   580  N  N   . ARG A 1  84 ?  -0.258 57.965 23.432 1 27.7869 ? N   ARG 84   A 1 1 
ATOM   581  C  CA  . ARG A 1  84 ?  -0.426 58.217 22.008 1 27.8787 ? CA  ARG 84   A 1 1 
ATOM   582  C  CB  . ARG A 1  84 ?  -0.934 59.643 21.785 1 28.5959 ? CB  ARG 84   A 1 1 
ATOM   583  C  CG  . ARG A 1  84 ?  -2.366 59.821 22.366 1 29.4744 ? CG  ARG 84   A 1 1 
ATOM   584  C  CD  . ARG A 1  84 ?  -2.984 61.115  21.99 1 30.3649 ? CD  ARG 84   A 1 1 
ATOM   585  N  NE  . ARG A 1  84 ?  -3.324 61.097 20.574 1 30.0698 ? NE  ARG 84   A 1 1 
ATOM   586  C  CZ  . ARG A 1  84 ?  -4.009 62.052 19.957 1 31.4697 ? CZ  ARG 84   A 1 1 
ATOM   587  N  NH1 . ARG A 1  84 ?  -4.476 63.105 20.612 1 31.9904 ? NH1 ARG 84   A 1 1 
ATOM   588  N  NH2 . ARG A 1  84 ?  -4.216 61.959 18.651 1 30.6964 ? NH2 ARG 84   A 1 1 
ATOM   589  C  C   . ARG A 1  84 ?   0.871 57.947 21.255 1 27.2555 ? C   ARG 84   A 1 1 
ATOM   590  O  O   . ARG A 1  84 ?   1.952 58.324 21.706 1 25.7873 ? O   ARG 84   A 1 1 
ATOM   591  N  N   . GLY A 1  85 ?   0.736 57.294 20.095 1 26.8093 ? N   GLY 85   A 1 1 
ATOM   592  C  CA  . GLY A 1  85 ?   1.868 56.816 19.329 1 25.9909 ? CA  GLY 85   A 1 1 
ATOM   593  C  C   . GLY A 1  85 ?    2.12 55.313 19.432 1 25.2255 ? C   GLY 85   A 1 1 
ATOM   594  O  O   . GLY A 1  85 ?   2.637 54.705 18.494 1 24.7961 ? O   GLY 85   A 1 1 
ATOM   595  N  N   . SER A 1  86 ?   1.817 54.732 20.598 1 25.0531 ? N   SER 86   A 1 1 
ATOM   596  C  CA  . SER A 1  86 ?   2.132 53.337 20.837 1  24.946 ? CA  SER 86   A 1 1 
ATOM   597  C  CB  . SER A 1  86 ?    2.17 53.041 22.327 1 26.3826 ? CB  SER 86   A 1 1 
ATOM   598  O  OG  . SER A 1  86 ?   0.872 53.161 22.888 1 29.4775 ? OG  SER 86   A 1 1 
ATOM   599  C  C   . SER A 1  86 ?   1.152 52.391 20.136 1 24.6795 ? C   SER 86   A 1 1 
ATOM   600  O  O   . SER A 1  86 ?   1.503 51.249 19.908 1 23.6148 ? O   SER 86   A 1 1 
ATOM   601  N  N   . LEU A 1  87 ?  -0.081 52.857 19.872 1  24.404 ? N   LEU 87   A 1 1 
ATOM   602  C  CA  . LEU A 1  87 ?  -1.137 52.143  19.15 1 24.9959 ? CA  LEU 87   A 1 1 
ATOM   603  C  CB  . LEU A 1  87 ?  -0.706 51.616 17.762 1  25.774 ? CB  LEU 87   A 1 1 
ATOM   604  C  CG  . LEU A 1  87 ?  -0.144 52.625 16.786 1 26.0721 ? CG  LEU 87   A 1 1 
ATOM   605  C  CD1 . LEU A 1  87 ?   0.106 51.964 15.428 1 26.3155 ? CD1 LEU 87   A 1 1 
ATOM   606  C  CD2 . LEU A 1  87 ?  -0.999 53.804 16.667 1 26.5631 ? CD2 LEU 87   A 1 1 
ATOM   607  C  C   . LEU A 1  87 ?  -1.786 50.973 19.881 1 24.3395 ? C   LEU 87   A 1 1 
ATOM   608  O  O   . LEU A 1  87 ?  -3.015 50.913 19.966 1 24.5943 ? O   LEU 87   A 1 1 
ATOM   609  N  N   . LEU A 1  88 ?   -0.97 50.036 20.381 1  24.626 ? N   LEU 88   A 1 1 
ATOM   610  C  CA  . LEU A 1  88 ?  -1.475 48.805 20.979 1 24.9027 ? CA  LEU 88   A 1 1 
ATOM   611  C  CB  . LEU A 1  88 ?  -0.304 48.005 21.566 1 25.3516 ? CB  LEU 88   A 1 1 
ATOM   612  C  CG  . LEU A 1  88 ?   0.571 47.276 20.595 1 25.6938 ? CG  LEU 88   A 1 1 
ATOM   613  C  CD1 . LEU A 1  88 ?   1.816 46.795 21.272 1 26.1795 ? CD1 LEU 88   A 1 1 
ATOM   614  C  CD2 . LEU A 1  88 ?  -0.142  46.04 19.975 1  25.947 ? CD2 LEU 88   A 1 1 
ATOM   615  C  C   . LEU A 1  88 ?  -2.464 49.041  22.12 1 25.0796 ? C   LEU 88   A 1 1 
ATOM   616  O  O   . LEU A 1  88 ?  -3.318 48.211 22.382 1 25.3078 ? O   LEU 88   A 1 1 
ATOM   617  N  N   . TRP A 1  89 ?  -2.258 50.133 22.854 1 24.4321 ? N   TRP 89   A 1 1 
ATOM   618  C  CA  . TRP A 1  89 ?  -3.008 50.409 24.067 1 26.2199 ? CA  TRP 89   A 1 1 
ATOM   619  C  CB  . TRP A 1  89 ?  -2.064 50.482 25.271 1 26.3605 ? CB  TRP 89   A 1 1 
ATOM   620  C  CG  . TRP A 1  89 ?  -1.287 49.215 25.354 1 27.0129 ? CG  TRP 89   A 1 1 
ATOM   621  C  CD1 . TRP A 1  89 ?  -1.743 47.979 25.717 1 27.3302 ? CD1 TRP 89   A 1 1 
ATOM   622  N  NE1 . TRP A 1  89 ?  -0.734 47.052 25.614 1 25.8115 ? NE1 TRP 89   A 1 1 
ATOM   623  C  CE2 . TRP A 1  89 ?   0.393 47.679 25.171 1 26.3072 ? CE2 TRP 89   A 1 1 
ATOM   624  C  CZ2 . TRP A 1  89 ?   1.639 47.172 24.876 1 26.4433 ? CZ2 TRP 89   A 1 1 
ATOM   625  C  CH2 . TRP A 1  89 ?   2.594 48.052 24.443 1 26.6847 ? CH2 TRP 89   A 1 1 
ATOM   626  C  CZ3 . TRP A 1  89 ?   2.306 49.397 24.244 1 28.2711 ? CZ3 TRP 89   A 1 1 
ATOM   627  C  CE3 . TRP A 1  89 ?   1.062 49.911  24.53 1 27.6895 ? CE3 TRP 89   A 1 1 
ATOM   628  C  CD2 . TRP A 1  89 ?   0.067  49.04 24.962 1  27.339 ? CD2 TRP 89   A 1 1 
ATOM   629  C  C   . TRP A 1  89 ?  -3.864 51.654 23.878 1 25.6096 ? C   TRP 89   A 1 1 
ATOM   630  O  O   . TRP A 1  89 ?  -4.304 52.265 24.845 1 26.9921 ? O   TRP 89   A 1 1 
ATOM   631  N  N   . GLN A 1  90 ?  -4.176  51.97 22.618 1 25.2356 ? N   GLN 90   A 1 1 
ATOM   632  C  CA  . GLN A 1  90 ?  -5.071  53.07 22.313 1 25.5923 ? CA  GLN 90   A 1 1 
ATOM   633  C  CB  . GLN A 1  90 ?  -4.454 53.989 21.286 1 25.6564 ? CB  GLN 90   A 1 1 
ATOM   634  C  CG  . GLN A 1  90 ?  -3.149 54.643 21.736 1 25.9965 ? CG  GLN 90   A 1 1 
ATOM   635  C  CD  . GLN A 1  90 ?  -2.735  55.65 20.695 1 26.3081 ? CD  GLN 90   A 1 1 
ATOM   636  O  OE1 . GLN A 1  90 ?  -3.459  56.66 20.423 1 27.4221 ? OE1 GLN 90   A 1 1 
ATOM   637  N  NE2 . GLN A 1  90 ?  -1.608 55.402 20.097 1 24.5342 ? NE2 GLN 90   A 1 1 
ATOM   638  C  C   . GLN A 1  90 ?  -6.385 52.549  21.75 1 26.0458 ? C   GLN 90   A 1 1 
ATOM   639  O  O   . GLN A 1  90 ?  -6.366 51.646  20.94 1 24.6633 ? O   GLN 90   A 1 1 
ATOM   640  N  N   . ASP A 1  91 ?  -7.497 53.224 22.078 1  27.221 ? N   ASP 91   A 1 1 
ATOM   641  C  CA  . ASP A 1  91 ?  -8.768 52.959 21.427 1 28.5137 ? CA  ASP 91   A 1 1 
ATOM   642  C  CB  . ASP A 1  91 ?    -9.9 52.867  22.44 1 29.4866 ? CB  ASP 91   A 1 1 
ATOM   643  C  CG  . ASP A 1  91 ?  -9.811 51.704 23.377 1 29.1468 ? CG  ASP 91   A 1 1 
ATOM   644  O  OD1 . ASP A 1  91 ?  -9.406 50.615 22.927 1 26.6835 ? OD1 ASP 91   A 1 1 
ATOM   645  O  OD2 . ASP A 1  91 ? -10.212 51.871 24.566 1  29.035 ? OD2 ASP 91   A 1 1 
ATOM   646  C  C   . ASP A 1  91 ?   -9.09 54.091 20.458 1 30.3088 ? C   ASP 91   A 1 1 
ATOM   647  O  O   . ASP A 1  91 ?  -8.494 55.167 20.527 1 29.9984 ? O   ASP 91   A 1 1 
ATOM   648  N  N   . GLU A 1  92 ? -10.053 53.846 19.563 1 31.8485 ? N   GLU 92   A 1 1 
ATOM   649  C  CA  . GLU A 1  92 ? -10.586 54.884 18.697 1 33.3718 ? CA  GLU 92   A 1 1 
ATOM   650  C  CB  . GLU A 1  92 ? -11.656 54.274 17.761 1 35.0917 ? CB  GLU 92   A 1 1 
ATOM   651  C  CG  . GLU A 1  92 ?  -12.97 53.879 18.459 1 37.4358 ? CG  GLU 92   A 1 1 
ATOM   652  C  CD  . GLU A 1  92 ? -13.995 54.992 18.701 1 40.3801 ? CD  GLU 92   A 1 1 
ATOM   653  O  OE1 . GLU A 1  92 ? -13.877 56.074 18.073 1 41.9673 ? OE1 GLU 92   A 1 1 
ATOM   654  O  OE2 . GLU A 1  92 ? -14.922 54.786  19.53 1 43.2131 ? OE2 GLU 92   A 1 1 
ATOM   655  C  C   . GLU A 1  92 ? -11.132 56.032 19.559 1 34.1733 ? C   GLU 92   A 1 1 
ATOM   656  O  O   . GLU A 1  92 ?  -11.59   55.8 20.672 1 34.6559 ? O   GLU 92   A 1 1 
ATOM   657  N  N   . PRO A 1  93 ? -11.113 57.308 19.109 1 32.9914 ? N   PRO 93   A 1 1 
ATOM   658  C  CA  . PRO A 1  93 ? -10.684 57.679 17.763 1 32.9233 ? CA  PRO 93   A 1 1 
ATOM   659  C  CB  . PRO A 1  93 ? -11.566 58.886 17.495 1 33.7454 ? CB  PRO 93   A 1 1 
ATOM   660  C  CG  . PRO A 1  93 ? -11.664 59.554 18.845 1 34.4059 ? CG  PRO 93   A 1 1 
ATOM   661  C  CD  . PRO A 1  93 ? -11.594 58.464 19.883 1 34.1946 ? CD  PRO 93   A 1 1 
ATOM   662  C  C   . PRO A 1  93 ?   -9.19 58.006 17.657 1  31.497 ? C   PRO 93   A 1 1 
ATOM   663  O  O   . PRO A 1  93 ?  -8.641   58.1 16.559 1 30.8893 ? O   PRO 93   A 1 1 
ATOM   664  N  N   . GLU A 1  94 ?  -8.523 58.121 18.805 1 30.9139 ? N   GLU 94   A 1 1 
ATOM   665  C  CA  . GLU A 1  94 ?  -7.099  58.42  18.82 1 30.1752 ? CA  GLU 94   A 1 1 
ATOM   666  C  CB  . GLU A 1  94 ?  -6.615  58.69 20.237 1 30.6642 ? CB  GLU 94   A 1 1 
ATOM   667  C  CG  . GLU A 1  94 ?    -7.1 60.046 20.697 1 31.8789 ? CG  GLU 94   A 1 1 
ATOM   668  C  CD  . GLU A 1  94 ?  -6.787 60.393 22.121 1 31.9971 ? CD  GLU 94   A 1 1 
ATOM   669  O  OE1 . GLU A 1  94 ?   -5.93 59.725 22.737 1 30.6344 ? OE1 GLU 94   A 1 1 
ATOM   670  O  OE2 . GLU A 1  94 ?  -7.392 61.364 22.611 1 33.1326 ? OE2 GLU 94   A 1 1 
ATOM   671  C  C   . GLU A 1  94 ?  -6.294 57.298 18.169 1 28.3871 ? C   GLU 94   A 1 1 
ATOM   672  O  O   . GLU A 1  94 ?  -5.382 57.561 17.397 1 27.9064 ? O   GLU 94   A 1 1 
ATOM   673  N  N   . HIS A 1  95 ?  -6.628 56.041 18.465 1 27.6564 ? N   HIS 95   A 1 1 
ATOM   674  C  CA  . HIS A 1  95 ?  -5.968 54.946 17.764 1 26.9994 ? CA  HIS 95   A 1 1 
ATOM   675  C  CB  . HIS A 1  95 ?  -6.614 53.586 18.073 1 26.7215 ? CB  HIS 95   A 1 1 
ATOM   676  C  CG  . HIS A 1  95 ?  -6.152 52.495 17.162 1 25.7501 ? CG  HIS 95   A 1 1 
ATOM   677  N  ND1 . HIS A 1  95 ?  -4.948 51.856 17.383 1 25.4849 ? ND1 HIS 95   A 1 1 
ATOM   678  C  CE1 . HIS A 1  95 ?  -4.823 50.968 16.425 1 24.2219 ? CE1 HIS 95   A 1 1 
ATOM   679  N  NE2 . HIS A 1  95 ?  -5.888 50.984 15.614 1 26.9064 ? NE2 HIS 95   A 1 1 
ATOM   680  C  CD2 . HIS A 1  95 ?   -6.75 51.948 16.089 1 25.3288 ? CD2 HIS 95   A 1 1 
ATOM   681  C  C   . HIS A 1  95 ?  -6.001 55.167 16.254 1 26.9461 ? C   HIS 95   A 1 1 
ATOM   682  O  O   . HIS A 1  95 ?  -4.994 54.995 15.578 1 27.1427 ? O   HIS 95   A 1 1 
ATOM   683  N  N   . THR A 1  96 ?  -7.181 55.511 15.724 1  28.021 ? N   THR 96   A 1 1 
ATOM   684  C  CA  . THR A 1  96 ?   -7.36 55.637 14.286 1 28.8378 ? CA  THR 96   A 1 1 
ATOM   685  C  CB  . THR A 1  96 ?  -8.868 55.857 13.965 1 30.6279 ? CB  THR 96   A 1 1 
ATOM   686  O  OG1 . THR A 1  96 ?  -9.683 55.039 14.832 1 30.5054 ? OG1 THR 96   A 1 1 
ATOM   687  C  CG2 . THR A 1  96 ?  -9.155 55.569 12.518 1 31.0775 ? CG2 THR 96   A 1 1 
ATOM   688  C  C   . THR A 1  96 ?  -6.479 56.738 13.687 1 29.1376 ? C   THR 96   A 1 1 
ATOM   689  O  O   . THR A 1  96 ?  -5.785 56.487 12.704 1 29.8784 ? O   THR 96   A 1 1 
ATOM   690  N  N   . SER A 1  97 ?  -6.497 57.941 14.295 1 29.7903 ? N   SER 97   A 1 1 
ATOM   691  C  CA  . SER A 1  97 ?  -5.766 59.094 13.777 1 29.8245 ? CA  SER 97   A 1 1 
ATOM   692  C  CB  . SER A 1  97 ?   -6.25 60.383 14.423 1 31.0436 ? CB  SER 97   A 1 1 
ATOM   693  O  OG  . SER A 1  97 ?  -6.122 60.402 15.842 1 31.0981 ? OG  SER 97   A 1 1 
ATOM   694  C  C   . SER A 1  97 ?  -4.253 58.941 13.935 1 28.9629 ? C   SER 97   A 1 1 
ATOM   695  O  O   . SER A 1  97 ?  -3.492 59.292 13.036 1 28.2522 ? O   SER 97   A 1 1 
ATOM   696  N  N   . ASP A 1  98 ?  -3.828 58.362 15.067 1 27.9555 ? N   ASP 98   A 1 1 
ATOM   697  C  CA  . ASP A 1  98 ?  -2.424 58.108 15.326 1 27.0873 ? CA  ASP 98   A 1 1 
ATOM   698  C  CB  . ASP A 1  98 ?  -2.227 57.774 16.819 1 26.2311 ? CB  ASP 98   A 1 1 
ATOM   699  C  CG  . ASP A 1  98 ?  -2.468 58.975 17.705 1 26.5949 ? CG  ASP 98   A 1 1 
ATOM   700  O  OD1 . ASP A 1  98 ?  -2.683   60.1 17.153 1 27.9431 ? OD1 ASP 98   A 1 1 
ATOM   701  O  OD2 . ASP A 1  98 ?  -2.439 58.813 18.936 1 26.0343 ? OD2 ASP 98   A 1 1 
ATOM   702  C  C   . ASP A 1  98 ?  -1.867 56.987 14.452 1 26.4044 ? C   ASP 98   A 1 1 
ATOM   703  O  O   . ASP A 1  98 ?  -0.763  57.09 13.937 1 25.5535 ? O   ASP 98   A 1 1 
ATOM   704  N  N   . ARG A 1  99 ?  -2.634 55.916 14.241 1 26.8264 ? N   ARG 99   A 1 1 
ATOM   705  C  CA  . ARG A 1  99 ?  -2.175 54.895 13.314 1 26.7738 ? CA  ARG 99   A 1 1 
ATOM   706  C  CB  . ARG A 1  99 ?  -3.084 53.681 13.341 1 27.9238 ? CB  ARG 99   A 1 1 
ATOM   707  C  CG  . ARG A 1  99 ?  -2.602 52.632 12.363 1 27.8015 ? CG  ARG 99   A 1 1 
ATOM   708  C  CD  . ARG A 1  99 ?   -3.22 51.289 12.628 1 28.0239 ? CD  ARG 99   A 1 1 
ATOM   709  N  NE  . ARG A 1  99 ?  -2.849 50.334 11.583 1 28.1963 ? NE  ARG 99   A 1 1 
ATOM   710  C  CZ  . ARG A 1  99 ?  -2.743 49.026 11.786 1 27.5748 ? CZ  ARG 99   A 1 1 
ATOM   711  N  NH1 . ARG A 1  99 ?  -2.853 48.502     13 1 26.6186 ? NH1 ARG 99   A 1 1 
ATOM   712  N  NH2 . ARG A 1  99 ?  -2.486 48.225 10.754 1 28.2277 ? NH2 ARG 99   A 1 1 
ATOM   713  C  C   . ARG A 1  99 ?  -2.037 55.423 11.884 1 27.5086 ? C   ARG 99   A 1 1 
ATOM   714  O  O   . ARG A 1  99 ?  -1.061 55.126 11.194 1 26.1121 ? O   ARG 99   A 1 1 
ATOM   715  N  N   . LYS A 1 100 ?  -2.987 56.248 11.455 1  29.824 ? N   LYS 100  A 1 1 
ATOM   716  C  CA  . LYS A 1 100 ?  -2.887 56.897 10.156 1 32.0562 ? CA  LYS 100  A 1 1 
ATOM   717  C  CB  . LYS A 1 100 ?  -4.142 57.729  9.918 1  34.811 ? CB  LYS 100  A 1 1 
ATOM   718  C  CG  . LYS A 1 100 ?   -4.23 58.369   8.54 1 36.9927 ? CG  LYS 100  A 1 1 
ATOM   719  C  CD  . LYS A 1 100 ?   -5.62 58.964  8.305 1 39.7361 ? CD  LYS 100  A 1 1 
ATOM   720  C  CE  . LYS A 1 100 ?  -5.644 59.951  7.154 1 41.7025 ? CE  LYS 100  A 1 1 
ATOM   721  N  NZ  . LYS A 1 100 ?  -7.023 60.432  6.888 1 43.3058 ? NZ  LYS 100  A 1 1 
ATOM   722  C  C   . LYS A 1 100 ?  -1.628 57.755 10.027 1 30.9928 ? C   LYS 100  A 1 1 
ATOM   723  O  O   . LYS A 1 100 ?  -0.944 57.699  9.009 1 29.3573 ? O   LYS 100  A 1 1 
ATOM   724  N  N   . LEU A 1 101 ?  -1.317 58.533 11.073 1 32.3609 ? N   LEU 101  A 1 1 
ATOM   725  C  CA  . LEU A 1 101 ?  -0.085 59.317 11.118 1 33.1793 ? CA  LEU 101  A 1 1 
ATOM   726  C  CB  . LEU A 1 101 ?   0.064 60.035 12.478 1 34.5521 ? CB  LEU 101  A 1 1 
ATOM   727  C  CG  . LEU A 1 101 ?  -0.029 61.567 12.548 1 37.5589 ? CG  LEU 101  A 1 1 
ATOM   728  C  CD1 . LEU A 1 101 ?  -0.864 62.181  11.48 1 38.7459 ? CD1 LEU 101  A 1 1 
ATOM   729  C  CD2 . LEU A 1 101 ?  -0.574 62.003 13.925 1 37.6477 ? CD2 LEU 101  A 1 1 
ATOM   730  C  C   . LEU A 1 101 ?    1.16  58.46 10.918 1 31.4955 ? C   LEU 101  A 1 1 
ATOM   731  O  O   . LEU A 1 101 ?    2.02 58.785 10.097 1 31.7764 ? O   LEU 101  A 1 1 
ATOM   732  N  N   . LEU A 1 102 ?   1.274 57.389 11.713 1 30.0326 ? N   LEU 102  A 1 1 
ATOM   733  C  CA  . LEU A 1 102 ?   2.404 56.482  11.59 1 29.2896 ? CA  LEU 102  A 1 1 
ATOM   734  C  CB  . LEU A 1 102 ?   2.335 55.355 12.601 1 29.4345 ? CB  LEU 102  A 1 1 
ATOM   735  C  CG  . LEU A 1 102 ?   2.533 55.711  14.04 1 31.5213 ? CG  LEU 102  A 1 1 
ATOM   736  C  CD1 . LEU A 1 102 ?   3.009 54.416 14.808 1 31.2848 ? CD1 LEU 102  A 1 1 
ATOM   737  C  CD2 . LEU A 1 102 ?   3.535 56.933 14.215 1 31.6821 ? CD2 LEU 102  A 1 1 
ATOM   738  C  C   . LEU A 1 102 ?   2.475 55.854 10.205 1 28.5603 ? C   LEU 102  A 1 1 
ATOM   739  O  O   . LEU A 1 102 ?   3.557 55.797  9.624 1 27.8731 ? O   LEU 102  A 1 1 
ATOM   740  N  N   . ALA A 1 103 ?   1.323  55.39   9.69 1 27.6049 ? N   ALA 103  A 1 1 
ATOM   741  C  CA  . ALA A 1 103 ?   1.264  54.65   8.43 1 27.2311 ? CA  ALA 103  A 1 1 
ATOM   742  C  CB  . ALA A 1 103 ?  -0.124 54.022  8.227 1 28.2148 ? CB  ALA 103  A 1 1 
ATOM   743  C  C   . ALA A 1 103 ?   1.603 55.519  7.227 1 27.7783 ? C   ALA 103  A 1 1 
ATOM   744  O  O   . ALA A 1 103 ?    1.96 55.007  6.167 1 28.3856 ? O   ALA 103  A 1 1 
ATOM   745  N  N   . LYS A 1 104 ?   1.457 56.833    7.4 1  29.806 ? N   LYS 104  A 1 1 
ATOM   746  C  CA  . LYS A 1 104 ?   1.858 57.818  6.409 1 31.0774 ? CA  LYS 104  A 1 1 
ATOM   747  C  CB  . LYS A 1 104 ?   1.528 59.236  6.938 1 34.1702 ? CB  LYS 104  A 1 1 
ATOM   748  C  CG  . LYS A 1 104 ?    1.89 60.366  5.991 1 37.6763 ? CG  LYS 104  A 1 1 
ATOM   749  C  CD  . LYS A 1 104 ?     1.2 60.288  4.641 1 40.6267 ? CD  LYS 104  A 1 1 
ATOM   750  C  CE  . LYS A 1 104 ?   1.528 61.533  3.803 1 42.8677 ? CE  LYS 104  A 1 1 
ATOM   751  N  NZ  . LYS A 1 104 ?   0.827 61.496  2.512 1 45.1871 ? NZ  LYS 104  A 1 1 
ATOM   752  C  C   . LYS A 1 104 ?    3.34  57.71  6.064 1 29.5474 ? C   LYS 104  A 1 1 
ATOM   753  O  O   . LYS A 1 104 ?   3.717 57.868  4.909 1 30.5907 ? O   LYS 104  A 1 1 
ATOM   754  N  N   . GLU A 1 105 ?   4.177 57.466  7.076 1  27.482 ? N   GLU 105  A 1 1 
ATOM   755  C  CA  . GLU A 1 105 ?   5.617 57.328  6.885 1  27.243 ? CA  GLU 105  A 1 1 
ATOM   756  C  CB  . GLU A 1 105 ?   6.362 58.127  7.973 1 26.1889 ? CB  GLU 105  A 1 1 
ATOM   757  C  CG  . GLU A 1 105 ?   6.003 59.596  7.957 1 27.3183 ? CG  GLU 105  A 1 1 
ATOM   758  C  CD  . GLU A 1 105 ?   6.279 60.371  6.681 1 28.4632 ? CD  GLU 105  A 1 1 
ATOM   759  O  OE1 . GLU A 1 105 ?   7.161 59.974  5.897 1 28.4406 ? OE1 GLU 105  A 1 1 
ATOM   760  O  OE2 . GLU A 1 105 ?   5.586 61.387  6.468 1 29.2143 ? OE2 GLU 105  A 1 1 
ATOM   761  C  C   . GLU A 1 105 ?   6.117 55.885  6.898 1 25.6304 ? C   GLU 105  A 1 1 
ATOM   762  O  O   . GLU A 1 105 ?   7.082 55.532  6.228 1 25.2036 ? O   GLU 105  A 1 1 
ATOM   763  N  N   . PHE A 1 106 ?   5.508 55.041  7.718 1 25.8332 ? N   PHE 106  A 1 1 
ATOM   764  C  CA  . PHE A 1 106 ?   5.939 53.657  7.765 1 25.1423 ? CA  PHE 106  A 1 1 
ATOM   765  C  CB  . PHE A 1 106 ?   5.793 53.102  9.171 1 24.6816 ? CB  PHE 106  A 1 1 
ATOM   766  C  CG  . PHE A 1 106 ?   6.259 51.683  9.403 1 24.4726 ? CG  PHE 106  A 1 1 
ATOM   767  C  CD1 . PHE A 1 106 ?    7.52 51.262  8.974 1 24.9572 ? CD1 PHE 106  A 1 1 
ATOM   768  C  CD2 . PHE A 1 106 ?   5.446 50.769 10.039 1 24.8427 ? CD2 PHE 106  A 1 1 
ATOM   769  C  CE1 . PHE A 1 106 ?    7.94 49.951  9.181 1 25.3147 ? CE1 PHE 106  A 1 1 
ATOM   770  C  CE2 . PHE A 1 106 ?   5.856 49.449 10.223 1 25.4225 ? CE2 PHE 106  A 1 1 
ATOM   771  C  CZ  . PHE A 1 106 ?   7.101 49.044  9.817 1 24.6678 ? CZ  PHE 106  A 1 1 
ATOM   772  C  C   . PHE A 1 106 ?   5.056 52.942  6.755 1 25.4835 ? C   PHE 106  A 1 1 
ATOM   773  O  O   . PHE A 1 106 ?   4.052 52.347  7.127 1 26.5728 ? O   PHE 106  A 1 1 
ATOM   774  N  N   . THR A 1 107 ?   5.442 53.012  5.483 1 27.6753 ? N   THR 107  A 1 1 
ATOM   775  C  CA  . THR A 1 107 ?   4.625 52.485  4.398 1 27.2105 ? CA  THR 107  A 1 1 
ATOM   776  C  CB  . THR A 1 107 ?   4.671 53.416  3.173 1 27.7252 ? CB  THR 107  A 1 1 
ATOM   777  O  OG1 . THR A 1 107 ?   5.972 53.434  2.655 1 27.4313 ? OG1 THR 107  A 1 1 
ATOM   778  C  CG2 . THR A 1 107 ?   4.283 54.834  3.514 1 28.5157 ? CG2 THR 107  A 1 1 
ATOM   779  C  C   . THR A 1 107 ?   5.067 51.081  3.997 1 28.1425 ? C   THR 107  A 1 1 
ATOM   780  O  O   . THR A 1 107 ?   6.217 50.663  4.208 1 26.8077 ? O   THR 107  A 1 1 
ATOM   781  N  N   . VAL A 1 108 ?   4.146 50.355  3.378 1 28.0218 ? N   VAL 108  A 1 1 
ATOM   782  C  CA  . VAL A 1 108 ?   4.477 49.039  2.866 1 27.9641 ? CA  VAL 108  A 1 1 
ATOM   783  C  CB  . VAL A 1 108 ?   3.241 48.297  2.363 1 29.2796 ? CB  VAL 108  A 1 1 
ATOM   784  C  CG1 . VAL A 1 108 ?   3.661 47.028  1.563 1 29.7437 ? CG1 VAL 108  A 1 1 
ATOM   785  C  CG2 . VAL A 1 108 ?    2.32 47.942  3.554 1 28.7055 ? CG2 VAL 108  A 1 1 
ATOM   786  C  C   . VAL A 1 108 ?   5.547 49.142  1.786 1 27.8879 ? C   VAL 108  A 1 1 
ATOM   787  O  O   . VAL A 1 108 ?   6.473 48.332  1.756 1 26.8506 ? O   VAL 108  A 1 1 
ATOM   788  N  N   . ARG A 1 109 ?   5.424 50.145  0.912 1  29.695 ? N   ARG 109  A 1 1 
ATOM   789  C  CA  . ARG A 1 109 ?   6.431 50.374 -0.113 1 30.9405 ? CA  ARG 109  A 1 1 
ATOM   790  C  CB  . ARG A 1 109 ?   6.025 51.555 -0.984 1 35.1197 ? CB  ARG 109  A 1 1 
ATOM   791  C  CG  . ARG A 1 109 ?   7.123 51.981 -1.956 1 39.1262 ? CG  ARG 109  A 1 1 
ATOM   792  C  CD  . ARG A 1 109 ?   6.725 53.217 -2.725 1 42.7564 ? CD  ARG 109  A 1 1 
ATOM   793  N  NE  . ARG A 1 109 ?   7.892 53.988 -3.136 1 47.2833 ? NE  ARG 109  A 1 1 
ATOM   794  C  CZ  . ARG A 1 109 ?   8.389 55.047 -2.486 1 47.4478 ? CZ  ARG 109  A 1 1 
ATOM   795  N  NH1 . ARG A 1 109 ?    8.38 55.124 -1.156 1 42.9664 ? NH1 ARG 109  A 1 1 
ATOM   796  N  NH2 . ARG A 1 109 ?   8.961 56.023  -3.19 1 48.8057 ? NH2 ARG 109  A 1 1 
ATOM   797  C  C   . ARG A 1 109 ?   7.826 50.579  0.484 1 29.9382 ? C   ARG 109  A 1 1 
ATOM   798  O  O   . ARG A 1 109 ?   8.809 50.007 -0.007 1 29.3125 ? O   ARG 109  A 1 1 
ATOM   799  N  N   . ARG A 1 110 ?   7.911 51.364  1.571 1   27.67 ? N   ARG 110  A 1 1 
ATOM   800  C  CA  . ARG A 1 110 ?   9.174  51.53  2.279 1 27.3661 ? CA  ARG 110  A 1 1 
ATOM   801  C  CB  . ARG A 1 110 ?   9.051  52.66  3.308 1 27.6831 ? CB  ARG 110  A 1 1 
ATOM   802  C  CG  . ARG A 1 110 ?   9.077 54.002  2.641 1 28.7728 ? CG  ARG 110  A 1 1 
ATOM   803  C  CD  . ARG A 1 110 ?   8.831 55.128  3.615 1 29.2921 ? CD  ARG 110  A 1 1 
ATOM   804  N  NE  . ARG A 1 110 ?   9.215 56.415   3.05 1 31.5288 ? NE  ARG 110  A 1 1 
ATOM   805  C  CZ  . ARG A 1 110 ?   8.896 57.593  3.572 1  32.389 ? CZ  ARG 110  A 1 1 
ATOM   806  N  NH1 . ARG A 1 110 ?   8.392 57.704  4.796 1 31.4806 ? NH1 ARG 110  A 1 1 
ATOM   807  N  NH2 . ARG A 1 110 ?   9.094  58.69  2.852 1 33.6626 ? NH2 ARG 110  A 1 1 
ATOM   808  C  C   . ARG A 1 110 ?   9.685 50.244  2.927 1 25.3387 ? C   ARG 110  A 1 1 
ATOM   809  O  O   . ARG A 1 110 ?  10.888 50.025  3.004 1 26.0672 ? O   ARG 110  A 1 1 
ATOM   810  N  N   . MET A 1 111 ?   8.777 49.391  3.406 1 24.3853 ? N   MET 111  A 1 1 
ATOM   811  C  CA  . MET A 1 111 ?   9.157 48.109  3.967 1 24.2674 ? CA  MET 111  A 1 1 
ATOM   812  C  CB  . MET A 1 111 ?   7.933 47.452  4.607 1 24.6068 ? CB  MET 111  A 1 1 
ATOM   813  C  CG  . MET A 1 111 ?   7.379 48.202  5.818 1 25.1197 ? CG  MET 111  A 1 1 
ATOM   814  S  SD  . MET A 1 111 ?   5.851 47.317  6.389 1 26.9758 ? SD  MET 111  A 1 1 
ATOM   815  C  CE  . MET A 1 111 ?    4.82 48.776   6.99 1 24.8946 ? CE  MET 111  A 1 1 
ATOM   816  C  C   . MET A 1 111 ?   9.723 47.266   2.82 1 24.6273 ? C   MET 111  A 1 1 
ATOM   817  O  O   . MET A 1 111 ?  10.768 46.645  2.951 1 25.3535 ? O   MET 111  A 1 1 
ATOM   818  N  N   . GLN A 1 112 ?   9.061 47.308  1.665 1 24.8092 ? N   GLN 112  A 1 1 
ATOM   819  C  CA  . GLN A 1 112 ?   9.525 46.579  0.502 1 25.4147 ? CA  GLN 112  A 1 1 
ATOM   820  C  CB  . GLN A 1 112 ?   8.507  46.73 -0.635 1  27.087 ? CB  GLN 112  A 1 1 
ATOM   821  C  CG  . GLN A 1 112 ?   7.216 45.906 -0.307 1 26.8355 ? CG  GLN 112  A 1 1 
ATOM   822  C  CD  . GLN A 1 112 ?   6.151 46.244 -1.275 1 27.5382 ? CD  GLN 112  A 1 1 
ATOM   823  O  OE1 . GLN A 1 112 ?   6.346 47.076 -2.144 1 28.9958 ? OE1 GLN 112  A 1 1 
ATOM   824  N  NE2 . GLN A 1 112 ?    5.01 45.608 -1.163 1 26.5482 ? NE2 GLN 112  A 1 1 
ATOM   825  C  C   . GLN A 1 112 ?  10.926 47.011  0.078 1 24.6525 ? C   GLN 112  A 1 1 
ATOM   826  O  O   . GLN A 1 112 ?  11.747 46.168 -0.292 1 22.8423 ? O   GLN 112  A 1 1 
ATOM   827  N  N   . ALA A 1 113 ?  11.192 48.317  0.173 1 24.3511 ? N   ALA 113  A 1 1 
ATOM   828  C  CA  . ALA A 1 113 ?  12.481 48.873   -0.2 1 24.6526 ? CA  ALA 113  A 1 1 
ATOM   829  C  CB  . ALA A 1 113 ?  12.413 50.409 -0.246 1 25.3512 ? CB  ALA 113  A 1 1 
ATOM   830  C  C   . ALA A 1 113 ?   13.62 48.414  0.725 1 23.3253 ? C   ALA 113  A 1 1 
ATOM   831  O  O   . ALA A 1 113 ?  14.787 48.586   0.38 1 23.2939 ? O   ALA 113  A 1 1 
ATOM   832  N  N   . LEU A 1 114 ?  13.301 47.777   1.86 1 22.4978 ? N   LEU 114  A 1 1 
ATOM   833  C  CA  . LEU A 1 114 ?  14.323 47.273  2.771 1 22.1846 ? CA  LEU 114  A 1 1 
ATOM   834  C  CB  . LEU A 1 114 ?  13.758 47.169  4.177 1 21.9753 ? CB  LEU 114  A 1 1 
ATOM   835  C  CG  . LEU A 1 114 ?  13.347 48.521  4.802 1 22.6892 ? CG  LEU 114  A 1 1 
ATOM   836  C  CD1 . LEU A 1 114 ?  12.909 48.338   6.27 1 23.1412 ? CD1 LEU 114  A 1 1 
ATOM   837  C  CD2 . LEU A 1 114 ?  14.464 49.614  4.729 1   22.61 ? CD2 LEU 114  A 1 1 
ATOM   838  C  C   . LEU A 1 114 ?  14.926 45.928  2.387 1 23.1317 ? C   LEU 114  A 1 1 
ATOM   839  O  O   . LEU A 1 114 ?  15.908 45.511  2.996 1 22.9695 ? O   LEU 114  A 1 1 
ATOM   840  N  N   . ARG A 1 115 ?  14.357 45.267  1.361 1 23.7729 ? N   ARG 115  A 1 1 
ATOM   841  C  CA  . ARG A 1 115 ?  14.802 43.945  0.952 1 25.8241 ? CA  ARG 115  A 1 1 
ATOM   842  C  CB  . ARG A 1 115 ?  14.025 43.502 -0.296 1 27.6575 ? CB  ARG 115  A 1 1 
ATOM   843  C  CG  . ARG A 1 115 ?  14.456 42.151 -0.887 1 32.3936 ? CG  ARG 115  A 1 1 
ATOM   844  C  CD  . ARG A 1 115 ?  13.317 41.513  -1.78 1  34.994 ? CD  ARG 115  A 1 1 
ATOM   845  N  NE  . ARG A 1 115 ?  11.973  41.62 -1.191 1 37.1608 ? NE  ARG 115  A 1 1 
ATOM   846  C  CZ  . ARG A 1 115 ?   11.23 40.603 -0.747 1 39.1657 ? CZ  ARG 115  A 1 1 
ATOM   847  N  NH1 . ARG A 1 115 ?  11.753 39.416 -0.496 1 39.8747 ? NH1 ARG 115  A 1 1 
ATOM   848  N  NH2 . ARG A 1 115 ?   9.934 40.796 -0.526 1 41.6545 ? NH2 ARG 115  A 1 1 
ATOM   849  C  C   . ARG A 1 115 ?  16.319  43.87  0.747 1 25.0023 ? C   ARG 115  A 1 1 
ATOM   850  O  O   . ARG A 1 115 ?  16.951 42.992    1.3 1 23.9365 ? O   ARG 115  A 1 1 
ATOM   851  N  N   . PRO A 1 116 ?   16.97 44.761 -0.028 1 25.8684 ? N   PRO 116  A 1 1 
ATOM   852  C  CA  . PRO A 1 116 ?  18.416 44.663 -0.209 1 25.7054 ? CA  PRO 116  A 1 1 
ATOM   853  C  CB  . PRO A 1 116 ?  18.723 45.829 -1.136 1 28.1269 ? CB  PRO 116  A 1 1 
ATOM   854  C  CG  . PRO A 1 116 ?   17.36 46.166 -1.804 1 28.4047 ? CG  PRO 116  A 1 1 
ATOM   855  C  CD  . PRO A 1 116 ?  16.382  45.92 -0.719 1 27.3835 ? CD  PRO 116  A 1 1 
ATOM   856  C  C   . PRO A 1 116 ?  19.198 44.734  1.105 1 23.9541 ? C   PRO 116  A 1 1 
ATOM   857  O  O   . PRO A 1 116 ?  20.165 43.994  1.322 1 22.6731 ? O   PRO 116  A 1 1 
ATOM   858  N  N   . ASN A 1 117 ?  18.781 45.629  2.004 1 24.2616 ? N   ASN 117  A 1 1 
ATOM   859  C  CA  . ASN A 1 117 ?  19.468 45.758  3.288 1 24.2131 ? CA  ASN 117  A 1 1 
ATOM   860  C  CB  . ASN A 1 117 ?  19.005 47.017  4.044 1 24.7313 ? CB  ASN 117  A 1 1 
ATOM   861  C  CG  . ASN A 1 117 ?  19.918 47.299  5.221 1 25.2852 ? CG  ASN 117  A 1 1 
ATOM   862  O  OD1 . ASN A 1 117 ?   21.17 47.302   5.09 1 25.3803 ? OD1 ASN 117  A 1 1 
ATOM   863  N  ND2 . ASN A 1 117 ?  19.359 47.481  6.389 1 25.5633 ? ND2 ASN 117  A 1 1 
ATOM   864  C  C   . ASN A 1 117 ?  19.275 44.523  4.165 1 23.2479 ? C   ASN 117  A 1 1 
ATOM   865  O  O   . ASN A 1 117 ?  20.198 44.096  4.872 1 22.9689 ? O   ASN 117  A 1 1 
ATOM   866  N  N   . ILE A 1 118 ?  18.063 43.948   4.12 1 21.2963 ? N   ILE 118  A 1 1 
ATOM   867  C  CA  . ILE A 1 118 ?  17.782  42.75  4.896 1 19.8958 ? CA  ILE 118  A 1 1 
ATOM   868  C  CB  . ILE A 1 118 ?  16.277 42.431   4.87 1 20.1206 ? CB  ILE 118  A 1 1 
ATOM   869  C  CG1 . ILE A 1 118 ?  15.436 43.538  5.568 1 21.3452 ? CG1 ILE 118  A 1 1 
ATOM   870  C  CG2 . ILE A 1 118 ?  16.004 41.065  5.478 1 20.1098 ? CG2 ILE 118  A 1 1 
ATOM   871  C  CD1 . ILE A 1 118 ?  13.982  43.62  5.088 1 22.5544 ? CD1 ILE 118  A 1 1 
ATOM   872  C  C   . ILE A 1 118 ?  18.639  41.58  4.407 1 19.6769 ? C   ILE 118  A 1 1 
ATOM   873  O  O   . ILE A 1 118 ?   19.24  40.85   5.21 1 20.1792 ? O   ILE 118  A 1 1 
ATOM   874  N  N   . GLN A 1 119 ?  18.726 41.454  3.083 1 19.1474 ? N   GLN 119  A 1 1 
ATOM   875  C  CA  . GLN A 1 119 ?  19.536 40.426  2.454 1 19.8435 ? CA  GLN 119  A 1 1 
ATOM   876  C  CB  . GLN A 1 119 ?  19.359 40.477   0.92 1 20.2051 ? CB  GLN 119  A 1 1 
ATOM   877  C  CG  . GLN A 1 119 ?  20.034 39.351  0.167 1 20.4876 ? CG  GLN 119  A 1 1 
ATOM   878  C  CD  . GLN A 1 119 ?  19.456 38.006  0.487 1 20.1872 ? CD  GLN 119  A 1 1 
ATOM   879  O  OE1 . GLN A 1 119 ?  20.143 37.118  1.086 1 22.0903 ? OE1 GLN 119  A 1 1 
ATOM   880  N  NE2 . GLN A 1 119 ?  18.199  37.77  0.149 1 18.0147 ? NE2 GLN 119  A 1 1 
ATOM   881  C  C   . GLN A 1 119 ?  20.995 40.565  2.868 1 20.3275 ? C   GLN 119  A 1 1 
ATOM   882  O  O   . GLN A 1 119 ?  21.604  39.57  3.259 1 21.3127 ? O   GLN 119  A 1 1 
ATOM   883  N  N   . ARG A 1 120 ?  21.537 41.794  2.822 1 21.3536 ? N   ARG 120  A 1 1 
ATOM   884  C  CA  . ARG A 1 120 ?  22.903 42.042  3.271 1 22.8577 ? CA  ARG 120  A 1 1 
ATOM   885  C  CB  . ARG A 1 120 ?  23.297 43.507  3.086 1 26.6144 ? CB  ARG 120  A 1 1 
ATOM   886  C  CG  . ARG A 1 120 ?  23.552  43.87  1.621 1 30.8095 ? CG  ARG 120  A 1 1 
ATOM   887  C  CD  . ARG A 1 120 ?  24.144 45.276   1.39 1 32.8001 ? CD  ARG 120  A 1 1 
ATOM   888  N  NE  . ARG A 1 120 ?  23.344 46.344  1.981 1 35.5726 ? NE  ARG 120  A 1 1 
ATOM   889  C  CZ  . ARG A 1 120 ?  22.412 47.055  1.356 1 35.6105 ? CZ  ARG 120  A 1 1 
ATOM   890  N  NH1 . ARG A 1 120 ?   22.01 46.752  0.134 1 36.5531 ? NH1 ARG 120  A 1 1 
ATOM   891  N  NH2 . ARG A 1 120 ?  21.854 48.087  1.985 1 35.5746 ? NH2 ARG 120  A 1 1 
ATOM   892  C  C   . ARG A 1 120 ?  23.126 41.642  4.738 1 21.1601 ? C   ARG 120  A 1 1 
ATOM   893  O  O   . ARG A 1 120 ?  24.131  41.02  5.095 1 21.4316 ? O   ARG 120  A 1 1 
ATOM   894  N  N   . ILE A 1 121 ?  22.187  42.02   5.61 1  20.313 ? N   ILE 121  A 1 1 
ATOM   895  C  CA  . ILE A 1 121 ?  22.275 41.676  7.025 1 19.3069 ? CA  ILE 121  A 1 1 
ATOM   896  C  CB  . ILE A 1 121 ?  21.127 42.377  7.796 1 19.8441 ? CB  ILE 121  A 1 1 
ATOM   897  C  CG1 . ILE A 1 121 ?  21.356 43.897  7.846 1 20.3554 ? CG1 ILE 121  A 1 1 
ATOM   898  C  CG2 . ILE A 1 121 ?  20.942 41.828  9.209 1 19.0864 ? CG2 ILE 121  A 1 1 
ATOM   899  C  CD1 . ILE A 1 121 ?  20.042 44.762  8.392 1 20.3145 ? CD1 ILE 121  A 1 1 
ATOM   900  C  C   . ILE A 1 121 ?  22.266 40.166  7.257 1 19.2276 ? C   ILE 121  A 1 1 
ATOM   901  O  O   . ILE A 1 121 ?  23.062 39.593  8.014 1 19.8703 ? O   ILE 121  A 1 1 
ATOM   902  N  N   . VAL A 1 122 ?  21.337 39.491  6.594 1 19.4954 ? N   VAL 122  A 1 1 
ATOM   903  C  CA  . VAL A 1 122 ?   21.25 38.057  6.716 1 18.8662 ? CA  VAL 122  A 1 1 
ATOM   904  C  CB  . VAL A 1 122 ?  20.004 37.568  5.974 1 18.6964 ? CB  VAL 122  A 1 1 
ATOM   905  C  CG1 . VAL A 1 122 ?  20.015 36.086  5.812 1 19.1285 ? CG1 VAL 122  A 1 1 
ATOM   906  C  CG2 . VAL A 1 122 ?  18.738 38.007  6.709 1 18.3524 ? CG2 VAL 122  A 1 1 
ATOM   907  C  C   . VAL A 1 122 ?  22.552 37.424  6.217 1 19.4297 ? C   VAL 122  A 1 1 
ATOM   908  O  O   . VAL A 1 122 ?  23.104 36.556  6.883 1 19.6034 ? O   VAL 122  A 1 1 
ATOM   909  N  N   . ASP A 1 123 ?  23.036 37.854  5.053 1 19.3661 ? N   ASP 123  A 1 1 
ATOM   910  C  CA  . ASP A 1 123 ?  24.237 37.263  4.508 1  19.572 ? CA  ASP 123  A 1 1 
ATOM   911  C  CB  . ASP A 1 123 ?   24.48 37.732  3.066 1  19.653 ? CB  ASP 123  A 1 1 
ATOM   912  C  CG  . ASP A 1 123 ?  23.678 36.977  2.012 1 20.0834 ? CG  ASP 123  A 1 1 
ATOM   913  O  OD1 . ASP A 1 123 ?  23.639 35.744  2.081 1 19.1537 ? OD1 ASP 123  A 1 1 
ATOM   914  O  OD2 . ASP A 1 123 ?  23.119 37.642  1.091 1  20.234 ? OD2 ASP 123  A 1 1 
ATOM   915  C  C   . ASP A 1 123 ?  25.459 37.524  5.384 1 19.8549 ? C   ASP 123  A 1 1 
ATOM   916  O  O   . ASP A 1 123 ?  26.333 36.663  5.519 1 20.7632 ? O   ASP 123  A 1 1 
ATOM   917  N  N   . GLU A 1 124 ?  25.513 38.704   5.99 1 21.0118 ? N   GLU 124  A 1 1 
ATOM   918  C  CA  . GLU A 1 124 ?  26.602 39.071  6.872 1 22.6556 ? CA  GLU 124  A 1 1 
ATOM   919  C  CB  . GLU A 1 124 ?  26.451 40.575  7.276 1   26.44 ? CB  GLU 124  A 1 1 
ATOM   920  C  CG  . GLU A 1 124 ?  27.526 41.052  8.236 1 30.5878 ? CG  GLU 124  A 1 1 
ATOM   921  C  CD  . GLU A 1 124 ?  27.811 42.549  8.173 1 35.6138 ? CD  GLU 124  A 1 1 
ATOM   922  O  OE1 . GLU A 1 124 ?  27.321 43.214  7.222 1 38.8407 ? OE1 GLU 124  A 1 1 
ATOM   923  O  OE2 . GLU A 1 124 ?  28.542 43.047  9.064 1  38.791 ? OE2 GLU 124  A 1 1 
ATOM   924  C  C   . GLU A 1 124 ?  26.647 38.156  8.096 1 20.8061 ? C   GLU 124  A 1 1 
ATOM   925  O  O   . GLU A 1 124 ?  27.722 37.714  8.523 1 19.8781 ? O   GLU 124  A 1 1 
ATOM   926  N  N   . HIS A 1 125 ?  25.487 37.894  8.685 1 20.1284 ? N   HIS 125  A 1 1 
ATOM   927  C  CA  . HIS A 1 125 ?  25.438 37.057  9.871 1   20.24 ? CA  HIS 125  A 1 1 
ATOM   928  C  CB  . HIS A 1 125 ?  24.071 37.167 10.574 1 21.0197 ? CB  HIS 125  A 1 1 
ATOM   929  C  CG  . HIS A 1 125 ?  23.944 38.436 11.363 1 22.6194 ? CG  HIS 125  A 1 1 
ATOM   930  N  ND1 . HIS A 1 125 ?  23.742  39.65 10.733 1 23.5647 ? ND1 HIS 125  A 1 1 
ATOM   931  C  CE1 . HIS A 1 125 ?  23.743 40.575 11.686 1 24.7958 ? CE1 HIS 125  A 1 1 
ATOM   932  N  NE2 . HIS A 1 125 ?  23.879 40.009  12.91 1 22.8414 ? NE2 HIS 125  A 1 1 
ATOM   933  C  CD2 . HIS A 1 125 ?  24.051 38.641 12.701 1 23.3194 ? CD2 HIS 125  A 1 1 
ATOM   934  C  C   . HIS A 1 125 ?  25.769 35.603  9.536 1 19.7743 ? C   HIS 125  A 1 1 
ATOM   935  O  O   . HIS A 1 125 ?   26.44 34.923 10.328 1 19.8988 ? O   HIS 125  A 1 1 
ATOM   936  N  N   . LEU A 1 126 ?  25.302 35.131  8.368 1 19.3878 ? N   LEU 126  A 1 1 
ATOM   937  C  CA  . LEU A 1 126 ?  25.687   33.8  7.918 1 20.1293 ? CA  LEU 126  A 1 1 
ATOM   938  C  CB  . LEU A 1 126 ?  24.768 33.343  6.781 1 20.6446 ? CB  LEU 126  A 1 1 
ATOM   939  C  CG  . LEU A 1 126 ?  23.324 33.071  7.203 1 19.6873 ? CG  LEU 126  A 1 1 
ATOM   940  C  CD1 . LEU A 1 126 ?  22.413 32.925  5.985 1 18.8949 ? CD1 LEU 126  A 1 1 
ATOM   941  C  CD2 . LEU A 1 126 ?  23.237 31.838  8.016 1 20.5339 ? CD2 LEU 126  A 1 1 
ATOM   942  C  C   . LEU A 1 126 ?   27.17 33.699  7.543 1 20.6843 ? C   LEU 126  A 1 1 
ATOM   943  O  O   . LEU A 1 126 ?  27.799 32.683  7.816 1 21.1776 ? O   LEU 126  A 1 1 
ATOM   944  N  N   . ASP A 1 127 ?   27.78 34.765  6.999 1 20.5453 ? N   ASP 127  A 1 1 
ATOM   945  C  CA  . ASP A 1 127 ?   29.23 34.772  6.836 1 22.2558 ? CA  ASP 127  A 1 1 
ATOM   946  C  CB  . ASP A 1 127 ?   29.78  36.07   6.22 1 22.9407 ? CB  ASP 127  A 1 1 
ATOM   947  C  CG  . ASP A 1 127 ?  29.336 36.383  4.816 1 24.3511 ? CG  ASP 127  A 1 1 
ATOM   948  O  OD1 . ASP A 1 127 ?  28.914 35.446    4.1 1 23.5179 ? OD1 ASP 127  A 1 1 
ATOM   949  O  OD2 . ASP A 1 127 ?  29.436 37.576  4.415 1 23.5859 ? OD2 ASP 127  A 1 1 
ATOM   950  C  C   . ASP A 1 127 ?  29.963 34.519  8.152 1 21.9169 ? C   ASP 127  A 1 1 
ATOM   951  O  O   . ASP A 1 127 ?  30.913 33.734  8.192 1 21.4211 ? O   ASP 127  A 1 1 
ATOM   952  N  N   . ALA A 1 128 ?  29.526 35.184  9.217 1 22.6541 ? N   ALA 128  A 1 1 
ATOM   953  C  CA  . ALA A 1 128 ?  30.133 35.043 10.535 1 22.6999 ? CA  ALA 128  A 1 1 
ATOM   954  C  CB  . ALA A 1 128 ?  29.475 36.011  11.53 1 22.8326 ? CB  ALA 128  A 1 1 
ATOM   955  C  C   . ALA A 1 128 ?  30.006 33.621 11.077 1 22.4396 ? C   ALA 128  A 1 1 
ATOM   956  O  O   . ALA A 1 128 ?  30.956 33.098 11.657 1 21.8448 ? O   ALA 128  A 1 1 
ATOM   957  N  N   . ILE A 1 129 ?  28.814 33.035 10.913 1 21.6926 ? N   ILE 129  A 1 1 
ATOM   958  C  CA  . ILE A 1 129 ?  28.518 31.669 11.324 1 21.9789 ? CA  ILE 129  A 1 1 
ATOM   959  C  CB  . ILE A 1 129 ?  27.012 31.385 11.121 1 22.2849 ? CB  ILE 129  A 1 1 
ATOM   960  C  CG1 . ILE A 1 129 ?  26.195 32.045 12.229 1 22.1515 ? CG1 ILE 129  A 1 1 
ATOM   961  C  CG2 . ILE A 1 129 ?  26.719 29.917 11.071 1 22.3361 ? CG2 ILE 129  A 1 1 
ATOM   962  C  CD1 . ILE A 1 129 ?   24.79 32.263  11.88 1 21.7175 ? CD1 ILE 129  A 1 1 
ATOM   963  C  C   . ILE A 1 129 ?  29.422 30.706 10.561 1 22.5708 ? C   ILE 129  A 1 1 
ATOM   964  O  O   . ILE A 1 129 ?   30.01 29.794 11.144 1 23.4332 ? O   ILE 129  A 1 1 
ATOM   965  N  N   . GLU A 1 130 ?  29.574 30.916  9.251 1 22.9926 ? N   GLU 130  A 1 1 
ATOM   966  C  CA  . GLU A 1 130 ?  30.441 30.023  8.491 1 23.6523 ? CA  GLU 130  A 1 1 
ATOM   967  C  CB  . GLU A 1 130 ?  30.262 30.257   6.99 1 24.1453 ? CB  GLU 130  A 1 1 
ATOM   968  C  CG  . GLU A 1 130 ?  28.909  29.81  6.413 1 23.3781 ? CG  GLU 130  A 1 1 
ATOM   969  C  CD  . GLU A 1 130 ?  29.018 29.599  4.901 1 23.3193 ? CD  GLU 130  A 1 1 
ATOM   970  O  OE1 . GLU A 1 130 ?  28.812 30.561  4.138 1 21.9406 ? OE1 GLU 130  A 1 1 
ATOM   971  O  OE2 . GLU A 1 130 ?  29.427 28.504  4.486 1 23.0356 ? OE2 GLU 130  A 1 1 
ATOM   972  C  C   . GLU A 1 130 ?  31.907 30.182  8.919 1 24.8355 ? C   GLU 130  A 1 1 
ATOM   973  O  O   . GLU A 1 130 ?  32.643 29.205   9.03 1   23.79 ? O   GLU 130  A 1 1 
ATOM   974  N  N   . ALA A 1 131 ?  32.332 31.423  9.197 1 26.6774 ? N   ALA 131  A 1 1 
ATOM   975  C  CA  . ALA A 1 131 ?  33.708 31.692  9.611 1 27.8123 ? CA  ALA 131  A 1 1 
ATOM   976  C  CB  . ALA A 1 131 ?  33.986 33.186  9.653 1  27.229 ? CB  ALA 131  A 1 1 
ATOM   977  C  C   . ALA A 1 131 ?  34.066 31.059 10.958 1 28.5653 ? C   ALA 131  A 1 1 
ATOM   978  O  O   . ALA A 1 131 ?   35.18 30.571 11.123 1 26.9755 ? O   ALA 131  A 1 1 
ATOM   979  N  N   . ARG A 1 132 ?  33.113 31.019 11.896 1 28.6952 ? N   ARG 132  A 1 1 
ATOM   980  C  CA  . ARG A 1 132 ?   33.39 30.406  13.19 1 30.1706 ? CA  ARG 132  A 1 1 
ATOM   981  C  CB  . ARG A 1 132 ?  32.556 31.026 14.339 1 31.0974 ? CB  ARG 132  A 1 1 
ATOM   982  C  CG  . ARG A 1 132 ?  31.086 30.781 14.218 1 32.8647 ? CG  ARG 132  A 1 1 
ATOM   983  C  CD  . ARG A 1 132 ?  30.269 31.708 15.108 1 34.4193 ? CD  ARG 132  A 1 1 
ATOM   984  N  NE  . ARG A 1 132 ?  30.471 31.364 16.511 1 35.8127 ? NE  ARG 132  A 1 1 
ATOM   985  C  CZ  . ARG A 1 132 ?  30.219 32.182 17.521 1 37.2563 ? CZ  ARG 132  A 1 1 
ATOM   986  N  NH1 . ARG A 1 132 ?  29.491 33.277 17.358 1 36.6226 ? NH1 ARG 132  A 1 1 
ATOM   987  N  NH2 . ARG A 1 132 ?   30.76 31.926 18.711 1 37.2323 ? NH2 ARG 132  A 1 1 
ATOM   988  C  C   . ARG A 1 132 ?  33.196 28.897 13.159 1 28.2821 ? C   ARG 132  A 1 1 
ATOM   989  O  O   . ARG A 1 132 ?  33.743 28.219 13.997 1 28.2447 ? O   ARG 132  A 1 1 
ATOM   990  N  N   . GLY A 1 133 ?   32.43 28.378 12.191 1 26.8259 ? N   GLY 133  A 1 1 
ATOM   991  C  CA  . GLY A 1 133 ?  32.174 26.957  12.07 1 25.9967 ? CA  GLY 133  A 1 1 
ATOM   992  C  C   . GLY A 1 133 ?  31.142 26.431 13.073 1 24.6262 ? C   GLY 133  A 1 1 
ATOM   993  O  O   . GLY A 1 133 ?  30.823 27.071 14.063 1 26.2037 ? O   GLY 133  A 1 1 
ATOM   994  N  N   . GLY A 1 134 ?  30.646 25.225 12.827 1 22.8243 ? N   GLY 134  A 1 1 
ATOM   995  C  CA  . GLY A 1 134 ?  29.626 24.631 13.671 1 21.9282 ? CA  GLY 134  A 1 1 
ATOM   996  C  C   . GLY A 1 134 ?  30.206 23.877 14.854 1 21.6939 ? C   GLY 134  A 1 1 
ATOM   997  O  O   . GLY A 1 134 ?  31.384 23.543 14.856 1 21.4872 ? O   GLY 134  A 1 1 
ATOM   998  N  N   . PRO A 1 135 ?  29.406 23.587 15.894 1 20.9673 ? N   PRO 135  A 1 1 
ATOM   999  C  CA  . PRO A 1 135 ?  28.013 24.016 15.964 1 21.5012 ? CA  PRO 135  A 1 1 
ATOM   1000 C  CB  . PRO A 1 135 ?  27.439 23.049     17 1 21.9017 ? CB  PRO 135  A 1 1 
ATOM   1001 C  CG  . PRO A 1 135 ?  28.588 22.894 17.965 1 21.9798 ? CG  PRO 135  A 1 1 
ATOM   1002 C  CD  . PRO A 1 135 ?  29.826 22.829 17.076 1  22.144 ? CD  PRO 135  A 1 1 
ATOM   1003 C  C   . PRO A 1 135 ?  27.846 25.463 16.427 1 22.1975 ? C   PRO 135  A 1 1 
ATOM   1004 O  O   . PRO A 1 135 ?   28.78 26.095 16.935 1  22.423 ? O   PRO 135  A 1 1 
ATOM   1005 N  N   . VAL A 1 136 ?   26.65 26.007 16.214 1 22.4194 ? N   VAL 136  A 1 1 
ATOM   1006 C  CA  . VAL A 1 136 ?  26.323 27.321 16.732 1 23.4149 ? CA  VAL 136  A 1 1 
ATOM   1007 C  CB  . VAL A 1 136 ?  26.398 28.449   15.7 1 23.4423 ? CB  VAL 136  A 1 1 
ATOM   1008 C  CG1 . VAL A 1 136 ?  27.784 28.503 15.059 1 24.4035 ? CG1 VAL 136  A 1 1 
ATOM   1009 C  CG2 . VAL A 1 136 ?   25.27 28.364 14.645 1 23.4473 ? CG2 VAL 136  A 1 1 
ATOM   1010 C  C   . VAL A 1 136 ?  24.925 27.281 17.328 1 23.3052 ? C   VAL 136  A 1 1 
ATOM   1011 O  O   . VAL A 1 136 ?   24.13 26.402  16.99 1 22.6125 ? O   VAL 136  A 1 1 
ATOM   1012 N  N   . ASP A 1 137 ?  24.671 28.257 18.198 1 22.1422 ? N   ASP 137  A 1 1 
ATOM   1013 C  CA  . ASP A 1 137 ?  23.342 28.556 18.693 1 22.4211 ? CA  ASP 137  A 1 1 
ATOM   1014 C  CB  . ASP A 1 137 ?  23.385 29.171  20.11 1 23.1145 ? CB  ASP 137  A 1 1 
ATOM   1015 C  CG  . ASP A 1 137 ?  21.981 29.596 20.571 1 25.0501 ? CG  ASP 137  A 1 1 
ATOM   1016 O  OD1 . ASP A 1 137 ?  20.978 29.264 19.863 1 21.6509 ? OD1 ASP 137  A 1 1 
ATOM   1017 O  OD2 . ASP A 1 137 ?  21.888 30.303 21.593 1 28.6544 ? OD2 ASP 137  A 1 1 
ATOM   1018 C  C   . ASP A 1 137 ?  22.713 29.575 17.748 1 21.3756 ? C   ASP 137  A 1 1 
ATOM   1019 O  O   . ASP A 1 137 ?   23.13 30.721 17.726 1 21.6693 ? O   ASP 137  A 1 1 
ATOM   1020 N  N   . LEU A 1 138 ?  21.742 29.145 16.944 1 21.5175 ? N   LEU 138  A 1 1 
ATOM   1021 C  CA  . LEU A 1 138 ?  21.134 30.026 15.965 1 20.9136 ? CA  LEU 138  A 1 1 
ATOM   1022 C  CB  . LEU A 1 138 ?  20.213 29.321 14.999 1 22.5676 ? CB  LEU 138  A 1 1 
ATOM   1023 C  CG  . LEU A 1 138 ?  20.713 28.803 13.726 1  24.452 ? CG  LEU 138  A 1 1 
ATOM   1024 C  CD1 . LEU A 1 138 ?  19.455 28.518 12.805 1 24.9793 ? CD1 LEU 138  A 1 1 
ATOM   1025 C  CD2 . LEU A 1 138 ?   21.74 29.721 13.003 1 23.6862 ? CD2 LEU 138  A 1 1 
ATOM   1026 C  C   . LEU A 1 138 ?   20.32 31.144 16.584 1 21.2059 ? C   LEU 138  A 1 1 
ATOM   1027 O  O   . LEU A 1 138 ?  20.118 32.142 15.911 1 21.2679 ? O   LEU 138  A 1 1 
ATOM   1028 N  N   . VAL A 1 139 ?  19.886 31.016 17.846 1 21.2534 ? N   VAL 139  A 1 1 
ATOM   1029 C  CA  . VAL A 1 139 ?  19.172 32.101 18.496 1 22.3215 ? CA  VAL 139  A 1 1 
ATOM   1030 C  CB  . VAL A 1 139 ?  18.492 31.605  19.79 1 22.6412 ? CB  VAL 139  A 1 1 
ATOM   1031 C  CG1 . VAL A 1 139 ?  17.852 32.733 20.573 1 23.0493 ? CG1 VAL 139  A 1 1 
ATOM   1032 C  CG2 . VAL A 1 139 ?  17.459 30.541 19.446 1 22.7347 ? CG2 VAL 139  A 1 1 
ATOM   1033 C  C   . VAL A 1 139 ?  20.085 33.299 18.738 1 22.6964 ? C   VAL 139  A 1 1 
ATOM   1034 O  O   . VAL A 1 139 ?  19.786 34.403 18.302 1 22.7434 ? O   VAL 139  A 1 1 
ATOM   1035 N  N   . LYS A 1 140 ?  21.233 33.071 19.363 1 23.2971 ? N   LYS 140  A 1 1 
ATOM   1036 C  CA  . LYS A 1 140 ?  22.132 34.173 19.667 1 25.4637 ? CA  LYS 140  A 1 1 
ATOM   1037 C  CB  . LYS A 1 140 ?  23.186 33.766  20.67 1 29.0746 ? CB  LYS 140  A 1 1 
ATOM   1038 C  CG  . LYS A 1 140 ?  22.686 33.506  22.05 1 33.1974 ? CG  LYS 140  A 1 1 
ATOM   1039 C  CD  . LYS A 1 140 ?  23.853 33.037 22.927 1 37.6854 ? CD  LYS 140  A 1 1 
ATOM   1040 C  CE  . LYS A 1 140 ?  23.558 33.202 24.403 1 41.1413 ? CE  LYS 140  A 1 1 
ATOM   1041 N  NZ  . LYS A 1 140 ?  24.613 32.551 25.217 1 44.4441 ? NZ  LYS 140  A 1 1 
ATOM   1042 C  C   . LYS A 1 140 ?   22.82 34.723 18.418 1 25.0614 ? C   LYS 140  A 1 1 
ATOM   1043 O  O   . LYS A 1 140 ?  22.993 35.933 18.306 1 24.7247 ? O   LYS 140  A 1 1 
ATOM   1044 N  N   . THR A 1 141 ?  23.193 33.845  17.48 1 23.3432 ? N   THR 141  A 1 1 
ATOM   1045 C  CA  . THR A 1 141 ?  24.018  34.26 16.348 1 22.7936 ? CA  THR 141  A 1 1 
ATOM   1046 C  CB  . THR A 1 141 ?  24.906 33.141 15.843 1  22.701 ? CB  THR 141  A 1 1 
ATOM   1047 O  OG1 . THR A 1 141 ?  24.097 32.054 15.353 1 22.1961 ? OG1 THR 141  A 1 1 
ATOM   1048 C  CG2 . THR A 1 141 ?  25.867 32.619 16.876 1 24.4082 ? CG2 THR 141  A 1 1 
ATOM   1049 C  C   . THR A 1 141 ?   23.22  34.76 15.146 1  21.869 ? C   THR 141  A 1 1 
ATOM   1050 O  O   . THR A 1 141 ?  23.776 35.315 14.198 1 21.0567 ? O   THR 141  A 1 1 
ATOM   1051 N  N   . PHE A 1 142 ?  21.903 34.564 15.175 1 20.9661 ? N   PHE 142  A 1 1 
ATOM   1052 C  CA  . PHE A 1 142 ?  21.125 34.769  13.97 1 21.1015 ? CA  PHE 142  A 1 1 
ATOM   1053 C  CB  . PHE A 1 142 ?  21.121 33.459  13.17 1 20.4987 ? CB  PHE 142  A 1 1 
ATOM   1054 C  CG  . PHE A 1 142 ?    20.6 33.595 11.748 1 20.1511 ? CG  PHE 142  A 1 1 
ATOM   1055 C  CD1 . PHE A 1 142 ?  21.267 34.381  10.82 1 19.9648 ? CD1 PHE 142  A 1 1 
ATOM   1056 C  CD2 . PHE A 1 142 ?  19.459 32.934 11.348 1 20.7065 ? CD2 PHE 142  A 1 1 
ATOM   1057 C  CE1 . PHE A 1 142 ?  20.828 34.485  9.512 1 19.6515 ? CE1 PHE 142  A 1 1 
ATOM   1058 C  CE2 . PHE A 1 142 ?  19.004 33.043 10.046 1 20.0728 ? CE2 PHE 142  A 1 1 
ATOM   1059 C  CZ  . PHE A 1 142 ?  19.691  33.81  9.122 1 19.7579 ? CZ  PHE 142  A 1 1 
ATOM   1060 C  C   . PHE A 1 142 ?  19.708 35.277 14.242 1 20.3704 ? C   PHE 142  A 1 1 
ATOM   1061 O  O   . PHE A 1 142 ?  19.332 36.373 13.816 1 21.5268 ? O   PHE 142  A 1 1 
ATOM   1062 N  N   . ALA A 1 143 ?  18.898 34.482 14.942 1 20.7713 ? N   ALA 143  A 1 1 
ATOM   1063 C  CA  . ALA A 1 143 ?    17.5 34.845 15.125 1 19.8415 ? CA  ALA 143  A 1 1 
ATOM   1064 C  CB  . ALA A 1 143 ?   16.76 33.771 15.902 1 18.8027 ? CB  ALA 143  A 1 1 
ATOM   1065 C  C   . ALA A 1 143 ?  17.328 36.191 15.832 1 20.5515 ? C   ALA 143  A 1 1 
ATOM   1066 O  O   . ALA A 1 143 ?  16.441 36.964 15.484 1 19.9011 ? O   ALA 143  A 1 1 
ATOM   1067 N  N   . ASN A 1 144 ?  18.064 36.402 16.924 1 21.4805 ? N   ASN 144  A 1 1 
ATOM   1068 C  CA  . ASN A 1 144 ?  17.906 37.618 17.715 1 22.9436 ? CA  ASN 144  A 1 1 
ATOM   1069 C  CB  . ASN A 1 144 ?  18.516 37.494 19.123 1 24.1394 ? CB  ASN 144  A 1 1 
ATOM   1070 C  CG  . ASN A 1 144 ?  17.755 36.526 19.986 1 25.3038 ? CG  ASN 144  A 1 1 
ATOM   1071 O  OD1 . ASN A 1 144 ?  16.701 36.058 19.609 1 25.9043 ? OD1 ASN 144  A 1 1 
ATOM   1072 N  ND2 . ASN A 1 144 ?  18.258 36.231 21.167 1 24.9337 ? ND2 ASN 144  A 1 1 
ATOM   1073 C  C   . ASN A 1 144 ?  18.568   38.8 17.021 1  23.351 ? C   ASN 144  A 1 1 
ATOM   1074 O  O   . ASN A 1 144 ?  18.096 39.933 17.143 1 25.0853 ? O   ASN 144  A 1 1 
ATOM   1075 N  N   . ALA A 1 145 ?   19.66 38.495 16.321 1 22.2415 ? N   ALA 145  A 1 1 
ATOM   1076 C  CA  . ALA A 1 145 ?  20.553 39.501 15.766 1 21.7535 ? CA  ALA 145  A 1 1 
ATOM   1077 C  CB  . ALA A 1 145 ?  21.916 38.906 15.523 1 22.1052 ? CB  ALA 145  A 1 1 
ATOM   1078 C  C   . ALA A 1 145 ?  20.024 40.144 14.487 1  20.428 ? C   ALA 145  A 1 1 
ATOM   1079 O  O   . ALA A 1 145 ?  19.982 41.369 14.374 1 20.4987 ? O   ALA 145  A 1 1 
ATOM   1080 N  N   . VAL A 1 146 ?  19.526 39.332 13.557 1 18.7398 ? N   VAL 146  A 1 1 
ATOM   1081 C  CA  . VAL A 1 146 ?  19.109 39.864 12.274 1 18.7936 ? CA  VAL 146  A 1 1 
ATOM   1082 C  CB  . VAL A 1 146 ?  18.752  38.73 11.304 1 18.4008 ? CB  VAL 146  A 1 1 
ATOM   1083 C  CG1 . VAL A 1 146 ?  17.923 39.277 10.168 1 18.8492 ? CG1 VAL 146  A 1 1 
ATOM   1084 C  CG2 . VAL A 1 146 ?  19.974 38.028 10.796 1 19.4019 ? CG2 VAL 146  A 1 1 
ATOM   1085 C  C   . VAL A 1 146 ?  17.965 40.876 12.405 1 18.3956 ? C   VAL 146  A 1 1 
ATOM   1086 O  O   . VAL A 1 146 ?  18.095 41.991 11.918 1 19.2234 ? O   VAL 146  A 1 1 
ATOM   1087 N  N   . PRO A 1 147 ?  16.806 40.553 13.025 1 18.6038 ? N   PRO 147  A 1 1 
ATOM   1088 C  CA  . PRO A 1 147 ?  15.693   41.5 13.096 1 19.1502 ? CA  PRO 147  A 1 1 
ATOM   1089 C  CB  . PRO A 1 147 ?  14.561 40.674 13.705 1 19.9706 ? CB  PRO 147  A 1 1 
ATOM   1090 C  CG  . PRO A 1 147 ?  15.214 39.604 14.398 1 20.5441 ? CG  PRO 147  A 1 1 
ATOM   1091 C  CD  . PRO A 1 147 ?  16.457 39.268 13.615 1 19.8237 ? CD  PRO 147  A 1 1 
ATOM   1092 C  C   . PRO A 1 147 ?  16.037 42.759 13.883 1  18.986 ? C   PRO 147  A 1 1 
ATOM   1093 O  O   . PRO A 1 147 ?  15.535 43.828 13.566 1 19.8421 ? O   PRO 147  A 1 1 
ATOM   1094 N  N   . SER A 1 148 ?  16.929 42.627 14.866 1 18.3628 ? N   SER 148  A 1 1 
ATOM   1095 C  CA  . SER A 1 148 ?  17.458 43.775  15.59 1 19.0736 ? CA  SER 148  A 1 1 
ATOM   1096 C  CB  . SER A 1 148 ?  18.435 43.354 16.691 1 19.3826 ? CB  SER 148  A 1 1 
ATOM   1097 O  OG  . SER A 1 148 ?  18.979 44.474 17.403 1 19.0717 ? OG  SER 148  A 1 1 
ATOM   1098 C  C   . SER A 1 148 ?  18.168 44.733 14.649 1 18.6781 ? C   SER 148  A 1 1 
ATOM   1099 O  O   . SER A 1 148 ?  17.907 45.948 14.668 1 19.3516 ? O   SER 148  A 1 1 
ATOM   1100 N  N   . MET A 1 149 ?  19.081 44.186 13.827 1 18.3729 ? N   MET 149  A 1 1 
ATOM   1101 C  CA  . MET A 1 149 ?   19.79 45.028 12.876 1  18.833 ? CA  MET 149  A 1 1 
ATOM   1102 C  CB  . MET A 1 149 ?  20.864 44.266 12.108 1 19.6875 ? CB  MET 149  A 1 1 
ATOM   1103 C  CG  . MET A 1 149 ?  21.978 43.675 12.976 1 20.8807 ? CG  MET 149  A 1 1 
ATOM   1104 S  SD  . MET A 1 149 ?  22.819 44.872 14.108 1 23.6099 ? SD  MET 149  A 1 1 
ATOM   1105 C  CE  . MET A 1 149 ?   22.03 44.563 15.685 1 23.7998 ? CE  MET 149  A 1 1 
ATOM   1106 C  C   . MET A 1 149 ?  18.809 45.684 11.897 1 19.1086 ? C   MET 149  A 1 1 
ATOM   1107 O  O   . MET A 1 149 ?  18.978 46.863 11.542 1 19.3043 ? O   MET 149  A 1 1 
ATOM   1108 N  N   . VAL A 1 150 ?  17.834 44.918 11.381 1 17.9406 ? N   VAL 150  A 1 1 
ATOM   1109 C  CA  . VAL A 1 150 ?  16.926 45.459 10.371 1 17.8992 ? CA  VAL 150  A 1 1 
ATOM   1110 C  CB  . VAL A 1 150 ?   15.94 44.385  9.884 1 17.9208 ? CB  VAL 150  A 1 1 
ATOM   1111 C  CG1 . VAL A 1 150 ?   14.92 44.968  8.941 1  18.483 ? CG1 VAL 150  A 1 1 
ATOM   1112 C  CG2 . VAL A 1 150 ?  16.678 43.196  9.257 1 17.8169 ? CG2 VAL 150  A 1 1 
ATOM   1113 C  C   . VAL A 1 150 ?  16.169 46.678 10.914 1 18.4906 ? C   VAL 150  A 1 1 
ATOM   1114 O  O   . VAL A 1 150 ?  16.121 47.755 10.278 1 19.1849 ? O   VAL 150  A 1 1 
ATOM   1115 N  N   . ILE A 1 151 ?  15.561  46.51 12.084 1 19.0486 ? N   ILE 151  A 1 1 
ATOM   1116 C  CA  . ILE A 1 151 ?  14.727 47.574  12.62 1 20.0408 ? CA  ILE 151  A 1 1 
ATOM   1117 C  CB  . ILE A 1 151 ?  13.699 47.051 13.626 1 19.5429 ? CB  ILE 151  A 1 1 
ATOM   1118 C  CG1 . ILE A 1 151 ?   12.55 48.072 13.799 1 20.7561 ? CG1 ILE 151  A 1 1 
ATOM   1119 C  CG2 . ILE A 1 151 ?  14.292 46.686 14.996 1 19.1931 ? CG2 ILE 151  A 1 1 
ATOM   1120 C  CD1 . ILE A 1 151 ?  11.642 48.209 12.577 1 20.9042 ? CD1 ILE 151  A 1 1 
ATOM   1121 C  C   . ILE A 1 151 ?  15.595 48.717 13.149 1 19.8352 ? C   ILE 151  A 1 1 
ATOM   1122 O  O   . ILE A 1 151 ?  15.215  49.88 13.056 1 21.3864 ? O   ILE 151  A 1 1 
ATOM   1123 N  N   . SER A 1 152 ?  16.767 48.374 13.667 1 19.3213 ? N   SER 152  A 1 1 
ATOM   1124 C  CA  . SER A 1 152 ?  17.679 49.378 14.193 1 20.0101 ? CA  SER 152  A 1 1 
ATOM   1125 C  CB  . SER A 1 152 ?   18.84 48.772 14.951 1 20.1014 ? CB  SER 152  A 1 1 
ATOM   1126 O  OG  . SER A 1 152 ?  18.414 48.152 16.161 1 19.4895 ? OG  SER 152  A 1 1 
ATOM   1127 C  C   . SER A 1 152 ?  18.151 50.235 13.025 1 20.6362 ? C   SER 152  A 1 1 
ATOM   1128 O  O   . SER A 1 152 ?  18.198 51.436 13.156 1 20.6016 ? O   SER 152  A 1 1 
ATOM   1129 N  N   . ASP A 1 153 ?  18.454 49.626 11.867 1  20.771 ? N   ASP 153  A 1 1 
ATOM   1130 C  CA  . ASP A 1 153 ?  18.845 50.426 10.711 1 21.3776 ? CA  ASP 153  A 1 1 
ATOM   1131 C  CB  . ASP A 1 153 ?  19.252 49.542  9.532 1 21.5024 ? CB  ASP 153  A 1 1 
ATOM   1132 C  CG  . ASP A 1 153 ?  20.647 48.905  9.549 1 22.0084 ? CG  ASP 153  A 1 1 
ATOM   1133 O  OD1 . ASP A 1 153 ?  21.479 49.231 10.486 1 22.9598 ? OD1 ASP 153  A 1 1 
ATOM   1134 O  OD2 . ASP A 1 153 ?  20.944  48.14  8.617 1 21.9992 ? OD2 ASP 153  A 1 1 
ATOM   1135 C  C   . ASP A 1 153 ?  17.752 51.394 10.248 1 21.2457 ? C   ASP 153  A 1 1 
ATOM   1136 O  O   . ASP A 1 153 ?  18.016 52.571  9.943 1 20.6707 ? O   ASP 153  A 1 1 
ATOM   1137 N  N   . LEU A 1 154 ?  16.506 50.928 10.265 1  21.303 ? N   LEU 154  A 1 1 
ATOM   1138 C  CA  . LEU A 1 154 ?  15.395 51.762  9.829 1  22.099 ? CA  LEU 154  A 1 1 
ATOM   1139 C  CB  . LEU A 1 154 ?  14.093 50.933  9.748 1 21.5573 ? CB  LEU 154  A 1 1 
ATOM   1140 C  CG  . LEU A 1 154 ?  12.816 51.687  9.412 1 22.4983 ? CG  LEU 154  A 1 1 
ATOM   1141 C  CD1 . LEU A 1 154 ?  12.835 52.271  8.002 1 21.9674 ? CD1 LEU 154  A 1 1 
ATOM   1142 C  CD2 . LEU A 1 154 ?  11.554 50.751  9.618 1 22.8768 ? CD2 LEU 154  A 1 1 
ATOM   1143 C  C   . LEU A 1 154 ?  15.251 52.959 10.757 1 21.3581 ? C   LEU 154  A 1 1 
ATOM   1144 O  O   . LEU A 1 154 ?  14.891 54.052 10.308 1 22.6701 ? O   LEU 154  A 1 1 
ATOM   1145 N  N   . PHE A 1 155 ?  15.567 52.763 12.037 1 21.3085 ? N   PHE 155  A 1 1 
ATOM   1146 C  CA  . PHE A 1 155 ?  15.476 53.829 13.025 1 22.2938 ? CA  PHE 155  A 1 1 
ATOM   1147 C  CB  . PHE A 1 155 ?  14.953 53.223 14.362 1 21.8409 ? CB  PHE 155  A 1 1 
ATOM   1148 C  CG  . PHE A 1 155 ?  13.435 53.145 14.443 1  21.713 ? CG  PHE 155  A 1 1 
ATOM   1149 C  CD1 . PHE A 1 155 ?  12.705 54.189 14.939 1 22.4522 ? CD1 PHE 155  A 1 1 
ATOM   1150 C  CD2 . PHE A 1 155 ?  12.752 52.042 13.963 1 22.1346 ? CD2 PHE 155  A 1 1 
ATOM   1151 C  CE1 . PHE A 1 155 ?  11.313 54.149 14.968 1 22.5304 ? CE1 PHE 155  A 1 1 
ATOM   1152 C  CE2 . PHE A 1 155 ?  11.338 52.006 13.983 1 22.4969 ? CE2 PHE 155  A 1 1 
ATOM   1153 C  CZ  . PHE A 1 155 ?  10.633 53.063 14.468 1  21.762 ? CZ  PHE 155  A 1 1 
ATOM   1154 C  C   . PHE A 1 155 ?  16.776 54.613 13.246 1  22.088 ? C   PHE 155  A 1 1 
ATOM   1155 O  O   . PHE A 1 155 ?  16.773 55.576     14 1 21.6481 ? O   PHE 155  A 1 1 
ATOM   1156 N  N   . GLY A 1 156 ?  17.876 54.201 12.595 1 22.5089 ? N   GLY 156  A 1 1 
ATOM   1157 C  CA  . GLY A 1 156 ?   19.18 54.842 12.772 1 23.9281 ? CA  GLY 156  A 1 1 
ATOM   1158 C  C   . GLY A 1 156 ?  19.729 54.726   14.2 1 24.4875 ? C   GLY 156  A 1 1 
ATOM   1159 O  O   . GLY A 1 156 ?   20.39  55.63 14.708 1 23.8985 ? O   GLY 156  A 1 1 
ATOM   1160 N  N   . VAL A 1 157 ?  19.424 53.602 14.859 1 23.0481 ? N   VAL 157  A 1 1 
ATOM   1161 C  CA  . VAL A 1 157 ?  19.965 53.334 16.182 1 23.1298 ? CA  VAL 157  A 1 1 
ATOM   1162 C  CB  . VAL A 1 157 ?  19.265 52.187 16.861 1 22.0486 ? CB  VAL 157  A 1 1 
ATOM   1163 C  CG1 . VAL A 1 157 ?  19.921 51.874 18.184 1 23.1988 ? CG1 VAL 157  A 1 1 
ATOM   1164 C  CG2 . VAL A 1 157 ?  17.809 52.471 17.033 1 22.8359 ? CG2 VAL 157  A 1 1 
ATOM   1165 C  C   . VAL A 1 157 ?  21.452 53.007 16.112 1 23.4141 ? C   VAL 157  A 1 1 
ATOM   1166 O  O   . VAL A 1 157 ?  21.852  52.03 15.476 1 21.9429 ? O   VAL 157  A 1 1 
ATOM   1167 N  N   . PRO A 1 158 ?  22.317 53.797 16.779 1 23.6655 ? N   PRO 158  A 1 1 
ATOM   1168 C  CA  . PRO A 1 158 ?  23.755 53.526 16.761 1 25.2391 ? CA  PRO 158  A 1 1 
ATOM   1169 C  CB  . PRO A 1 158 ?  24.309 54.527 17.775 1 26.6028 ? CB  PRO 158  A 1 1 
ATOM   1170 C  CG  . PRO A 1 158 ?  23.342 55.671 17.742 1 26.3482 ? CG  PRO 158  A 1 1 
ATOM   1171 C  CD  . PRO A 1 158 ?  21.962 54.981 17.562 1 25.3887 ? CD  PRO 158  A 1 1 
ATOM   1172 C  C   . PRO A 1 158 ?  24.075 52.079 17.119 1 25.1544 ? C   PRO 158  A 1 1 
ATOM   1173 O  O   . PRO A 1 158 ?  23.404 51.517 17.994 1 23.6073 ? O   PRO 158  A 1 1 
ATOM   1174 N  N   . VAL A 1 159 ?   25.04 51.483 16.399 1 24.6639 ? N   VAL 159  A 1 1 
ATOM   1175 C  CA  . VAL A 1 159 ?  25.287 50.049 16.508 1 25.5509 ? CA  VAL 159  A 1 1 
ATOM   1176 C  CB  . VAL A 1 159 ?  26.391  49.51 15.544 1  25.334 ? CB  VAL 159  A 1 1 
ATOM   1177 C  CG1 . VAL A 1 159 ?  25.912 49.556 14.106 1 24.8408 ? CG1 VAL 159  A 1 1 
ATOM   1178 C  CG2 . VAL A 1 159 ?   27.72 50.246 15.709 1 27.0021 ? CG2 VAL 159  A 1 1 
ATOM   1179 C  C   . VAL A 1 159 ?   25.61 49.644 17.945 1 26.2983 ? C   VAL 159  A 1 1 
ATOM   1180 O  O   . VAL A 1 159 ?  25.199 48.572 18.386 1 25.0471 ? O   VAL 159  A 1 1 
ATOM   1181 N  N   . GLU A 1 160 ?  26.331 50.511 18.678 1 27.0011 ? N   GLU 160  A 1 1 
ATOM   1182 C  CA  . GLU A 1 160 ?  26.714 50.187 20.046 1 28.2544 ? CA  GLU 160  A 1 1 
ATOM   1183 C  CB  . GLU A 1 160 ?  27.863 51.128 20.496 1 31.0139 ? CB  GLU 160  A 1 1 
ATOM   1184 C  CG  . GLU A 1 160 ?  27.446  52.55  20.77 1 32.2112 ? CG  GLU 160  A 1 1 
ATOM   1185 C  CD  . GLU A 1 160 ?  27.487 53.503 19.589 1 34.5222 ? CD  GLU 160  A 1 1 
ATOM   1186 O  OE1 . GLU A 1 160 ?  27.662 53.062 18.419 1 33.8086 ? OE1 GLU 160  A 1 1 
ATOM   1187 O  OE2 . GLU A 1 160 ?  27.342 54.721 19.868 1 34.6727 ? OE2 GLU 160  A 1 1 
ATOM   1188 C  C   . GLU A 1 160 ?  25.577 50.168 21.082 1 27.2024 ? C   GLU 160  A 1 1 
ATOM   1189 O  O   . GLU A 1 160 ?  25.818 49.823 22.241 1 26.7068 ? O   GLU 160  A 1 1 
ATOM   1190 N  N   . ARG A 1 161 ?  24.345 50.529 20.674 1 25.5765 ? N   ARG 161  A 1 1 
ATOM   1191 C  CA  . ARG A 1 161 ?  23.201 50.541 21.568 1 25.8648 ? CA  ARG 161  A 1 1 
ATOM   1192 C  CB  . ARG A 1 161 ?   22.37 51.834 21.451 1 27.5367 ? CB  ARG 161  A 1 1 
ATOM   1193 C  CG  . ARG A 1 161 ?  23.143 53.057 21.685 1 29.4097 ? CG  ARG 161  A 1 1 
ATOM   1194 C  CD  . ARG A 1 161 ?  22.238 54.245 21.689 1 30.8435 ? CD  ARG 161  A 1 1 
ATOM   1195 N  NE  . ARG A 1 161 ?  23.016 55.447 21.423 1 32.6071 ? NE  ARG 161  A 1 1 
ATOM   1196 C  CZ  . ARG A 1 161 ?  22.489 56.625 21.131 1 32.0818 ? CZ  ARG 161  A 1 1 
ATOM   1197 N  NH1 . ARG A 1 161 ?  21.202 56.754 20.819 1 30.2888 ? NH1 ARG 161  A 1 1 
ATOM   1198 N  NH2 . ARG A 1 161 ?   23.27 57.698 21.162 1  33.604 ? NH2 ARG 161  A 1 1 
ATOM   1199 C  C   . ARG A 1 161 ?  22.236 49.409 21.276 1 24.2066 ? C   ARG 161  A 1 1 
ATOM   1200 O  O   . ARG A 1 161 ?  21.271  49.25 22.008 1 24.1246 ? O   ARG 161  A 1 1 
ATOM   1201 N  N   . ARG A 1 162 ?  22.477 48.638 20.212 1  22.959 ? N   ARG 162  A 1 1 
ATOM   1202 C  CA  . ARG A 1 162 ?  21.445  47.74 19.729 1 23.7412 ? CA  ARG 162  A 1 1 
ATOM   1203 C  CB  . ARG A 1 162 ?  21.736  47.26 18.285 1 22.5856 ? CB  ARG 162  A 1 1 
ATOM   1204 C  CG  . ARG A 1 162 ?  21.693 48.408 17.322 1 23.2251 ? CG  ARG 162  A 1 1 
ATOM   1205 C  CD  . ARG A 1 162 ?  22.112 48.022 15.894 1 22.1686 ? CD  ARG 162  A 1 1 
ATOM   1206 N  NE  . ARG A 1 162 ?  22.069 49.205 15.046 1 23.5589 ? NE  ARG 162  A 1 1 
ATOM   1207 C  CZ  . ARG A 1 162 ?  21.967 49.175 13.716 1 23.4291 ? CZ  ARG 162  A 1 1 
ATOM   1208 N  NH1 . ARG A 1 162 ?  21.943 48.037 13.053 1 23.9963 ? NH1 ARG 162  A 1 1 
ATOM   1209 N  NH2 . ARG A 1 162 ?  21.883 50.315 13.042 1 24.9568 ? NH2 ARG 162  A 1 1 
ATOM   1210 C  C   . ARG A 1 162 ?  21.277 46.558 20.676 1 23.1886 ? C   ARG 162  A 1 1 
ATOM   1211 O  O   . ARG A 1 162 ?  20.177 46.039 20.814 1 23.2662 ? O   ARG 162  A 1 1 
ATOM   1212 N  N   . ALA A 1 163 ?  22.375 46.138 21.309 1 23.0541 ? N   ALA 163  A 1 1 
ATOM   1213 C  CA  . ALA A 1 163 ?   22.35  44.99 22.195 1 24.6227 ? CA  ALA 163  A 1 1 
ATOM   1214 C  CB  . ALA A 1 163 ?  23.766 44.622 22.614 1 25.1366 ? CB  ALA 163  A 1 1 
ATOM   1215 C  C   . ALA A 1 163 ?  21.478 45.314 23.404 1 25.3591 ? C   ALA 163  A 1 1 
ATOM   1216 O  O   . ALA A 1 163 ?  20.735  44.48 23.896 1 24.2741 ? O   ALA 163  A 1 1 
ATOM   1217 N  N   . GLU A 1 164 ?  21.534 46.563 23.857 1 26.3164 ? N   GLU 164  A 1 1 
ATOM   1218 C  CA  . GLU A 1 164 ?  20.674 47.008 24.936 1 27.8476 ? CA  GLU 164  A 1 1 
ATOM   1219 C  CB  . GLU A 1 164 ?  20.958 48.459 25.303 1 31.1189 ? CB  GLU 164  A 1 1 
ATOM   1220 C  CG  . GLU A 1 164 ?  22.071 48.658 26.272 1 35.1582 ? CG  GLU 164  A 1 1 
ATOM   1221 C  CD  . GLU A 1 164 ?  22.075 50.097 26.756 1 37.8381 ? CD  GLU 164  A 1 1 
ATOM   1222 O  OE1 . GLU A 1 164 ?  21.206  50.45 27.585 1 38.5325 ? OE1 GLU 164  A 1 1 
ATOM   1223 O  OE2 . GLU A 1 164 ?  22.883 50.889 26.213 1 40.8185 ? OE2 GLU 164  A 1 1 
ATOM   1224 C  C   . GLU A 1 164 ?  19.192 46.871 24.602 1 26.0649 ? C   GLU 164  A 1 1 
ATOM   1225 O  O   . GLU A 1 164 ?  18.429 46.431 25.448 1 23.5975 ? O   GLU 164  A 1 1 
ATOM   1226 N  N   . PHE A 1 165 ?  18.789 47.258 23.377 1 25.3589 ? N   PHE 165  A 1 1 
ATOM   1227 C  CA  . PHE A 1 165 ?  17.403  47.09 22.956 1 25.1396 ? CA  PHE 165  A 1 1 
ATOM   1228 C  CB  . PHE A 1 165 ?  17.168 47.718 21.561 1 24.8065 ? CB  PHE 165  A 1 1 
ATOM   1229 C  CG  . PHE A 1 165 ?  16.959 49.212 21.542 1 25.4594 ? CG  PHE 165  A 1 1 
ATOM   1230 C  CD1 . PHE A 1 165 ?  15.698 49.755 21.746 1  25.969 ? CD1 PHE 165  A 1 1 
ATOM   1231 C  CD2 . PHE A 1 165 ?  18.022 50.077 21.358 1 27.0237 ? CD2 PHE 165  A 1 1 
ATOM   1232 C  CE1 . PHE A 1 165 ?  15.492 51.108  21.71 1 25.7411 ? CE1 PHE 165  A 1 1 
ATOM   1233 C  CE2 . PHE A 1 165 ?  17.822 51.446 21.359 1 26.6729 ? CE2 PHE 165  A 1 1 
ATOM   1234 C  CZ  . PHE A 1 165 ?  16.547 51.961 21.554 1 26.3054 ? CZ  PHE 165  A 1 1 
ATOM   1235 C  C   . PHE A 1 165 ?  16.982 45.613 22.976 1  24.156 ? C   PHE 165  A 1 1 
ATOM   1236 O  O   . PHE A 1 165 ?  15.887 45.278  23.41 1 23.1975 ? O   PHE 165  A 1 1 
ATOM   1237 N  N   . GLN A 1 166 ?  17.871 44.727 22.512 1 23.3292 ? N   GLN 166  A 1 1 
ATOM   1238 C  CA  . GLN A 1 166 ?  17.626 43.296 22.565 1 24.1381 ? CA  GLN 166  A 1 1 
ATOM   1239 C  CB  . GLN A 1 166 ?   18.81 42.515 21.929 1 24.2445 ? CB  GLN 166  A 1 1 
ATOM   1240 C  CG  . GLN A 1 166 ?  18.945 42.677 20.396 1 24.4095 ? CG  GLN 166  A 1 1 
ATOM   1241 C  CD  . GLN A 1 166 ?  20.233 42.158 19.842 1 24.2891 ? CD  GLN 166  A 1 1 
ATOM   1242 O  OE1 . GLN A 1 166 ?  20.701 41.089  20.27 1 23.3673 ? OE1 GLN 166  A 1 1 
ATOM   1243 N  NE2 . GLN A 1 166 ?  20.792 42.877 18.855 1 23.4028 ? NE2 GLN 166  A 1 1 
ATOM   1244 C  C   . GLN A 1 166 ?  17.423 42.828 24.009 1 24.8547 ? C   GLN 166  A 1 1 
ATOM   1245 O  O   . GLN A 1 166 ?  16.535 42.024 24.274 1 24.3168 ? O   GLN 166  A 1 1 
ATOM   1246 N  N   . ASP A 1 167 ?  18.288 43.292 24.933 1 24.1869 ? N   ASP 167  A 1 1 
ATOM   1247 C  CA  . ASP A 1 167 ?  18.198 42.894 26.331 1  25.589 ? CA  ASP 167  A 1 1 
ATOM   1248 C  CB  . ASP A 1 167 ?  19.436 43.391  27.14 1 27.1253 ? CB  ASP 167  A 1 1 
ATOM   1249 C  CG  . ASP A 1 167 ?  20.736 42.709 26.717 1 28.3951 ? CG  ASP 167  A 1 1 
ATOM   1250 O  OD1 . ASP A 1 167 ?  20.669 41.685 26.001 1 30.1523 ? OD1 ASP 167  A 1 1 
ATOM   1251 O  OD2 . ASP A 1 167 ?  21.815   43.2 27.101 1 29.9341 ? OD2 ASP 167  A 1 1 
ATOM   1252 C  C   . ASP A 1 167 ?  16.904 43.394 26.981 1 25.3927 ? C   ASP 167  A 1 1 
ATOM   1253 O  O   . ASP A 1 167 ?  16.275 42.662  27.76 1 24.4424 ? O   ASP 167  A 1 1 
ATOM   1254 N  N   . ILE A 1 168 ?   16.44  44.59 26.589 1 24.3433 ? N   ILE 168  A 1 1 
ATOM   1255 C  CA  . ILE A 1 168 ?  15.134 45.051 27.046 1  24.949 ? CA  ILE 168  A 1 1 
ATOM   1256 C  CB  . ILE A 1 168 ?  14.809 46.499 26.559 1 26.5855 ? CB  ILE 168  A 1 1 
ATOM   1257 C  CG1 . ILE A 1 168 ?  15.795  47.53 27.127 1  28.078 ? CG1 ILE 168  A 1 1 
ATOM   1258 C  CG2 . ILE A 1 168 ?  13.359 46.876 26.886 1 27.0352 ? CG2 ILE 168  A 1 1 
ATOM   1259 C  CD1 . ILE A 1 168 ?   15.91 47.506 28.553 1 28.6119 ? CD1 ILE 168  A 1 1 
ATOM   1260 C  C   . ILE A 1 168 ?  14.006 44.098 26.637 1 23.1981 ? C   ILE 168  A 1 1 
ATOM   1261 O  O   . ILE A 1 168 ?  13.186 43.734 27.475 1 21.2509 ? O   ILE 168  A 1 1 
ATOM   1262 N  N   . ALA A 1 169 ?  13.986 43.639 25.375 1 22.9634 ? N   ALA 169  A 1 1 
ATOM   1263 C  CA  . ALA A 1 169 ?  12.932 42.734 24.941 1 23.8593 ? CA  ALA 169  A 1 1 
ATOM   1264 C  CB  . ALA A 1 169 ?  13.092 42.341 23.457 1 24.7344 ? CB  ALA 169  A 1 1 
ATOM   1265 C  C   . ALA A 1 169 ?  12.916 41.472 25.803 1  24.387 ? C   ALA 169  A 1 1 
ATOM   1266 O  O   . ALA A 1 169 ?  11.849 40.978 26.168 1 24.4677 ? O   ALA 169  A 1 1 
ATOM   1267 N  N   . GLU A 1 170 ?  14.109 40.969 26.129 1 25.5416 ? N   GLU 170  A 1 1 
ATOM   1268 C  CA  . GLU A 1 170 ?  14.228 39.793 26.973 1 26.9056 ? CA  GLU 170  A 1 1 
ATOM   1269 C  CB  . GLU A 1 170 ?  15.669 39.266 26.973 1  29.548 ? CB  GLU 170  A 1 1 
ATOM   1270 C  CG  . GLU A 1 170 ?  15.934 38.151 27.984 1 32.8785 ? CG  GLU 170  A 1 1 
ATOM   1271 C  CD  . GLU A 1 170 ?  17.381 37.716 27.912 1 36.3072 ? CD  GLU 170  A 1 1 
ATOM   1272 O  OE1 . GLU A 1 170 ?  17.751 37.136 26.867 1 37.0712 ? OE1 GLU 170  A 1 1 
ATOM   1273 O  OE2 . GLU A 1 170 ?  18.161  38.02 28.852 1 40.0831 ? OE2 GLU 170  A 1 1 
ATOM   1274 C  C   . GLU A 1 170 ?  13.788 40.051 28.411 1 24.5196 ? C   GLU 170  A 1 1 
ATOM   1275 O  O   . GLU A 1 170 ?  13.211 39.154 29.021 1 24.2869 ? O   GLU 170  A 1 1 
ATOM   1276 N  N   . ALA A 1 171 ?  14.045  41.26 28.929 1 22.9036 ? N   ALA 171  A 1 1 
ATOM   1277 C  CA  . ALA A 1 171 ?  13.728 41.592 30.308 1 22.7436 ? CA  ALA 171  A 1 1 
ATOM   1278 C  CB  . ALA A 1 171 ?  14.562 42.783 30.789 1 23.1766 ? CB  ALA 171  A 1 1 
ATOM   1279 C  C   . ALA A 1 171 ?   12.25 41.926 30.437 1 22.1467 ? C   ALA 171  A 1 1 
ATOM   1280 O  O   . ALA A 1 171 ?  11.691 41.757 31.503 1 22.3313 ? O   ALA 171  A 1 1 
ATOM   1281 N  N   . MET A 1 172 ?  11.655 42.411 29.345 1 21.7768 ? N   MET 172  A 1 1 
ATOM   1282 C  CA  . MET A 1 172 ?  10.358 43.046 29.379 1 22.3689 ? CA  MET 172  A 1 1 
ATOM   1283 C  CB  . MET A 1 172 ?  10.388 44.282 28.518 1 23.4077 ? CB  MET 172  A 1 1 
ATOM   1284 C  CG  . MET A 1 172 ?   9.151 45.155 28.695 1 25.5633 ? CG  MET 172  A 1 1 
ATOM   1285 S  SD  . MET A 1 172 ?   9.286 46.816 27.923 1 27.7893 ? SD  MET 172  A 1 1 
ATOM   1286 C  CE  . MET A 1 172 ?   9.197 46.223 26.293 1 25.2222 ? CE  MET 172  A 1 1 
ATOM   1287 C  C   . MET A 1 172 ?   9.251 42.097 28.912 1 22.2443 ? C   MET 172  A 1 1 
ATOM   1288 O  O   . MET A 1 172 ?   8.156 42.139 29.442 1 22.0362 ? O   MET 172  A 1 1 
ATOM   1289 N  N   . MET A 1 173 ?   9.507 41.267 27.901 1 22.3375 ? N   MET 173  A 1 1 
ATOM   1290 C  CA  . MET A 1 173 ?   8.418 40.556 27.236 1 22.2553 ? CA  MET 173  A 1 1 
ATOM   1291 C  CB  . MET A 1 173 ?   8.701 40.481 25.746 1 22.3807 ? CB  MET 173  A 1 1 
ATOM   1292 C  CG  . MET A 1 173 ?   8.797 41.866 25.066 1 22.3793 ? CG  MET 173  A 1 1 
ATOM   1293 S  SD  . MET A 1 173 ?   7.223 42.732 24.982 1 23.6055 ? SD  MET 173  A 1 1 
ATOM   1294 C  CE  . MET A 1 173 ?   6.307 41.615 23.926 1 23.2812 ? CE  MET 173  A 1 1 
ATOM   1295 C  C   . MET A 1 173 ?   8.196 39.163 27.838 1 21.8682 ? C   MET 173  A 1 1 
ATOM   1296 O  O   . MET A 1 173 ?   8.214 38.132 27.134 1 21.0493 ? O   MET 173  A 1 1 
ATOM   1297 N  N   . ARG A 1 174 ?   7.948 39.177 29.156 1 23.1052 ? N   ARG 174  A 1 1 
ATOM   1298 C  CA  . ARG A 1 174 ?   7.873 37.991 29.994 1 22.3149 ? CA  ARG 174  A 1 1 
ATOM   1299 C  CB  . ARG A 1 174 ?   8.963 38.048 31.062 1 22.8556 ? CB  ARG 174  A 1 1 
ATOM   1300 C  CG  . ARG A 1 174 ?  10.341 38.417 30.557 1 22.7495 ? CG  ARG 174  A 1 1 
ATOM   1301 C  CD  . ARG A 1 174 ?  11.379 38.282 31.645 1 23.1984 ? CD  ARG 174  A 1 1 
ATOM   1302 N  NE  . ARG A 1 174 ?  11.662 36.889 31.975 1 23.2518 ? NE  ARG 174  A 1 1 
ATOM   1303 C  CZ  . ARG A 1 174 ?  12.503 36.108 31.305 1 22.9766 ? CZ  ARG 174  A 1 1 
ATOM   1304 N  NH1 . ARG A 1 174 ?  13.251 36.575 30.314 1 22.7638 ? NH1 ARG 174  A 1 1 
ATOM   1305 N  NH2 . ARG A 1 174 ?  12.598 34.822 31.641 1 23.6461 ? NH2 ARG 174  A 1 1 
ATOM   1306 C  C   . ARG A 1 174 ?   6.538 37.812 30.715 1 23.2528 ? C   ARG 174  A 1 1 
ATOM   1307 O  O   . ARG A 1 174 ?   5.835 38.778  31.02 1  23.028 ? O   ARG 174  A 1 1 
ATOM   1308 N  N   . VAL A 1 175 ?   6.207 36.562 31.048 1 22.8158 ? N   VAL 175  A 1 1 
ATOM   1309 C  CA  . VAL A 1 175 ?   5.041 36.292 31.878 1 23.4329 ? CA  VAL 175  A 1 1 
ATOM   1310 C  CB  . VAL A 1 175 ?   4.037 35.342 31.136 1 23.3534 ? CB  VAL 175  A 1 1 
ATOM   1311 C  CG1 . VAL A 1 175 ?   3.439 36.023 29.934 1 23.4274 ? CG1 VAL 175  A 1 1 
ATOM   1312 C  CG2 . VAL A 1 175 ?   4.671 34.017 30.737 1 23.1517 ? CG2 VAL 175  A 1 1 
ATOM   1313 C  C   . VAL A 1 175 ?   5.402 35.692  33.23 1 23.9908 ? C   VAL 175  A 1 1 
ATOM   1314 O  O   . VAL A 1 175 ?   4.512 35.228 33.945 1 24.2974 ? O   VAL 175  A 1 1 
ATOM   1315 N  N   . ASP A 1 176 ?   6.701 35.667 33.544 1 23.4914 ? N   ASP 176  A 1 1 
ATOM   1316 C  CA  . ASP A 1 176 ?   7.189 35.005 34.741 1 24.5254 ? CA  ASP 176  A 1 1 
ATOM   1317 C  CB  . ASP A 1 176 ?   8.333 34.034 34.392 1 24.5471 ? CB  ASP 176  A 1 1 
ATOM   1318 C  CG  . ASP A 1 176 ?   9.619 34.682 33.864 1 24.0208 ? CG  ASP 176  A 1 1 
ATOM   1319 O  OD1 . ASP A 1 176 ?   9.604 35.879 33.578 1 23.5051 ? OD1 ASP 176  A 1 1 
ATOM   1320 O  OD2 . ASP A 1 176 ?  10.633 33.983 33.755 1 25.3455 ? OD2 ASP 176  A 1 1 
ATOM   1321 C  C   . ASP A 1 176 ?   7.676 35.958 35.825 1 24.4967 ? C   ASP 176  A 1 1 
ATOM   1322 O  O   . ASP A 1 176 ?   8.487 35.565 36.657 1 24.2289 ? O   ASP 176  A 1 1 
ATOM   1323 N  N   . GLN A 1 177 ?    7.19 37.205 35.825 1 24.4343 ? N   GLN 177  A 1 1 
ATOM   1324 C  CA  . GLN A 1 177 ?   7.684 38.151 36.805 1 25.3752 ? CA  GLN 177  A 1 1 
ATOM   1325 C  CB  . GLN A 1 177 ?   8.935 38.909 36.252 1 24.8487 ? CB  GLN 177  A 1 1 
ATOM   1326 C  CG  . GLN A 1 177 ?   8.602 39.839 35.146 1 23.6383 ? CG  GLN 177  A 1 1 
ATOM   1327 C  CD  . GLN A 1 177 ?   9.869 40.298 34.412 1 24.3185 ? CD  GLN 177  A 1 1 
ATOM   1328 O  OE1 . GLN A 1 177 ?  10.985 39.823 34.653 1 23.3333 ? OE1 GLN 177  A 1 1 
ATOM   1329 N  NE2 . GLN A 1 177 ?   9.688 41.184  33.47 1 23.8278 ? NE2 GLN 177  A 1 1 
ATOM   1330 C  C   . GLN A 1 177 ?   6.554 39.097 37.176 1 26.1564 ? C   GLN 177  A 1 1 
ATOM   1331 O  O   . GLN A 1 177 ?    5.47 39.092 36.575 1  25.721 ? O   GLN 177  A 1 1 
ATOM   1332 N  N   . ASP A 1 178 ?   6.848 39.938 38.158 1  27.338 ? N   ASP 178  A 1 1 
ATOM   1333 C  CA  . ASP A 1 178 ?   5.852  40.86 38.666 1 28.2993 ? CA  ASP 178  A 1 1 
ATOM   1334 C  CB  . ASP A 1 178 ?   6.015 41.003 40.182 1 31.5321 ? CB  ASP 178  A 1 1 
ATOM   1335 C  CG  . ASP A 1 178 ?   7.358 41.497 40.724 1 34.9971 ? CG  ASP 178  A 1 1 
ATOM   1336 O  OD1 . ASP A 1 178 ?   8.249 41.852 39.909 1 37.0328 ? OD1 ASP 178  A 1 1 
ATOM   1337 O  OD2 . ASP A 1 178 ?   7.511 41.542 41.982 1 40.3526 ? OD2 ASP 178  A 1 1 
ATOM   1338 C  C   . ASP A 1 178 ?   5.927 42.186  37.92 1 26.3564 ? C   ASP 178  A 1 1 
ATOM   1339 O  O   . ASP A 1 178 ?   6.866 42.442 37.172 1 25.1803 ? O   ASP 178  A 1 1 
ATOM   1340 N  N   . ALA A 1 179 ?    4.92  43.03 38.114 1 25.6307 ? N   ALA 179  A 1 1 
ATOM   1341 C  CA  . ALA A 1 179 ?   4.839 44.277 37.372 1 25.5165 ? CA  ALA 179  A 1 1 
ATOM   1342 C  CB  . ALA A 1 179 ?   3.564 45.028 37.752 1 26.4453 ? CB  ALA 179  A 1 1 
ATOM   1343 C  C   . ALA A 1 179 ?   6.076 45.159 37.569 1 25.4512 ? C   ALA 179  A 1 1 
ATOM   1344 O  O   . ALA A 1 179 ?   6.552 45.778 36.617 1 24.5974 ? O   ALA 179  A 1 1 
ATOM   1345 N  N   . ALA A 1 180 ?   6.605 45.204 38.798 1 24.8279 ? N   ALA 180  A 1 1 
ATOM   1346 C  CA  . ALA A 1 180 ?   7.785 45.997 39.106 1 25.3336 ? CA  ALA 180  A 1 1 
ATOM   1347 C  CB  . ALA A 1 180 ?   8.133 45.803 40.578 1 26.5352 ? CB  ALA 180  A 1 1 
ATOM   1348 C  C   . ALA A 1 180 ?   8.992 45.699 38.215 1 23.6787 ? C   ALA 180  A 1 1 
ATOM   1349 O  O   . ALA A 1 180 ?   9.684 46.605 37.763 1 23.6258 ? O   ALA 180  A 1 1 
ATOM   1350 N  N   . ALA A 1 181 ?   9.252 44.411 37.958 1 23.7562 ? N   ALA 181  A 1 1 
ATOM   1351 C  CA  . ALA A 1 181 ?  10.295 44.016 37.027 1 22.6829 ? CA  ALA 181  A 1 1 
ATOM   1352 C  CB  . ALA A 1 181 ?  10.487 42.509  37.11 1 23.1045 ? CB  ALA 181  A 1 1 
ATOM   1353 C  C   . ALA A 1 181 ?  10.014 44.465 35.587 1 21.6071 ? C   ALA 181  A 1 1 
ATOM   1354 O  O   . ALA A 1 181 ?  10.881 45.031 34.904 1 20.1755 ? O   ALA 181  A 1 1 
ATOM   1355 N  N   . THR A 1 182 ?   8.777 44.262 35.129 1 21.4709 ? N   THR 182  A 1 1 
ATOM   1356 C  CA  . THR A 1 182 ?   8.438 44.593  33.75 1 20.8258 ? CA  THR 182  A 1 1 
ATOM   1357 C  CB  . THR A 1 182 ?   7.052 44.036 33.427 1 21.3961 ? CB  THR 182  A 1 1 
ATOM   1358 O  OG1 . THR A 1 182 ?   7.043 42.654  33.72 1 21.1134 ? OG1 THR 182  A 1 1 
ATOM   1359 C  CG2 . THR A 1 182 ?   6.658 44.297 32.038 1 21.2215 ? CG2 THR 182  A 1 1 
ATOM   1360 C  C   . THR A 1 182 ?   8.533 46.106 33.537 1 21.1524 ? C   THR 182  A 1 1 
ATOM   1361 O  O   . THR A 1 182 ?   9.073 46.588 32.541 1  20.275 ? O   THR 182  A 1 1 
ATOM   1362 N  N   . GLU A 1 183 ?   7.967 46.868 34.467 1 21.8366 ? N   GLU 183  A 1 1 
ATOM   1363 C  CA  . GLU A 1 183 ?   7.996 48.325 34.368 1 23.2177 ? CA  GLU 183  A 1 1 
ATOM   1364 C  CB  . GLU A 1 183 ?   7.146 48.995 35.449 1 24.4588 ? CB  GLU 183  A 1 1 
ATOM   1365 C  CG  . GLU A 1 183 ?   5.674 48.693 35.329 1  26.021 ? CG  GLU 183  A 1 1 
ATOM   1366 C  CD  . GLU A 1 183 ?     4.8  49.65 36.118 1 27.8658 ? CD  GLU 183  A 1 1 
ATOM   1367 O  OE1 . GLU A 1 183 ?   5.229 50.145 37.182 1 31.0879 ? OE1 GLU 183  A 1 1 
ATOM   1368 O  OE2 . GLU A 1 183 ?   3.683 49.918 35.658 1 28.9452 ? OE2 GLU 183  A 1 1 
ATOM   1369 C  C   . GLU A 1 183 ?   9.393 48.915 34.481 1 23.0212 ? C   GLU 183  A 1 1 
ATOM   1370 O  O   . GLU A 1 183 ?   9.676 49.961 33.905 1 22.7687 ? O   GLU 183  A 1 1 
ATOM   1371 N  N   . ALA A 1 184 ?  10.274 48.259 35.249 1  23.414 ? N   ALA 184  A 1 1 
ATOM   1372 C  CA  . ALA A 1 184 ?  11.631 48.777 35.329 1 23.8107 ? CA  ALA 184  A 1 1 
ATOM   1373 C  CB  . ALA A 1 184 ?  12.443 48.111  36.41 1 24.5623 ? CB  ALA 184  A 1 1 
ATOM   1374 C  C   . ALA A 1 184 ?  12.331 48.646 33.987 1 23.2627 ? C   ALA 184  A 1 1 
ATOM   1375 O  O   . ALA A 1 184 ?  13.097 49.527 33.623 1 22.7893 ? O   ALA 184  A 1 1 
ATOM   1376 N  N   . ALA A 1 185 ?  12.078  47.54 33.255 1 22.3525 ? N   ALA 185  A 1 1 
ATOM   1377 C  CA  . ALA A 1 185 ?  12.628 47.383 31.925 1 21.5869 ? CA  ALA 185  A 1 1 
ATOM   1378 C  CB  . ALA A 1 185 ?  12.329 45.972 31.436 1 21.4144 ? CB  ALA 185  A 1 1 
ATOM   1379 C  C   . ALA A 1 185 ?  12.048 48.428 30.976 1 21.3767 ? C   ALA 185  A 1 1 
ATOM   1380 O  O   . ALA A 1 185 ?  12.756 49.005 30.129 1 20.5627 ? O   ALA 185  A 1 1 
ATOM   1381 N  N   . GLY A 1 186 ?  10.722 48.586 31.051 1 21.8104 ? N   GLY 186  A 1 1 
ATOM   1382 C  CA  . GLY A 1 186 ?  10.011 49.668 30.376 1 22.2502 ? CA  GLY 186  A 1 1 
ATOM   1383 C  C   . GLY A 1 186 ?  10.665 51.032 30.601 1 22.4313 ? C   GLY 186  A 1 1 
ATOM   1384 O  O   . GLY A 1 186 ?  10.863   51.8 29.662 1 22.0117 ? O   GLY 186  A 1 1 
ATOM   1385 N  N   . MET A 1 187 ?  11.038 51.326 31.852 1 24.1865 ? N   MET 187  A 1 1 
ATOM   1386 C  CA  . MET A 1 187 ?  11.561 52.638 32.185 1 25.5372 ? CA  MET 187  A 1 1 
ATOM   1387 C  CB  . MET A 1 187 ?  11.626 52.795 33.714 1 27.0341 ? CB  MET 187  A 1 1 
ATOM   1388 C  CG  . MET A 1 187 ?  11.654 54.204 34.194 1 30.1961 ? CG  MET 187  A 1 1 
ATOM   1389 S  SD  . MET A 1 187 ?  11.239 54.374 35.985 1 32.5557 ? SD  MET 187  A 1 1 
ATOM   1390 C  CE  . MET A 1 187 ?  10.138 53.227 36.164 1 32.0001 ? CE  MET 187  A 1 1 
ATOM   1391 C  C   . MET A 1 187 ?  12.932 52.823 31.533 1 24.5214 ? C   MET 187  A 1 1 
ATOM   1392 O  O   . MET A 1 187 ?  13.206 53.884 30.958 1 22.6402 ? O   MET 187  A 1 1 
ATOM   1393 N  N   . ARG A 1 188 ?  13.772  51.78 31.611 1 23.8567 ? N   ARG 188  A 1 1 
ATOM   1394 C  CA  . ARG A 1 188 ?  15.079 51.775 30.971 1 24.9405 ? CA  ARG 188  A 1 1 
ATOM   1395 C  CB  . ARG A 1 188 ?  15.855 50.478 31.201 1  25.757 ? CB  ARG 188  A 1 1 
ATOM   1396 C  CG  . ARG A 1 188 ?  16.245 50.223 32.646 1 28.1977 ? CG  ARG 188  A 1 1 
ATOM   1397 C  CD  . ARG A 1 188 ?  17.396 49.206 32.784 1 29.8026 ? CD  ARG 188  A 1 1 
ATOM   1398 N  NE  . ARG A 1 188 ?  17.136 47.922 32.135 1 30.3564 ? NE  ARG 188  A 1 1 
ATOM   1399 C  CZ  . ARG A 1 188 ?  16.306 46.986 32.599 1 32.4931 ? CZ  ARG 188  A 1 1 
ATOM   1400 N  NH1 . ARG A 1 188 ?  15.661 47.127 33.754 1   32.54 ? NH1 ARG 188  A 1 1 
ATOM   1401 N  NH2 . ARG A 1 188 ?  16.141 45.866 31.906 1 32.2031 ? NH2 ARG 188  A 1 1 
ATOM   1402 C  C   . ARG A 1 188 ?  14.934 51.988 29.464 1  22.953 ? C   ARG 188  A 1 1 
ATOM   1403 O  O   . ARG A 1 188 ?  15.663 52.764 28.853 1 22.2278 ? O   ARG 188  A 1 1 
ATOM   1404 N  N   . LEU A 1 189 ?  13.926 51.358 28.875 1 21.2907 ? N   LEU 189  A 1 1 
ATOM   1405 C  CA  . LEU A 1 189 ?  13.689 51.564 27.457 1 21.0143 ? CA  LEU 189  A 1 1 
ATOM   1406 C  CB  . LEU A 1 189 ?  12.532 50.665 26.976 1  20.978 ? CB  LEU 189  A 1 1 
ATOM   1407 C  CG  . LEU A 1 189 ?  12.115 50.807 25.521 1 21.0865 ? CG  LEU 189  A 1 1 
ATOM   1408 C  CD1 . LEU A 1 189 ?  13.204 50.424 24.549 1 20.4047 ? CD1 LEU 189  A 1 1 
ATOM   1409 C  CD2 . LEU A 1 189 ?  10.888 49.908 25.222 1 21.8615 ? CD2 LEU 189  A 1 1 
ATOM   1410 C  C   . LEU A 1 189 ?   13.41 53.037  27.17 1 20.4217 ? C   LEU 189  A 1 1 
ATOM   1411 O  O   . LEU A 1 189 ?  13.914 53.598 26.189 1 20.7349 ? O   LEU 189  A 1 1 
ATOM   1412 N  N   . GLY A 1 190 ?  12.612 53.673 28.038 1  20.272 ? N   GLY 190  A 1 1 
ATOM   1413 C  CA  . GLY A 1 190 ?  12.276 55.078 27.868 1 20.8804 ? CA  GLY 190  A 1 1 
ATOM   1414 C  C   . GLY A 1 190 ?  13.515 55.964 27.769 1  21.179 ? C   GLY 190  A 1 1 
ATOM   1415 O  O   . GLY A 1 190 ?   13.56  56.88 26.958 1 20.4726 ? O   GLY 190  A 1 1 
ATOM   1416 N  N   . GLY A 1 191 ?  14.547 55.666 28.574 1 21.6052 ? N   GLY 191  A 1 1 
ATOM   1417 C  CA  . GLY A 1 191 ?  15.806 56.395 28.475 1 22.0387 ? CA  GLY 191  A 1 1 
ATOM   1418 C  C   . GLY A 1 191 ?  16.451 56.284  27.09 1 22.2931 ? C   GLY 191  A 1 1 
ATOM   1419 O  O   . GLY A 1 191 ?  16.946 57.273 26.531 1 21.4868 ? O   GLY 191  A 1 1 
ATOM   1420 N  N   . LEU A 1 192 ?  16.472 55.062 26.548 1 21.6013 ? N   LEU 192  A 1 1 
ATOM   1421 C  CA  . LEU A 1 192 ?  17.044 54.851 25.226 1 22.8218 ? CA  LEU 192  A 1 1 
ATOM   1422 C  CB  . LEU A 1 192 ?  17.106  53.37  24.88 1 23.2193 ? CB  LEU 192  A 1 1 
ATOM   1423 C  CG  . LEU A 1 192 ?  17.909 52.496 25.789 1 24.8708 ? CG  LEU 192  A 1 1 
ATOM   1424 C  CD1 . LEU A 1 192 ?  17.659 50.981 25.448 1 25.6956 ? CD1 LEU 192  A 1 1 
ATOM   1425 C  CD2 . LEU A 1 192 ?  19.376 52.865 25.745 1 27.3952 ? CD2 LEU 192  A 1 1 
ATOM   1426 C  C   . LEU A 1 192 ?  16.241 55.581  24.15 1 21.5294 ? C   LEU 192  A 1 1 
ATOM   1427 O  O   . LEU A 1 192 ?  16.832 56.181 23.258 1 21.7994 ? O   LEU 192  A 1 1 
ATOM   1428 N  N   . LEU A 1 193 ?  14.906 55.565 24.286 1 21.4783 ? N   LEU 193  A 1 1 
ATOM   1429 C  CA  . LEU A 1 193 ?  14.014 56.189  23.31 1 22.1291 ? CA  LEU 193  A 1 1 
ATOM   1430 C  CB  . LEU A 1 193 ?  12.572 55.783 23.552 1 22.1413 ? CB  LEU 193  A 1 1 
ATOM   1431 C  CG  . LEU A 1 193 ?  12.301 54.306 23.425 1 23.0733 ? CG  LEU 193  A 1 1 
ATOM   1432 C  CD1 . LEU A 1 193 ?   10.92 53.962  23.93 1 23.9912 ? CD1 LEU 193  A 1 1 
ATOM   1433 C  CD2 . LEU A 1 193 ?   12.42 53.824  21.99 1 23.2115 ? CD2 LEU 193  A 1 1 
ATOM   1434 C  C   . LEU A 1 193 ?  14.121  57.71 23.378 1 22.1087 ? C   LEU 193  A 1 1 
ATOM   1435 O  O   . LEU A 1 193 ?  14.112 58.401 22.358 1 22.2359 ? O   LEU 193  A 1 1 
ATOM   1436 N  N   . TYR A 1 194 ?  14.234 58.239 24.593 1 21.7133 ? N   TYR 194  A 1 1 
ATOM   1437 C  CA  . TYR A 1 194 ?  14.409 59.674 24.764 1 21.7769 ? CA  TYR 194  A 1 1 
ATOM   1438 C  CB  . TYR A 1 194 ?  14.488 60.072 26.238 1 21.9718 ? CB  TYR 194  A 1 1 
ATOM   1439 C  CG  . TYR A 1 194 ?  14.759 61.535 26.481 1 21.7919 ? CG  TYR 194  A 1 1 
ATOM   1440 C  CD1 . TYR A 1 194 ?  13.744 62.483 26.363 1 21.8115 ? CD1 TYR 194  A 1 1 
ATOM   1441 C  CD2 . TYR A 1 194 ?  16.003 61.967 26.929 1 21.5111 ? CD2 TYR 194  A 1 1 
ATOM   1442 C  CE1 . TYR A 1 194 ?  13.979 63.819 26.615 1 22.1636 ? CE1 TYR 194  A 1 1 
ATOM   1443 C  CE2 . TYR A 1 194 ?  16.251 63.317 27.176 1 21.8257 ? CE2 TYR 194  A 1 1 
ATOM   1444 C  CZ  . TYR A 1 194 ?  15.231 64.235 27.024 1  22.073 ? CZ  TYR 194  A 1 1 
ATOM   1445 O  OH  . TYR A 1 194 ?  15.428 65.559 27.287 1 23.1596 ? OH  TYR 194  A 1 1 
ATOM   1446 C  C   . TYR A 1 194 ?  15.664 60.139 24.042 1 22.3848 ? C   TYR 194  A 1 1 
ATOM   1447 O  O   . TYR A 1 194 ?   15.59 61.075 23.254 1 23.8069 ? O   TYR 194  A 1 1 
ATOM   1448 N  N   . GLN A 1 195 ?  16.782 59.433 24.246 1 21.6212 ? N   GLN 195  A 1 1 
ATOM   1449 C  CA  . GLN A 1 195 ?  18.044 59.809 23.635 1  22.972 ? CA  GLN 195  A 1 1 
ATOM   1450 C  CB  . GLN A 1 195 ?  19.187 58.879 24.095 1 23.8938 ? CB  GLN 195  A 1 1 
ATOM   1451 C  CG  . GLN A 1 195 ?  20.537 59.273 23.571 1 24.6805 ? CG  GLN 195  A 1 1 
ATOM   1452 C  CD  . GLN A 1 195 ?  21.072 60.585 24.087 1 26.5798 ? CD  GLN 195  A 1 1 
ATOM   1453 O  OE1 . GLN A 1 195 ?  20.697 61.085 25.154 1 26.4178 ? OE1 GLN 195  A 1 1 
ATOM   1454 N  NE2 . GLN A 1 195 ?  22.024 61.201 23.325 1 27.9507 ? NE2 GLN 195  A 1 1 
ATOM   1455 C  C   . GLN A 1 195 ?   17.93 59.804 22.114 1 22.7003 ? C   GLN 195  A 1 1 
ATOM   1456 O  O   . GLN A 1 195 ?  18.413 60.716 21.457 1 23.2384 ? O   GLN 195  A 1 1 
ATOM   1457 N  N   . LEU A 1 196 ?  17.271 58.772 21.585 1   22.08 ? N   LEU 196  A 1 1 
ATOM   1458 C  CA  . LEU A 1 196 ?  17.116 58.577 20.163 1 23.1286 ? CA  LEU 196  A 1 1 
ATOM   1459 C  CB  . LEU A 1 196 ?   16.48 57.172 19.926 1 24.4077 ? CB  LEU 196  A 1 1 
ATOM   1460 C  CG  . LEU A 1 196 ?  16.569 56.646 18.524 1 26.6811 ? CG  LEU 196  A 1 1 
ATOM   1461 C  CD1 . LEU A 1 196 ?  18.063 56.412 18.153 1 27.8756 ? CD1 LEU 196  A 1 1 
ATOM   1462 C  CD2 . LEU A 1 196 ?   15.75 55.409  18.38 1 27.0183 ? CD2 LEU 196  A 1 1 
ATOM   1463 C  C   . LEU A 1 196 ?  16.268 59.679 19.552 1 22.3508 ? C   LEU 196  A 1 1 
ATOM   1464 O  O   . LEU A 1 196 ?  16.677 60.316 18.599 1 22.9089 ? O   LEU 196  A 1 1 
ATOM   1465 N  N   . VAL A 1 197 ?  15.135     60 20.177 1 21.9694 ? N   VAL 197  A 1 1 
ATOM   1466 C  CA  . VAL A 1 197 ?  14.315 61.094 19.685 1 21.6975 ? CA  VAL 197  A 1 1 
ATOM   1467 C  CB  . VAL A 1 197 ?   12.95 61.098 20.395 1  21.619 ? CB  VAL 197  A 1 1 
ATOM   1468 C  CG1 . VAL A 1 197 ?  12.119 62.325 19.993 1 22.1911 ? CG1 VAL 197  A 1 1 
ATOM   1469 C  CG2 . VAL A 1 197 ?  12.247 59.805 20.017 1 21.0049 ? CG2 VAL 197  A 1 1 
ATOM   1470 C  C   . VAL A 1 197 ?  15.006  62.44 19.714 1 22.0395 ? C   VAL 197  A 1 1 
ATOM   1471 O  O   . VAL A 1 197 ?  14.992 63.159 18.727 1 22.4313 ? O   VAL 197  A 1 1 
ATOM   1472 N  N   . GLN A 1 198 ?  15.651 62.772 20.831 1  21.825 ? N   GLN 198  A 1 1 
ATOM   1473 C  CA  . GLN A 1 198 ?  16.438 63.975  20.91 1 22.4114 ? CA  GLN 198  A 1 1 
ATOM   1474 C  CB  . GLN A 1 198 ?  17.148 64.037 22.266 1 22.8309 ? CB  GLN 198  A 1 1 
ATOM   1475 C  CG  . GLN A 1 198 ?   16.14 64.343 23.411 1 23.6359 ? CG  GLN 198  A 1 1 
ATOM   1476 C  CD  . GLN A 1 198 ?   15.57 65.727 23.359 1 24.5747 ? CD  GLN 198  A 1 1 
ATOM   1477 O  OE1 . GLN A 1 198 ?  14.322 65.946 23.155 1 27.0707 ? OE1 GLN 198  A 1 1 
ATOM   1478 N  NE2 . GLN A 1 198 ?  16.398 66.701 23.565 1 24.1262 ? NE2 GLN 198  A 1 1 
ATOM   1479 C  C   . GLN A 1 198 ?  17.473 64.077 19.794 1 22.7239 ? C   GLN 198  A 1 1 
ATOM   1480 O  O   . GLN A 1 198 ?  17.663 65.158 19.235 1 23.7925 ? O   GLN 198  A 1 1 
ATOM   1481 N  N   . GLU A 1 199 ?  18.165 62.977 19.526 1 22.4657 ? N   GLU 199  A 1 1 
ATOM   1482 C  CA  . GLU A 1 199 ?  19.199 62.962 18.496 1  24.032 ? CA  GLU 199  A 1 1 
ATOM   1483 C  CB  . GLU A 1 199 ?  19.958 61.631 18.495 1 24.4755 ? CB  GLU 199  A 1 1 
ATOM   1484 C  CG  . GLU A 1 199 ?  20.872 61.437 19.699 1 25.0949 ? CG  GLU 199  A 1 1 
ATOM   1485 C  CD  . GLU A 1 199 ?  21.516 60.082 19.901 1 25.3318 ? CD  GLU 199  A 1 1 
ATOM   1486 O  OE1 . GLU A 1 199 ?  21.005 59.037 19.426 1 24.5147 ? OE1 GLU 199  A 1 1 
ATOM   1487 O  OE2 . GLU A 1 199 ?  22.548 60.078 20.622 1  26.189 ? OE2 GLU 199  A 1 1 
ATOM   1488 C  C   . GLU A 1 199 ?  18.614 63.223 17.106 1 25.0543 ? C   GLU 199  A 1 1 
ATOM   1489 O  O   . GLU A 1 199 ?   19.15 64.007 16.325 1 24.6706 ? O   GLU 199  A 1 1 
ATOM   1490 N  N   . ARG A 1 200 ?  17.486 62.572   16.8 1 26.6408 ? N   ARG 200  A 1 1 
ATOM   1491 C  CA  . ARG A 1 200 ?  16.883 62.728 15.482 1   27.71 ? CA  ARG 200  A 1 1 
ATOM   1492 C  CB  . ARG A 1 200 ?   15.86 61.601  15.27 1 28.8162 ? CB  ARG 200  A 1 1 
ATOM   1493 C  CG  . ARG A 1 200 ?  16.411 60.189 15.583 1 30.3898 ? CG  ARG 200  A 1 1 
ATOM   1494 C  CD  . ARG A 1 200 ?  16.953 59.361 14.405 1 32.5999 ? CD  ARG 200  A 1 1 
ATOM   1495 N  NE  . ARG A 1 200 ?  18.303 59.653 13.965 1 36.1953 ? NE  ARG 200  A 1 1 
ATOM   1496 C  CZ  . ARG A 1 200 ?  19.326 59.933 14.751 1 37.2393 ? CZ  ARG 200  A 1 1 
ATOM   1497 N  NH1 . ARG A 1 200 ?  20.096 60.998 14.532 1 39.2158 ? NH1 ARG 200  A 1 1 
ATOM   1498 N  NH2 . ARG A 1 200 ?  19.705 59.023 15.643 1 37.1486 ? NH2 ARG 200  A 1 1 
ATOM   1499 C  C   . ARG A 1 200 ?  16.307 64.133 15.296 1 28.7227 ? C   ARG 200  A 1 1 
ATOM   1500 O  O   . ARG A 1 200 ?  16.423 64.743 14.227 1 29.2801 ? O   ARG 200  A 1 1 
ATOM   1501 N  N   . ARG A 1 201 ?  15.725 64.692 16.355 1 28.0128 ? N   ARG 201  A 1 1 
ATOM   1502 C  CA  . ARG A 1 201 ?   15.37 66.093 16.371 1 28.9487 ? CA  ARG 201  A 1 1 
ATOM   1503 C  CB  . ARG A 1 201 ?  14.838 66.533 17.719 1 30.1715 ? CB  ARG 201  A 1 1 
ATOM   1504 C  CG  . ARG A 1 201 ?   13.46 66.123 18.037 1 30.9234 ? CG  ARG 201  A 1 1 
ATOM   1505 C  CD  . ARG A 1 201 ?  12.467 67.223 17.797 1 32.0219 ? CD  ARG 201  A 1 1 
ATOM   1506 N  NE  . ARG A 1 201 ?  11.164 66.814 18.282 1 31.6573 ? NE  ARG 201  A 1 1 
ATOM   1507 C  CZ  . ARG A 1 201 ?  10.043 66.865 17.585 1 32.1806 ? CZ  ARG 201  A 1 1 
ATOM   1508 N  NH1 . ARG A 1 201 ?   9.984 67.455 16.399 1 32.5861 ? NH1 ARG 201  A 1 1 
ATOM   1509 N  NH2 . ARG A 1 201 ?   8.935 66.356 18.112 1 31.6971 ? NH2 ARG 201  A 1 1 
ATOM   1510 C  C   . ARG A 1 201 ?  16.602 66.937 16.096 1 29.0735 ? C   ARG 201  A 1 1 
ATOM   1511 O  O   . ARG A 1 201 ?  16.522   67.9 15.355 1 29.7805 ? O   ARG 201  A 1 1 
ATOM   1512 N  N   . ALA A 1 202 ?  17.722 66.603 16.746 1  27.917 ? N   ALA 202  A 1 1 
ATOM   1513 C  CA  . ALA A 1 202 ?  18.894 67.467 16.678 1 28.7405 ? CA  ALA 202  A 1 1 
ATOM   1514 C  CB  . ALA A 1 202 ?  19.849 67.127 17.805 1 28.7361 ? CB  ALA 202  A 1 1 
ATOM   1515 C  C   . ALA A 1 202 ?  19.621 67.354 15.345 1 28.6415 ? C   ALA 202  A 1 1 
ATOM   1516 O  O   . ALA A 1 202 ?  20.285 68.302 14.932 1 29.5064 ? O   ALA 202  A 1 1 
ATOM   1517 N  N   . ASN A 1 203 ?  19.511 66.172 14.732 1 28.4912 ? N   ASN 203  A 1 1 
ATOM   1518 C  CA  . ASN A 1 203 ?  20.378 65.719 13.659 1 29.0096 ? CA  ASN 203  A 1 1 
ATOM   1519 C  CB  . ASN A 1 203 ?  21.544 64.935 14.242 1  29.122 ? CB  ASN 203  A 1 1 
ATOM   1520 C  CG  . ASN A 1 203 ?  22.589 64.559 13.234 1 29.0233 ? CG  ASN 203  A 1 1 
ATOM   1521 O  OD1 . ASN A 1 203 ?  22.733 65.206 12.195 1 29.4072 ? OD1 ASN 203  A 1 1 
ATOM   1522 N  ND2 . ASN A 1 203 ?   23.36 63.563 13.591 1 27.5273 ? ND2 ASN 203  A 1 1 
ATOM   1523 C  C   . ASN A 1 203 ?  19.625  64.79 12.713 1 28.4795 ? C   ASN 203  A 1 1 
ATOM   1524 O  O   . ASN A 1 203 ?  19.943 63.599 12.633 1 26.5801 ? O   ASN 203  A 1 1 
ATOM   1525 N  N   . PRO A 1 204 ?  18.654 65.321 11.938 1 29.4719 ? N   PRO 204  A 1 1 
ATOM   1526 C  CA  . PRO A 1 204 ?  17.813 64.473 11.103 1 29.2144 ? CA  PRO 204  A 1 1 
ATOM   1527 C  CB  . PRO A 1 204 ?  16.875 65.452 10.383 1  29.977 ? CB  PRO 204  A 1 1 
ATOM   1528 C  CG  . PRO A 1 204 ?  17.049 66.762 11.048 1 32.2301 ? CG  PRO 204  A 1 1 
ATOM   1529 C  CD  . PRO A 1 204 ?  18.382 66.755 11.771 1 31.4475 ? CD  PRO 204  A 1 1 
ATOM   1530 C  C   . PRO A 1 204 ?  18.631 63.671 10.101 1 28.2949 ? C   PRO 204  A 1 1 
ATOM   1531 O  O   . PRO A 1 204 ?  19.682 64.117  9.655 1 27.4654 ? O   PRO 204  A 1 1 
ATOM   1532 N  N   . GLY A 1 205 ?  18.107 62.502  9.757 1 28.0374 ? N   GLY 205  A 1 1 
ATOM   1533 C  CA  . GLY A 1 205 ?  18.792 61.545  8.913 1 28.6545 ? CA  GLY 205  A 1 1 
ATOM   1534 C  C   . GLY A 1 205 ?  17.775 60.763  8.092 1 28.3825 ? C   GLY 205  A 1 1 
ATOM   1535 O  O   . GLY A 1 205 ?  16.607  61.15  8.008 1 27.5543 ? O   GLY 205  A 1 1 
ATOM   1536 N  N   . ASP A 1 206 ?  18.276 59.701  7.454 1 28.8666 ? N   ASP 206  A 1 1 
ATOM   1537 C  CA  . ASP A 1 206 ?  17.497 58.849  6.575 1 29.3599 ? CA  ASP 206  A 1 1 
ATOM   1538 C  CB  . ASP A 1 206 ?  18.392 58.331  5.441 1 31.4278 ? CB  ASP 206  A 1 1 
ATOM   1539 C  CG  . ASP A 1 206 ?  17.761 57.312   4.52 1 34.0172 ? CG  ASP 206  A 1 1 
ATOM   1540 O  OD1 . ASP A 1 206 ?   16.52 57.217  4.503 1 33.6193 ? OD1 ASP 206  A 1 1 
ATOM   1541 O  OD2 . ASP A 1 206 ?  18.527 56.565  3.846 1 36.1171 ? OD2 ASP 206  A 1 1 
ATOM   1542 C  C   . ASP A 1 206 ?  16.974  57.72  7.456 1 28.5036 ? C   ASP 206  A 1 1 
ATOM   1543 O  O   . ASP A 1 206 ?  17.537 56.628  7.477 1 31.3033 ? O   ASP 206  A 1 1 
ATOM   1544 N  N   . ASP A 1 207 ?  15.923 58.029  8.206 1 27.6396 ? N   ASP 207  A 1 1 
ATOM   1545 C  CA  . ASP A 1 207 ?  15.434 57.143  9.239 1 25.8226 ? CA  ASP 207  A 1 1 
ATOM   1546 C  CB  . ASP A 1 207 ?  16.312 57.223 10.501 1 26.7395 ? CB  ASP 207  A 1 1 
ATOM   1547 C  CG  . ASP A 1 207 ?  16.339 58.552 11.148 1 27.5237 ? CG  ASP 207  A 1 1 
ATOM   1548 O  OD1 . ASP A 1 207 ?  15.388 58.871 11.866 1 28.4347 ? OD1 ASP 207  A 1 1 
ATOM   1549 O  OD2 . ASP A 1 207 ?   17.33 59.269 10.963 1 29.4381 ? OD2 ASP 207  A 1 1 
ATOM   1550 C  C   . ASP A 1 207 ?  14.006  57.53  9.553 1 24.7216 ? C   ASP 207  A 1 1 
ATOM   1551 O  O   . ASP A 1 207 ?  13.571 58.636  9.239 1 25.2208 ? O   ASP 207  A 1 1 
ATOM   1552 N  N   . LEU A 1 208 ?  13.311 56.604 10.211 1 24.2665 ? N   LEU 208  A 1 1 
ATOM   1553 C  CA  . LEU A 1 208 ?  11.874 56.685  10.32 1 24.5593 ? CA  LEU 208  A 1 1 
ATOM   1554 C  CB  . LEU A 1 208 ?  11.322 55.333 10.719 1 24.6504 ? CB  LEU 208  A 1 1 
ATOM   1555 C  CG  . LEU A 1 208 ?   9.821 55.239 10.798 1 25.5873 ? CG  LEU 208  A 1 1 
ATOM   1556 C  CD1 . LEU A 1 208 ?   9.182 55.546  9.469 1 26.8365 ? CD1 LEU 208  A 1 1 
ATOM   1557 C  CD2 . LEU A 1 208 ?   9.425 53.855  11.25 1 25.8941 ? CD2 LEU 208  A 1 1 
ATOM   1558 C  C   . LEU A 1 208 ?  11.422 57.764 11.296 1 24.1438 ? C   LEU 208  A 1 1 
ATOM   1559 O  O   . LEU A 1 208 ?  10.459  58.47 11.023 1 24.2305 ? O   LEU 208  A 1 1 
ATOM   1560 N  N   . ILE A 1 209 ?  12.139 57.941 12.413 1 24.1337 ? N   ILE 209  A 1 1 
ATOM   1561 C  CA  . ILE A 1 209 ?  11.823 59.071 13.285 1 24.1465 ? CA  ILE 209  A 1 1 
ATOM   1562 C  CB  . ILE A 1 209 ?  12.672 59.046  14.56 1  23.891 ? CB  ILE 209  A 1 1 
ATOM   1563 C  CG1 . ILE A 1 209 ?  12.297 57.867 15.399 1 23.2073 ? CG1 ILE 209  A 1 1 
ATOM   1564 C  CG2 . ILE A 1 209 ?  12.496 60.405 15.312 1 24.1638 ? CG2 ILE 209  A 1 1 
ATOM   1565 C  CD1 . ILE A 1 209 ?  13.226 57.548 16.502 1 23.3256 ? CD1 ILE 209  A 1 1 
ATOM   1566 C  C   . ILE A 1 209 ?  11.935 60.438 12.606 1  24.111 ? C   ILE 209  A 1 1 
ATOM   1567 O  O   . ILE A 1 209 ?  11.062  61.29 12.767 1 24.9353 ? O   ILE 209  A 1 1 
ATOM   1568 N  N   . SER A 1 210 ?  12.986 60.624 11.805 1 23.7672 ? N   SER 210  A 1 1 
ATOM   1569 C  CA  . SER A 1 210 ?  13.182 61.875 11.082 1 24.2468 ? CA  SER 210  A 1 1 
ATOM   1570 C  CB  . SER A 1 210 ?  14.492 61.891 10.303 1 24.1212 ? CB  SER 210  A 1 1 
ATOM   1571 O  OG  . SER A 1 210 ?  15.622 61.772 11.154 1 24.1075 ? OG  SER 210  A 1 1 
ATOM   1572 C  C   . SER A 1 210 ?  12.022 62.139 10.124 1 24.8291 ? C   SER 210  A 1 1 
ATOM   1573 O  O   . SER A 1 210 ?  11.577 63.272 10.016 1 25.1313 ? O   SER 210  A 1 1 
ATOM   1574 N  N   . ALA A 1 211 ?  11.544 61.092   9.44 1  24.665 ? N   ALA 211  A 1 1 
ATOM   1575 C  CA  . ALA A 1 211 ?  10.391 61.206  8.557 1 24.8543 ? CA  ALA 211  A 1 1 
ATOM   1576 C  CB  . ALA A 1 211 ?  10.206 59.908  7.805 1 24.5293 ? CB  ALA 211  A 1 1 
ATOM   1577 C  C   . ALA A 1 211 ?   9.102 61.542  9.303 1 25.0167 ? C   ALA 211  A 1 1 
ATOM   1578 O  O   . ALA A 1 211 ?   8.308 62.368  8.844 1  26.229 ? O   ALA 211  A 1 1 
ATOM   1579 N  N   . LEU A 1 212 ?   8.918 60.953 10.487 1 25.1077 ? N   LEU 212  A 1 1 
ATOM   1580 C  CA  . LEU A 1 212 ?   7.739 61.271 11.295 1 25.2314 ? CA  LEU 212  A 1 1 
ATOM   1581 C  CB  . LEU A 1 212 ?   7.631 60.315 12.497 1 24.3799 ? CB  LEU 212  A 1 1 
ATOM   1582 C  CG  . LEU A 1 212 ?   7.198 58.875 12.173 1 25.2333 ? CG  LEU 212  A 1 1 
ATOM   1583 C  CD1 . LEU A 1 212 ?   7.443 57.943 13.307 1 24.8651 ? CD1 LEU 212  A 1 1 
ATOM   1584 C  CD2 . LEU A 1 212 ?    5.77 58.814 11.817 1 25.9215 ? CD2 LEU 212  A 1 1 
ATOM   1585 C  C   . LEU A 1 212 ?    7.75 62.727 11.755 1 25.7985 ? C   LEU 212  A 1 1 
ATOM   1586 O  O   . LEU A 1 212 ?   6.704 63.377  11.81 1 25.1973 ? O   LEU 212  A 1 1 
ATOM   1587 N  N   . ILE A 1 213 ?   8.948 63.256 12.059 1 25.7865 ? N   ILE 213  A 1 1 
ATOM   1588 C  CA  . ILE A 1 213 ?   9.058 64.634 12.508 1 28.0749 ? CA  ILE 213  A 1 1 
ATOM   1589 C  CB  . ILE A 1 213 ?  10.539 64.934 12.925 1 28.1409 ? CB  ILE 213  A 1 1 
ATOM   1590 C  CG1 . ILE A 1 213 ?  10.821 64.273 14.281 1 27.2737 ? CG1 ILE 213  A 1 1 
ATOM   1591 C  CG2 . ILE A 1 213 ?  10.861 66.437 12.957 1 29.0387 ? CG2 ILE 213  A 1 1 
ATOM   1592 C  CD1 . ILE A 1 213 ?  12.287 64.262 14.674 1 27.2126 ? CD1 ILE 213  A 1 1 
ATOM   1593 C  C   . ILE A 1 213 ?   8.499  65.62 11.489 1 29.9832 ? C   ILE 213  A 1 1 
ATOM   1594 O  O   . ILE A 1 213 ?   7.911 66.625 11.875 1 32.5715 ? O   ILE 213  A 1 1 
ATOM   1595 N  N   . THR A 1 214 ?   8.676  65.32 10.198 1 30.4586 ? N   THR 214  A 1 1 
ATOM   1596 C  CA  . THR A 1 214 ?   8.234 66.188  9.118 1 33.1518 ? CA  THR 214  A 1 1 
ATOM   1597 C  CB  . THR A 1 214 ?   9.294  66.22  8.015 1 33.3976 ? CB  THR 214  A 1 1 
ATOM   1598 O  OG1 . THR A 1 214 ?   9.479 64.883  7.552 1 31.8897 ? OG1 THR 214  A 1 1 
ATOM   1599 C  CG2 . THR A 1 214 ?  10.626 66.805  8.481 1 33.8551 ? CG2 THR 214  A 1 1 
ATOM   1600 C  C   . THR A 1 214 ?   6.897 65.802  8.485 1 33.8611 ? C   THR 214  A 1 1 
ATOM   1601 O  O   . THR A 1 214 ?   6.475  66.45  7.543 1 35.5649 ? O   THR 214  A 1 1 
ATOM   1602 N  N   . THR A 1 215 ?   6.222 64.773  9.009 1 33.7532 ? N   THR 215  A 1 1 
ATOM   1603 C  CA  . THR A 1 215 ?   4.947 64.337  8.468 1 34.0444 ? CA  THR 215  A 1 1 
ATOM   1604 C  CB  . THR A 1 215 ?   4.581 62.934  9.024 1 33.2485 ? CB  THR 215  A 1 1 
ATOM   1605 O  OG1 . THR A 1 215 ?    3.69 62.306  8.118 1 34.0772 ? OG1 THR 215  A 1 1 
ATOM   1606 C  CG2 . THR A 1 215 ?   3.947 62.964 10.412 1 33.6701 ? CG2 THR 215  A 1 1 
ATOM   1607 C  C   . THR A 1 215 ?    3.87 65.392  8.715 1 35.5806 ? C   THR 215  A 1 1 
ATOM   1608 O  O   . THR A 1 215 ?   3.937  66.16  9.673 1 34.0994 ? O   THR 215  A 1 1 
ATOM   1609 N  N   . GLU A 1 216 ?   2.884 65.429  7.813 1 37.2812 ? N   GLU 216  A 1 1 
ATOM   1610 C  CA  . GLU A 1 216 ?    1.76 66.345  7.928 1 39.7452 ? CA  GLU 216  A 1 1 
ATOM   1611 C  CB  . GLU A 1 216 ?   0.807 66.137  6.726 1 43.3108 ? CB  GLU 216  A 1 1 
ATOM   1612 C  CG  . GLU A 1 216 ?  -0.326 67.156  6.619 1 48.4333 ? CG  GLU 216  A 1 1 
ATOM   1613 C  CD  . GLU A 1 216 ?   0.106 68.611  6.632 1 52.5817 ? CD  GLU 216  A 1 1 
ATOM   1614 O  OE1 . GLU A 1 216 ?   1.231 68.893  6.153 1 56.5922 ? OE1 GLU 216  A 1 1 
ATOM   1615 O  OE2 . GLU A 1 216 ?  -0.695 69.474  7.069 1 55.9141 ? OE2 GLU 216  A 1 1 
ATOM   1616 C  C   . GLU A 1 216 ?   1.038 66.129  9.257 1 37.7127 ? C   GLU 216  A 1 1 
ATOM   1617 O  O   . GLU A 1 216 ?   0.509 65.056  9.512 1 35.8047 ? O   GLU 216  A 1 1 
ATOM   1618 N  N   . ASP A 1 217 ?   1.051 67.146 10.112 1 37.6788 ? N   ASP 217  A 1 1 
ATOM   1619 C  CA  . ASP A 1 217 ?   0.574 67.006 11.476 1 38.2519 ? CA  ASP 217  A 1 1 
ATOM   1620 C  CB  . ASP A 1 217 ?   1.751 66.857 12.464 1 37.1909 ? CB  ASP 217  A 1 1 
ATOM   1621 C  CG  . ASP A 1 217 ?   1.286 66.671 13.884 1 36.1492 ? CG  ASP 217  A 1 1 
ATOM   1622 O  OD1 . ASP A 1 217 ?   0.126 66.268 14.074 1 36.2087 ? OD1 ASP 217  A 1 1 
ATOM   1623 O  OD2 . ASP A 1 217 ?    2.06  66.96 14.805 1 35.4906 ? OD2 ASP 217  A 1 1 
ATOM   1624 C  C   . ASP A 1 217 ?  -0.263 68.226 11.845 1 41.2967 ? C   ASP 217  A 1 1 
ATOM   1625 O  O   . ASP A 1 217 ?   0.139 69.014 12.696 1 40.6103 ? O   ASP 217  A 1 1 
ATOM   1626 N  N   . PRO A 1 218 ?  -1.458 68.417 11.231 1 44.7848 ? N   PRO 218  A 1 1 
ATOM   1627 C  CA  . PRO A 1 218 ?  -2.224 69.639 11.452 1 45.8135 ? CA  PRO 218  A 1 1 
ATOM   1628 C  CB  . PRO A 1 218 ?  -3.443 69.469 10.533 1 47.2486 ? CB  PRO 218  A 1 1 
ATOM   1629 C  CG  . PRO A 1 218 ?  -3.044 68.367  9.543 1 46.8359 ? CG  PRO 218  A 1 1 
ATOM   1630 C  CD  . PRO A 1 218 ?   -2.11 67.482 10.296 1 44.7288 ? CD  PRO 218  A 1 1 
ATOM   1631 C  C   . PRO A 1 218 ?  -2.628 69.874 12.907 1 46.2119 ? C   PRO 218  A 1 1 
ATOM   1632 O  O   . PRO A 1 218 ?  -2.758  71.02 13.318 1 46.1655 ? O   PRO 218  A 1 1 
ATOM   1633 N  N   . ASP A 1 219 ?  -2.817 68.802  13.69 1 45.4503 ? N   ASP 219  A 1 1 
ATOM   1634 C  CA  . ASP A 1 219 ?  -3.241 68.949 15.078 1 45.5914 ? CA  ASP 219  A 1 1 
ATOM   1635 C  CB  . ASP A 1 219 ?  -4.263 67.835 15.415 1 46.2876 ? CB  ASP 219  A 1 1 
ATOM   1636 C  CG  . ASP A 1 219 ?  -5.604 67.971 14.695 1 48.2596 ? CG  ASP 219  A 1 1 
ATOM   1637 O  OD1 . ASP A 1 219 ?  -6.255 69.015 14.852 1 50.1548 ? OD1 ASP 219  A 1 1 
ATOM   1638 O  OD2 . ASP A 1 219 ?  -5.994 67.034 13.978 1 49.4618 ? OD2 ASP 219  A 1 1 
ATOM   1639 C  C   . ASP A 1 219 ?  -2.097 68.963 16.104 1 44.1671 ? C   ASP 219  A 1 1 
ATOM   1640 O  O   . ASP A 1 219 ?   -2.34 68.981 17.312 1 42.8186 ? O   ASP 219  A 1 1 
ATOM   1641 N  N   . GLY A 1 220 ?  -0.843 68.949 15.629 1 42.2247 ? N   GLY 220  A 1 1 
ATOM   1642 C  CA  . GLY A 1 220 ?   0.313 68.998 16.515 1 40.1538 ? CA  GLY 220  A 1 1 
ATOM   1643 C  C   . GLY A 1 220 ?   0.399 67.836 17.507 1  37.899 ? C   GLY 220  A 1 1 
ATOM   1644 O  O   . GLY A 1 220 ?   0.705 68.039 18.675 1 36.0628 ? O   GLY 220  A 1 1 
ATOM   1645 N  N   . VAL A 1 221 ?   0.126 66.606 17.048 1 36.3997 ? N   VAL 221  A 1 1 
ATOM   1646 C  CA  . VAL A 1 221 ?   0.168 65.478 17.966 1 35.2065 ? CA  VAL 221  A 1 1 
ATOM   1647 C  CB  . VAL A 1 221 ?  -0.922 64.417 17.708 1 36.1686 ? CB  VAL 221  A 1 1 
ATOM   1648 C  CG1 . VAL A 1 221 ?  -2.095 64.977 16.923 1 37.5337 ? CG1 VAL 221  A 1 1 
ATOM   1649 C  CG2 . VAL A 1 221 ?  -0.394 63.197 17.034 1 35.3807 ? CG2 VAL 221  A 1 1 
ATOM   1650 C  C   . VAL A 1 221 ?    1.57 64.865 17.979 1 32.4249 ? C   VAL 221  A 1 1 
ATOM   1651 O  O   . VAL A 1 221 ?   1.925 64.159 18.918 1 30.9513 ? O   VAL 221  A 1 1 
ATOM   1652 N  N   . VAL A 1 222 ?   2.383 65.149 16.952 1 32.1003 ? N   VAL 222  A 1 1 
ATOM   1653 C  CA  . VAL A 1 222 ?   3.679 64.489  16.84 1 30.5628 ? CA  VAL 222  A 1 1 
ATOM   1654 C  CB  . VAL A 1 222 ?    4.11  64.31 15.368 1 30.4546 ? CB  VAL 222  A 1 1 
ATOM   1655 C  CG1 . VAL A 1 222 ?   5.456 63.603  15.27 1 29.9995 ? CG1 VAL 222  A 1 1 
ATOM   1656 C  CG2 . VAL A 1 222 ?   3.062 63.524 14.606 1 30.3948 ? CG2 VAL 222  A 1 1 
ATOM   1657 C  C   . VAL A 1 222 ?   4.734 65.235 17.657 1 29.9239 ? C   VAL 222  A 1 1 
ATOM   1658 O  O   . VAL A 1 222 ?   5.545 65.967 17.097 1 30.3992 ? O   VAL 222  A 1 1 
ATOM   1659 N  N   . ASP A 1 223 ?    4.69 65.061 18.979 1 28.1718 ? N   ASP 223  A 1 1 
ATOM   1660 C  CA  . ASP A 1 223 ?   5.656  65.66 19.893 1 27.7175 ? CA  ASP 223  A 1 1 
ATOM   1661 C  CB  . ASP A 1 223 ?   4.972 66.274 21.132 1 28.3024 ? CB  ASP 223  A 1 1 
ATOM   1662 C  CG  . ASP A 1 223 ?    4.07 65.354 21.964 1 28.0343 ? CG  ASP 223  A 1 1 
ATOM   1663 O  OD1 . ASP A 1 223 ?   4.103 64.146 21.751 1 26.3308 ? OD1 ASP 223  A 1 1 
ATOM   1664 O  OD2 . ASP A 1 223 ?   3.254 65.882 22.757 1 28.1735 ? OD2 ASP 223  A 1 1 
ATOM   1665 C  C   . ASP A 1 223 ?   6.635  64.56 20.285 1 26.1809 ? C   ASP 223  A 1 1 
ATOM   1666 O  O   . ASP A 1 223 ?   6.504 63.432 19.808 1 24.5746 ? O   ASP 223  A 1 1 
ATOM   1667 N  N   . ASP A 1 224 ?   7.583 64.872 21.183 1 25.2812 ? N   ASP 224  A 1 1 
ATOM   1668 C  CA  . ASP A 1 224 ?    8.63 63.916 21.523 1 24.7294 ? CA  ASP 224  A 1 1 
ATOM   1669 C  CB  . ASP A 1 224 ?   9.695 64.585 22.444 1 25.2276 ? CB  ASP 224  A 1 1 
ATOM   1670 C  CG  . ASP A 1 224 ?  10.649  65.48 21.712 1 26.0131 ? CG  ASP 224  A 1 1 
ATOM   1671 O  OD1 . ASP A 1 224 ?  10.524 65.585 20.465 1 26.1924 ? OD1 ASP 224  A 1 1 
ATOM   1672 O  OD2 . ASP A 1 224 ?  11.543 66.063 22.371 1 24.8117 ? OD2 ASP 224  A 1 1 
ATOM   1673 C  C   . ASP A 1 224 ?   8.055 62.675 22.209 1 24.6162 ? C   ASP 224  A 1 1 
ATOM   1674 O  O   . ASP A 1 224 ?   8.509  61.57  21.94 1 23.7443 ? O   ASP 224  A 1 1 
ATOM   1675 N  N   . MET A 1 225 ?   7.063 62.858 23.096 1 25.4253 ? N   MET 225  A 1 1 
ATOM   1676 C  CA  . MET A 1 225 ?   6.448 61.714 23.756 1 26.7203 ? CA  MET 225  A 1 1 
ATOM   1677 C  CB  . MET A 1 225 ?   5.428 62.175 24.795 1 29.2399 ? CB  MET 225  A 1 1 
ATOM   1678 C  CG  . MET A 1 225 ?   4.832 61.037 25.577 1 32.7212 ? CG  MET 225  A 1 1 
ATOM   1679 S  SD  . MET A 1 225 ?   4.003 61.588 27.098 1 40.4593 ? SD  MET 225  A 1 1 
ATOM   1680 C  CE  . MET A 1 225 ?   2.433 62.188  26.36 1 40.1269 ? CE  MET 225  A 1 1 
ATOM   1681 C  C   . MET A 1 225 ?   5.794 60.772 22.733 1  25.046 ? C   MET 225  A 1 1 
ATOM   1682 O  O   . MET A 1 225 ?   5.922 59.555 22.834 1 23.6395 ? O   MET 225  A 1 1 
ATOM   1683 N  N   . PHE A 1 226 ?   5.094 61.338  21.74 1 24.2924 ? N   PHE 226  A 1 1 
ATOM   1684 C  CA  . PHE A 1 226 ?   4.499 60.532 20.682 1 23.7509 ? CA  PHE 226  A 1 1 
ATOM   1685 C  CB  . PHE A 1 226 ?   3.664   61.4 19.754 1 24.6372 ? CB  PHE 226  A 1 1 
ATOM   1686 C  CG  . PHE A 1 226 ?    2.96 60.698 18.612 1 24.9129 ? CG  PHE 226  A 1 1 
ATOM   1687 C  CD1 . PHE A 1 226 ?   3.659 60.288 17.485 1 24.4907 ? CD1 PHE 226  A 1 1 
ATOM   1688 C  CD2 . PHE A 1 226 ?     1.6  60.43 18.675 1  25.961 ? CD2 PHE 226  A 1 1 
ATOM   1689 C  CE1 . PHE A 1 226 ?   3.002 59.662  16.42 1 24.5633 ? CE1 PHE 226  A 1 1 
ATOM   1690 C  CE2 . PHE A 1 226 ?   0.945 59.797 17.613 1 25.3782 ? CE2 PHE 226  A 1 1 
ATOM   1691 C  CZ  . PHE A 1 226 ?   1.653 59.414 16.491 1 24.7814 ? CZ  PHE 226  A 1 1 
ATOM   1692 C  C   . PHE A 1 226 ?   5.542 59.732 19.896 1 23.6198 ? C   PHE 226  A 1 1 
ATOM   1693 O  O   . PHE A 1 226 ?   5.374 58.527 19.664 1 21.3327 ? O   PHE 226  A 1 1 
ATOM   1694 N  N   . LEU A 1 227 ?   6.678  60.37 19.592 1 23.0643 ? N   LEU 227  A 1 1 
ATOM   1695 C  CA  . LEU A 1 227 ?   7.745 59.695 18.863 1 22.2732 ? CA  LEU 227  A 1 1 
ATOM   1696 C  CB  . LEU A 1 227 ?    8.82 60.708 18.442 1 23.0201 ? CB  LEU 227  A 1 1 
ATOM   1697 C  CG  . LEU A 1 227 ?   8.363 61.796 17.537 1 24.7271 ? CG  LEU 227  A 1 1 
ATOM   1698 C  CD1 . LEU A 1 227 ?   9.432  62.93 17.395 1 25.4582 ? CD1 LEU 227  A 1 1 
ATOM   1699 C  CD2 . LEU A 1 227 ?   8.004 61.228 16.139 1 24.9853 ? CD2 LEU 227  A 1 1 
ATOM   1700 C  C   . LEU A 1 227 ?   8.385 58.572 19.681 1  22.131 ? C   LEU 227  A 1 1 
ATOM   1701 O  O   . LEU A 1 227 ?    8.71 57.488 19.163 1 22.2494 ? O   LEU 227  A 1 1 
ATOM   1702 N  N   . MET A 1 228 ?   8.601 58.831 20.968 1 21.2481 ? N   MET 228  A 1 1 
ATOM   1703 C  CA  . MET A 1 228 ?   9.167 57.845 21.861 1  21.005 ? CA  MET 228  A 1 1 
ATOM   1704 C  CB  . MET A 1 228 ?   9.354 58.369 23.268 1 21.2572 ? CB  MET 228  A 1 1 
ATOM   1705 C  CG  . MET A 1 228 ?  10.482 59.369 23.402 1 21.6266 ? CG  MET 228  A 1 1 
ATOM   1706 S  SD  . MET A 1 228 ?  10.567 60.145  25.05 1  23.162 ? SD  MET 228  A 1 1 
ATOM   1707 C  CE  . MET A 1 228 ?  10.701 58.793 26.054 1  23.498 ? CE  MET 228  A 1 1 
ATOM   1708 C  C   . MET A 1 228 ?   8.231 56.642 21.907 1 20.8891 ? C   MET 228  A 1 1 
ATOM   1709 O  O   . MET A 1 228 ?   8.692   55.5 21.816 1 19.8459 ? O   MET 228  A 1 1 
ATOM   1710 N  N   . ASN A 1 229 ?   6.926 56.902 22.019 1 20.7542 ? N   ASN 229  A 1 1 
ATOM   1711 C  CA  . ASN A 1 229 ?   5.956 55.815 22.167 1 21.7299 ? CA  ASN 229  A 1 1 
ATOM   1712 C  CB  . ASN A 1 229 ?   4.589 56.409 22.492 1 22.8634 ? CB  ASN 229  A 1 1 
ATOM   1713 C  CG  . ASN A 1 229 ?   4.499 56.971 23.902 1 24.2359 ? CG  ASN 229  A 1 1 
ATOM   1714 O  OD1 . ASN A 1 229 ?   5.267 56.609 24.796 1 25.1171 ? OD1 ASN 229  A 1 1 
ATOM   1715 N  ND2 . ASN A 1 229 ?   3.524 57.824 24.167 1 25.2678 ? ND2 ASN 229  A 1 1 
ATOM   1716 C  C   . ASN A 1 229 ?   5.897 54.968 20.891 1  21.697 ? C   ASN 229  A 1 1 
ATOM   1717 O  O   . ASN A 1 229 ?   5.844 53.744 20.926 1 20.5504 ? O   ASN 229  A 1 1 
ATOM   1718 N  N   . ALA A 1 230 ?   5.909 55.646 19.747 1 22.2655 ? N   ALA 230  A 1 1 
ATOM   1719 C  CA  . ALA A 1 230 ?   5.813 54.961 18.476 1  23.109 ? CA  ALA 230  A 1 1 
ATOM   1720 C  CB  . ALA A 1 230 ?   5.569 55.921 17.363 1 23.7757 ? CB  ALA 230  A 1 1 
ATOM   1721 C  C   . ALA A 1 230 ?   7.092 54.173 18.232 1 22.9781 ? C   ALA 230  A 1 1 
ATOM   1722 O  O   . ALA A 1 230 ?   7.048 53.008 17.866 1 23.9017 ? O   ALA 230  A 1 1 
ATOM   1723 N  N   . ALA A 1 231 ?   8.239 54.801 18.475 1 23.3185 ? N   ALA 231  A 1 1 
ATOM   1724 C  CA  . ALA A 1 231 ?   9.513 54.122 18.316 1 23.3693 ? CA  ALA 231  A 1 1 
ATOM   1725 C  CB  . ALA A 1 231 ?  10.656  55.11 18.558 1 23.5691 ? CB  ALA 231  A 1 1 
ATOM   1726 C  C   . ALA A 1 231 ?   9.625 52.902 19.228 1 23.6168 ? C   ALA 231  A 1 1 
ATOM   1727 O  O   . ALA A 1 231 ?  10.155 51.867 18.832 1 23.6125 ? O   ALA 231  A 1 1 
ATOM   1728 N  N   . GLY A 1 232 ?   9.185 53.041 20.477 1 24.2163 ? N   GLY 232  A 1 1 
ATOM   1729 C  CA  . GLY A 1 232 ?   9.217 51.956 21.446 1 24.0967 ? CA  GLY 232  A 1 1 
ATOM   1730 C  C   . GLY A 1 232 ?   8.434 50.741 20.974 1 24.2857 ? C   GLY 232  A 1 1 
ATOM   1731 O  O   . GLY A 1 232 ?   8.945 49.618 20.988 1 24.2071 ? O   GLY 232  A 1 1 
ATOM   1732 N  N   . THR A 1 233 ?   7.217 50.968 20.492 1 24.9509 ? N   THR 233  A 1 1 
ATOM   1733 C  CA  . THR A 1 233 ?   6.373 49.862 20.099 1 25.2164 ? CA  THR 233  A 1 1 
ATOM   1734 C  CB  . THR A 1 233 ?   4.947 50.263  19.85 1 27.6307 ? CB  THR 233  A 1 1 
ATOM   1735 O  OG1 . THR A 1 233 ?   4.427 50.839 21.033 1 30.3114 ? OG1 THR 233  A 1 1 
ATOM   1736 C  CG2 . THR A 1 233 ?   4.102 49.091  19.51 1 29.4669 ? CG2 THR 233  A 1 1 
ATOM   1737 C  C   . THR A 1 233 ?   6.994 49.207 18.877 1 23.1544 ? C   THR 233  A 1 1 
ATOM   1738 O  O   . THR A 1 233 ?   7.133 47.991 18.849 1 20.9015 ? O   THR 233  A 1 1 
ATOM   1739 N  N   . LEU A 1 234 ?   7.333 50.011 17.866 1 21.9242 ? N   LEU 234  A 1 1 
ATOM   1740 C  CA  . LEU A 1 234 ?   7.868 49.445 16.645 1 22.5863 ? CA  LEU 234  A 1 1 
ATOM   1741 C  CB  . LEU A 1 234 ?   8.047 50.514 15.591 1 23.7255 ? CB  LEU 234  A 1 1 
ATOM   1742 C  CG  . LEU A 1 234 ?   6.728 51.124 15.084 1 25.7891 ? CG  LEU 234  A 1 1 
ATOM   1743 C  CD1 . LEU A 1 234 ?   6.968 52.466 14.443 1 26.6859 ? CD1 LEU 234  A 1 1 
ATOM   1744 C  CD2 . LEU A 1 234 ?    6.04 50.222 14.111 1 26.9496 ? CD2 LEU 234  A 1 1 
ATOM   1745 C  C   . LEU A 1 234 ?   9.194 48.722  16.88 1 21.4835 ? C   LEU 234  A 1 1 
ATOM   1746 O  O   . LEU A 1 234 ?   9.418 47.649 16.326 1 20.4173 ? O   LEU 234  A 1 1 
ATOM   1747 N  N   . LEU A 1 235 ?  10.098 49.309 17.671 1 21.8441 ? N   LEU 235  A 1 1 
ATOM   1748 C  CA  . LEU A 1 235 ?  11.394  48.67 17.907 1 21.3047 ? CA  LEU 235  A 1 1 
ATOM   1749 C  CB  . LEU A 1 235 ?  12.345 49.658 18.662 1 21.2548 ? CB  LEU 235  A 1 1 
ATOM   1750 C  CG  . LEU A 1 235 ?      13 50.697 17.755 1 21.9002 ? CG  LEU 235  A 1 1 
ATOM   1751 C  CD1 . LEU A 1 235 ?  13.588 51.842 18.531 1 22.0596 ? CD1 LEU 235  A 1 1 
ATOM   1752 C  CD2 . LEU A 1 235 ?  14.084 50.064 16.903 1 21.6992 ? CD2 LEU 235  A 1 1 
ATOM   1753 C  C   . LEU A 1 235 ?  11.269 47.348 18.657 1 21.4593 ? C   LEU 235  A 1 1 
ATOM   1754 O  O   . LEU A 1 235 ?  11.888 46.341 18.277 1 21.9689 ? O   LEU 235  A 1 1 
ATOM   1755 N  N   . ILE A 1 236 ?   10.48  47.34 19.748 1 20.4947 ? N   ILE 236  A 1 1 
ATOM   1756 C  CA  . ILE A 1 236 ?  10.341  46.12 20.511 1 20.1642 ? CA  ILE 236  A 1 1 
ATOM   1757 C  CB  . ILE A 1 236 ?   9.696 46.336 21.875 1 21.5141 ? CB  ILE 236  A 1 1 
ATOM   1758 C  CG1 . ILE A 1 236 ?  10.536 47.326 22.743 1 22.4933 ? CG1 ILE 236  A 1 1 
ATOM   1759 C  CG2 . ILE A 1 236 ?   9.491 44.988 22.552 1 20.9069 ? CG2 ILE 236  A 1 1 
ATOM   1760 C  CD1 . ILE A 1 236 ?  12.023 46.855 22.963 1 22.8734 ? CD1 ILE 236  A 1 1 
ATOM   1761 C  C   . ILE A 1 236 ?   9.567 45.062 19.725 1 19.5595 ? C   ILE 236  A 1 1 
ATOM   1762 O  O   . ILE A 1 236 ?   9.973 43.898 19.696 1 19.0716 ? O   ILE 236  A 1 1 
ATOM   1763 N  N   . ALA A 1 237 ?   8.464 45.439 19.088 1 19.4805 ? N   ALA 237  A 1 1 
ATOM   1764 C  CA  . ALA A 1 237 ?   7.691 44.443 18.349 1 19.7658 ? CA  ALA 237  A 1 1 
ATOM   1765 C  CB  . ALA A 1 237 ?   6.474 45.056 17.733 1 19.5616 ? CB  ALA 237  A 1 1 
ATOM   1766 C  C   . ALA A 1 237 ?   8.564 43.819  17.26 1  20.548 ? C   ALA 237  A 1 1 
ATOM   1767 O  O   . ALA A 1 237 ?   8.604 42.595 17.092 1 20.9858 ? O   ALA 237  A 1 1 
ATOM   1768 N  N   . ALA A 1 238 ?    9.27 44.669 16.498 1 20.5498 ? N   ALA 238  A 1 1 
ATOM   1769 C  CA  . ALA A 1 238 ?  10.025 44.159 15.362 1 21.6883 ? CA  ALA 238  A 1 1 
ATOM   1770 C  CB  . ALA A 1 238 ?  10.527 45.276 14.464 1 21.9486 ? CB  ALA 238  A 1 1 
ATOM   1771 C  C   . ALA A 1 238 ?  11.196 43.268 15.773 1 22.3237 ? C   ALA 238  A 1 1 
ATOM   1772 O  O   . ALA A 1 238 ?  11.546  42.37 14.995 1 24.1725 ? O   ALA 238  A 1 1 
ATOM   1773 N  N   . HIS A 1 239 ?  11.744 43.486 16.977 1  21.867 ? N   HIS 239  A 1 1 
ATOM   1774 C  CA  . HIS A 1 239 ?   12.85 42.705 17.536 1 24.0018 ? CA  HIS 239  A 1 1 
ATOM   1775 C  CB  . HIS A 1 239 ?  13.528 43.325 18.824 1 26.1089 ? CB  HIS 239  A 1 1 
ATOM   1776 C  CG  . HIS A 1 239 ?  14.665 44.308 18.693 1  29.579 ? CG  HIS 239  A 1 1 
ATOM   1777 N  ND1 . HIS A 1 239 ?  14.465 45.698 18.404 1 31.1905 ? ND1 HIS 239  A 1 1 
ATOM   1778 C  CE1 . HIS A 1 239 ?  15.674 46.264 18.364 1 32.1782 ? CE1 HIS 239  A 1 1 
ATOM   1779 N  NE2 . HIS A 1 239 ?  16.643  45.36 18.646 1 31.1582 ? NE2 HIS 239  A 1 1 
ATOM   1780 C  CD2 . HIS A 1 239 ?  15.996 44.118 18.899 1 30.2059 ? CD2 HIS 239  A 1 1 
ATOM   1781 C  C   . HIS A 1 239 ?  12.322 41.328 17.952 1 23.4594 ? C   HIS 239  A 1 1 
ATOM   1782 O  O   . HIS A 1 239 ?  12.794 40.279 17.487 1 22.9948 ? O   HIS 239  A 1 1 
ATOM   1783 N  N   . ASP A 1 240 ?  11.362  41.35 18.878 1 22.1449 ? N   ASP 240  A 1 1 
ATOM   1784 C  CA  . ASP A 1 240 ?  10.986  40.15 19.615 1 21.0915 ? CA  ASP 240  A 1 1 
ATOM   1785 C  CB  . ASP A 1 240 ?  10.158 40.572  20.83 1 21.8555 ? CB  ASP 240  A 1 1 
ATOM   1786 C  CG  . ASP A 1 240 ?  10.065 39.509 21.917 1  22.833 ? CG  ASP 240  A 1 1 
ATOM   1787 O  OD1 . ASP A 1 240 ?  11.041 38.736 22.084 1 22.9311 ? OD1 ASP 240  A 1 1 
ATOM   1788 O  OD2 . ASP A 1 240 ?   9.013 39.435 22.584 1 23.8711 ? OD2 ASP 240  A 1 1 
ATOM   1789 C  C   . ASP A 1 240 ?  10.238 39.109 18.767 1 19.9491 ? C   ASP 240  A 1 1 
ATOM   1790 O  O   . ASP A 1 240 ?  10.587 37.937 18.754 1 18.4775 ? O   ASP 240  A 1 1 
ATOM   1791 N  N   . THR A 1 241 ?   9.179 39.533 18.092 1 20.4488 ? N   THR 241  A 1 1 
ATOM   1792 C  CA  . THR A 1 241 ?   8.334 38.626 17.333 1 20.3792 ? CA  THR 241  A 1 1 
ATOM   1793 C  CB  . THR A 1 241 ?   7.146 39.352 16.733 1 21.0352 ? CB  THR 241  A 1 1 
ATOM   1794 O  OG1 . THR A 1 241 ?   7.642 40.396 15.891 1  22.679 ? OG1 THR 241  A 1 1 
ATOM   1795 C  CG2 . THR A 1 241 ?   6.234   39.9 17.752 1 21.7536 ? CG2 THR 241  A 1 1 
ATOM   1796 C  C   . THR A 1 241 ?   9.114  37.92 16.232 1  20.362 ? C   THR 241  A 1 1 
ATOM   1797 O  O   . THR A 1 241 ?   9.134 36.681 16.176 1 19.5382 ? O   THR 241  A 1 1 
ATOM   1798 N  N   . THR A 1 242 ?   9.763 38.724 15.377 1 19.3461 ? N   THR 242  A 1 1 
ATOM   1799 C  CA  . THR A 1 242 ?  10.545 38.204 14.267 1 20.0476 ? CA  THR 242  A 1 1 
ATOM   1800 C  CB  . THR A 1 242 ?  11.173 39.358 13.468 1  19.625 ? CB  THR 242  A 1 1 
ATOM   1801 O  OG1 . THR A 1 242 ?  10.194 40.415 13.326 1 21.9774 ? OG1 THR 242  A 1 1 
ATOM   1802 C  CG2 . THR A 1 242 ?  11.587  38.91 12.099 1 19.9851 ? CG2 THR 242  A 1 1 
ATOM   1803 C  C   . THR A 1 242 ?  11.607 37.222 14.774 1 19.5077 ? C   THR 242  A 1 1 
ATOM   1804 O  O   . THR A 1 242 ?  11.724 36.126 14.239 1 19.2347 ? O   THR 242  A 1 1 
ATOM   1805 N  N   . ALA A 1 243 ?  12.334 37.584 15.838 1 19.2606 ? N   ALA 243  A 1 1 
ATOM   1806 C  CA  . ALA A 1 243 ?  13.363 36.692 16.376 1 18.6781 ? CA  ALA 243  A 1 1 
ATOM   1807 C  CB  . ALA A 1 243 ?  14.037 37.285 17.601 1 19.4961 ? CB  ALA 243  A 1 1 
ATOM   1808 C  C   . ALA A 1 243 ?  12.741 35.349 16.754 1 18.9507 ? C   ALA 243  A 1 1 
ATOM   1809 O  O   . ALA A 1 243 ?  13.294 34.274 16.451 1 17.3394 ? O   ALA 243  A 1 1 
ATOM   1810 N  N   . CYS A 1 244 ?  11.632 35.422 17.498 1 18.9189 ? N   CYS 244  A 1 1 
ATOM   1811 C  CA  . CYS A 1 244 ?  10.928 34.208 17.899 1 19.3982 ? CA  CYS 244  A 1 1 
ATOM   1812 C  CB  . CYS A 1 244 ?   9.702  34.57 18.705 1 20.0331 ? CB  CYS 244  A 1 1 
ATOM   1813 S  SG  . CYS A 1 244 ?  10.053 35.113 20.399 1 21.1706 ? SG  CYS 244  A 1 1 
ATOM   1814 C  C   . CYS A 1 244 ?  10.542 33.292 16.734 1 19.9427 ? C   CYS 244  A 1 1 
ATOM   1815 O  O   . CYS A 1 244 ?  10.658 32.069 16.838 1  20.229 ? O   CYS 244  A 1 1 
ATOM   1816 N  N   . MET A 1 245 ?  10.004 33.886 15.664 1 19.9118 ? N   MET 245  A 1 1 
ATOM   1817 C  CA  . MET A 1 245 ?   9.596 33.117 14.488 1 19.8547 ? CA  MET 245  A 1 1 
ATOM   1818 C  CB  . MET A 1 245 ?   8.822 33.995 13.465 1 19.9212 ? CB  MET 245  A 1 1 
ATOM   1819 C  CG  . MET A 1 245 ?    7.35 34.159 13.809 1 20.9888 ? CG  MET 245  A 1 1 
ATOM   1820 S  SD  . MET A 1 245 ?    6.43 32.632 13.848 1  22.068 ? SD  MET 245  A 1 1 
ATOM   1821 C  CE  . MET A 1 245 ?   6.862 31.967 12.282 1 21.6489 ? CE  MET 245  A 1 1 
ATOM   1822 C  C   . MET A 1 245 ?  10.808 32.487 13.787 1  19.539 ? C   MET 245  A 1 1 
ATOM   1823 O  O   . MET A 1 245 ?  10.747 31.371 13.305 1 19.4716 ? O   MET 245  A 1 1 
ATOM   1824 N  N   . ILE A 1 246 ?  11.919 33.213 13.697 1 20.1271 ? N   ILE 246  A 1 1 
ATOM   1825 C  CA  . ILE A 1 246 ?  13.105 32.652 13.067 1 19.1027 ? CA  ILE 246  A 1 1 
ATOM   1826 C  CB  . ILE A 1 246 ?  14.253 33.675 12.977 1 19.1231 ? CB  ILE 246  A 1 1 
ATOM   1827 C  CG1 . ILE A 1 246 ?   13.82 34.888 12.086 1 19.4367 ? CG1 ILE 246  A 1 1 
ATOM   1828 C  CG2 . ILE A 1 246 ?  15.554 32.971 12.452 1 18.5504 ? CG2 ILE 246  A 1 1 
ATOM   1829 C  CD1 . ILE A 1 246 ?  14.745 36.105 12.099 1 19.5351 ? CD1 ILE 246  A 1 1 
ATOM   1830 C  C   . ILE A 1 246 ?  13.582 31.389 13.786 1 19.4849 ? C   ILE 246  A 1 1 
ATOM   1831 O  O   . ILE A 1 246 ?  13.791 30.338 13.183 1 18.7256 ? O   ILE 246  A 1 1 
ATOM   1832 N  N   . GLY A 1 247 ?  13.797 31.514   15.1 1 20.0306 ? N   GLY 247  A 1 1 
ATOM   1833 C  CA  . GLY A 1 247 ?  14.264 30.389 15.895 1    19.9 ? CA  GLY 247  A 1 1 
ATOM   1834 C  C   . GLY A 1 247 ?  13.263 29.235 15.871 1 19.9928 ? C   GLY 247  A 1 1 
ATOM   1835 O  O   . GLY A 1 247 ?  13.646 28.087 15.665 1 19.4171 ? O   GLY 247  A 1 1 
ATOM   1836 N  N   . LEU A 1 248 ?  11.979 29.539 16.061 1 20.0166 ? N   LEU 248  A 1 1 
ATOM   1837 C  CA  . LEU A 1 248 ?  10.979 28.473 16.166 1 20.1785 ? CA  LEU 248  A 1 1 
ATOM   1838 C  CB  . LEU A 1 248 ?   9.708 28.971 16.839 1 19.6019 ? CB  LEU 248  A 1 1 
ATOM   1839 C  CG  . LEU A 1 248 ?   8.643 27.958 17.169 1 19.9706 ? CG  LEU 248  A 1 1 
ATOM   1840 C  CD1 . LEU A 1 248 ?   9.093 26.926 18.183 1 20.2074 ? CD1 LEU 248  A 1 1 
ATOM   1841 C  CD2 . LEU A 1 248 ?   7.403 28.665 17.704 1 20.0656 ? CD2 LEU 248  A 1 1 
ATOM   1842 C  C   . LEU A 1 248 ?   10.61 27.865 14.824 1 20.6107 ? C   LEU 248  A 1 1 
ATOM   1843 O  O   . LEU A 1 248 ?  10.437 26.656  14.73 1 21.5332 ? O   LEU 248  A 1 1 
ATOM   1844 N  N   . GLY A 1 249 ?  10.555 28.691 13.776 1 20.7777 ? N   GLY 249  A 1 1 
ATOM   1845 C  CA  . GLY A 1 249 ?  10.336 28.186 12.436 1 20.3387 ? CA  GLY 249  A 1 1 
ATOM   1846 C  C   . GLY A 1 249 ?  11.501 27.321 11.952 1 20.2265 ? C   GLY 249  A 1 1 
ATOM   1847 O  O   . GLY A 1 249 ?  11.276 26.325 11.299 1 19.4911 ? O   GLY 249  A 1 1 
ATOM   1848 N  N   . THR A 1 250 ?  12.744 27.722 12.256 1 19.4181 ? N   THR 250  A 1 1 
ATOM   1849 C  CA  . THR A 1 250 ?  13.891 26.886  11.96 1  19.945 ? CA  THR 250  A 1 1 
ATOM   1850 C  CB  . THR A 1 250 ?  15.184 27.602 12.278 1 20.0064 ? CB  THR 250  A 1 1 
ATOM   1851 O  OG1 . THR A 1 250 ?  15.224  28.83 11.546 1 19.8135 ? OG1 THR 250  A 1 1 
ATOM   1852 C  CG2 . THR A 1 250 ?  16.435  26.73 11.962 1 20.7622 ? CG2 THR 250  A 1 1 
ATOM   1853 C  C   . THR A 1 250 ?  13.788 25.531 12.663 1 20.5412 ? C   THR 250  A 1 1 
ATOM   1854 O  O   . THR A 1 250 ?  13.976 24.478 12.058 1  21.396 ? O   THR 250  A 1 1 
ATOM   1855 N  N   . ALA A 1 251 ?  13.507 25.556 13.964 1 19.5234 ? N   ALA 251  A 1 1 
ATOM   1856 C  CA  . ALA A 1 251 ?  13.424 24.324 14.734 1  20.872 ? CA  ALA 251  A 1 1 
ATOM   1857 C  CB  . ALA A 1 251 ?   13.13 24.643 16.176 1 20.6049 ? CB  ALA 251  A 1 1 
ATOM   1858 C  C   . ALA A 1 251 ?  12.345 23.387 14.189 1 21.3704 ? C   ALA 251  A 1 1 
ATOM   1859 O  O   . ALA A 1 251 ?  12.549 22.187 14.056 1  21.153 ? O   ALA 251  A 1 1 
ATOM   1860 N  N   . LEU A 1 252 ?  11.205 23.961 13.818 1 21.4611 ? N   LEU 252  A 1 1 
ATOM   1861 C  CA  . LEU A 1 252 ?  10.125 23.162 13.277 1 21.7558 ? CA  LEU 252  A 1 1 
ATOM   1862 C  CB  . LEU A 1 252 ?    8.87 23.994 13.071 1 22.3343 ? CB  LEU 252  A 1 1 
ATOM   1863 C  CG  . LEU A 1 252 ?   7.778 23.274 12.313 1 23.3096 ? CG  LEU 252  A 1 1 
ATOM   1864 C  CD1 . LEU A 1 252 ?    7.36 22.035 13.022 1 24.2369 ? CD1 LEU 252  A 1 1 
ATOM   1865 C  CD2 . LEU A 1 252 ?   6.573 24.188  12.09 1 24.0178 ? CD2 LEU 252  A 1 1 
ATOM   1866 C  C   . LEU A 1 252 ?  10.534 22.518 11.957 1 21.4114 ? C   LEU 252  A 1 1 
ATOM   1867 O  O   . LEU A 1 252 ?  10.332  21.32 11.768 1 21.4028 ? O   LEU 252  A 1 1 
ATOM   1868 N  N   . LEU A 1 253 ?  11.119 23.301 11.045 1 20.5187 ? N   LEU 253  A 1 1 
ATOM   1869 C  CA  . LEU A 1 253 ?  11.547 22.718  9.774 1 21.6608 ? CA  LEU 253  A 1 1 
ATOM   1870 C  CB  . LEU A 1 253 ?  12.022 23.838  8.832 1  21.391 ? CB  LEU 253  A 1 1 
ATOM   1871 C  CG  . LEU A 1 253 ?  10.874 24.552  8.097 1 21.5378 ? CG  LEU 253  A 1 1 
ATOM   1872 C  CD1 . LEU A 1 253 ?  11.276 25.886  7.629 1 21.7848 ? CD1 LEU 253  A 1 1 
ATOM   1873 C  CD2 . LEU A 1 253 ?  10.392 23.737  6.946 1 22.3274 ? CD2 LEU 253  A 1 1 
ATOM   1874 C  C   . LEU A 1 253 ?  12.638 21.659   9.96 1 21.8975 ? C   LEU 253  A 1 1 
ATOM   1875 O  O   . LEU A 1 253 ?  12.663 20.633  9.275 1 22.7708 ? O   LEU 253  A 1 1 
ATOM   1876 N  N   . LEU A 1 254 ?  13.529 21.897 10.928 1 22.6339 ? N   LEU 254  A 1 1 
ATOM   1877 C  CA  . LEU A 1 254 ?  14.597 20.967 11.225 1  23.172 ? CA  LEU 254  A 1 1 
ATOM   1878 C  CB  . LEU A 1 254 ?  15.651 21.676 12.094 1 22.8628 ? CB  LEU 254  A 1 1 
ATOM   1879 C  CG  . LEU A 1 254 ?  16.514 22.692 11.418 1 22.5223 ? CG  LEU 254  A 1 1 
ATOM   1880 C  CD1 . LEU A 1 254 ?  17.623 23.205 12.379 1 22.6637 ? CD1 LEU 254  A 1 1 
ATOM   1881 C  CD2 . LEU A 1 254 ?  17.154 22.122 10.185 1 23.1878 ? CD2 LEU 254  A 1 1 
ATOM   1882 C  C   . LEU A 1 254 ?  14.077 19.692 11.887 1 25.3592 ? C   LEU 254  A 1 1 
ATOM   1883 O  O   . LEU A 1 254 ?  14.794 18.692 11.957 1   27.63 ? O   LEU 254  A 1 1 
ATOM   1884 N  N   . ASP A 1 255 ?  12.824 19.717 12.348 1 25.8361 ? N   ASP 255  A 1 1 
ATOM   1885 C  CA  . ASP A 1 255 ?  12.178 18.536 12.887 1 26.9155 ? CA  ASP 255  A 1 1 
ATOM   1886 C  CB  . ASP A 1 255 ?  11.637 18.853 14.272 1 27.6663 ? CB  ASP 255  A 1 1 
ATOM   1887 C  CG  . ASP A 1 255 ?  11.335   17.6 15.077 1 29.1178 ? CG  ASP 255  A 1 1 
ATOM   1888 O  OD1 . ASP A 1 255 ?  12.207 16.696  15.11 1 31.0504 ? OD1 ASP 255  A 1 1 
ATOM   1889 O  OD2 . ASP A 1 255 ?  10.243 17.531 15.669 1 29.1226 ? OD2 ASP 255  A 1 1 
ATOM   1890 C  C   . ASP A 1 255 ?  11.072 18.036 11.968 1 26.6131 ? C   ASP 255  A 1 1 
ATOM   1891 O  O   . ASP A 1 255 ?  10.283 17.191 12.365 1 28.2263 ? O   ASP 255  A 1 1 
ATOM   1892 N  N   . SER A 1 256 ?  11.036 18.558 10.732 1 26.7301 ? N   SER 256  A 1 1 
ATOM   1893 C  CA  . SER A 1 256 ?  10.032 18.207  9.744 1  26.847 ? CA  SER 256  A 1 1 
ATOM   1894 C  CB  . SER A 1 256 ?   9.081 19.373  9.507 1 26.7455 ? CB  SER 256  A 1 1 
ATOM   1895 O  OG  . SER A 1 256 ?   8.492 19.832 10.709 1 27.3101 ? OG  SER 256  A 1 1 
ATOM   1896 C  C   . SER A 1 256 ?  10.707 17.845  8.425 1 27.3496 ? C   SER 256  A 1 1 
ATOM   1897 O  O   . SER A 1 256 ?  10.693 18.659   7.51 1 24.5662 ? O   SER 256  A 1 1 
ATOM   1898 N  N   . PRO A 1 257 ?  11.275 16.625  8.268 1 28.0308 ? N   PRO 257  A 1 1 
ATOM   1899 C  CA  . PRO A 1 257 ?  12.128 16.329  7.115 1 28.7175 ? CA  PRO 257  A 1 1 
ATOM   1900 C  CB  . PRO A 1 257 ?  12.578 14.879  7.322 1 30.4117 ? CB  PRO 257  A 1 1 
ATOM   1901 C  CG  . PRO A 1 257 ?  12.045 14.437  8.643 1 31.3717 ? CG  PRO 257  A 1 1 
ATOM   1902 C  CD  . PRO A 1 257 ?  11.141 15.501  9.205 1 30.4708 ? CD  PRO 257  A 1 1 
ATOM   1903 C  C   . PRO A 1 257 ?  11.452 16.501  5.754 1  28.266 ? C   PRO 257  A 1 1 
ATOM   1904 O  O   . PRO A 1 257 ?  12.063 17.062  4.856 1 26.2699 ? O   PRO 257  A 1 1 
ATOM   1905 N  N   . ASP A 1 258 ?  10.207 16.023  5.587 1 28.7157 ? N   ASP 258  A 1 1 
ATOM   1906 C  CA  . ASP A 1 258 ?   9.539 16.107   4.29 1 29.2428 ? CA  ASP 258  A 1 1 
ATOM   1907 C  CB  . ASP A 1 258 ?   8.197 15.377  4.309 1 31.9536 ? CB  ASP 258  A 1 1 
ATOM   1908 C  CG  . ASP A 1 258 ?   8.307 13.879  4.412 1 34.5915 ? CG  ASP 258  A 1 1 
ATOM   1909 O  OD1 . ASP A 1 258 ?   9.448 13.362  4.423 1  35.955 ? OD1 ASP 258  A 1 1 
ATOM   1910 O  OD2 . ASP A 1 258 ?   7.259  13.22  4.448 1 38.2211 ? OD2 ASP 258  A 1 1 
ATOM   1911 C  C   . ASP A 1 258 ?   9.279 17.543  3.841 1 28.0337 ? C   ASP 258  A 1 1 
ATOM   1912 O  O   . ASP A 1 258 ?   9.477 17.885  2.667 1 26.6164 ? O   ASP 258  A 1 1 
ATOM   1913 N  N   . GLN A 1 259 ?   8.835  18.37  4.797 1 26.2724 ? N   GLN 259  A 1 1 
ATOM   1914 C  CA  . GLN A 1 259 ?   8.615 19.779  4.545 1 26.5512 ? CA  GLN 259  A 1 1 
ATOM   1915 C  CB  . GLN A 1 259 ?   7.946 20.444  5.752 1 26.6655 ? CB  GLN 259  A 1 1 
ATOM   1916 C  CG  . GLN A 1 259 ?   6.555 19.881  6.054 1 27.9182 ? CG  GLN 259  A 1 1 
ATOM   1917 C  CD  . GLN A 1 259 ?   5.702 19.835  4.829 1 28.9284 ? CD  GLN 259  A 1 1 
ATOM   1918 O  OE1 . GLN A 1 259 ?   5.387 20.881   4.21 1 29.6287 ? OE1 GLN 259  A 1 1 
ATOM   1919 N  NE2 . GLN A 1 259 ?   5.323 18.631  4.436 1 28.1696 ? NE2 GLN 259  A 1 1 
ATOM   1920 C  C   . GLN A 1 259 ?   9.927 20.489  4.232 1   25.91 ? C   GLN 259  A 1 1 
ATOM   1921 O  O   . GLN A 1 259 ?    9.99 21.291  3.303 1  25.385 ? O   GLN 259  A 1 1 
ATOM   1922 N  N   . LEU A 1 260 ?  10.981 20.188  4.992 1 26.3267 ? N   LEU 260  A 1 1 
ATOM   1923 C  CA  . LEU A 1 260 ?  12.245 20.863  4.744 1 26.0049 ? CA  LEU 260  A 1 1 
ATOM   1924 C  CB  . LEU A 1 260 ?  13.258  20.54    5.8 1 27.6373 ? CB  LEU 260  A 1 1 
ATOM   1925 C  CG  . LEU A 1 260 ?  14.601 21.283  5.624 1 29.9223 ? CG  LEU 260  A 1 1 
ATOM   1926 C  CD1 . LEU A 1 260 ?  14.395 22.793  5.451 1 30.5406 ? CD1 LEU 260  A 1 1 
ATOM   1927 C  CD2 . LEU A 1 260 ?  15.506 21.022  6.765 1 30.4683 ? CD2 LEU 260  A 1 1 
ATOM   1928 C  C   . LEU A 1 260 ?   12.82 20.501  3.376 1 25.2108 ? C   LEU 260  A 1 1 
ATOM   1929 O  O   . LEU A 1 260 ?  13.358 21.356  2.668 1 25.9491 ? O   LEU 260  A 1 1 
ATOM   1930 N  N   . ALA A 1 261 ?  12.678 19.232  2.997 1 25.1442 ? N   ALA 261  A 1 1 
ATOM   1931 C  CA  . ALA A 1 261 ?  13.052 18.793  1.659 1 25.4039 ? CA  ALA 261  A 1 1 
ATOM   1932 C  CB  . ALA A 1 261 ?  12.793 17.322   1.52 1 26.8965 ? CB  ALA 261  A 1 1 
ATOM   1933 C  C   . ALA A 1 261 ?  12.315 19.561  0.562 1 25.1624 ? C   ALA 261  A 1 1 
ATOM   1934 O  O   . ALA A 1 261 ?  12.905 19.874 -0.469 1 25.2906 ? O   ALA 261  A 1 1 
ATOM   1935 N  N   . LEU A 1 262 ?  11.034 19.886  0.767 1 25.1709 ? N   LEU 262  A 1 1 
ATOM   1936 C  CA  . LEU A 1 262 ?  10.303 20.603 -0.271 1 25.0765 ? CA  LEU 262  A 1 1 
ATOM   1937 C  CB  . LEU A 1 262 ?   8.828 20.704  0.013 1 26.2411 ? CB  LEU 262  A 1 1 
ATOM   1938 C  CG  . LEU A 1 262 ?   8.069  19.35  -0.01 1 28.7188 ? CG  LEU 262  A 1 1 
ATOM   1939 C  CD1 . LEU A 1 262 ?   6.632 19.538  0.484 1  29.912 ? CD1 LEU 262  A 1 1 
ATOM   1940 C  CD2 . LEU A 1 262 ?   8.042 18.707 -1.413 1 28.7724 ? CD2 LEU 262  A 1 1 
ATOM   1941 C  C   . LEU A 1 262 ?  10.882 21.997 -0.437 1 23.4102 ? C   LEU 262  A 1 1 
ATOM   1942 O  O   . LEU A 1 262 ?  11.009 22.488 -1.549 1 22.8867 ? O   LEU 262  A 1 1 
ATOM   1943 N  N   . LEU A 1 263 ?  11.179  22.66  0.686 1 23.1539 ? N   LEU 263  A 1 1 
ATOM   1944 C  CA  . LEU A 1 263 ?  11.759 23.993  0.632 1 22.0951 ? CA  LEU 263  A 1 1 
ATOM   1945 C  CB  . LEU A 1 263 ?  11.782 24.576  2.051 1 22.1751 ? CB  LEU 263  A 1 1 
ATOM   1946 C  CG  . LEU A 1 263 ?   12.19 26.023  2.178 1  21.716 ? CG  LEU 263  A 1 1 
ATOM   1947 C  CD1 . LEU A 1 263 ?  11.298 26.958  1.344 1 22.4346 ? CD1 LEU 263  A 1 1 
ATOM   1948 C  CD2 . LEU A 1 263 ?  12.105 26.487  3.568 1 21.6664 ? CD2 LEU 263  A 1 1 
ATOM   1949 C  C   . LEU A 1 263 ?  13.161 23.993  0.025 1 22.4461 ? C   LEU 263  A 1 1 
ATOM   1950 O  O   . LEU A 1 263 ?  13.547 24.918 -0.695 1  21.763 ? O   LEU 263  A 1 1 
ATOM   1951 N  N   . ARG A 1 264 ?  13.945 22.965  0.333 1 23.3479 ? N   ARG 264  A 1 1 
ATOM   1952 C  CA  . ARG A 1 264 ?  15.282 22.861 -0.228 1 25.2356 ? CA  ARG 264  A 1 1 
ATOM   1953 C  CB  . ARG A 1 264 ?  16.099 21.747  0.447 1  25.649 ? CB  ARG 264  A 1 1 
ATOM   1954 C  CG  . ARG A 1 264 ?  16.707  22.18  1.727 1 26.1317 ? CG  ARG 264  A 1 1 
ATOM   1955 C  CD  . ARG A 1 264 ?  17.334 21.002  2.448 1 27.0735 ? CD  ARG 264  A 1 1 
ATOM   1956 N  NE  . ARG A 1 264 ?  18.283 21.412  3.482 1 25.6398 ? NE  ARG 264  A 1 1 
ATOM   1957 C  CZ  . ARG A 1 264 ?  18.363  20.87  4.679 1 24.4189 ? CZ  ARG 264  A 1 1 
ATOM   1958 N  NH1 . ARG A 1 264 ?  19.004  21.47  5.663 1 23.8741 ? NH1 ARG 264  A 1 1 
ATOM   1959 N  NH2 . ARG A 1 264 ?  18.037 19.598  4.822 1 24.2294 ? NH2 ARG 264  A 1 1 
ATOM   1960 C  C   . ARG A 1 264 ?  15.235 22.578 -1.722 1 26.4439 ? C   ARG 264  A 1 1 
ATOM   1961 O  O   . ARG A 1 264 ?  16.119 23.001 -2.457 1 27.4932 ? O   ARG 264  A 1 1 
ATOM   1962 N  N   . GLU A 1 265 ?  14.207 21.869 -2.172 1  27.341 ? N   GLU 265  A 1 1 
ATOM   1963 C  CA  . GLU A 1 265 ?  14.049 21.646   -3.6 1 28.7272 ? CA  GLU 265  A 1 1 
ATOM   1964 C  CB  . GLU A 1 265 ?  12.955 20.589 -3.846 1 30.9475 ? CB  GLU 265  A 1 1 
ATOM   1965 C  CG  . GLU A 1 265 ?  12.518  20.43 -5.301 1 35.1617 ? CG  GLU 265  A 1 1 
ATOM   1966 C  CD  . GLU A 1 265 ?  11.322 19.505 -5.508 1 38.2356 ? CD  GLU 265  A 1 1 
ATOM   1967 O  OE1 . GLU A 1 265 ?  10.347 19.585 -4.718 1 40.3741 ? OE1 GLU 265  A 1 1 
ATOM   1968 O  OE2 . GLU A 1 265 ?  11.355 18.712 -6.477 1  40.438 ? OE2 GLU 265  A 1 1 
ATOM   1969 C  C   . GLU A 1 265 ?  13.705 22.976 -4.258 1 26.4085 ? C   GLU 265  A 1 1 
ATOM   1970 O  O   . GLU A 1 265 ?  14.138  23.25  -5.38 1 26.3659 ? O   GLU 265  A 1 1 
ATOM   1971 N  N   . ASP A 1 266 ?  12.866  23.77 -3.588 1 26.4031 ? N   ASP 266  A 1 1 
ATOM   1972 C  CA  . ASP A 1 266 ?  12.278  24.96 -4.194 1 26.0846 ? CA  ASP 266  A 1 1 
ATOM   1973 C  CB  . ASP A 1 266 ?   10.86 24.663 -4.679 1  29.128 ? CB  ASP 266  A 1 1 
ATOM   1974 C  CG  . ASP A 1 266 ?  10.333 25.708 -5.655 1 31.8115 ? CG  ASP 266  A 1 1 
ATOM   1975 O  OD1 . ASP A 1 266 ?  11.044 26.737 -5.906 1 31.4795 ? OD1 ASP 266  A 1 1 
ATOM   1976 O  OD2 . ASP A 1 266 ?   9.259  25.51 -6.173 1 37.6397 ? OD2 ASP 266  A 1 1 
ATOM   1977 C  C   . ASP A 1 266 ?  12.216 26.194 -3.303 1 23.5523 ? C   ASP 266  A 1 1 
ATOM   1978 O  O   . ASP A 1 266 ?  11.243 26.418 -2.601 1 23.3223 ? O   ASP 266  A 1 1 
ATOM   1979 N  N   . PRO A 1 267 ?  13.258 27.043 -3.348 1 22.6503 ? N   PRO 267  A 1 1 
ATOM   1980 C  CA  . PRO A 1 267 ?  13.275 28.314 -2.624 1 22.1404 ? CA  PRO 267  A 1 1 
ATOM   1981 C  CB  . PRO A 1 267 ?  14.504 28.994 -3.165 1 22.0273 ? CB  PRO 267  A 1 1 
ATOM   1982 C  CG  . PRO A 1 267 ?  15.426 27.838 -3.645 1 22.7577 ? CG  PRO 267  A 1 1 
ATOM   1983 C  CD  . PRO A 1 267 ?   14.51 26.743 -4.064 1 23.6761 ? CD  PRO 267  A 1 1 
ATOM   1984 C  C   . PRO A 1 267 ?  12.045   29.2 -2.858 1 20.8608 ? C   PRO 267  A 1 1 
ATOM   1985 O  O   . PRO A 1 267 ?   11.68 29.948 -1.969 1 20.1539 ? O   PRO 267  A 1 1 
ATOM   1986 N  N   . SER A 1 268 ?  11.411   29.1 -4.041 1 21.5142 ? N   SER 268  A 1 1 
ATOM   1987 C  CA  . SER A 1 268 ?   10.31 30.004 -4.399 1  22.622 ? CA  SER 268  A 1 1 
ATOM   1988 C  CB  . SER A 1 268 ?  10.014 29.976 -5.898 1 22.0688 ? CB  SER 268  A 1 1 
ATOM   1989 O  OG  . SER A 1 268 ?   9.412 28.754 -6.263 1 23.1003 ? OG  SER 268  A 1 1 
ATOM   1990 C  C   . SER A 1 268 ?   9.016 29.693  -3.64 1 22.8968 ? C   SER 268  A 1 1 
ATOM   1991 O  O   . SER A 1 268 ?   8.071 30.504 -3.635 1 23.2681 ? O   SER 268  A 1 1 
ATOM   1992 N  N   . LEU A 1 269 ?   9.025 28.546 -2.951 1 22.3543 ? N   LEU 269  A 1 1 
ATOM   1993 C  CA  . LEU A 1 269 ?   7.958 28.192  -2.03 1  23.783 ? CA  LEU 269  A 1 1 
ATOM   1994 C  CB  . LEU A 1 269 ?   7.982 26.679 -1.702 1 26.0621 ? CB  LEU 269  A 1 1 
ATOM   1995 C  CG  . LEU A 1 269 ?   7.104  25.77 -2.525 1  30.558 ? CG  LEU 269  A 1 1 
ATOM   1996 C  CD1 . LEU A 1 269 ?   7.208 24.355 -2.037 1 31.7578 ? CD1 LEU 269  A 1 1 
ATOM   1997 C  CD2 . LEU A 1 269 ?    5.64 26.216  -2.48 1 31.7104 ? CD2 LEU 269  A 1 1 
ATOM   1998 C  C   . LEU A 1 269 ?   8.015 28.909 -0.688 1 21.8529 ? C   LEU 269  A 1 1 
ATOM   1999 O  O   . LEU A 1 269 ?   7.101 28.719  0.117 1 21.9167 ? O   LEU 269  A 1 1 
ATOM   2000 N  N   . VAL A 1 270 ?   9.067 29.703 -0.439 1 21.0292 ? N   VAL 270  A 1 1 
ATOM   2001 C  CA  . VAL A 1 270 ?   9.258 30.294  0.875 1  20.627 ? CA  VAL 270  A 1 1 
ATOM   2002 C  CB  . VAL A 1 270 ?  10.619     31  1.004 1 20.3469 ? CB  VAL 270  A 1 1 
ATOM   2003 C  CG1 . VAL A 1 270 ?  10.589 32.368  0.372 1 20.8488 ? CG1 VAL 270  A 1 1 
ATOM   2004 C  CG2 . VAL A 1 270 ?  11.066 31.097  2.449 1 20.4727 ? CG2 VAL 270  A 1 1 
ATOM   2005 C  C   . VAL A 1 270 ?     8.1 31.217  1.264 1 20.9854 ? C   VAL 270  A 1 1 
ATOM   2006 O  O   . VAL A 1 270 ?   7.854 31.406  2.456 1 21.7608 ? O   VAL 270  A 1 1 
ATOM   2007 N  N   . GLY A 1 271 ?   7.406 31.783  0.273 1 21.3333 ? N   GLY 271  A 1 1 
ATOM   2008 C  CA  . GLY A 1 271 ?   6.274  32.66  0.551 1 22.1462 ? CA  GLY 271  A 1 1 
ATOM   2009 C  C   . GLY A 1 271 ?   5.115 31.867  1.157 1 22.5617 ? C   GLY 271  A 1 1 
ATOM   2010 O  O   . GLY A 1 271 ?   4.606 32.213  2.233 1 20.2881 ? O   GLY 271  A 1 1 
ATOM   2011 N  N   . ASN A 1 272 ?   4.806 30.726  0.527 1 22.0856 ? N   ASN 272  A 1 1 
ATOM   2012 C  CA  . ASN A 1 272 ?   3.831 29.796  1.085 1 22.5184 ? CA  ASN 272  A 1 1 
ATOM   2013 C  CB  . ASN A 1 272 ?   3.592 28.564  0.256 1 22.8714 ? CB  ASN 272  A 1 1 
ATOM   2014 C  CG  . ASN A 1 272 ?   2.769  28.76 -0.974 1 24.1893 ? CG  ASN 272  A 1 1 
ATOM   2015 O  OD1 . ASN A 1 272 ?   1.753 28.031 -1.235 1 26.2351 ? OD1 ASN 272  A 1 1 
ATOM   2016 N  ND2 . ASN A 1 272 ?   3.207 29.664 -1.735 1 23.8106 ? ND2 ASN 272  A 1 1 
ATOM   2017 C  C   . ASN A 1 272 ?   4.286 29.293  2.449 1 22.0186 ? C   ASN 272  A 1 1 
ATOM   2018 O  O   . ASN A 1 272 ?   3.464 29.148  3.351 1 21.5383 ? O   ASN 272  A 1 1 
ATOM   2019 N  N   . ALA A 1 273 ?   5.586 28.973  2.555 1 21.1812 ? N   ALA 273  A 1 1 
ATOM   2020 C  CA  . ALA A 1 273 ?   6.116  28.38  3.764 1 20.8246 ? CA  ALA 273  A 1 1 
ATOM   2021 C  CB  . ALA A 1 273 ?   7.553 27.918  3.591 1 19.8324 ? CB  ALA 273  A 1 1 
ATOM   2022 C  C   . ALA A 1 273 ?   6.003 29.334  4.941 1 20.0197 ? C   ALA 273  A 1 1 
ATOM   2023 O  O   . ALA A 1 273 ?   5.614 28.911  6.028 1 21.4499 ? O   ALA 273  A 1 1 
ATOM   2024 N  N   . VAL A 1 274 ?   6.277 30.625  4.713 1 19.1442 ? N   VAL 274  A 1 1 
ATOM   2025 C  CA  . VAL A 1 274 ?    6.19 31.617  5.777 1 18.5708 ? CA  VAL 274  A 1 1 
ATOM   2026 C  CB  . VAL A 1 274 ?   6.848 32.952  5.353 1 18.8447 ? CB  VAL 274  A 1 1 
ATOM   2027 C  CG1 . VAL A 1 274 ?   6.387 34.119  6.206 1 18.7298 ? CG1 VAL 274  A 1 1 
ATOM   2028 C  CG2 . VAL A 1 274 ?   8.404 32.855  5.407 1 18.5175 ? CG2 VAL 274  A 1 1 
ATOM   2029 C  C   . VAL A 1 274 ?    4.75 31.763  6.284 1 19.5235 ? C   VAL 274  A 1 1 
ATOM   2030 O  O   . VAL A 1 274 ?   4.541 31.825  7.491 1 18.7004 ? O   VAL 274  A 1 1 
ATOM   2031 N  N   . GLU A 1 275 ?   3.758 31.778  5.376 1  19.889 ? N   GLU 275  A 1 1 
ATOM   2032 C  CA  . GLU A 1 275 ?   2.358 31.808  5.806 1 20.6735 ? CA  GLU 275  A 1 1 
ATOM   2033 C  CB  . GLU A 1 275 ?   1.388 31.958  4.621 1  20.897 ? CB  GLU 275  A 1 1 
ATOM   2034 C  CG  . GLU A 1 275 ?   1.572 33.281  3.913 1 20.8212 ? CG  GLU 275  A 1 1 
ATOM   2035 C  CD  . GLU A 1 275 ?   1.659 34.464  4.853 1  20.123 ? CD  GLU 275  A 1 1 
ATOM   2036 O  OE1 . GLU A 1 275 ?   0.675 34.707  5.597 1 18.8463 ? OE1 GLU 275  A 1 1 
ATOM   2037 O  OE2 . GLU A 1 275 ?   2.725 35.133  4.868 1 19.4891 ? OE2 GLU 275  A 1 1 
ATOM   2038 C  C   . GLU A 1 275 ?   1.965 30.604  6.654 1 21.4831 ? C   GLU 275  A 1 1 
ATOM   2039 O  O   . GLU A 1 275 ?    1.27 30.755   7.66 1 20.7701 ? O   GLU 275  A 1 1 
ATOM   2040 N  N   . GLU A 1 276 ?   2.415 29.414  6.251 1 22.1206 ? N   GLU 276  A 1 1 
ATOM   2041 C  CA  . GLU A 1 276 ?   2.109 28.209  6.998 1 22.8211 ? CA  GLU 276  A 1 1 
ATOM   2042 C  CB  . GLU A 1 276 ?     2.3 26.983   6.08 1   23.64 ? CB  GLU 276  A 1 1 
ATOM   2043 C  CG  . GLU A 1 276 ?   2.128 25.672  6.818 1 24.5669 ? CG  GLU 276  A 1 1 
ATOM   2044 C  CD  . GLU A 1 276 ?   0.718 25.302  7.217 1 25.8463 ? CD  GLU 276  A 1 1 
ATOM   2045 O  OE1 . GLU A 1 276 ?  -0.199 26.154  7.133 1 25.2996 ? OE1 GLU 276  A 1 1 
ATOM   2046 O  OE2 . GLU A 1 276 ?   0.526 24.113   7.56 1 26.4932 ? OE2 GLU 276  A 1 1 
ATOM   2047 C  C   . GLU A 1 276 ?   2.887 28.152  8.312 1 22.1547 ? C   GLU 276  A 1 1 
ATOM   2048 O  O   . GLU A 1 276 ?    2.34 27.724  9.333 1 22.0064 ? O   GLU 276  A 1 1 
ATOM   2049 N  N   . LEU A 1 277 ?    4.11 28.693  8.348 1 20.6963 ? N   LEU 277  A 1 1 
ATOM   2050 C  CA  . LEU A 1 277 ?   4.852 28.804  9.601 1 20.2786 ? CA  LEU 277  A 1 1 
ATOM   2051 C  CB  . LEU A 1 277 ?    6.26 29.316  9.312 1 19.8526 ? CB  LEU 277  A 1 1 
ATOM   2052 C  CG  . LEU A 1 277 ?   7.211 28.259  8.784 1 20.2922 ? CG  LEU 277  A 1 1 
ATOM   2053 C  CD1 . LEU A 1 277 ?   8.476 28.866  8.269 1 20.6524 ? CD1 LEU 277  A 1 1 
ATOM   2054 C  CD2 . LEU A 1 277 ?   7.549 27.261  9.852 1 21.0215 ? CD2 LEU 277  A 1 1 
ATOM   2055 C  C   . LEU A 1 277 ?   4.149 29.741 10.589 1 20.5044 ? C   LEU 277  A 1 1 
ATOM   2056 O  O   . LEU A 1 277 ?   4.049 29.438 11.775 1 19.7634 ? O   LEU 277  A 1 1 
ATOM   2057 N  N   . LEU A 1 278 ?   3.677 30.884 10.068 1 20.1428 ? N   LEU 278  A 1 1 
ATOM   2058 C  CA  . LEU A 1 278 ?   2.989 31.871 10.876 1 20.4961 ? CA  LEU 278  A 1 1 
ATOM   2059 C  CB  . LEU A 1 278 ?   2.663   33.1 10.042 1 20.4903 ? CB  LEU 278  A 1 1 
ATOM   2060 C  CG  . LEU A 1 278 ?   3.846 33.968  9.733 1  19.738 ? CG  LEU 278  A 1 1 
ATOM   2061 C  CD1 . LEU A 1 278 ?   3.565 34.971  8.671 1 20.1571 ? CD1 LEU 278  A 1 1 
ATOM   2062 C  CD2 . LEU A 1 278 ?   4.292 34.773 10.953 1 19.2154 ? CD2 LEU 278  A 1 1 
ATOM   2063 C  C   . LEU A 1 278 ?   1.747 31.257   11.5 1 21.0769 ? C   LEU 278  A 1 1 
ATOM   2064 O  O   . LEU A 1 278 ?   1.519 31.429 12.685 1 22.0581 ? O   LEU 278  A 1 1 
ATOM   2065 N  N   . ARG A 1 279 ?   0.951 30.549 10.699 1 21.6045 ? N   ARG 279  A 1 1 
ATOM   2066 C  CA  . ARG A 1 279 ?  -0.263 29.918 11.189 1 21.9253 ? CA  ARG 279  A 1 1 
ATOM   2067 C  CB  . ARG A 1 279 ?   -1.05 29.271 10.017 1 23.1587 ? CB  ARG 279  A 1 1 
ATOM   2068 C  CG  . ARG A 1 279 ?  -2.376 28.618 10.414 1 24.3963 ? CG  ARG 279  A 1 1 
ATOM   2069 C  CD  . ARG A 1 279 ?  -2.895 27.603  9.351 1 25.8002 ? CD  ARG 279  A 1 1 
ATOM   2070 N  NE  . ARG A 1 279 ?  -2.044 26.423  9.271 1  25.758 ? NE  ARG 279  A 1 1 
ATOM   2071 C  CZ  . ARG A 1 279 ?    -2.2 25.299  9.964 1 26.4388 ? CZ  ARG 279  A 1 1 
ATOM   2072 N  NH1 . ARG A 1 279 ?  -3.022 25.217 11.002 1 27.5988 ? NH1 ARG 279  A 1 1 
ATOM   2073 N  NH2 . ARG A 1 279 ?  -1.498 24.229  9.614 1 26.0415 ? NH2 ARG 279  A 1 1 
ATOM   2074 C  C   . ARG A 1 279 ?   0.072 28.832   12.2 1 22.0316 ? C   ARG 279  A 1 1 
ATOM   2075 O  O   . ARG A 1 279 ?  -0.528 28.742 13.263 1 23.4019 ? O   ARG 279  A 1 1 
ATOM   2076 N  N   . TYR A 1 280 ?   0.977 27.931 11.823 1 21.6395 ? N   TYR 280  A 1 1 
ATOM   2077 C  CA  . TYR A 1 280 ?   1.268 26.781 12.655 1 21.8748 ? CA  TYR 280  A 1 1 
ATOM   2078 C  CB  . TYR A 1 280 ?   2.154 25.816 11.858 1 21.6668 ? CB  TYR 280  A 1 1 
ATOM   2079 C  CG  . TYR A 1 280 ?   2.098 24.394 12.354 1 22.3173 ? CG  TYR 280  A 1 1 
ATOM   2080 C  CD1 . TYR A 1 280 ?   1.208 23.484 11.807 1 23.4922 ? CD1 TYR 280  A 1 1 
ATOM   2081 C  CD2 . TYR A 1 280 ?   2.994 23.931  13.31 1 22.3031 ? CD2 TYR 280  A 1 1 
ATOM   2082 C  CE1 . TYR A 1 280 ?    1.14 22.177 12.267 1 24.4514 ? CE1 TYR 280  A 1 1 
ATOM   2083 C  CE2 . TYR A 1 280 ?    2.94 22.618 13.775 1 23.7564 ? CE2 TYR 280  A 1 1 
ATOM   2084 C  CZ  . TYR A 1 280 ?   2.033 21.737 13.224 1 23.9961 ? CZ  TYR 280  A 1 1 
ATOM   2085 O  OH  . TYR A 1 280 ?   1.972 20.436 13.634 1 25.2376 ? OH  TYR 280  A 1 1 
ATOM   2086 C  C   . TYR A 1 280 ?   1.868 27.177 14.004 1 21.9298 ? C   TYR 280  A 1 1 
ATOM   2087 O  O   . TYR A 1 280 ?   1.497 26.622 15.028 1 23.6455 ? O   TYR 280  A 1 1 
ATOM   2088 N  N   . LEU A 1 281 ?   2.724 28.198 14.035 1 21.9644 ? N   LEU 281  A 1 1 
ATOM   2089 C  CA  . LEU A 1 281 ?   3.431 28.537 15.253 1 22.3635 ? CA  LEU 281  A 1 1 
ATOM   2090 C  CB  . LEU A 1 281 ?   4.859 28.958  14.85 1 21.4834 ? CB  LEU 281  A 1 1 
ATOM   2091 C  CG  . LEU A 1 281 ?   5.632 27.807 14.207 1 21.9401 ? CG  LEU 281  A 1 1 
ATOM   2092 C  CD1 . LEU A 1 281 ?    6.95 28.223 13.825 1 21.9551 ? CD1 LEU 281  A 1 1 
ATOM   2093 C  CD2 . LEU A 1 281 ?   5.653 26.551 15.155 1 22.0874 ? CD2 LEU 281  A 1 1 
ATOM   2094 C  C   . LEU A 1 281 ?   2.774 29.615 16.111 1 23.4061 ? C   LEU 281  A 1 1 
ATOM   2095 O  O   . LEU A 1 281 ?   3.053 29.634 17.319 1 22.8662 ? O   LEU 281  A 1 1 
ATOM   2096 N  N   . THR A 1 282 ?    1.89 30.433 15.484 1 23.7197 ? N   THR 282  A 1 1 
ATOM   2097 C  CA  . THR A 1 282 ?   1.138 31.512 16.128 1 23.1518 ? CA  THR 282  A 1 1 
ATOM   2098 C  CB  . THR A 1 282 ?   -0.38  31.16 16.219 1 23.8203 ? CB  THR 282  A 1 1 
ATOM   2099 O  OG1 . THR A 1 282 ?  -0.877 30.736 14.924 1 24.5461 ? OG1 THR 282  A 1 1 
ATOM   2100 C  CG2 . THR A 1 282 ?  -1.253 32.353 16.716 1 24.0409 ? CG2 THR 282  A 1 1 
ATOM   2101 C  C   . THR A 1 282 ?   1.756 31.838 17.485 1 22.7764 ? C   THR 282  A 1 1 
ATOM   2102 O  O   . THR A 1 282 ?   1.262 31.424 18.542 1 22.9799 ? O   THR 282  A 1 1 
ATOM   2103 N  N   . ILE A 1 283 ?   2.832 32.626 17.441 1 22.9597 ? N   ILE 283  A 1 1 
ATOM   2104 C  CA  . ILE A 1 283 ?   3.695 32.791 18.598 1 22.8345 ? CA  ILE 283  A 1 1 
ATOM   2105 C  CB  . ILE A 1 283 ?   5.041  33.38 18.166 1 23.0477 ? CB  ILE 283  A 1 1 
ATOM   2106 C  CG1 . ILE A 1 283 ?   4.891 34.567 17.204 1 23.6281 ? CG1 ILE 283  A 1 1 
ATOM   2107 C  CG2 . ILE A 1 283 ?   5.944 32.284 17.533 1    23.1 ? CG2 ILE 283  A 1 1 
ATOM   2108 C  CD1 . ILE A 1 283 ?   6.071 35.523 17.225 1 23.5314 ? CD1 ILE 283  A 1 1 
ATOM   2109 C  C   . ILE A 1 283 ?   3.065 33.602 19.726 1 22.8389 ? C   ILE 283  A 1 1 
ATOM   2110 O  O   . ILE A 1 283 ?   3.553 33.555 20.864 1 22.2192 ? O   ILE 283  A 1 1 
ATOM   2111 N  N   . GLY A 1 284 ?   1.997 34.345 19.414 1 21.6552 ? N   GLY 284  A 1 1 
ATOM   2112 C  CA  . GLY A 1 284 ?   1.233 35.017 20.457 1 22.3688 ? CA  GLY 284  A 1 1 
ATOM   2113 C  C   . GLY A 1 284 ?   0.369 34.011 21.226 1 22.7873 ? C   GLY 284  A 1 1 
ATOM   2114 O  O   . GLY A 1 284 ?  -0.846 34.016 21.102 1 22.6085 ? O   GLY 284  A 1 1 
ATOM   2115 N  N   . GLN A 1 285 ?   1.042 33.147 21.992 1 22.2152 ? N   GLN 285  A 1 1 
ATOM   2116 C  CA  . GLN A 1 285 ?   0.475 31.935 22.538 1 22.6383 ? CA  GLN 285  A 1 1 
ATOM   2117 C  CB  . GLN A 1 285 ?   1.632 31.115 23.157 1  23.086 ? CB  GLN 285  A 1 1 
ATOM   2118 C  CG  . GLN A 1 285 ?   2.382  31.84  24.31 1 22.3525 ? CG  GLN 285  A 1 1 
ATOM   2119 C  CD  . GLN A 1 285 ?   3.531 30.985 24.886 1 22.2599 ? CD  GLN 285  A 1 1 
ATOM   2120 O  OE1 . GLN A 1 285 ?   3.486 29.761 24.897 1 21.8196 ? OE1 GLN 285  A 1 1 
ATOM   2121 N  NE2 . GLN A 1 285 ?   4.607 31.644 25.306 1 20.6026 ? NE2 GLN 285  A 1 1 
ATOM   2122 C  C   . GLN A 1 285 ?   -0.66 32.114 23.546 1 23.8084 ? C   GLN 285  A 1 1 
ATOM   2123 O  O   . GLN A 1 285 ?  -1.525 31.247 23.627 1 23.9235 ? O   GLN 285  A 1 1 
ATOM   2124 N  N   . PHE A 1 286 ?  -0.648 33.212 24.332 1 23.0484 ? N   PHE 286  A 1 1 
ATOM   2125 C  CA  . PHE A 1 286 ?  -1.649 33.387 25.384 1 24.0333 ? CA  PHE 286  A 1 1 
ATOM   2126 C  CB  . PHE A 1 286 ?  -1.006 33.991 26.665 1  25.344 ? CB  PHE 286  A 1 1 
ATOM   2127 C  CG  . PHE A 1 286 ?   0.188 33.183 27.171 1 24.8831 ? CG  PHE 286  A 1 1 
ATOM   2128 C  CD1 . PHE A 1 286 ?   0.047 31.845  27.52 1 25.4053 ? CD1 PHE 286  A 1 1 
ATOM   2129 C  CD2 . PHE A 1 286 ?   1.437 33.757 27.269 1 24.6722 ? CD2 PHE 286  A 1 1 
ATOM   2130 C  CE1 . PHE A 1 286 ?   1.144 31.095  27.96 1 25.3195 ? CE1 PHE 286  A 1 1 
ATOM   2131 C  CE2 . PHE A 1 286 ?   2.539 33.013 27.715 1 24.3064 ? CE2 PHE 286  A 1 1 
ATOM   2132 C  CZ  . PHE A 1 286 ?   2.392 31.696  28.06 1 25.0302 ? CZ  PHE 286  A 1 1 
ATOM   2133 C  C   . PHE A 1 286 ?  -2.853 34.205 24.919 1 24.4053 ? C   PHE 286  A 1 1 
ATOM   2134 O  O   . PHE A 1 286 ?  -3.872 34.302 25.624 1 24.6845 ? O   PHE 286  A 1 1 
ATOM   2135 N  N   . GLY A 1 287 ?  -2.708 34.838 23.749 1 24.2408 ? N   GLY 287  A 1 1 
ATOM   2136 C  CA  . GLY A 1 287 ?  -3.803 35.563 23.128 1  24.567 ? CA  GLY 287  A 1 1 
ATOM   2137 C  C   . GLY A 1 287 ?  -3.884 37.029 23.524 1 24.2067 ? C   GLY 287  A 1 1 
ATOM   2138 O  O   . GLY A 1 287 ?   -3.28 37.459 24.508 1 23.8666 ? O   GLY 287  A 1 1 
ATOM   2139 N  N   . GLY A 1 288 ?  -4.647 37.785 22.728 1 24.7825 ? N   GLY 288  A 1 1 
ATOM   2140 C  CA  . GLY A 1 288 ?  -4.864   39.2  22.95 1 24.5439 ? CA  GLY 288  A 1 1 
ATOM   2141 C  C   . GLY A 1 288 ?  -5.948 39.483 23.986 1 25.4133 ? C   GLY 288  A 1 1 
ATOM   2142 O  O   . GLY A 1 288 ?  -6.939  38.76 24.087 1 27.0425 ? O   GLY 288  A 1 1 
ATOM   2143 N  N   . GLU A 1 289 ?  -5.761 40.558 24.748 1 24.2797 ? N   GLU 289  A 1 1 
ATOM   2144 C  CA  . GLU A 1 289 ?  -6.708 40.911 25.787 1 25.3223 ? CA  GLU 289  A 1 1 
ATOM   2145 C  CB  . GLU A 1 289 ?  -5.947 41.211 27.073 1 25.7601 ? CB  GLU 289  A 1 1 
ATOM   2146 C  CG  . GLU A 1 289 ?    -5.2 40.009 27.648 1 25.7092 ? CG  GLU 289  A 1 1 
ATOM   2147 C  CD  . GLU A 1 289 ?  -4.518 40.291 28.971 1 25.9599 ? CD  GLU 289  A 1 1 
ATOM   2148 O  OE1 . GLU A 1 289 ?  -3.412 40.893 28.956 1   23.55 ? OE1 GLU 289  A 1 1 
ATOM   2149 O  OE2 . GLU A 1 289 ?   -5.16 40.056 30.016 1 26.7799 ? OE2 GLU 289  A 1 1 
ATOM   2150 C  C   . GLU A 1 289 ?  -7.558 42.105 25.372 1 25.6782 ? C   GLU 289  A 1 1 
ATOM   2151 O  O   . GLU A 1 289 ?  -7.021 43.094 24.876 1 24.6108 ? O   GLU 289  A 1 1 
ATOM   2152 N  N   . ARG A 1 290 ?  -8.876 41.993 25.605 1 27.3094 ? N   ARG 290  A 1 1 
ATOM   2153 C  CA  . ARG A 1 290 ?   -9.83 43.046 25.315 1 27.5598 ? CA  ARG 290  A 1 1 
ATOM   2154 C  CB  . ARG A 1 290 ?  -10.57 42.768 23.999 1 28.6421 ? CB  ARG 290  A 1 1 
ATOM   2155 C  CG  . ARG A 1 290 ?   -9.69  42.72 22.735 1 27.4832 ? CG  ARG 290  A 1 1 
ATOM   2156 C  CD  . ARG A 1 290 ?  -9.025 44.057 22.417 1 27.5328 ? CD  ARG 290  A 1 1 
ATOM   2157 N  NE  . ARG A 1 290 ?  -8.443 44.092 21.078 1  26.999 ? NE  ARG 290  A 1 1 
ATOM   2158 C  CZ  . ARG A 1 290 ?  -7.215   43.7 20.763 1 27.5143 ? CZ  ARG 290  A 1 1 
ATOM   2159 N  NH1 . ARG A 1 290 ?  -6.376 43.242 21.684 1 27.3103 ? NH1 ARG 290  A 1 1 
ATOM   2160 N  NH2 . ARG A 1 290 ?  -6.808 43.787 19.495 1 26.8556 ? NH2 ARG 290  A 1 1 
ATOM   2161 C  C   . ARG A 1 290 ? -10.859 43.113 26.439 1 28.1095 ? C   ARG 290  A 1 1 
ATOM   2162 O  O   . ARG A 1 290 ? -10.985 42.185 27.236 1 28.4924 ? O   ARG 290  A 1 1 
ATOM   2163 N  N   . VAL A 1 291 ? -11.597 44.217 26.494 1 28.8424 ? N   VAL 291  A 1 1 
ATOM   2164 C  CA  . VAL A 1 291 ? -12.687 44.348 27.447 1 30.3882 ? CA  VAL 291  A 1 1 
ATOM   2165 C  CB  . VAL A 1 291 ? -12.198 45.096 28.717 1 30.5892 ? CB  VAL 291  A 1 1 
ATOM   2166 C  CG1 . VAL A 1 291 ? -11.819 46.551  28.44 1 30.3924 ? CG1 VAL 291  A 1 1 
ATOM   2167 C  CG2 . VAL A 1 291 ? -13.249 45.011 29.812 1 31.9386 ? CG2 VAL 291  A 1 1 
ATOM   2168 C  C   . VAL A 1 291 ? -13.919 44.997 26.813 1 31.2881 ? C   VAL 291  A 1 1 
ATOM   2169 O  O   . VAL A 1 291 ? -13.803 45.974 26.076 1 31.2148 ? O   VAL 291  A 1 1 
ATOM   2170 N  N   . ALA A 1 292 ?  -15.11 44.448 27.112 1 32.2864 ? N   ALA 292  A 1 1 
ATOM   2171 C  CA  . ALA A 1 292 ? -16.332 44.904 26.468 1 32.7693 ? CA  ALA 292  A 1 1 
ATOM   2172 C  CB  . ALA A 1 292 ? -17.454 43.899 26.677 1  33.832 ? CB  ALA 292  A 1 1 
ATOM   2173 C  C   . ALA A 1 292 ? -16.683 46.276 27.041 1 33.2954 ? C   ALA 292  A 1 1 
ATOM   2174 O  O   . ALA A 1 292 ? -16.619 46.466 28.257 1 33.0222 ? O   ALA 292  A 1 1 
ATOM   2175 N  N   . THR A 1 293 ? -17.021 47.243 26.177 1 33.8745 ? N   THR 293  A 1 1 
ATOM   2176 C  CA  . THR A 1 293 ? -17.464 48.545 26.665 1  35.665 ? CA  THR 293  A 1 1 
ATOM   2177 C  CB  . THR A 1 293 ? -16.877 49.666 25.868 1 35.3402 ? CB  THR 293  A 1 1 
ATOM   2178 O  OG1 . THR A 1 293 ? -17.387 49.539 24.556 1 35.9537 ? OG1 THR 293  A 1 1 
ATOM   2179 C  CG2 . THR A 1 293 ? -15.387 49.638 25.865 1 34.0596 ? CG2 THR 293  A 1 1 
ATOM   2180 C  C   . THR A 1 293 ? -18.983 48.672 26.665 1 38.6718 ? C   THR 293  A 1 1 
ATOM   2181 O  O   . THR A 1 293 ? -19.536 49.644 27.187 1 38.2093 ? O   THR 293  A 1 1 
ATOM   2182 N  N   . ARG A 1 294 ? -19.653 47.683 26.071 1 41.2422 ? N   ARG 294  A 1 1 
ATOM   2183 C  CA  . ARG A 1 294 ?  -21.09 47.556 26.242 1 45.3892 ? CA  ARG 294  A 1 1 
ATOM   2184 C  CB  . ARG A 1 294 ? -21.822 48.451 25.236 1 48.7659 ? CB  ARG 294  A 1 1 
ATOM   2185 C  CG  . ARG A 1 294 ? -21.225 48.382 23.842 1 51.6792 ? CG  ARG 294  A 1 1 
ATOM   2186 C  CD  . ARG A 1 294 ? -22.019 49.186 22.829 1 54.7585 ? CD  ARG 294  A 1 1 
ATOM   2187 N  NE  . ARG A 1 294 ? -21.904 48.593 21.501 1 57.7304 ? NE  ARG 294  A 1 1 
ATOM   2188 C  CZ  . ARG A 1 294 ? -22.389 47.399 21.155 1 61.1842 ? CZ  ARG 294  A 1 1 
ATOM   2189 N  NH1 . ARG A 1 294 ? -23.159 46.696 21.976 1 62.5552 ? NH1 ARG 294  A 1 1 
ATOM   2190 N  NH2 . ARG A 1 294 ? -22.103 46.905 19.951 1 61.0248 ? NH2 ARG 294  A 1 1 
ATOM   2191 C  C   . ARG A 1 294 ? -21.424 46.075 26.097 1 45.0499 ? C   ARG 294  A 1 1 
ATOM   2192 O  O   . ARG A 1 294 ? -20.574 45.293 25.679 1 42.5946 ? O   ARG 294  A 1 1 
ATOM   2193 N  N   . ASP A 1 295 ? -22.647 45.693 26.487 1 46.6945 ? N   ASP 295  A 1 1 
ATOM   2194 C  CA  . ASP A 1 295 ? -23.122 44.335  26.28 1  47.428 ? CA  ASP 295  A 1 1 
ATOM   2195 C  CB  . ASP A 1 295 ? -24.561 44.168 26.779 1 49.1339 ? CB  ASP 295  A 1 1 
ATOM   2196 C  CG  . ASP A 1 295 ? -24.762 44.324 28.273 1 49.8534 ? CG  ASP 295  A 1 1 
ATOM   2197 O  OD1 . ASP A 1 295 ? -23.781 44.616 28.984 1  48.243 ? OD1 ASP 295  A 1 1 
ATOM   2198 O  OD2 . ASP A 1 295 ? -25.897 44.167 28.728 1  51.845 ? OD2 ASP 295  A 1 1 
ATOM   2199 C  C   . ASP A 1 295 ? -23.047 43.988 24.796 1 47.6127 ? C   ASP 295  A 1 1 
ATOM   2200 O  O   . ASP A 1 295 ?  -23.43   44.8 23.963 1    48.9 ? O   ASP 295  A 1 1 
ATOM   2201 N  N   . VAL A 1 296 ? -22.543  42.79 24.477 1 47.0822 ? N   VAL 296  A 1 1 
ATOM   2202 C  CA  . VAL A 1 296 ? -22.437 42.333   23.1 1 48.2202 ? CA  VAL 296  A 1 1 
ATOM   2203 C  CB  . VAL A 1 296 ? -21.073 42.792 22.429 1 47.6663 ? CB  VAL 296  A 1 1 
ATOM   2204 C  CG1 . VAL A 1 296 ?  -19.91  42.78 23.406 1 46.6569 ? CG1 VAL 296  A 1 1 
ATOM   2205 C  CG2 . VAL A 1 296 ? -20.706 41.966 21.187 1 47.7454 ? CG2 VAL 296  A 1 1 
ATOM   2206 C  C   . VAL A 1 296 ? -22.675 40.823 23.041 1 49.0722 ? C   VAL 296  A 1 1 
ATOM   2207 O  O   . VAL A 1 296 ? -22.412  40.09 23.995 1 50.3442 ? O   VAL 296  A 1 1 
ATOM   2208 N  N   . GLU A 1 297 ? -23.212 40.377 21.906 1 48.6404 ? N   GLU 297  A 1 1 
ATOM   2209 C  CA  . GLU A 1 297 ? -23.365 38.967 21.612 1 49.1033 ? CA  GLU 297  A 1 1 
ATOM   2210 C  CB  . GLU A 1 297 ? -24.582 38.774 20.724 1 52.0122 ? CB  GLU 297  A 1 1 
ATOM   2211 C  CG  . GLU A 1 297 ? -25.155  37.38 20.777 1  54.823 ? CG  GLU 297  A 1 1 
ATOM   2212 C  CD  . GLU A 1 297 ? -26.422 37.277 21.604 1 57.7333 ? CD  GLU 297  A 1 1 
ATOM   2213 O  OE1 . GLU A 1 297 ?  -26.45 37.804 22.743 1 58.4268 ? OE1 GLU 297  A 1 1 
ATOM   2214 O  OE2 . GLU A 1 297 ? -27.391  36.66 21.107 1 60.2565 ? OE2 GLU 297  A 1 1 
ATOM   2215 C  C   . GLU A 1 297 ? -22.129 38.483 20.864 1 46.6674 ? C   GLU 297  A 1 1 
ATOM   2216 O  O   . GLU A 1 297 ? -21.773 39.072 19.852 1 48.6135 ? O   GLU 297  A 1 1 
ATOM   2217 N  N   . LEU A 1 298 ? -21.476 37.425 21.349 1 43.6399 ? N   LEU 298  A 1 1 
ATOM   2218 C  CA  . LEU A 1 298 ? -20.295 36.893 20.685 1 41.3034 ? CA  LEU 298  A 1 1 
ATOM   2219 C  CB  . LEU A 1 298 ? -19.006 37.222 21.473 1 40.1053 ? CB  LEU 298  A 1 1 
ATOM   2220 C  CG  . LEU A 1 298 ? -17.718  36.72 20.845 1 39.1401 ? CG  LEU 298  A 1 1 
ATOM   2221 C  CD1 . LEU A 1 298 ? -17.534 37.351 19.461 1 38.8368 ? CD1 LEU 298  A 1 1 
ATOM   2222 C  CD2 . LEU A 1 298 ? -16.483 36.983 21.775 1 38.1946 ? CD2 LEU 298  A 1 1 
ATOM   2223 C  C   . LEU A 1 298 ?  -20.43 35.384 20.522 1 40.3954 ? C   LEU 298  A 1 1 
ATOM   2224 O  O   . LEU A 1 298 ? -20.454 34.646 21.505 1 40.1702 ? O   LEU 298  A 1 1 
ATOM   2225 N  N   . GLY A 1 299 ? -20.538 34.943 19.266 1 39.9513 ? N   GLY 299  A 1 1 
ATOM   2226 C  CA  . GLY A 1 299 ? -20.903 33.571 18.973 1  40.966 ? CA  GLY 299  A 1 1 
ATOM   2227 C  C   . GLY A 1 299 ? -22.079 33.122  19.83 1 42.9502 ? C   GLY 299  A 1 1 
ATOM   2228 O  O   . GLY A 1 299 ? -22.072 32.017 20.361 1 43.5354 ? O   GLY 299  A 1 1 
ATOM   2229 N  N   . GLY A 1 300 ? -23.092 33.989 19.967 1 43.9401 ? N   GLY 300  A 1 1 
ATOM   2230 C  CA  . GLY A 1 300 ?  -24.31 33.621 20.665 1 45.2306 ? CA  GLY 300  A 1 1 
ATOM   2231 C  C   . GLY A 1 300 ? -24.242 33.667 22.192 1 45.0802 ? C   GLY 300  A 1 1 
ATOM   2232 O  O   . GLY A 1 300 ? -25.229 33.355 22.838 1 47.2262 ? O   GLY 300  A 1 1 
ATOM   2233 N  N   . VAL A 1 301 ? -23.091 34.056 22.758 1 43.7438 ? N   VAL 301  A 1 1 
ATOM   2234 C  CA  . VAL A 1 301 ? -22.888 34.174 24.199 1 43.4907 ? CA  VAL 301  A 1 1 
ATOM   2235 C  CB  . VAL A 1 301 ? -21.513 33.551 24.626 1 41.6658 ? CB  VAL 301  A 1 1 
ATOM   2236 C  CG1 . VAL A 1 301 ? -21.213 33.755 26.118 1  40.877 ? CG1 VAL 301  A 1 1 
ATOM   2237 C  CG2 . VAL A 1 301 ? -21.426 32.079  24.26 1  41.992 ? CG2 VAL 301  A 1 1 
ATOM   2238 C  C   . VAL A 1 301 ?  -22.91 35.647 24.602 1  44.213 ? C   VAL 301  A 1 1 
ATOM   2239 O  O   . VAL A 1 301 ? -22.207  36.46 23.999 1 43.3717 ? O   VAL 301  A 1 1 
ATOM   2240 N  N   . ARG A 1 302 ?  -23.67 35.984 25.654 1 45.4529 ? N   ARG 302  A 1 1 
ATOM   2241 C  CA  . ARG A 1 302 ? -23.705  37.35 26.143 1 46.7905 ? CA  ARG 302  A 1 1 
ATOM   2242 C  CB  . ARG A 1 302 ? -24.953 37.594 26.986 1 50.9348 ? CB  ARG 302  A 1 1 
ATOM   2243 C  CG  . ARG A 1 302 ? -25.111  39.05 27.376 1 53.3358 ? CG  ARG 302  A 1 1 
ATOM   2244 C  CD  . ARG A 1 302 ? -26.398 39.272  28.17 1 58.4158 ? CD  ARG 302  A 1 1 
ATOM   2245 N  NE  . ARG A 1 302 ? -26.284 40.384 29.115 1 61.1237 ? NE  ARG 302  A 1 1 
ATOM   2246 C  CZ  . ARG A 1 302 ? -25.554 40.369  30.23 1 63.2797 ? CZ  ARG 302  A 1 1 
ATOM   2247 N  NH1 . ARG A 1 302 ? -24.813  39.32 30.567 1 62.3112 ? NH1 ARG 302  A 1 1 
ATOM   2248 N  NH2 . ARG A 1 302 ? -25.583 41.431 31.038 1 64.6895 ? NH2 ARG 302  A 1 1 
ATOM   2249 C  C   . ARG A 1 302 ? -22.456 37.693 26.959 1 44.9311 ? C   ARG 302  A 1 1 
ATOM   2250 O  O   . ARG A 1 302 ? -22.163  37.05 27.964 1 43.7594 ? O   ARG 302  A 1 1 
ATOM   2251 N  N   . ILE A 1 303 ? -21.738  38.72 26.493 1 43.4324 ? N   ILE 303  A 1 1 
ATOM   2252 C  CA  . ILE A 1 303 ? -20.592 39.295 27.184 1 42.4285 ? CA  ILE 303  A 1 1 
ATOM   2253 C  CB  . ILE A 1 303 ? -19.421 39.548 26.211 1 40.7581 ? CB  ILE 303  A 1 1 
ATOM   2254 C  CG1 . ILE A 1 303 ? -19.095 38.313 25.367 1 41.4349 ? CG1 ILE 303  A 1 1 
ATOM   2255 C  CG2 . ILE A 1 303 ? -18.192 40.067 26.967 1 39.0334 ? CG2 ILE 303  A 1 1 
ATOM   2256 C  CD1 . ILE A 1 303 ? -18.303  37.34 26.025 1 41.4231 ? CD1 ILE 303  A 1 1 
ATOM   2257 C  C   . ILE A 1 303 ? -21.048 40.621 27.779 1 42.6528 ? C   ILE 303  A 1 1 
ATOM   2258 O  O   . ILE A 1 303 ? -21.491 41.506 27.047 1 43.6158 ? O   ILE 303  A 1 1 
ATOM   2259 N  N   . ALA A 1 304 ? -20.939 40.766 29.098 1 42.1273 ? N   ALA 304  A 1 1 
ATOM   2260 C  CA  . ALA A 1 304 ? -21.455 41.955 29.751 1 41.9641 ? CA  ALA 304  A 1 1 
ATOM   2261 C  CB  . ALA A 1 304 ? -21.797 41.649 31.194 1 42.5664 ? CB  ALA 304  A 1 1 
ATOM   2262 C  C   . ALA A 1 304 ? -20.435 43.088 29.665 1 40.9259 ? C   ALA 304  A 1 1 
ATOM   2263 O  O   . ALA A 1 304 ? -19.231 42.846  29.63 1 38.2364 ? O   ALA 304  A 1 1 
ATOM   2264 N  N   . LYS A 1 305 ? -20.931 44.332 29.625 1 41.2954 ? N   LYS 305  A 1 1 
ATOM   2265 C  CA  . LYS A 1 305 ? -20.057 45.488 29.758 1 41.0286 ? CA  LYS 305  A 1 1 
ATOM   2266 C  CB  . LYS A 1 305 ? -20.899 46.741 30.002 1 42.2527 ? CB  LYS 305  A 1 1 
ATOM   2267 C  CG  . LYS A 1 305 ?  -20.12 48.001 30.305 1  42.572 ? CG  LYS 305  A 1 1 
ATOM   2268 C  CD  . LYS A 1 305 ? -21.056 49.193 30.595 1 44.6902 ? CD  LYS 305  A 1 1 
ATOM   2269 C  CE  . LYS A 1 305 ? -20.268  50.46 30.779 1  45.202 ? CE  LYS 305  A 1 1 
ATOM   2270 N  NZ  . LYS A 1 305 ?  -21.18 51.572 31.059 1 47.5925 ? NZ  LYS 305  A 1 1 
ATOM   2271 C  C   . LYS A 1 305 ?  -19.09  45.27 30.919 1 39.9716 ? C   LYS 305  A 1 1 
ATOM   2272 O  O   . LYS A 1 305 ? -19.512 44.871 32.007 1 41.0641 ? O   LYS 305  A 1 1 
ATOM   2273 N  N   . GLY A 1 306 ? -17.804 45.527 30.674 1 37.9643 ? N   GLY 306  A 1 1 
ATOM   2274 C  CA  . GLY A 1 306 ? -16.785 45.503 31.714 1 36.9478 ? CA  GLY 306  A 1 1 
ATOM   2275 C  C   . GLY A 1 306 ? -16.044 44.171 31.842 1 36.0195 ? C   GLY 306  A 1 1 
ATOM   2276 O  O   . GLY A 1 306 ? -15.059  44.08 32.572 1   35.54 ? O   GLY 306  A 1 1 
ATOM   2277 N  N   . GLU A 1 307 ? -16.527 43.145 31.129 1 35.2487 ? N   GLU 307  A 1 1 
ATOM   2278 C  CA  . GLU A 1 307 ? -15.944 41.817 31.207 1 34.9977 ? CA  GLU 307  A 1 1 
ATOM   2279 C  CB  . GLU A 1 307 ? -16.996 40.727 30.932 1 36.6082 ? CB  GLU 307  A 1 1 
ATOM   2280 C  CG  . GLU A 1 307 ? -18.107 40.721 31.961 1 38.0183 ? CG  GLU 307  A 1 1 
ATOM   2281 C  CD  . GLU A 1 307 ? -19.011 39.508 31.917 1 39.1822 ? CD  GLU 307  A 1 1 
ATOM   2282 O  OE1 . GLU A 1 307 ? -19.346 39.033 30.809 1 38.9823 ? OE1 GLU 307  A 1 1 
ATOM   2283 O  OE2 . GLU A 1 307 ? -19.426 39.063 33.007 1 40.3409 ? OE2 GLU 307  A 1 1 
ATOM   2284 C  C   . GLU A 1 307 ? -14.779 41.668 30.231 1 33.5321 ? C   GLU 307  A 1 1 
ATOM   2285 O  O   . GLU A 1 307 ? -14.853 42.101 29.075 1 32.8141 ? O   GLU 307  A 1 1 
ATOM   2286 N  N   . GLN A 1 308 ? -13.701  41.06 30.727 1 31.9189 ? N   GLN 308  A 1 1 
ATOM   2287 C  CA  . GLN A 1 308 ? -12.463 40.957  29.97 1  31.265 ? CA  GLN 308  A 1 1 
ATOM   2288 C  CB  . GLN A 1 308 ? -11.273 40.896  30.92 1 30.3329 ? CB  GLN 308  A 1 1 
ATOM   2289 C  CG  . GLN A 1 308 ?  -9.911 40.977 30.218 1 29.6208 ? CG  GLN 308  A 1 1 
ATOM   2290 C  CD  . GLN A 1 308 ?   -8.83 41.603 31.097 1  28.677 ? CD  GLN 308  A 1 1 
ATOM   2291 O  OE1 . GLN A 1 308 ?  -9.109 42.347 32.028 1 29.6141 ? OE1 GLN 308  A 1 1 
ATOM   2292 N  NE2 . GLN A 1 308 ?  -7.602 41.349 30.774 1 26.8313 ? NE2 GLN 308  A 1 1 
ATOM   2293 C  C   . GLN A 1 308 ?  -12.58 39.717 29.089 1 30.9843 ? C   GLN 308  A 1 1 
ATOM   2294 O  O   . GLN A 1 308 ? -13.255 38.768 29.468 1 30.6425 ? O   GLN 308  A 1 1 
ATOM   2295 N  N   . VAL A 1 309 ? -11.928 39.741 27.912 1 30.8701 ? N   VAL 309  A 1 1 
ATOM   2296 C  CA  . VAL A 1 309 ? -12.018 38.669  26.93 1 31.0651 ? CA  VAL 309  A 1 1 
ATOM   2297 C  CB  . VAL A 1 309 ?  -13.04 38.984 25.788 1 32.4606 ? CB  VAL 309  A 1 1 
ATOM   2298 C  CG1 . VAL A 1 309 ? -13.283 37.776  24.92 1  33.147 ? CG1 VAL 309  A 1 1 
ATOM   2299 C  CG2 . VAL A 1 309 ? -14.362 39.461 26.354 1 34.1001 ? CG2 VAL 309  A 1 1 
ATOM   2300 C  C   . VAL A 1 309 ?  -10.63 38.418 26.356 1 29.6293 ? C   VAL 309  A 1 1 
ATOM   2301 O  O   . VAL A 1 309 ?  -9.835 39.354 26.244 1 28.4949 ? O   VAL 309  A 1 1 
ATOM   2302 N  N   . VAL A 1 310 ? -10.332 37.138 26.082 1 28.7594 ? N   VAL 310  A 1 1 
ATOM   2303 C  CA  . VAL A 1 310 ?  -9.061 36.739 25.514 1 27.3459 ? CA  VAL 310  A 1 1 
ATOM   2304 C  CB  . VAL A 1 310 ?   -8.29 35.741   26.4 1 26.9904 ? CB  VAL 310  A 1 1 
ATOM   2305 C  CG1 . VAL A 1 310 ?  -7.067 35.197 25.651 1 26.2359 ? CG1 VAL 310  A 1 1 
ATOM   2306 C  CG2 . VAL A 1 310 ?   -7.87 36.413 27.721 1   26.55 ? CG2 VAL 310  A 1 1 
ATOM   2307 C  C   . VAL A 1 310 ?  -9.272 36.152 24.125 1   26.98 ? C   VAL 310  A 1 1 
ATOM   2308 O  O   . VAL A 1 310 ? -10.007 35.186  23.97 1 27.2403 ? O   VAL 310  A 1 1 
ATOM   2309 N  N   . ALA A 1 311 ?  -8.606 36.759 23.139 1 26.2539 ? N   ALA 311  A 1 1 
ATOM   2310 C  CA  . ALA A 1 311 ?  -8.546 36.241 21.777 1 25.8273 ? CA  ALA 311  A 1 1 
ATOM   2311 C  CB  . ALA A 1 311 ?  -8.357 37.381 20.804 1 25.3536 ? CB  ALA 311  A 1 1 
ATOM   2312 C  C   . ALA A 1 311 ?  -7.381 35.274 21.595 1 24.2599 ? C   ALA 311  A 1 1 
ATOM   2313 O  O   . ALA A 1 311 ?  -6.267 35.722 21.366 1 24.0144 ? O   ALA 311  A 1 1 
ATOM   2314 N  N   . HIS A 1 312 ?  -7.651 33.975 21.735 1 24.2048 ? N   HIS 312  A 1 1 
ATOM   2315 C  CA  . HIS A 1 312 ?   -6.64 32.926 21.686 1 23.8513 ? CA  HIS 312  A 1 1 
ATOM   2316 C  CB  . HIS A 1 312 ?  -7.071  31.73 22.543 1 24.8486 ? CB  HIS 312  A 1 1 
ATOM   2317 C  CG  . HIS A 1 312 ?  -5.961 30.846 23.038 1 24.4137 ? CG  HIS 312  A 1 1 
ATOM   2318 N  ND1 . HIS A 1 312 ?  -5.164  30.16 22.165 1 24.9921 ? ND1 HIS 312  A 1 1 
ATOM   2319 C  CE1 . HIS A 1 312 ?  -4.326 29.433 22.917 1 24.3347 ? CE1 HIS 312  A 1 1 
ATOM   2320 N  NE2 . HIS A 1 312 ?  -4.558 29.636 24.215 1   24.11 ? NE2 HIS 312  A 1 1 
ATOM   2321 C  CD2 . HIS A 1 312 ?  -5.605 30.517 24.302 1 24.2839 ? CD2 HIS 312  A 1 1 
ATOM   2322 C  C   . HIS A 1 312 ?  -6.415 32.572 20.217 1 23.2164 ? C   HIS 312  A 1 1 
ATOM   2323 O  O   . HIS A 1 312 ?  -7.018 31.653 19.655 1 22.8119 ? O   HIS 312  A 1 1 
ATOM   2324 N  N   . VAL A 1 313 ?  -5.556 33.374  19.59 1 22.6665 ? N   VAL 313  A 1 1 
ATOM   2325 C  CA  . VAL A 1 313 ?   -5.28 33.269  18.17 1 22.4523 ? CA  VAL 313  A 1 1 
ATOM   2326 C  CB  . VAL A 1 313 ?  -4.484 34.487 17.672 1 22.6792 ? CB  VAL 313  A 1 1 
ATOM   2327 C  CG1 . VAL A 1 313 ?  -5.322 35.755 17.631 1 22.9213 ? CG1 VAL 313  A 1 1 
ATOM   2328 C  CG2 . VAL A 1 313 ?  -3.235 34.696 18.501 1 22.7343 ? CG2 VAL 313  A 1 1 
ATOM   2329 C  C   . VAL A 1 313 ?  -4.563 31.954 17.852 1  22.713 ? C   VAL 313  A 1 1 
ATOM   2330 O  O   . VAL A 1 313 ?  -4.699 31.446  16.75 1 23.6256 ? O   VAL 313  A 1 1 
ATOM   2331 N  N   . LEU A 1 314 ?  -3.825 31.382 18.815 1 22.1412 ? N   LEU 314  A 1 1 
ATOM   2332 C  CA  . LEU A 1 314 ?  -3.168 30.099 18.593 1 22.9024 ? CA  LEU 314  A 1 1 
ATOM   2333 C  CB  . LEU A 1 314 ?  -2.279 29.748 19.789 1 22.6747 ? CB  LEU 314  A 1 1 
ATOM   2334 C  CG  . LEU A 1 314 ?  -1.614 28.347 19.768 1 23.5355 ? CG  LEU 314  A 1 1 
ATOM   2335 C  CD1 . LEU A 1 314 ?   -0.79  28.08 18.469 1 23.2787 ? CD1 LEU 314  A 1 1 
ATOM   2336 C  CD2 . LEU A 1 314 ?  -0.681 28.209 20.963 1   23.61 ? CD2 LEU 314  A 1 1 
ATOM   2337 C  C   . LEU A 1 314 ?  -4.218 29.016 18.397 1 24.3128 ? C   LEU 314  A 1 1 
ATOM   2338 O  O   . LEU A 1 314 ?  -4.192 28.258 17.441 1 25.5552 ? O   LEU 314  A 1 1 
ATOM   2339 N  N   . ALA A 1 315 ?  -5.186 28.982 19.307 1 24.9746 ? N   ALA 315  A 1 1 
ATOM   2340 C  CA  . ALA A 1 315 ?  -6.281 28.035 19.191 1 26.1634 ? CA  ALA 315  A 1 1 
ATOM   2341 C  CB  . ALA A 1 315 ?  -7.211 28.202 20.375 1 26.4999 ? CB  ALA 315  A 1 1 
ATOM   2342 C  C   . ALA A 1 315 ?  -7.043 28.206 17.879 1 26.6829 ? C   ALA 315  A 1 1 
ATOM   2343 O  O   . ALA A 1 315 ?   -7.37  27.23 17.206 1 27.3092 ? O   ALA 315  A 1 1 
ATOM   2344 N  N   . ALA A 1 316 ?  -7.361 29.454 17.546 1 26.3389 ? N   ALA 316  A 1 1 
ATOM   2345 C  CA  . ALA A 1 316 ?  -8.136 29.763 16.353 1 26.7007 ? CA  ALA 316  A 1 1 
ATOM   2346 C  CB  . ALA A 1 316 ?  -8.373 31.271 16.273 1 26.4839 ? CB  ALA 316  A 1 1 
ATOM   2347 C  C   . ALA A 1 316 ?  -7.464  29.27 15.071 1 26.2552 ? C   ALA 316  A 1 1 
ATOM   2348 O  O   . ALA A 1 316 ?  -8.143 28.808 14.141 1 26.4722 ? O   ALA 316  A 1 1 
ATOM   2349 N  N   . ASP A 1 317 ?  -6.128 29.377 15.024 1 25.4466 ? N   ASP 317  A 1 1 
ATOM   2350 C  CA  . ASP A 1 317 ?  -5.375 28.976 13.851 1 25.2655 ? CA  ASP 317  A 1 1 
ATOM   2351 C  CB  . ASP A 1 317 ?  -3.979 29.622  13.89 1 24.1022 ? CB  ASP 317  A 1 1 
ATOM   2352 C  CG  . ASP A 1 317 ?  -3.956 31.051 13.401 1 23.3223 ? CG  ASP 317  A 1 1 
ATOM   2353 O  OD1 . ASP A 1 317 ?  -4.944 31.468 12.747 1 24.6619 ? OD1 ASP 317  A 1 1 
ATOM   2354 O  OD2 . ASP A 1 317 ?  -2.937  31.77 13.658 1 22.1537 ? OD2 ASP 317  A 1 1 
ATOM   2355 C  C   . ASP A 1 317 ?  -5.282 27.461 13.638 1 26.6595 ? C   ASP 317  A 1 1 
ATOM   2356 O  O   . ASP A 1 317 ?  -4.777 26.994 12.603 1 26.4654 ? O   ASP 317  A 1 1 
ATOM   2357 N  N   . PHE A 1 318 ?  -5.737 26.702 14.634 1 27.2795 ? N   PHE 318  A 1 1 
ATOM   2358 C  CA  . PHE A 1 318 ?  -5.873 25.265 14.514 1  28.001 ? CA  PHE 318  A 1 1 
ATOM   2359 C  CB  . PHE A 1 318 ?  -5.141 24.599 15.669 1  28.198 ? CB  PHE 318  A 1 1 
ATOM   2360 C  CG  . PHE A 1 318 ?  -3.682 24.585 15.416 1 26.9884 ? CG  PHE 318  A 1 1 
ATOM   2361 C  CD1 . PHE A 1 318 ?  -2.916 25.713 15.638 1 26.4252 ? CD1 PHE 318  A 1 1 
ATOM   2362 C  CD2 . PHE A 1 318 ?  -3.061 23.455 14.931 1 27.3072 ? CD2 PHE 318  A 1 1 
ATOM   2363 C  CE1 . PHE A 1 318 ?  -1.557 25.701 15.388 1 25.4092 ? CE1 PHE 318  A 1 1 
ATOM   2364 C  CE2 . PHE A 1 318 ?  -1.701 23.463 14.655 1 26.0633 ? CE2 PHE 318  A 1 1 
ATOM   2365 C  CZ  . PHE A 1 318 ?   -0.96 24.569 14.905 1 25.7998 ? CZ  PHE 318  A 1 1 
ATOM   2366 C  C   . PHE A 1 318 ?  -7.325 24.798 14.472 1 28.9671 ? C   PHE 318  A 1 1 
ATOM   2367 O  O   . PHE A 1 318 ?  -7.602 23.617 14.698 1 28.5779 ? O   PHE 318  A 1 1 
ATOM   2368 N  N   . ASP A 1 319 ?  -8.247 25.735  14.22 1 29.4134 ? N   ASP 319  A 1 1 
ATOM   2369 C  CA  . ASP A 1 319 ?  -9.657 25.402 14.091 1 30.9635 ? CA  ASP 319  A 1 1 
ATOM   2370 C  CB  . ASP A 1 319 ? -10.511 26.683  14.11 1 31.2943 ? CB  ASP 319  A 1 1 
ATOM   2371 C  CG  . ASP A 1 319 ?  -12.01 26.506 14.263 1 31.6293 ? CG  ASP 319  A 1 1 
ATOM   2372 O  OD1 . ASP A 1 319 ? -12.498 25.397 13.999 1 31.4551 ? OD1 ASP 319  A 1 1 
ATOM   2373 O  OD2 . ASP A 1 319 ? -12.693 27.489 14.679 1 32.1444 ? OD2 ASP 319  A 1 1 
ATOM   2374 C  C   . ASP A 1 319 ?  -9.861 24.628 12.793 1 32.6673 ? C   ASP 319  A 1 1 
ATOM   2375 O  O   . ASP A 1 319 ?  -9.488 25.132 11.729 1 31.8487 ? O   ASP 319  A 1 1 
ATOM   2376 N  N   . PRO A 1 320 ? -10.454 23.404 12.836 1 34.4743 ? N   PRO 320  A 1 1 
ATOM   2377 C  CA  . PRO A 1 320 ?  -10.62 22.592 11.633 1 34.8921 ? CA  PRO 320  A 1 1 
ATOM   2378 C  CB  . PRO A 1 320 ? -11.027 21.208 12.177 1 35.9629 ? CB  PRO 320  A 1 1 
ATOM   2379 C  CG  . PRO A 1 320 ? -11.742  21.51  13.52 1 36.6039 ? CG  PRO 320  A 1 1 
ATOM   2380 C  CD  . PRO A 1 320 ? -10.981 22.757 14.057 1 35.7379 ? CD  PRO 320  A 1 1 
ATOM   2381 C  C   . PRO A 1 320 ? -11.626 23.162 10.631 1 35.8595 ? C   PRO 320  A 1 1 
ATOM   2382 O  O   . PRO A 1 320 ? -11.651  22.74   9.48 1 36.4817 ? O   PRO 320  A 1 1 
ATOM   2383 N  N   . ALA A 1 321 ? -12.437 24.128 11.077 1 35.7491 ? N   ALA 321  A 1 1 
ATOM   2384 C  CA  . ALA A 1 321 ? -13.293 24.914 10.208 1   35.72 ? CA  ALA 321  A 1 1 
ATOM   2385 C  CB  . ALA A 1 321 ? -14.366 25.587 11.053 1   37.31 ? CB  ALA 321  A 1 1 
ATOM   2386 C  C   . ALA A 1 321 ? -12.544 25.974  9.402 1  34.742 ? C   ALA 321  A 1 1 
ATOM   2387 O  O   . ALA A 1 321 ?  -13.08 26.493  8.432 1 34.2386 ? O   ALA 321  A 1 1 
ATOM   2388 N  N   . PHE A 1 322 ? -11.305 26.282  9.808 1 33.3568 ? N   PHE 322  A 1 1 
ATOM   2389 C  CA  . PHE A 1 322 ? -10.462  27.26  9.135 1 33.0781 ? CA  PHE 322  A 1 1 
ATOM   2390 C  CB  . PHE A 1 322 ?  -9.546 27.944 10.182 1 31.4526 ? CB  PHE 322  A 1 1 
ATOM   2391 C  CG  . PHE A 1 322 ?  -8.468  28.83  9.627 1 31.1005 ? CG  PHE 322  A 1 1 
ATOM   2392 C  CD1 . PHE A 1 322 ?  -8.732 29.693  8.577 1 31.6488 ? CD1 PHE 322  A 1 1 
ATOM   2393 C  CD2 . PHE A 1 322 ?  -7.195 28.821 10.169 1 30.5091 ? CD2 PHE 322  A 1 1 
ATOM   2394 C  CE1 . PHE A 1 322 ?  -7.745  30.51  8.075 1 30.4525 ? CE1 PHE 322  A 1 1 
ATOM   2395 C  CE2 . PHE A 1 322 ?   -6.21 29.652  9.667 1 30.0909 ? CE2 PHE 322  A 1 1 
ATOM   2396 C  CZ  . PHE A 1 322 ?  -6.493 30.489  8.619 1 30.3855 ? CZ  PHE 322  A 1 1 
ATOM   2397 C  C   . PHE A 1 322 ?  -9.652 26.613   8.01 1 32.9812 ? C   PHE 322  A 1 1 
ATOM   2398 O  O   . PHE A 1 322 ?  -9.767  27.01  6.856 1 31.5516 ? O   PHE 322  A 1 1 
ATOM   2399 N  N   . VAL A 1 323 ?  -8.824 25.622  8.359 1 33.6435 ? N   VAL 323  A 1 1 
ATOM   2400 C  CA  . VAL A 1 323 ?   -8.12 24.821  7.367 1 34.1574 ? CA  VAL 323  A 1 1 
ATOM   2401 C  CB  . VAL A 1 323 ?  -6.635 25.222  7.205 1 33.7323 ? CB  VAL 323  A 1 1 
ATOM   2402 C  CG1 . VAL A 1 323 ?  -6.501 26.671  6.727 1 32.6567 ? CG1 VAL 323  A 1 1 
ATOM   2403 C  CG2 . VAL A 1 323 ?   -5.82 24.999  8.496 1 33.3587 ? CG2 VAL 323  A 1 1 
ATOM   2404 C  C   . VAL A 1 323 ?  -8.256  23.34   7.71 1 35.4985 ? C   VAL 323  A 1 1 
ATOM   2405 O  O   . VAL A 1 323 ?  -8.447 22.982  8.875 1 34.4686 ? O   VAL 323  A 1 1 
ATOM   2406 N  N   . GLU A 1 324 ?   -8.19   22.5  6.668 1 36.3368 ? N   GLU 324  A 1 1 
ATOM   2407 C  CA  . GLU A 1 324 ?  -8.236 21.053  6.825 1 38.8815 ? CA  GLU 324  A 1 1 
ATOM   2408 C  CB  . GLU A 1 324 ?  -8.365 20.384  5.439 1 42.9646 ? CB  GLU 324  A 1 1 
ATOM   2409 C  CG  . GLU A 1 324 ?  -7.385 19.238   5.15 1 47.2329 ? CG  GLU 324  A 1 1 
ATOM   2410 C  CD  . GLU A 1 324 ?  -6.435 19.473   3.98 1 51.0802 ? CD  GLU 324  A 1 1 
ATOM   2411 O  OE1 . GLU A 1 324 ?  -6.965 19.678  2.862 1 58.0364 ? OE1 GLU 324  A 1 1 
ATOM   2412 O  OE2 . GLU A 1 324 ?  -5.187 19.422  4.145 1 53.7331 ? OE2 GLU 324  A 1 1 
ATOM   2413 C  C   . GLU A 1 324 ?  -7.022 20.508  7.579 1 36.9468 ? C   GLU 324  A 1 1 
ATOM   2414 O  O   . GLU A 1 324 ?  -5.905 21.001    7.4 1 34.9496 ? O   GLU 324  A 1 1 
ATOM   2415 N  N   . GLU A 1 325 ?  -7.259 19.464  8.391 1 36.2334 ? N   GLU 325  A 1 1 
ATOM   2416 C  CA  . GLU A 1 325 ?  -6.227 18.789  9.166 1 36.1879 ? CA  GLU 325  A 1 1 
ATOM   2417 C  CB  . GLU A 1 325 ?  -5.467 17.762  8.326 1 37.6914 ? CB  GLU 325  A 1 1 
ATOM   2418 C  CG  . GLU A 1 325 ?  -6.238 16.521  7.914 1 41.2117 ? CG  GLU 325  A 1 1 
ATOM   2419 C  CD  . GLU A 1 325 ?  -5.458 15.744  6.869 1 43.2334 ? CD  GLU 325  A 1 1 
ATOM   2420 O  OE1 . GLU A 1 325 ?  -4.201 15.724  6.953 1 41.9847 ? OE1 GLU 325  A 1 1 
ATOM   2421 O  OE2 . GLU A 1 325 ?  -6.101 15.155  5.972 1   44.82 ? OE2 GLU 325  A 1 1 
ATOM   2422 C  C   . GLU A 1 325 ?  -5.214 19.792  9.705 1 33.8038 ? C   GLU 325  A 1 1 
ATOM   2423 O  O   . GLU A 1 325 ?  -4.021 19.705  9.397 1   32.46 ? O   GLU 325  A 1 1 
ATOM   2424 N  N   . PRO A 1 326 ?  -5.669 20.752 10.542 1 32.2189 ? N   PRO 326  A 1 1 
ATOM   2425 C  CA  . PRO A 1 326 ?  -4.836 21.879 10.917 1 31.0168 ? CA  PRO 326  A 1 1 
ATOM   2426 C  CB  . PRO A 1 326 ?  -5.728 22.708 11.862 1  31.374 ? CB  PRO 326  A 1 1 
ATOM   2427 C  CG  . PRO A 1 326 ?  -7.074 22.183 11.778 1 32.9912 ? CG  PRO 326  A 1 1 
ATOM   2428 C  CD  . PRO A 1 326 ?  -7.012 20.788 11.153 1  32.929 ? CD  PRO 326  A 1 1 
ATOM   2429 C  C   . PRO A 1 326 ?  -3.548 21.489 11.627 1 29.8471 ? C   PRO 326  A 1 1 
ATOM   2430 O  O   . PRO A 1 326 ?  -2.617 22.281 11.665 1 27.9218 ? O   PRO 326  A 1 1 
ATOM   2431 N  N   . GLU A 1 327 ?  -3.512 20.301 12.233 1 30.3063 ? N   GLU 327  A 1 1 
ATOM   2432 C  CA  . GLU A 1 327 ?  -2.302 19.868 12.909 1 31.9702 ? CA  GLU 327  A 1 1 
ATOM   2433 C  CB  . GLU A 1 327 ?  -2.628 18.823 13.995 1 35.0122 ? CB  GLU 327  A 1 1 
ATOM   2434 C  CG  . GLU A 1 327 ?  -3.439 19.408 15.161 1  37.819 ? CG  GLU 327  A 1 1 
ATOM   2435 C  CD  . GLU A 1 327 ?  -3.516 18.548 16.411 1 41.6933 ? CD  GLU 327  A 1 1 
ATOM   2436 O  OE1 . GLU A 1 327 ?  -2.924 17.442 16.415 1  44.479 ? OE1 GLU 327  A 1 1 
ATOM   2437 O  OE2 . GLU A 1 327 ?  -4.174  18.97  17.39 1 45.7968 ? OE2 GLU 327  A 1 1 
ATOM   2438 C  C   . GLU A 1 327 ?  -1.238 19.349 11.947 1   31.23 ? C   GLU 327  A 1 1 
ATOM   2439 O  O   . GLU A 1 327 ?  -0.141 19.037  12.38 1 29.7906 ? O   GLU 327  A 1 1 
ATOM   2440 N  N   . ARG A 1 328 ?  -1.562 19.249 10.652 1  31.899 ? N   ARG 328  A 1 1 
ATOM   2441 C  CA  . ARG A 1 328 ?  -0.575 18.903   9.65 1  32.258 ? CA  ARG 328  A 1 1 
ATOM   2442 C  CB  . ARG A 1 328 ?  -1.234 18.206  8.447 1 35.7397 ? CB  ARG 328  A 1 1 
ATOM   2443 C  CG  . ARG A 1 328 ?  -0.238  17.53  7.488 1  38.632 ? CG  ARG 328  A 1 1 
ATOM   2444 C  CD  . ARG A 1 328 ?  -0.877 16.933  6.194 1 41.2497 ? CD  ARG 328  A 1 1 
ATOM   2445 N  NE  . ARG A 1 328 ?  -1.195 17.957  5.187 1 42.9423 ? NE  ARG 328  A 1 1 
ATOM   2446 C  CZ  . ARG A 1 328 ?  -2.414 18.444  4.926 1 44.3789 ? CZ  ARG 328  A 1 1 
ATOM   2447 N  NH1 . ARG A 1 328 ?  -3.502 17.938  5.487 1 46.3377 ? NH1 ARG 328  A 1 1 
ATOM   2448 N  NH2 . ARG A 1 328 ?  -2.543  19.47   4.09 1 43.6565 ? NH2 ARG 328  A 1 1 
ATOM   2449 C  C   . ARG A 1 328 ?    0.15  20.17  9.204 1 30.5835 ? C   ARG 328  A 1 1 
ATOM   2450 O  O   . ARG A 1 328 ?  -0.463 21.121   8.72 1 29.8491 ? O   ARG 328  A 1 1 
ATOM   2451 N  N   . PHE A 1 329 ?   1.467  20.18  9.407 1  29.488 ? N   PHE 329  A 1 1 
ATOM   2452 C  CA  . PHE A 1 329 ?   2.312  21.26  8.948 1 27.1043 ? CA  PHE 329  A 1 1 
ATOM   2453 C  CB  . PHE A 1 329 ?   3.599 21.341  9.756 1 26.9428 ? CB  PHE 329  A 1 1 
ATOM   2454 C  CG  . PHE A 1 329 ?    4.66 22.305  9.237 1 25.7213 ? CG  PHE 329  A 1 1 
ATOM   2455 C  CD1 . PHE A 1 329 ?   4.346 23.616  8.943 1 25.2476 ? CD1 PHE 329  A 1 1 
ATOM   2456 C  CD2 . PHE A 1 329 ?   5.974  21.89  9.055 1 25.1356 ? CD2 PHE 329  A 1 1 
ATOM   2457 C  CE1 . PHE A 1 329 ?   5.335 24.511  8.497 1 24.1494 ? CE1 PHE 329  A 1 1 
ATOM   2458 C  CE2 . PHE A 1 329 ?   6.955 22.768  8.601 1 24.4185 ? CE2 PHE 329  A 1 1 
ATOM   2459 C  CZ  . PHE A 1 329 ?   6.635 24.073  8.299 1 24.4056 ? CZ  PHE 329  A 1 1 
ATOM   2460 C  C   . PHE A 1 329 ?   2.636  20.99  7.485 1 26.9879 ? C   PHE 329  A 1 1 
ATOM   2461 O  O   . PHE A 1 329 ?   3.282 20.005  7.175 1 26.6015 ? O   PHE 329  A 1 1 
ATOM   2462 N  N   . ASP A 1 330 ?   2.174 21.875  6.607 1 26.0718 ? N   ASP 330  A 1 1 
ATOM   2463 C  CA  . ASP A 1 330 ?   2.229 21.654  5.174 1 26.6292 ? CA  ASP 330  A 1 1 
ATOM   2464 C  CB  . ASP A 1 330 ?   0.951 20.989  4.698 1 28.1375 ? CB  ASP 330  A 1 1 
ATOM   2465 C  CG  . ASP A 1 330 ?   0.843 20.754  3.209 1 28.7815 ? CG  ASP 330  A 1 1 
ATOM   2466 O  OD1 . ASP A 1 330 ?   1.789 21.118  2.474 1 28.2113 ? OD1 ASP 330  A 1 1 
ATOM   2467 O  OD2 . ASP A 1 330 ?   -0.17 20.212  2.782 1 29.7955 ? OD2 ASP 330  A 1 1 
ATOM   2468 C  C   . ASP A 1 330 ?   2.455 22.984  4.461 1 26.3394 ? C   ASP 330  A 1 1 
ATOM   2469 O  O   . ASP A 1 330 ?   1.518 23.755  4.248 1 25.9818 ? O   ASP 330  A 1 1 
ATOM   2470 N  N   . ILE A 1 331 ?   3.704  23.21  4.053 1 25.8897 ? N   ILE 331  A 1 1 
ATOM   2471 C  CA  . ILE A 1 331 ?   4.083 24.461  3.423 1 26.4096 ? CA  ILE 331  A 1 1 
ATOM   2472 C  CB  . ILE A 1 331 ?   5.607 24.657  3.388 1 25.1155 ? CB  ILE 331  A 1 1 
ATOM   2473 C  CG1 . ILE A 1 331 ?   6.316 23.635   2.47 1  26.726 ? CG1 ILE 331  A 1 1 
ATOM   2474 C  CG2 . ILE A 1 331 ?   6.166 24.596  4.762 1  25.099 ? CG2 ILE 331  A 1 1 
ATOM   2475 C  CD1 . ILE A 1 331 ?   7.834 23.944  2.265 1 26.5219 ? CD1 ILE 331  A 1 1 
ATOM   2476 C  C   . ILE A 1 331 ?    3.54 24.612  2.013 1 26.9258 ? C   ILE 331  A 1 1 
ATOM   2477 O  O   . ILE A 1 331 ?   3.661 25.693  1.464 1 27.8855 ? O   ILE 331  A 1 1 
ATOM   2478 N  N   . THR A 1 332 ?   2.979 23.543  1.428 1 28.2501 ? N   THR 332  A 1 1 
ATOM   2479 C  CA  . THR A 1 332 ?   2.349 23.636  0.117 1 28.8325 ? CA  THR 332  A 1 1 
ATOM   2480 C  CB  . THR A 1 332 ?   2.334 22.283 -0.628 1 30.0168 ? CB  THR 332  A 1 1 
ATOM   2481 O  OG1 . THR A 1 332 ?   1.359 21.413  -0.06 1 29.7887 ? OG1 THR 332  A 1 1 
ATOM   2482 C  CG2 . THR A 1 332 ?   3.726 21.589 -0.651 1 30.3873 ? CG2 THR 332  A 1 1 
ATOM   2483 C  C   . THR A 1 332 ?   0.916 24.157  0.156 1 28.7562 ? C   THR 332  A 1 1 
ATOM   2484 O  O   . THR A 1 332 ?   0.296 24.337 -0.893 1 27.7322 ? O   THR 332  A 1 1 
ATOM   2485 N  N   . ARG A 1 333 ?    0.37  24.37   1.36 1 29.1896 ? N   ARG 333  A 1 1 
ATOM   2486 C  CA  . ARG A 1 333 ?  -0.977  24.92  1.448 1 30.0936 ? CA  ARG 333  A 1 1 
ATOM   2487 C  CB  . ARG A 1 333 ?  -1.453 25.129  2.879 1 29.9448 ? CB  ARG 333  A 1 1 
ATOM   2488 C  CG  . ARG A 1 333 ?  -1.639  23.92  3.704 1 29.9942 ? CG  ARG 333  A 1 1 
ATOM   2489 C  CD  . ARG A 1 333 ?  -2.096 24.375  5.058 1 29.6247 ? CD  ARG 333  A 1 1 
ATOM   2490 N  NE  . ARG A 1 333 ?  -2.012 23.316  6.044 1 29.3145 ? NE  ARG 333  A 1 1 
ATOM   2491 C  CZ  . ARG A 1 333 ?  -3.045 22.552  6.394 1  29.446 ? CZ  ARG 333  A 1 1 
ATOM   2492 N  NH1 . ARG A 1 333 ?  -4.216 22.676  5.802 1 30.1157 ? NH1 ARG 333  A 1 1 
ATOM   2493 N  NH2 . ARG A 1 333 ?  -2.901 21.671  7.378 1 29.6394 ? NH2 ARG 333  A 1 1 
ATOM   2494 C  C   . ARG A 1 333 ?  -1.062  26.28   0.77 1 30.0417 ? C   ARG 333  A 1 1 
ATOM   2495 O  O   . ARG A 1 333 ?  -0.146 27.097  0.875 1 29.3293 ? O   ARG 333  A 1 1 
ATOM   2496 N  N   . ARG A 1 334 ?  -2.201 26.534   0.13 1 32.1789 ? N   ARG 334  A 1 1 
ATOM   2497 C  CA  . ARG A 1 334 ?  -2.561 27.887 -0.272 1 35.0036 ? CA  ARG 334  A 1 1 
ATOM   2498 C  CB  . ARG A 1 334 ?  -3.941 27.968 -0.896 1 39.6285 ? CB  ARG 334  A 1 1 
ATOM   2499 C  CG  . ARG A 1 334 ?  -4.094 27.127 -2.159 1  44.212 ? CG  ARG 334  A 1 1 
ATOM   2500 C  CD  . ARG A 1 334 ?  -5.532 27.137 -2.658 1 48.3102 ? CD  ARG 334  A 1 1 
ATOM   2501 N  NE  . ARG A 1 334 ?  -5.644 26.343 -3.876 1 53.0886 ? NE  ARG 334  A 1 1 
ATOM   2502 C  CZ  . ARG A 1 334 ?  -6.077 25.087 -3.926 1 57.5818 ? CZ  ARG 334  A 1 1 
ATOM   2503 N  NH1 . ARG A 1 334 ?  -6.698 24.526 -2.901 1 60.7319 ? NH1 ARG 334  A 1 1 
ATOM   2504 N  NH2 . ARG A 1 334 ?  -5.876 24.373 -5.031 1 58.8823 ? NH2 ARG 334  A 1 1 
ATOM   2505 C  C   . ARG A 1 334 ?  -2.583 28.757  0.976 1 33.2017 ? C   ARG 334  A 1 1 
ATOM   2506 O  O   . ARG A 1 334 ?  -3.143 28.344  1.982 1  33.691 ? O   ARG 334  A 1 1 
ATOM   2507 N  N   . PRO A 1 335 ?  -1.951  29.95  0.979 1 30.9046 ? N   PRO 335  A 1 1 
ATOM   2508 C  CA  . PRO A 1 335 ?  -1.995 30.804  2.161 1 29.8762 ? CA  PRO 335  A 1 1 
ATOM   2509 C  CB  . PRO A 1 335 ?  -1.246 32.063  1.708 1  29.026 ? CB  PRO 335  A 1 1 
ATOM   2510 C  CG  . PRO A 1 335 ?   -0.41 31.634  0.527 1 28.6745 ? CG  PRO 335  A 1 1 
ATOM   2511 C  CD  . PRO A 1 335 ?  -1.141   30.5 -0.118 1 29.7281 ? CD  PRO 335  A 1 1 
ATOM   2512 C  C   . PRO A 1 335 ?  -3.422 31.119  2.607 1 31.0871 ? C   PRO 335  A 1 1 
ATOM   2513 O  O   . PRO A 1 335 ?  -4.266 31.447  1.797 1 31.8011 ? O   PRO 335  A 1 1 
ATOM   2514 N  N   . ALA A 1 336 ?  -3.723 30.974  3.892 1 32.0617 ? N   ALA 336  A 1 1 
ATOM   2515 C  CA  . ALA A 1 336 ?  -5.053 31.325  4.359 1 32.6616 ? CA  ALA 336  A 1 1 
ATOM   2516 C  CB  . ALA A 1 336 ?  -5.727 30.144  5.051 1 34.7562 ? CB  ALA 336  A 1 1 
ATOM   2517 C  C   . ALA A 1 336 ?  -4.919 32.522  5.292 1 30.8781 ? C   ALA 336  A 1 1 
ATOM   2518 O  O   . ALA A 1 336 ?  -3.827 32.777  5.775 1 27.6692 ? O   ALA 336  A 1 1 
ATOM   2519 N  N   . PRO A 1 337 ?  -5.999 33.317  5.508 1 31.6007 ? N   PRO 337  A 1 1 
ATOM   2520 C  CA  . PRO A 1 337 ?  -5.929 34.468   6.41 1 31.0568 ? CA  PRO 337  A 1 1 
ATOM   2521 C  CB  . PRO A 1 337 ?   -7.19 35.269  6.049 1 32.6039 ? CB  PRO 337  A 1 1 
ATOM   2522 C  CG  . PRO A 1 337 ?  -8.133  34.26  5.491 1 33.9977 ? CG  PRO 337  A 1 1 
ATOM   2523 C  CD  . PRO A 1 337 ?  -7.301 33.187  4.829 1 33.3675 ? CD  PRO 337  A 1 1 
ATOM   2524 C  C   . PRO A 1 337 ?  -5.869 34.058  7.882 1 28.7414 ? C   PRO 337  A 1 1 
ATOM   2525 O  O   . PRO A 1 337 ?  -6.858 34.106  8.595 1 27.1185 ? O   PRO 337  A 1 1 
ATOM   2526 N  N   . HIS A 1 338 ?    -4.7 33.566    8.3 1 26.4121 ? N   HIS 338  A 1 1 
ATOM   2527 C  CA  . HIS A 1 338 ?  -4.474 33.215  9.692 1 25.6136 ? CA  HIS 338  A 1 1 
ATOM   2528 C  CB  . HIS A 1 338 ?  -3.146 32.456    9.8 1 25.2773 ? CB  HIS 338  A 1 1 
ATOM   2529 C  CG  . HIS A 1 338 ?  -1.987 33.266  9.334 1 24.9546 ? CG  HIS 338  A 1 1 
ATOM   2530 N  ND1 . HIS A 1 338 ?  -1.517  34.35 10.081 1 25.1347 ? ND1 HIS 338  A 1 1 
ATOM   2531 C  CE1 . HIS A 1 338 ?  -0.485 34.829   9.39 1 24.6756 ? CE1 HIS 338  A 1 1 
ATOM   2532 N  NE2 . HIS A 1 338 ?  -0.283 34.123  8.262 1 24.5204 ? NE2 HIS 338  A 1 1 
ATOM   2533 C  CD2 . HIS A 1 338 ?  -1.225 33.123  8.225 1 25.3273 ? CD2 HIS 338  A 1 1 
ATOM   2534 C  C   . HIS A 1 338 ?  -4.482 34.454 10.583 1 25.1372 ? C   HIS 338  A 1 1 
ATOM   2535 O  O   . HIS A 1 338 ?   -4.58  35.59 10.111 1 24.6739 ? O   HIS 338  A 1 1 
ATOM   2536 N  N   . LEU A 1 339 ?   -4.36  34.22 11.884 1 24.4273 ? N   LEU 339  A 1 1 
ATOM   2537 C  CA  . LEU A 1 339 ?  -4.461 35.279 12.877 1 24.1744 ? CA  LEU 339  A 1 1 
ATOM   2538 C  CB  . LEU A 1 339 ?  -5.539 34.842 13.853 1 24.9824 ? CB  LEU 339  A 1 1 
ATOM   2539 C  CG  . LEU A 1 339 ?   -6.95 34.848   13.3 1 26.0501 ? CG  LEU 339  A 1 1 
ATOM   2540 C  CD1 . LEU A 1 339 ?  -7.892  34.04 14.155 1 27.1272 ? CD1 LEU 339  A 1 1 
ATOM   2541 C  CD2 . LEU A 1 339 ?  -7.457 36.269 13.191 1 26.4241 ? CD2 LEU 339  A 1 1 
ATOM   2542 C  C   . LEU A 1 339 ?  -3.184 35.602 13.649 1 23.4585 ? C   LEU 339  A 1 1 
ATOM   2543 O  O   . LEU A 1 339 ?  -3.245 36.225 14.711 1 23.4383 ? O   LEU 339  A 1 1 
ATOM   2544 N  N   . ALA A 1 340 ?  -2.035 35.212 13.093 1 22.7862 ? N   ALA 340  A 1 1 
ATOM   2545 C  CA  . ALA A 1 340 ?  -0.759 35.364 13.781 1 22.2567 ? CA  ALA 340  A 1 1 
ATOM   2546 C  CB  . ALA A 1 340 ?   0.312 34.653 13.003 1 22.2092 ? CB  ALA 340  A 1 1 
ATOM   2547 C  C   . ALA A 1 340 ?  -0.425 36.841 13.996 1 21.6843 ? C   ALA 340  A 1 1 
ATOM   2548 O  O   . ALA A 1 340 ?   0.251 37.216 14.975 1 21.5263 ? O   ALA 340  A 1 1 
ATOM   2549 N  N   . PHE A 1 341 ?  -0.992 37.677 13.113 1 21.2005 ? N   PHE 341  A 1 1 
ATOM   2550 C  CA  . PHE A 1 341 ?  -0.865 39.122 13.181 1 21.8744 ? CA  PHE 341  A 1 1 
ATOM   2551 C  CB  . PHE A 1 341 ?  -0.578 39.659 11.778 1 21.9087 ? CB  PHE 341  A 1 1 
ATOM   2552 C  CG  . PHE A 1 341 ?   0.761 39.259 11.231 1 21.4733 ? CG  PHE 341  A 1 1 
ATOM   2553 C  CD1 . PHE A 1 341 ?   1.937 39.647 11.872 1 21.0843 ? CD1 PHE 341  A 1 1 
ATOM   2554 C  CD2 . PHE A 1 341 ?   0.853 38.542 10.066 1 21.9317 ? CD2 PHE 341  A 1 1 
ATOM   2555 C  CE1 . PHE A 1 341 ?   3.169 39.301 11.352 1 20.2952 ? CE1 PHE 341  A 1 1 
ATOM   2556 C  CE2 . PHE A 1 341 ?   2.087 38.203  9.543 1 21.7489 ? CE2 PHE 341  A 1 1 
ATOM   2557 C  CZ  . PHE A 1 341 ?    3.23 38.584 10.183 1 20.5515 ? CZ  PHE 341  A 1 1 
ATOM   2558 C  C   . PHE A 1 341 ?  -2.112 39.815 13.709 1 22.6324 ? C   PHE 341  A 1 1 
ATOM   2559 O  O   . PHE A 1 341 ?  -2.233 41.039 13.629 1 22.8677 ? O   PHE 341  A 1 1 
ATOM   2560 N  N   . GLY A 1 342 ?  -3.057 39.025 14.217 1 23.1564 ? N   GLY 342  A 1 1 
ATOM   2561 C  CA  . GLY A 1 342 ?  -4.251 39.613 14.806 1 22.7951 ? CA  GLY 342  A 1 1 
ATOM   2562 C  C   . GLY A 1 342 ?  -5.217 39.965 13.691 1 23.4013 ? C   GLY 342  A 1 1 
ATOM   2563 O  O   . GLY A 1 342 ?  -5.163 39.363 12.616 1 23.1821 ? O   GLY 342  A 1 1 
ATOM   2564 N  N   . PHE A 1 343 ?  -6.111 40.915 13.962 1 23.6217 ? N   PHE 343  A 1 1 
ATOM   2565 C  CA  . PHE A 1 343 ?   -7.24 41.162 13.079 1 25.0055 ? CA  PHE 343  A 1 1 
ATOM   2566 C  CB  . PHE A 1 343 ?  -8.197 39.963 13.051 1 26.3309 ? CB  PHE 343  A 1 1 
ATOM   2567 C  CG  . PHE A 1 343 ?  -9.223 39.966 11.944 1 27.9449 ? CG  PHE 343  A 1 1 
ATOM   2568 C  CD1 . PHE A 1 343 ?  -8.845 39.783 10.627 1 28.2415 ? CD1 PHE 343  A 1 1 
ATOM   2569 C  CD2 . PHE A 1 343 ? -10.577 40.108 12.227 1 29.6919 ? CD2 PHE 343  A 1 1 
ATOM   2570 C  CE1 . PHE A 1 343 ?  -9.797 39.768  9.606 1 28.7894 ? CE1 PHE 343  A 1 1 
ATOM   2571 C  CE2 . PHE A 1 343 ? -11.528 40.097 11.206 1 29.8773 ? CE2 PHE 343  A 1 1 
ATOM   2572 C  CZ  . PHE A 1 343 ? -11.132 39.918  9.906 1  29.986 ? CZ  PHE 343  A 1 1 
ATOM   2573 C  C   . PHE A 1 343 ?  -7.972 42.409 13.541 1 24.2893 ? C   PHE 343  A 1 1 
ATOM   2574 O  O   . PHE A 1 343 ?  -7.931 42.726 14.729 1 23.3694 ? O   PHE 343  A 1 1 
ATOM   2575 N  N   . GLY A 1 344 ?  -8.655  43.07 12.598 1 24.9586 ? N   GLY 344  A 1 1 
ATOM   2576 C  CA  . GLY A 1 344 ?  -9.424 44.266 12.918 1 26.0363 ? CA  GLY 344  A 1 1 
ATOM   2577 C  C   . GLY A 1 344 ?  -8.471 45.445 13.129 1 25.7605 ? C   GLY 344  A 1 1 
ATOM   2578 O  O   . GLY A 1 344 ?  -7.377 45.466 12.578 1 24.0971 ? O   GLY 344  A 1 1 
ATOM   2579 N  N   . ALA A 1 345 ?  -8.879 46.411  13.96 1 25.7629 ? N   ALA 345  A 1 1 
ATOM   2580 C  CA  . ALA A 1 345 ?  -8.223 47.707 13.971 1 26.3959 ? CA  ALA 345  A 1 1 
ATOM   2581 C  CB  . ALA A 1 345 ?  -8.967 48.678 14.883 1 27.1479 ? CB  ALA 345  A 1 1 
ATOM   2582 C  C   . ALA A 1 345 ?  -6.745 47.624 14.354 1 25.6501 ? C   ALA 345  A 1 1 
ATOM   2583 O  O   . ALA A 1 345 ?  -5.931  48.39 13.835 1 26.1236 ? O   ALA 345  A 1 1 
ATOM   2584 N  N   . HIS A 1 346 ?  -6.401  46.69 15.254 1 25.0478 ? N   HIS 346  A 1 1 
ATOM   2585 C  CA  . HIS A 1 346 ?  -5.048 46.583 15.769 1 24.0984 ? CA  HIS 346  A 1 1 
ATOM   2586 C  CB  . HIS A 1 346 ?  -5.057 46.273 17.286 1 23.7404 ? CB  HIS 346  A 1 1 
ATOM   2587 C  CG  . HIS A 1 346 ?  -5.604 47.406 18.108 1 23.6813 ? CG  HIS 346  A 1 1 
ATOM   2588 N  ND1 . HIS A 1 346 ?  -4.802 48.469 18.481 1 23.1496 ? ND1 HIS 346  A 1 1 
ATOM   2589 C  CE1 . HIS A 1 346 ?  -5.561 49.262 19.215 1 23.3679 ? CE1 HIS 346  A 1 1 
ATOM   2590 N  NE2 . HIS A 1 346 ?  -6.792 48.768 19.339 1 24.5079 ? NE2 HIS 346  A 1 1 
ATOM   2591 C  CD2 . HIS A 1 346 ?  -6.821 47.571 18.653 1 24.4994 ? CD2 HIS 346  A 1 1 
ATOM   2592 C  C   . HIS A 1 346 ?  -4.166 45.561 15.053 1 23.6805 ? C   HIS 346  A 1 1 
ATOM   2593 O  O   . HIS A 1 346 ?  -3.029 45.343 15.459 1 22.7153 ? O   HIS 346  A 1 1 
ATOM   2594 N  N   . GLN A 1 347 ?  -4.665 44.978 13.967 1 24.2546 ? N   GLN 347  A 1 1 
ATOM   2595 C  CA  . GLN A 1 347 ?  -3.859 44.049 13.189 1 24.5271 ? CA  GLN 347  A 1 1 
ATOM   2596 C  CB  . GLN A 1 347 ?   -4.54 43.683 11.879 1 25.7914 ? CB  GLN 347  A 1 1 
ATOM   2597 C  CG  . GLN A 1 347 ?  -3.806 42.542   11.2 1 27.2271 ? CG  GLN 347  A 1 1 
ATOM   2598 C  CD  . GLN A 1 347 ?  -4.428 42.019  9.886 1 29.0596 ? CD  GLN 347  A 1 1 
ATOM   2599 O  OE1 . GLN A 1 347 ?  -4.315 42.628  8.851 1 30.0644 ? OE1 GLN 347  A 1 1 
ATOM   2600 N  NE2 . GLN A 1 347 ?  -5.083 40.861  9.915 1 29.8478 ? NE2 GLN 347  A 1 1 
ATOM   2601 C  C   . GLN A 1 347 ?  -2.473 44.617 12.876 1 23.5538 ? C   GLN 347  A 1 1 
ATOM   2602 O  O   . GLN A 1 347 ?  -2.329 45.777 12.498 1 24.1513 ? O   GLN 347  A 1 1 
ATOM   2603 N  N   . CYS A 1 348 ?  -1.453 43.772  13.01 1 23.5162 ? N   CYS 348  A 1 1 
ATOM   2604 C  CA  . CYS A 1 348 ?  -0.063 44.204  12.92 1 22.9589 ? CA  CYS 348  A 1 1 
ATOM   2605 C  CB  . CYS A 1 348 ?    0.81 42.979 12.724 1 22.9284 ? CB  CYS 348  A 1 1 
ATOM   2606 S  SG  . CYS A 1 348 ?   2.559  43.37 12.707 1 22.5578 ? SG  CYS 348  A 1 1 
ATOM   2607 C  C   . CYS A 1 348 ?   0.222 45.229 11.818 1  22.686 ? C   CYS 348  A 1 1 
ATOM   2608 O  O   . CYS A 1 348 ?  -0.048  44.97 10.658 1 22.4396 ? O   CYS 348  A 1 1 
ATOM   2609 N  N   . ILE A 1 349 ?   0.748 46.408 12.152 1 22.4519 ? N   ILE 349  A 1 1 
ATOM   2610 C  CA  . ILE A 1 349 ?   1.068 47.369 11.107 1 23.4727 ? CA  ILE 349  A 1 1 
ATOM   2611 C  CB  . ILE A 1 349 ?   1.112 48.778 11.715 1 25.0588 ? CB  ILE 349  A 1 1 
ATOM   2612 C  CG1 . ILE A 1 349 ?   1.135  49.89 10.644 1 26.5239 ? CG1 ILE 349  A 1 1 
ATOM   2613 C  CG2 . ILE A 1 349 ?   2.266 48.934  12.65 1 24.5362 ? CG2 ILE 349  A 1 1 
ATOM   2614 C  CD1 . ILE A 1 349 ?   1.237 51.326 11.339 1 27.8501 ? CD1 ILE 349  A 1 1 
ATOM   2615 C  C   . ILE A 1 349 ?   2.372 46.991 10.387 1 23.1413 ? C   ILE 349  A 1 1 
ATOM   2616 O  O   . ILE A 1 349 ?   2.645 47.446  9.273 1 23.4133 ? O   ILE 349  A 1 1 
ATOM   2617 N  N   . GLY A 1 350 ?   3.171 46.142 11.014 1  22.391 ? N   GLY 350  A 1 1 
ATOM   2618 C  CA  . GLY A 1 350 ?   4.457 45.736 10.455 1 21.6544 ? CA  GLY 350  A 1 1 
ATOM   2619 C  C   . GLY A 1 350 ?   4.511 44.362  9.791 1 21.7162 ? C   GLY 350  A 1 1 
ATOM   2620 O  O   . GLY A 1 350 ?   5.606 43.853    9.5 1 21.9066 ? O   GLY 350  A 1 1 
ATOM   2621 N  N   . GLN A 1 351 ?   3.336 43.797  9.494 1 21.9165 ? N   GLN 351  A 1 1 
ATOM   2622 C  CA  . GLN A 1 351 ?   3.293 42.419  9.042 1 21.8479 ? CA  GLN 351  A 1 1 
ATOM   2623 C  CB  . GLN A 1 351 ?   1.847  41.93  9.033 1 24.0884 ? CB  GLN 351  A 1 1 
ATOM   2624 C  CG  . GLN A 1 351 ?   0.919 42.653  8.088 1 25.0562 ? CG  GLN 351  A 1 1 
ATOM   2625 C  CD  . GLN A 1 351 ?  -0.454 41.962  8.191 1 29.5257 ? CD  GLN 351  A 1 1 
ATOM   2626 O  OE1 . GLN A 1 351 ?  -0.861  41.09  7.395 1 32.6971 ? OE1 GLN 351  A 1 1 
ATOM   2627 N  NE2 . GLN A 1 351 ?  -1.174 42.278  9.189 1 30.9554 ? NE2 GLN 351  A 1 1 
ATOM   2628 C  C   . GLN A 1 351 ?   3.985 42.233  7.691 1 22.0236 ? C   GLN 351  A 1 1 
ATOM   2629 O  O   . GLN A 1 351 ?   4.593 41.199  7.474 1 21.2794 ? O   GLN 351  A 1 1 
ATOM   2630 N  N   . GLN A 1 352 ?    3.98  43.23  6.806 1 21.2635 ? N   GLN 352  A 1 1 
ATOM   2631 C  CA  . GLN A 1 352 ?   4.682 43.037   5.54 1 23.1412 ? CA  GLN 352  A 1 1 
ATOM   2632 C  CB  . GLN A 1 352 ?   4.218 44.043  4.482 1 25.3585 ? CB  GLN 352  A 1 1 
ATOM   2633 C  CG  . GLN A 1 352 ?   2.717 43.905  4.178 1 28.8944 ? CG  GLN 352  A 1 1 
ATOM   2634 C  CD  . GLN A 1 352 ?   2.345  42.47  3.715 1 31.7384 ? CD  GLN 352  A 1 1 
ATOM   2635 O  OE1 . GLN A 1 352 ?   1.588 41.707    4.4 1 30.1047 ? OE1 GLN 352  A 1 1 
ATOM   2636 N  NE2 . GLN A 1 352 ?    2.95 42.033   2.62 1 33.6377 ? NE2 GLN 352  A 1 1 
ATOM   2637 C  C   . GLN A 1 352 ?   6.206 43.027   5.71 1 22.4451 ? C   GLN 352  A 1 1 
ATOM   2638 O  O   . GLN A 1 352 ?   6.885 42.287  5.006 1 21.2798 ? O   GLN 352  A 1 1 
ATOM   2639 N  N   . LEU A 1 353 ?   6.745 43.859  6.614 1 21.6306 ? N   LEU 353  A 1 1 
ATOM   2640 C  CA  . LEU A 1 353 ?   8.162 43.798  6.956 1  21.433 ? CA  LEU 353  A 1 1 
ATOM   2641 C  CB  . LEU A 1 353 ?   8.561 44.966  7.852 1 21.8535 ? CB  LEU 353  A 1 1 
ATOM   2642 C  CG  . LEU A 1 353 ?  10.027     45  8.305 1 21.8985 ? CG  LEU 353  A 1 1 
ATOM   2643 C  CD1 . LEU A 1 353 ?  10.944  45.08  7.169 1 22.5078 ? CD1 LEU 353  A 1 1 
ATOM   2644 C  CD2 . LEU A 1 353 ?  10.349 46.187  9.222 1 22.1304 ? CD2 LEU 353  A 1 1 
ATOM   2645 C  C   . LEU A 1 353 ?   8.534 42.461  7.621 1 20.4364 ? C   LEU 353  A 1 1 
ATOM   2646 O  O   . LEU A 1 353 ?   9.564 41.866  7.292 1  20.129 ? O   LEU 353  A 1 1 
ATOM   2647 N  N   . ALA A 1 354 ?   7.696 41.998  8.555 1 20.7302 ? N   ALA 354  A 1 1 
ATOM   2648 C  CA  . ALA A 1 354 ?    7.85 40.693  9.174 1 20.4659 ? CA  ALA 354  A 1 1 
ATOM   2649 C  CB  . ALA A 1 354 ?   6.712 40.414  10.15 1 20.4067 ? CB  ALA 354  A 1 1 
ATOM   2650 C  C   . ALA A 1 354 ?    7.93 39.603  8.108 1 19.7883 ? C   ALA 354  A 1 1 
ATOM   2651 O  O   . ALA A 1 354 ?   8.861 38.805  8.122 1  18.687 ? O   ALA 354  A 1 1 
ATOM   2652 N  N   . ARG A 1 355 ?   7.019 39.643   7.13 1 19.9464 ? N   ARG 355  A 1 1 
ATOM   2653 C  CA  . ARG A 1 355 ?   6.978 38.606  6.103 1 20.8985 ? CA  ARG 355  A 1 1 
ATOM   2654 C  CB  . ARG A 1 355 ?   5.733 38.775  5.258 1 21.9594 ? CB  ARG 355  A 1 1 
ATOM   2655 C  CG  . ARG A 1 355 ?   4.472 38.335  5.957 1 22.8019 ? CG  ARG 355  A 1 1 
ATOM   2656 C  CD  . ARG A 1 355 ?   3.209  38.62  5.127 1 23.5866 ? CD  ARG 355  A 1 1 
ATOM   2657 N  NE  . ARG A 1 355 ?   2.071 37.803  5.545 1 24.1124 ? NE  ARG 355  A 1 1 
ATOM   2658 C  CZ  . ARG A 1 355 ?   0.963 38.251  6.118 1 24.5771 ? CZ  ARG 355  A 1 1 
ATOM   2659 N  NH1 . ARG A 1 355 ?    0.76  39.54  6.323 1 25.8411 ? NH1 ARG 355  A 1 1 
ATOM   2660 N  NH2 . ARG A 1 355 ?   0.009 37.386  6.447 1 23.8297 ? NH2 ARG 355  A 1 1 
ATOM   2661 C  C   . ARG A 1 355 ?   8.234 38.632  5.236 1 20.6302 ? C   ARG 355  A 1 1 
ATOM   2662 O  O   . ARG A 1 355 ?   8.833 37.593  4.974 1 19.8406 ? O   ARG 355  A 1 1 
ATOM   2663 N  N   . ILE A 1 356 ?   8.636 39.838  4.812 1 20.5176 ? N   ILE 356  A 1 1 
ATOM   2664 C  CA  . ILE A 1 356 ?   9.847 40.006  4.035 1  21.007 ? CA  ILE 356  A 1 1 
ATOM   2665 C  CB  . ILE A 1 356 ?  10.008 41.476  3.657 1 22.0839 ? CB  ILE 356  A 1 1 
ATOM   2666 C  CG1 . ILE A 1 356 ?   8.957 41.898  2.621 1  23.823 ? CG1 ILE 356  A 1 1 
ATOM   2667 C  CG2 . ILE A 1 356 ?  11.397 41.736  3.154 1 23.6092 ? CG2 ILE 356  A 1 1 
ATOM   2668 C  CD1 . ILE A 1 356 ?   8.719 43.264  2.607 1 25.1315 ? CD1 ILE 356  A 1 1 
ATOM   2669 C  C   . ILE A 1 356 ?   11.07 39.473  4.774 1 20.6305 ? C   ILE 356  A 1 1 
ATOM   2670 O  O   . ILE A 1 356 ?  11.882 38.749  4.201 1 19.3963 ? O   ILE 356  A 1 1 
ATOM   2671 N  N   . GLU A 1 357 ?  11.173 39.822  6.058 1 19.5765 ? N   GLU 357  A 1 1 
ATOM   2672 C  CA  . GLU A 1 357 ?  12.328 39.373  6.838 1 19.7478 ? CA  GLU 357  A 1 1 
ATOM   2673 C  CB  . GLU A 1 357 ?  12.333 39.933   8.26 1 20.0029 ? CB  GLU 357  A 1 1 
ATOM   2674 C  CG  . GLU A 1 357 ?  12.678 41.407   8.41 1  21.189 ? CG  GLU 357  A 1 1 
ATOM   2675 C  CD  . GLU A 1 357 ?  12.995 41.853  9.844 1 21.5381 ? CD  GLU 357  A 1 1 
ATOM   2676 O  OE1 . GLU A 1 357 ?  13.884  41.24 10.475 1  23.263 ? OE1 GLU 357  A 1 1 
ATOM   2677 O  OE2 . GLU A 1 357 ?  12.395 42.838 10.314 1 21.2904 ? OE2 GLU 357  A 1 1 
ATOM   2678 C  C   . GLU A 1 357 ?   12.36 37.847  6.873 1 18.6474 ? C   GLU 357  A 1 1 
ATOM   2679 O  O   . GLU A 1 357 ?    13.4  37.23  6.642 1 18.5497 ? O   GLU 357  A 1 1 
ATOM   2680 N  N   . LEU A 1 358 ?  11.211 37.238  7.198 1 17.7132 ? N   LEU 358  A 1 1 
ATOM   2681 C  CA  . LEU A 1 358 ?  11.134 35.791  7.314 1 18.3793 ? CA  LEU 358  A 1 1 
ATOM   2682 C  CB  . LEU A 1 358 ?   9.793 35.371  7.894 1 18.3526 ? CB  LEU 358  A 1 1 
ATOM   2683 C  CG  . LEU A 1 358 ?   9.602 35.835  9.349 1 19.0204 ? CG  LEU 358  A 1 1 
ATOM   2684 C  CD1 . LEU A 1 358 ?   8.225  35.36  9.863 1 20.2492 ? CD1 LEU 358  A 1 1 
ATOM   2685 C  CD2 . LEU A 1 358 ?   10.72 35.313 10.271 1 19.3484 ? CD2 LEU 358  A 1 1 
ATOM   2686 C  C   . LEU A 1 358 ?  11.403 35.068  6.001 1 18.7316 ? C   LEU 358  A 1 1 
ATOM   2687 O  O   . LEU A 1 358 ?  12.078  34.03  5.995 1 18.2117 ? O   LEU 358  A 1 1 
ATOM   2688 N  N   . GLN A 1 359 ?   10.95 35.646  4.878 1 19.0454 ? N   GLN 359  A 1 1 
ATOM   2689 C  CA  . GLN A 1 359 ?  11.214 35.019   3.59 1 19.8752 ? CA  GLN 359  A 1 1 
ATOM   2690 C  CB  . GLN A 1 359 ?  10.476 35.731  2.469 1 20.3955 ? CB  GLN 359  A 1 1 
ATOM   2691 C  CG  . GLN A 1 359 ?   8.954 35.689  2.598 1 21.7152 ? CG  GLN 359  A 1 1 
ATOM   2692 C  CD  . GLN A 1 359 ?   8.212 36.763  1.863 1 22.3706 ? CD  GLN 359  A 1 1 
ATOM   2693 O  OE1 . GLN A 1 359 ?   8.805 37.628  1.212 1 22.7471 ? OE1 GLN 359  A 1 1 
ATOM   2694 N  NE2 . GLN A 1 359 ?    6.88  36.76  1.993 1 23.0401 ? NE2 GLN 359  A 1 1 
ATOM   2695 C  C   . GLN A 1 359 ?  12.707 35.001  3.274 1 19.5196 ? C   GLN 359  A 1 1 
ATOM   2696 O  O   . GLN A 1 359 ?  13.238  33.98  2.856 1 19.9075 ? O   GLN 359  A 1 1 
ATOM   2697 N  N   . ILE A 1 360 ?  13.351 36.157  3.429 1  19.005 ? N   ILE 360  A 1 1 
ATOM   2698 C  CA  . ILE A 1 360 ?  14.783 36.293  3.205 1  19.223 ? CA  ILE 360  A 1 1 
ATOM   2699 C  CB  . ILE A 1 360 ?  15.199 37.789   3.27 1 19.7681 ? CB  ILE 360  A 1 1 
ATOM   2700 C  CG1 . ILE A 1 360 ?  14.626 38.541  2.064 1 20.9674 ? CG1 ILE 360  A 1 1 
ATOM   2701 C  CG2 . ILE A 1 360 ?  16.702 37.962  3.326 1  19.841 ? CG2 ILE 360  A 1 1 
ATOM   2702 C  CD1 . ILE A 1 360 ?  14.819 39.926  2.067 1 21.5696 ? CD1 ILE 360  A 1 1 
ATOM   2703 C  C   . ILE A 1 360 ?  15.565 35.401  4.165 1 18.7773 ? C   ILE 360  A 1 1 
ATOM   2704 O  O   . ILE A 1 360 ?   16.48   34.7  3.738 1  18.973 ? O   ILE 360  A 1 1 
ATOM   2705 N  N   . VAL A 1 361 ?  15.147 35.383  5.431 1 18.4861 ? N   VAL 361  A 1 1 
ATOM   2706 C  CA  . VAL A 1 361 ?   15.86 34.647  6.456 1 18.8391 ? CA  VAL 361  A 1 1 
ATOM   2707 C  CB  . VAL A 1 361 ?  15.391 34.984  7.879 1 19.3391 ? CB  VAL 361  A 1 1 
ATOM   2708 C  CG1 . VAL A 1 361 ?  15.739 33.903  8.867 1 20.6437 ? CG1 VAL 361  A 1 1 
ATOM   2709 C  CG2 . VAL A 1 361 ?  15.996  36.32  8.323 1 19.0687 ? CG2 VAL 361  A 1 1 
ATOM   2710 C  C   . VAL A 1 361 ?  15.818 33.163  6.142 1 20.1873 ? C   VAL 361  A 1 1 
ATOM   2711 O  O   . VAL A 1 361 ?  16.888 32.551  6.041 1  19.758 ? O   VAL 361  A 1 1 
ATOM   2712 N  N   . PHE A 1 362 ?  14.614 32.637  5.884 1 19.5857 ? N   PHE 362  A 1 1 
ATOM   2713 C  CA  . PHE A 1 362 ?  14.487   31.2  5.708 1 21.1942 ? CA  PHE 362  A 1 1 
ATOM   2714 C  CB  . PHE A 1 362 ?  13.033  30.73  5.846 1  21.172 ? CB  PHE 362  A 1 1 
ATOM   2715 C  CG  . PHE A 1 362 ?  12.502 30.791  7.262 1 21.2361 ? CG  PHE 362  A 1 1 
ATOM   2716 C  CD1 . PHE A 1 362 ?  13.224 30.266  8.311 1 21.3737 ? CD1 PHE 362  A 1 1 
ATOM   2717 C  CD2 . PHE A 1 362 ?  11.302 31.413  7.536 1 21.3773 ? CD2 PHE 362  A 1 1 
ATOM   2718 C  CE1 . PHE A 1 362 ?  12.731 30.325  9.617 1 21.4053 ? CE1 PHE 362  A 1 1 
ATOM   2719 C  CE2 . PHE A 1 362 ?  10.818 31.484   8.85 1 21.8197 ? CE2 PHE 362  A 1 1 
ATOM   2720 C  CZ  . PHE A 1 362 ?  11.529 30.917  9.872 1 21.4056 ? CZ  PHE 362  A 1 1 
ATOM   2721 C  C   . PHE A 1 362 ?  15.086 30.774  4.376 1 20.1387 ? C   PHE 362  A 1 1 
ATOM   2722 O  O   . PHE A 1 362 ?  15.778 29.765  4.305 1 22.9757 ? O   PHE 362  A 1 1 
ATOM   2723 N  N   . GLU A 1 363 ?  14.838  31.54  3.312 1 19.9907 ? N   GLU 363  A 1 1 
ATOM   2724 C  CA  . GLU A 1 363 ?  15.402 31.171  2.027 1 20.5463 ? CA  GLU 363  A 1 1 
ATOM   2725 C  CB  . GLU A 1 363 ?  14.929 32.111  0.938 1 21.2855 ? CB  GLU 363  A 1 1 
ATOM   2726 C  CG  . GLU A 1 363 ?   15.31 31.638 -0.468 1  22.412 ? CG  GLU 363  A 1 1 
ATOM   2727 C  CD  . GLU A 1 363 ?  16.733 31.886 -0.891 1 22.2032 ? CD  GLU 363  A 1 1 
ATOM   2728 O  OE1 . GLU A 1 363 ?  17.297 32.934 -0.479 1 21.4171 ? OE1 GLU 363  A 1 1 
ATOM   2729 O  OE2 . GLU A 1 363 ?  17.279 31.046 -1.648 1 20.8149 ? OE2 GLU 363  A 1 1 
ATOM   2730 C  C   . GLU A 1 363 ?  16.929 31.146  2.097 1 19.4964 ? C   GLU 363  A 1 1 
ATOM   2731 O  O   . GLU A 1 363 ?  17.543 30.191  1.654 1  20.596 ? O   GLU 363  A 1 1 
ATOM   2732 N  N   . THR A 1 364 ?  17.545 32.159   2.71 1 18.8644 ? N   THR 364  A 1 1 
ATOM   2733 C  CA  . THR A 1 364 ?  18.994 32.274  2.686 1 19.2603 ? CA  THR 364  A 1 1 
ATOM   2734 C  CB  . THR A 1 364 ?  19.421 33.668  2.969 1 19.3193 ? CB  THR 364  A 1 1 
ATOM   2735 O  OG1 . THR A 1 364 ?  18.741 34.584  2.073 1 19.0893 ? OG1 THR 364  A 1 1 
ATOM   2736 C  CG2 . THR A 1 364 ?  20.979 33.855  2.818 1 19.1415 ? CG2 THR 364  A 1 1 
ATOM   2737 C  C   . THR A 1 364 ?  19.636 31.231  3.609 1 19.4181 ? C   THR 364  A 1 1 
ATOM   2738 O  O   . THR A 1 364 ?  20.607  30.56  3.219 1 20.1039 ? O   THR 364  A 1 1 
ATOM   2739 N  N   . LEU A 1 365 ?  19.053  31.08  4.797 1 19.2371 ? N   LEU 365  A 1 1 
ATOM   2740 C  CA  . LEU A 1 365 ?  19.525 30.123  5.781 1 19.3918 ? CA  LEU 365  A 1 1 
ATOM   2741 C  CB  . LEU A 1 365 ?  18.603 30.129  7.003 1 19.5005 ? CB  LEU 365  A 1 1 
ATOM   2742 C  CG  . LEU A 1 365 ?  18.926 29.109  8.069 1 19.6038 ? CG  LEU 365  A 1 1 
ATOM   2743 C  CD1 . LEU A 1 365 ?  20.277 29.403  8.679 1 19.9272 ? CD1 LEU 365  A 1 1 
ATOM   2744 C  CD2 . LEU A 1 365 ?  17.831 29.042  9.122 1 18.3339 ? CD2 LEU 365  A 1 1 
ATOM   2745 C  C   . LEU A 1 365 ?  19.631 28.715  5.206 1 20.3308 ? C   LEU 365  A 1 1 
ATOM   2746 O  O   . LEU A 1 365 ?  20.697 28.099  5.269 1 20.9581 ? O   LEU 365  A 1 1 
ATOM   2747 N  N   . PHE A 1 366 ?   18.53 28.214  4.637 1 19.8381 ? N   PHE 366  A 1 1 
ATOM   2748 C  CA  . PHE A 1 366 ?  18.503  26.83  4.167 1 20.8263 ? CA  PHE 366  A 1 1 
ATOM   2749 C  CB  . PHE A 1 366 ?  17.066 26.361  4.067 1 20.9305 ? CB  PHE 366  A 1 1 
ATOM   2750 C  CG  . PHE A 1 366 ?  16.492  26.12  5.431 1 20.8805 ? CG  PHE 366  A 1 1 
ATOM   2751 C  CD1 . PHE A 1 366 ?  16.984 25.111  6.233 1 21.7853 ? CD1 PHE 366  A 1 1 
ATOM   2752 C  CD2 . PHE A 1 366 ?  15.429 26.868  5.894 1 22.1331 ? CD2 PHE 366  A 1 1 
ATOM   2753 C  CE1 . PHE A 1 366 ?  16.469 24.911    7.5 1 21.6027 ? CE1 PHE 366  A 1 1 
ATOM   2754 C  CE2 . PHE A 1 366 ?   14.91 26.655  7.153 1 21.7094 ? CE2 PHE 366  A 1 1 
ATOM   2755 C  CZ  . PHE A 1 366 ?  15.435 25.687   7.95 1 22.1548 ? CZ  PHE 366  A 1 1 
ATOM   2756 C  C   . PHE A 1 366 ?  19.259 26.616  2.862 1 21.0186 ? C   PHE 366  A 1 1 
ATOM   2757 O  O   . PHE A 1 366 ?  19.617 25.486  2.528 1 21.2482 ? O   PHE 366  A 1 1 
ATOM   2758 N  N   . ARG A 1 367 ?  19.528 27.705  2.126 1 20.2457 ? N   ARG 367  A 1 1 
ATOM   2759 C  CA  . ARG A 1 367 ?  20.403 27.641  0.957 1 20.0774 ? CA  ARG 367  A 1 1 
ATOM   2760 C  CB  . ARG A 1 367 ?  20.104   28.8 -0.035 1 20.2561 ? CB  ARG 367  A 1 1 
ATOM   2761 C  CG  . ARG A 1 367 ?  21.142 29.051 -1.111 1 20.4164 ? CG  ARG 367  A 1 1 
ATOM   2762 C  CD  . ARG A 1 367 ?  20.602 30.016 -2.185 1 20.7505 ? CD  ARG 367  A 1 1 
ATOM   2763 N  NE  . ARG A 1 367 ?  20.055 31.269 -1.654 1 20.2596 ? NE  ARG 367  A 1 1 
ATOM   2764 C  CZ  . ARG A 1 367 ?  20.788 32.296 -1.218 1 19.9063 ? CZ  ARG 367  A 1 1 
ATOM   2765 N  NH1 . ARG A 1 367 ?  22.105 32.263 -1.235 1 20.0203 ? NH1 ARG 367  A 1 1 
ATOM   2766 N  NH2 . ARG A 1 367 ?  20.182 33.373 -0.731 1 20.0981 ? NH2 ARG 367  A 1 1 
ATOM   2767 C  C   . ARG A 1 367 ?   21.88 27.617  1.357 1 21.0029 ? C   ARG 367  A 1 1 
ATOM   2768 O  O   . ARG A 1 367 ?  22.653 26.826  0.806 1  20.602 ? O   ARG 367  A 1 1 
ATOM   2769 N  N   . ARG A 1 368 ?  22.252 28.436  2.359 1 20.6238 ? N   ARG 368  A 1 1 
ATOM   2770 C  CA  . ARG A 1 368 ?   23.65 28.727  2.622 1 20.4857 ? CA  ARG 368  A 1 1 
ATOM   2771 C  CB  . ARG A 1 368 ?   23.82 30.154  3.068 1 20.2129 ? CB  ARG 368  A 1 1 
ATOM   2772 C  CG  . ARG A 1 368 ?  23.671 31.137  1.919 1 19.8601 ? CG  ARG 368  A 1 1 
ATOM   2773 C  CD  . ARG A 1 368 ?  24.232 32.514  2.221 1 19.9784 ? CD  ARG 368  A 1 1 
ATOM   2774 N  NE  . ARG A 1 368 ?  25.671 32.477  2.484 1 21.3082 ? NE  ARG 368  A 1 1 
ATOM   2775 C  CZ  . ARG A 1 368 ?  26.356  33.39  3.167 1 21.5776 ? CZ  ARG 368  A 1 1 
ATOM   2776 N  NH1 . ARG A 1 368 ?  25.863 34.594  3.415 1 21.6502 ? NH1 ARG 368  A 1 1 
ATOM   2777 N  NH2 . ARG A 1 368 ?  27.571 33.085  3.609 1  21.806 ? NH2 ARG 368  A 1 1 
ATOM   2778 C  C   . ARG A 1 368 ?  24.367 27.795  3.605 1 20.6801 ? C   ARG 368  A 1 1 
ATOM   2779 O  O   . ARG A 1 368 ?  25.587 27.681  3.535 1 20.9485 ? O   ARG 368  A 1 1 
ATOM   2780 N  N   . LEU A 1 369 ?  23.623 27.094  4.467 1 19.7834 ? N   LEU 369  A 1 1 
ATOM   2781 C  CA  . LEU A 1 369 ?  24.258 26.175  5.414 1 19.4487 ? CA  LEU 369  A 1 1 
ATOM   2782 C  CB  . LEU A 1 369 ?  23.799 26.442  6.834 1 19.1972 ? CB  LEU 369  A 1 1 
ATOM   2783 C  CG  . LEU A 1 369 ?  24.192 27.824  7.402 1 19.3966 ? CG  LEU 369  A 1 1 
ATOM   2784 C  CD1 . LEU A 1 369 ?  23.806 27.977  8.813 1 18.7891 ? CD1 LEU 369  A 1 1 
ATOM   2785 C  CD2 . LEU A 1 369 ?   25.66 28.089  7.218 1 19.7056 ? CD2 LEU 369  A 1 1 
ATOM   2786 C  C   . LEU A 1 369 ?  23.892 24.765  4.983 1 19.6683 ? C   LEU 369  A 1 1 
ATOM   2787 O  O   . LEU A 1 369 ?  22.871 24.243    5.4 1  19.439 ? O   LEU 369  A 1 1 
ATOM   2788 N  N   . PRO A 1 370 ?  24.679 24.127  4.092 1  19.828 ? N   PRO 370  A 1 1 
ATOM   2789 C  CA  . PRO A 1 370 ?  24.264 22.851  3.531 1 20.6234 ? CA  PRO 370  A 1 1 
ATOM   2790 C  CB  . PRO A 1 370 ?  25.379 22.517  2.547 1  20.898 ? CB  PRO 370  A 1 1 
ATOM   2791 C  CG  . PRO A 1 370 ?  26.605 23.328  3.087 1 21.4276 ? CG  PRO 370  A 1 1 
ATOM   2792 C  CD  . PRO A 1 370 ?  25.988 24.588  3.622 1 20.3356 ? CD  PRO 370  A 1 1 
ATOM   2793 C  C   . PRO A 1 370 ?  24.167 21.793  4.628 1 20.4568 ? C   PRO 370  A 1 1 
ATOM   2794 O  O   . PRO A 1 370 ?  25.071 21.682  5.456 1 20.3806 ? O   PRO 370  A 1 1 
ATOM   2795 N  N   . GLY A 1 371 ?  23.078 21.041  4.601 1 19.9558 ? N   GLY 371  A 1 1 
ATOM   2796 C  CA  . GLY A 1 371 ?  22.846 19.964   5.55 1 20.5249 ? CA  GLY 371  A 1 1 
ATOM   2797 C  C   . GLY A 1 371 ?  22.575 20.451  6.968 1 20.1971 ? C   GLY 371  A 1 1 
ATOM   2798 O  O   . GLY A 1 371 ?  22.736 19.684  7.916 1 21.2132 ? O   GLY 371  A 1 1 
ATOM   2799 N  N   . LEU A 1 372 ?  22.141 21.708  7.102 1 19.6906 ? N   LEU 372  A 1 1 
ATOM   2800 C  CA  . LEU A 1 372 ?  21.712 22.238  8.391 1 20.0979 ? CA  LEU 372  A 1 1 
ATOM   2801 C  CB  . LEU A 1 372 ?  21.038 23.614  8.174 1 20.2401 ? CB  LEU 372  A 1 1 
ATOM   2802 C  CG  . LEU A 1 372 ?  20.706 24.373  9.441 1 21.4046 ? CG  LEU 372  A 1 1 
ATOM   2803 C  CD1 . LEU A 1 372 ?  21.923 24.736 10.213 1 21.7928 ? CD1 LEU 372  A 1 1 
ATOM   2804 C  CD2 . LEU A 1 372 ?  19.939 25.651  9.158 1 21.5378 ? CD2 LEU 372  A 1 1 
ATOM   2805 C  C   . LEU A 1 372 ?  20.751 21.264  9.077 1 20.1286 ? C   LEU 372  A 1 1 
ATOM   2806 O  O   . LEU A 1 372 ?  19.816 20.768  8.457 1 20.7544 ? O   LEU 372  A 1 1 
ATOM   2807 N  N   . ARG A 1 373 ?  20.989 20.982 10.369 1 20.7062 ? N   ARG 373  A 1 1 
ATOM   2808 C  CA  . ARG A 1 373 ?  20.247 19.993 11.134 1 21.0329 ? CA  ARG 373  A 1 1 
ATOM   2809 C  CB  . ARG A 1 373 ?  20.671 18.531 10.772 1 21.9986 ? CB  ARG 373  A 1 1 
ATOM   2810 C  CG  . ARG A 1 373 ?    22.2 18.241 10.893 1 22.1177 ? CG  ARG 373  A 1 1 
ATOM   2811 C  CD  . ARG A 1 373 ?  22.668 16.913 10.284 1 23.2309 ? CD  ARG 373  A 1 1 
ATOM   2812 N  NE  . ARG A 1 373 ?  24.109 16.754 10.497 1 24.3418 ? NE  ARG 373  A 1 1 
ATOM   2813 C  CZ  . ARG A 1 373 ?  25.038 16.825  9.554 1 24.3937 ? CZ  ARG 373  A 1 1 
ATOM   2814 N  NH1 . ARG A 1 373 ?  26.199 16.193  9.679 1 23.7977 ? NH1 ARG 373  A 1 1 
ATOM   2815 N  NH2 . ARG A 1 373 ?  24.864 17.676  8.547 1 23.8454 ? NH2 ARG 373  A 1 1 
ATOM   2816 C  C   . ARG A 1 373 ?  20.512  20.28 12.609 1  21.229 ? C   ARG 373  A 1 1 
ATOM   2817 O  O   . ARG A 1 373 ?  21.451  20.99 12.974 1 20.5019 ? O   ARG 373  A 1 1 
ATOM   2818 N  N   . LEU A 1 374 ?  19.662 19.725 13.455 1 22.1113 ? N   LEU 374  A 1 1 
ATOM   2819 C  CA  . LEU A 1 374 ?  19.802 19.899 14.888 1 22.4279 ? CA  LEU 374  A 1 1 
ATOM   2820 C  CB  . LEU A 1 374 ?  18.567 19.268 15.546 1  24.124 ? CB  LEU 374  A 1 1 
ATOM   2821 C  CG  . LEU A 1 374 ?  17.267 19.995 15.305 1 25.1966 ? CG  LEU 374  A 1 1 
ATOM   2822 C  CD1 . LEU A 1 374 ?  16.073 19.153 15.782 1 25.7718 ? CD1 LEU 374  A 1 1 
ATOM   2823 C  CD2 . LEU A 1 374 ?  17.253 21.308 15.995 1 25.4689 ? CD2 LEU 374  A 1 1 
ATOM   2824 C  C   . LEU A 1 374 ?  21.086 19.271 15.426 1 22.9892 ? C   LEU 374  A 1 1 
ATOM   2825 O  O   . LEU A 1 374 ?  21.518 18.225 14.947 1 24.3205 ? O   LEU 374  A 1 1 
ATOM   2826 N  N   . ALA A 1 375 ?   21.69 19.949 16.413 1 22.6897 ? N   ALA 375  A 1 1 
ATOM   2827 C  CA  . ALA A 1 375 ?  22.828 19.456 17.176 1 23.4836 ? CA  ALA 375  A 1 1 
ATOM   2828 C  CB  . ALA A 1 375 ?  23.984 20.468 17.138 1  22.651 ? CB  ALA 375  A 1 1 
ATOM   2829 C  C   . ALA A 1 375 ?  22.432 19.142 18.615 1 24.5824 ? C   ALA 375  A 1 1 
ATOM   2830 O  O   . ALA A 1 375 ?  23.257 18.674 19.403 1 25.7199 ? O   ALA 375  A 1 1 
ATOM   2831 N  N   . LYS A 1 376 ?   21.14 19.351 18.915 1 24.9028 ? N   LYS 376  A 1 1 
ATOM   2832 C  CA  . LYS A 1 376 ?  20.564 19.049 20.209 1 26.0895 ? CA  LYS 376  A 1 1 
ATOM   2833 C  CB  . LYS A 1 376 ?  20.623 20.291 21.089 1 26.5067 ? CB  LYS 376  A 1 1 
ATOM   2834 C  CG  . LYS A 1 376 ?  20.107 20.113 22.532 1 27.7846 ? CG  LYS 376  A 1 1 
ATOM   2835 C  CD  . LYS A 1 376 ?   20.49 21.328 23.424 1 28.0962 ? CD  LYS 376  A 1 1 
ATOM   2836 C  CE  . LYS A 1 376 ?  20.082 21.105 24.866 1 29.1852 ? CE  LYS 376  A 1 1 
ATOM   2837 N  NZ  . LYS A 1 376 ?  20.614 22.209 25.725 1 29.2717 ? NZ  LYS 376  A 1 1 
ATOM   2838 C  C   . LYS A 1 376 ?  19.117 18.672 19.913 1 26.8243 ? C   LYS 376  A 1 1 
ATOM   2839 O  O   . LYS A 1 376 ?  18.444 19.424 19.207 1 24.8522 ? O   LYS 376  A 1 1 
ATOM   2840 N  N   . PRO A 1 377 ?  18.595 17.534 20.414 1 28.3449 ? N   PRO 377  A 1 1 
ATOM   2841 C  CA  . PRO A 1 377 ?  17.231 17.133 20.062 1 28.9859 ? CA  PRO 377  A 1 1 
ATOM   2842 C  CB  . PRO A 1 377 ?   17.08 15.744 20.653 1 29.9058 ? CB  PRO 377  A 1 1 
ATOM   2843 C  CG  . PRO A 1 377 ?  18.445 15.343 21.218 1  30.628 ? CG  PRO 377  A 1 1 
ATOM   2844 C  CD  . PRO A 1 377 ?  19.291 16.593 21.309 1 29.7693 ? CD  PRO 377  A 1 1 
ATOM   2845 C  C   . PRO A 1 377 ?  16.145 18.062   20.6 1  27.956 ? C   PRO 377  A 1 1 
ATOM   2846 O  O   . PRO A 1 377 ?  16.296 18.651 21.672 1 27.3795 ? O   PRO 377  A 1 1 
ATOM   2847 N  N   . VAL A 1 378 ?  15.053  18.18 19.833 1 28.1452 ? N   VAL 378  A 1 1 
ATOM   2848 C  CA  . VAL A 1 378 ?  13.908 18.986 20.213 1 29.1009 ? CA  VAL 378  A 1 1 
ATOM   2849 C  CB  . VAL A 1 378 ?  12.719 18.658 19.274 1 30.6331 ? CB  VAL 378  A 1 1 
ATOM   2850 C  CG1 . VAL A 1 378 ?   11.43 19.294 19.775 1 31.8872 ? CG1 VAL 378  A 1 1 
ATOM   2851 C  CG2 . VAL A 1 378 ?   13.02 19.078 17.856 1 31.6356 ? CG2 VAL 378  A 1 1 
ATOM   2852 C  C   . VAL A 1 378 ?  13.525 18.774 21.674 1 29.0858 ? C   VAL 378  A 1 1 
ATOM   2853 O  O   . VAL A 1 378 ?  13.301 19.747 22.399 1 28.2968 ? O   VAL 378  A 1 1 
ATOM   2854 N  N   . GLU A 1 379 ?  13.471 17.506 22.108 1 30.4758 ? N   GLU 379  A 1 1 
ATOM   2855 C  CA  . GLU A 1 379 ?  12.925  17.19 23.422 1  32.568 ? CA  GLU 379  A 1 1 
ATOM   2856 C  CB  . GLU A 1 379 ?   12.54 15.681 23.552 1 37.0809 ? CB  GLU 379  A 1 1 
ATOM   2857 C  CG  . GLU A 1 379 ?  13.641 14.656 23.334 1 41.2899 ? CG  GLU 379  A 1 1 
ATOM   2858 C  CD  . GLU A 1 379 ?  13.971 14.221 21.904 1 43.8866 ? CD  GLU 379  A 1 1 
ATOM   2859 O  OE1 . GLU A 1 379 ?   13.64  14.93 20.917 1  44.106 ? OE1 GLU 379  A 1 1 
ATOM   2860 O  OE2 . GLU A 1 379 ?  14.595 13.138 21.791 1 49.4284 ? OE2 GLU 379  A 1 1 
ATOM   2861 C  C   . GLU A 1 379 ?  13.822 17.674 24.559 1 31.3342 ? C   GLU 379  A 1 1 
ATOM   2862 O  O   . GLU A 1 379 ?  13.373 17.774 25.706 1 30.7765 ? O   GLU 379  A 1 1 
ATOM   2863 N  N   . GLU A 1 380 ?  15.058  18.08 24.235 1 29.5591 ? N   GLU 380  A 1 1 
ATOM   2864 C  CA  . GLU A 1 380 ?  15.933 18.722 25.211 1 29.0374 ? CA  GLU 380  A 1 1 
ATOM   2865 C  CB  . GLU A 1 380 ?  17.366 18.214 25.037 1 29.9889 ? CB  GLU 380  A 1 1 
ATOM   2866 C  CG  . GLU A 1 380 ?   17.51 16.709 25.221 1 31.9756 ? CG  GLU 380  A 1 1 
ATOM   2867 C  CD  . GLU A 1 380 ?  18.949  16.24 25.185 1 33.4928 ? CD  GLU 380  A 1 1 
ATOM   2868 O  OE1 . GLU A 1 380 ?  19.839  16.97 25.681 1 34.6905 ? OE1 GLU 380  A 1 1 
ATOM   2869 O  OE2 . GLU A 1 380 ?  19.182 15.121 24.685 1 36.5327 ? OE2 GLU 380  A 1 1 
ATOM   2870 C  C   . GLU A 1 380 ?   15.96 20.253 25.161 1 27.3874 ? C   GLU 380  A 1 1 
ATOM   2871 O  O   . GLU A 1 380 ?  16.605 20.879     26 1 26.4609 ? O   GLU 380  A 1 1 
ATOM   2872 N  N   . LEU A 1 381 ?  15.273 20.849 24.181 1 26.5721 ? N   LEU 381  A 1 1 
ATOM   2873 C  CA  . LEU A 1 381 ?  15.331 22.292 23.987 1 27.7494 ? CA  LEU 381  A 1 1 
ATOM   2874 C  CB  . LEU A 1 381 ?  14.817 22.671 22.584 1 27.3963 ? CB  LEU 381  A 1 1 
ATOM   2875 C  CG  . LEU A 1 381 ?  15.702 22.227 21.414 1 28.1232 ? CG  LEU 381  A 1 1 
ATOM   2876 C  CD1 . LEU A 1 381 ?  15.084 22.631 20.081 1 27.9525 ? CD1 LEU 381  A 1 1 
ATOM   2877 C  CD2 . LEU A 1 381 ?  17.116 22.769  21.56 1 28.9084 ? CD2 LEU 381  A 1 1 
ATOM   2878 C  C   . LEU A 1 381 ?  14.483 23.006 25.027 1 27.6033 ? C   LEU 381  A 1 1 
ATOM   2879 O  O   . LEU A 1 381 ?  13.442  22.49 25.436 1 27.7818 ? O   LEU 381  A 1 1 
ATOM   2880 N  N   . ARG A 1 382 ?  14.923 24.206 25.422 1 27.7085 ? N   ARG 382  A 1 1 
ATOM   2881 C  CA  . ARG A 1 382 ?  14.136 25.053 26.303 1 29.0602 ? CA  ARG 382  A 1 1 
ATOM   2882 C  CB  . ARG A 1 382 ?  15.048 25.965 27.191 1 32.7228 ? CB  ARG 382  A 1 1 
ATOM   2883 C  CG  . ARG A 1 382 ?  15.842 25.263 28.339 1 38.1668 ? CG  ARG 382  A 1 1 
ATOM   2884 C  CD  . ARG A 1 382 ?  16.815 26.258  29.05 1 41.8167 ? CD  ARG 382  A 1 1 
ATOM   2885 N  NE  . ARG A 1 382 ?  16.128 27.417  29.63 1 45.3748 ? NE  ARG 382  A 1 1 
ATOM   2886 C  CZ  . ARG A 1 382 ?   16.43 28.697 29.394 1 46.0826 ? CZ  ARG 382  A 1 1 
ATOM   2887 N  NH1 . ARG A 1 382 ?  17.493 29.042 28.674 1 45.9648 ? NH1 ARG 382  A 1 1 
ATOM   2888 N  NH2 . ARG A 1 382 ?  15.651 29.654 29.901 1 44.3873 ? NH2 ARG 382  A 1 1 
ATOM   2889 C  C   . ARG A 1 382 ?  13.191 25.925 25.473 1 25.9971 ? C   ARG 382  A 1 1 
ATOM   2890 O  O   . ARG A 1 382 ?  13.628 26.892 24.846 1 23.2988 ? O   ARG 382  A 1 1 
ATOM   2891 N  N   . PHE A 1 383 ?  11.889 25.621 25.529 1 24.1013 ? N   PHE 383  A 1 1 
ATOM   2892 C  CA  . PHE A 1 383 ?  10.885 26.454 24.895 1   23.38 ? CA  PHE 383  A 1 1 
ATOM   2893 C  CB  . PHE A 1 383 ?   9.714 25.588  24.42 1 23.7637 ? CB  PHE 383  A 1 1 
ATOM   2894 C  CG  . PHE A 1 383 ?  10.055 24.726 23.219 1 24.6241 ? CG  PHE 383  A 1 1 
ATOM   2895 C  CD1 . PHE A 1 383 ?  10.789 23.563 23.363 1 26.0831 ? CD1 PHE 383  A 1 1 
ATOM   2896 C  CD2 . PHE A 1 383 ?   9.667 25.105  21.94 1 24.6103 ? CD2 PHE 383  A 1 1 
ATOM   2897 C  CE1 . PHE A 1 383 ?  11.083  22.77 22.264 1 25.4678 ? CE1 PHE 383  A 1 1 
ATOM   2898 C  CE2 . PHE A 1 383 ?   9.985 24.325  20.84 1  24.976 ? CE2 PHE 383  A 1 1 
ATOM   2899 C  CZ  . PHE A 1 383 ?  10.681 23.157 21.012 1 24.6862 ? CZ  PHE 383  A 1 1 
ATOM   2900 C  C   . PHE A 1 383 ?  10.446 27.634 25.773 1  22.764 ? C   PHE 383  A 1 1 
ATOM   2901 O  O   . PHE A 1 383 ?  10.611 27.625 27.002 1  23.255 ? O   PHE 383  A 1 1 
ATOM   2902 N  N   . ARG A 1 384 ?   9.898 28.665 25.119 1 21.9099 ? N   ARG 384  A 1 1 
ATOM   2903 C  CA  . ARG A 1 384 ?    9.58 29.933 25.768 1 22.1627 ? CA  ARG 384  A 1 1 
ATOM   2904 C  CB  . ARG A 1 384 ?   9.669 31.105  24.76 1 20.8843 ? CB  ARG 384  A 1 1 
ATOM   2905 C  CG  . ARG A 1 384 ?  11.078 31.385 24.272 1 20.6398 ? CG  ARG 384  A 1 1 
ATOM   2906 C  CD  . ARG A 1 384 ?  11.146 32.375 23.115 1 19.6347 ? CD  ARG 384  A 1 1 
ATOM   2907 N  NE  . ARG A 1 384 ?  10.568 33.669 23.455 1 19.9855 ? NE  ARG 384  A 1 1 
ATOM   2908 C  CZ  . ARG A 1 384 ?  11.269 34.786 23.638 1 20.8647 ? CZ  ARG 384  A 1 1 
ATOM   2909 N  NH1 . ARG A 1 384 ?  12.594 34.776 23.626 1 21.6679 ? NH1 ARG 384  A 1 1 
ATOM   2910 N  NH2 . ARG A 1 384 ?  10.627 35.942  23.81 1 21.1611 ? NH2 ARG 384  A 1 1 
ATOM   2911 C  C   . ARG A 1 384 ?   8.202 29.943 26.426 1 23.3764 ? C   ARG 384  A 1 1 
ATOM   2912 O  O   . ARG A 1 384 ?   7.378 30.802 26.123 1 23.2485 ? O   ARG 384  A 1 1 
ATOM   2913 N  N   . HIS A 1 385 ?   7.983 29.025 27.382 1 25.1927 ? N   HIS 385  A 1 1 
ATOM   2914 C  CA  . HIS A 1 385 ?   6.741 28.988 28.154 1   28.47 ? CA  HIS 385  A 1 1 
ATOM   2915 C  CB  . HIS A 1 385 ?   6.678 27.688  28.99 1   31.58 ? CB  HIS 385  A 1 1 
ATOM   2916 C  CG  . HIS A 1 385 ?   7.843 27.499  29.92 1 35.5187 ? CG  HIS 385  A 1 1 
ATOM   2917 N  ND1 . HIS A 1 385 ?   7.942 28.188 31.141 1 41.0689 ? ND1 HIS 385  A 1 1 
ATOM   2918 C  CE1 . HIS A 1 385 ?   9.095 27.807 31.695 1 40.6822 ? CE1 HIS 385  A 1 1 
ATOM   2919 N  NE2 . HIS A 1 385 ?   9.727 26.912 30.912 1 41.0541 ? NE2 HIS 385  A 1 1 
ATOM   2920 C  CD2 . HIS A 1 385 ?   8.933 26.705 29.789 1 38.6268 ? CD2 HIS 385  A 1 1 
ATOM   2921 C  C   . HIS A 1 385 ?   6.621 30.217 29.057 1 27.4218 ? C   HIS 385  A 1 1 
ATOM   2922 O  O   . HIS A 1 385 ?   5.519 30.608 29.453 1 28.1558 ? O   HIS 385  A 1 1 
ATOM   2923 N  N   . ASP A 1 386 ?   7.778 30.834 29.351 1 25.6475 ? N   ASP 386  A 1 1 
ATOM   2924 C  CA  . ASP A 1 386 ?   7.886 31.936 30.308 1 25.0957 ? CA  ASP 386  A 1 1 
ATOM   2925 C  CB  . ASP A 1 386 ?   9.186  31.77 31.125 1 24.9334 ? CB  ASP 386  A 1 1 
ATOM   2926 C  CG  . ASP A 1 386 ?  10.458 31.418 30.374 1 25.0633 ? CG  ASP 386  A 1 1 
ATOM   2927 O  OD1 . ASP A 1 386 ?  10.401 31.252 29.097 1 23.4811 ? OD1 ASP 386  A 1 1 
ATOM   2928 O  OD2 . ASP A 1 386 ?  11.497 31.209 31.046 1 24.1563 ? OD2 ASP 386  A 1 1 
ATOM   2929 C  C   . ASP A 1 386 ?   7.881  33.33 29.688 1 23.9878 ? C   ASP 386  A 1 1 
ATOM   2930 O  O   . ASP A 1 386 ?    8.04 34.345 30.397 1 23.9171 ? O   ASP 386  A 1 1 
ATOM   2931 N  N   . MET A 1 387 ?   7.664 33.367 28.367 1 22.7149 ? N   MET 387  A 1 1 
ATOM   2932 C  CA  . MET A 1 387 ?   7.741 34.598 27.603 1 22.0995 ? CA  MET 387  A 1 1 
ATOM   2933 C  CB  . MET A 1 387 ?   8.846  34.55 26.505 1 21.7345 ? CB  MET 387  A 1 1 
ATOM   2934 C  CG  . MET A 1 387 ?  10.157 34.048 26.988 1  21.893 ? CG  MET 387  A 1 1 
ATOM   2935 S  SD  . MET A 1 387 ?  10.938 35.173  28.18 1 23.1431 ? SD  MET 387  A 1 1 
ATOM   2936 C  CE  . MET A 1 387 ?  11.493 36.498 27.102 1 22.1479 ? CE  MET 387  A 1 1 
ATOM   2937 C  C   . MET A 1 387 ?   6.394 34.838 26.939 1 21.9467 ? C   MET 387  A 1 1 
ATOM   2938 O  O   . MET A 1 387 ?   5.617 33.894  26.71 1 20.9961 ? O   MET 387  A 1 1 
ATOM   2939 N  N   . VAL A 1 388 ?    6.13 36.114 26.639 1 21.6756 ? N   VAL 388  A 1 1 
ATOM   2940 C  CA  . VAL A 1 388 ?   4.893 36.482 25.975 1  22.078 ? CA  VAL 388  A 1 1 
ATOM   2941 C  CB  . VAL A 1 388 ?   4.718 37.997 25.764 1  22.206 ? CB  VAL 388  A 1 1 
ATOM   2942 C  CG1 . VAL A 1 388 ?   3.469 38.273 24.935 1 22.1022 ? CG1 VAL 388  A 1 1 
ATOM   2943 C  CG2 . VAL A 1 388 ?   4.634 38.807 27.099 1 23.0309 ? CG2 VAL 388  A 1 1 
ATOM   2944 C  C   . VAL A 1 388 ?   4.842 35.751 24.632 1 21.5304 ? C   VAL 388  A 1 1 
ATOM   2945 O  O   . VAL A 1 388 ?   3.843  35.12 24.299 1 20.2614 ? O   VAL 388  A 1 1 
ATOM   2946 N  N   . PHE A 1 389 ?   5.908 35.904 23.837 1 20.4407 ? N   PHE 389  A 1 1 
ATOM   2947 C  CA  . PHE A 1 389 ?   5.979 35.248 22.537 1  20.926 ? CA  PHE 389  A 1 1 
ATOM   2948 C  CB  . PHE A 1 389 ?   6.613 36.197 21.491 1 20.9261 ? CB  PHE 389  A 1 1 
ATOM   2949 C  CG  . PHE A 1 389 ?   5.612 37.266 21.113 1 21.3501 ? CG  PHE 389  A 1 1 
ATOM   2950 C  CD1 . PHE A 1 389 ?   4.485 36.952  20.36 1 22.4049 ? CD1 PHE 389  A 1 1 
ATOM   2951 C  CD2 . PHE A 1 389 ?   5.764 38.567 21.557 1 21.6514 ? CD2 PHE 389  A 1 1 
ATOM   2952 C  CE1 . PHE A 1 389 ?   3.549 37.931 20.042 1 22.6202 ? CE1 PHE 389  A 1 1 
ATOM   2953 C  CE2 . PHE A 1 389 ?   4.816 39.534 21.257 1 21.4843 ? CE2 PHE 389  A 1 1 
ATOM   2954 C  CZ  . PHE A 1 389 ?   3.727 39.222 20.496 1 21.2215 ? CZ  PHE 389  A 1 1 
ATOM   2955 C  C   . PHE A 1 389 ?   6.721 33.918 22.643 1 20.7553 ? C   PHE 389  A 1 1 
ATOM   2956 O  O   . PHE A 1 389 ?    7.79 33.844 23.251 1 20.6705 ? O   PHE 389  A 1 1 
ATOM   2957 N  N   . TYR A 1 390 ?   6.064 32.864 22.136 1 20.5239 ? N   TYR 390  A 1 1 
ATOM   2958 C  CA  . TYR A 1 390 ?   6.601 31.522 22.153 1 20.5736 ? CA  TYR 390  A 1 1 
ATOM   2959 C  CB  . TYR A 1 390 ?   5.453 30.541 21.846 1 20.9321 ? CB  TYR 390  A 1 1 
ATOM   2960 C  CG  . TYR A 1 390 ?   5.778 29.085 22.082 1  20.926 ? CG  TYR 390  A 1 1 
ATOM   2961 C  CD1 . TYR A 1 390 ?    6.13 28.624 23.349 1 21.6056 ? CD1 TYR 390  A 1 1 
ATOM   2962 C  CD2 . TYR A 1 390 ?    5.66 28.154 21.061 1  21.094 ? CD2 TYR 390  A 1 1 
ATOM   2963 C  CE1 . TYR A 1 390 ?    6.37 27.278 23.585 1 21.7496 ? CE1 TYR 390  A 1 1 
ATOM   2964 C  CE2 . TYR A 1 390 ?   5.934 26.813 21.273 1 21.5167 ? CE2 TYR 390  A 1 1 
ATOM   2965 C  CZ  . TYR A 1 390 ?   6.284 26.373 22.545 1  21.749 ? CZ  TYR 390  A 1 1 
ATOM   2966 O  OH  . TYR A 1 390 ?   6.518 25.048 22.762 1    21.9 ? OH  TYR 390  A 1 1 
ATOM   2967 C  C   . TYR A 1 390 ?   7.743 31.384 21.157 1 20.5993 ? C   TYR 390  A 1 1 
ATOM   2968 O  O   . TYR A 1 390 ?   7.914 32.233 20.266 1 20.4058 ? O   TYR 390  A 1 1 
ATOM   2969 N  N   . GLY A 1 391 ?   8.497 30.279 21.316 1  20.611 ? N   GLY 391  A 1 1 
ATOM   2970 C  CA  . GLY A 1 391 ?   9.731 30.054 20.585 1 21.1144 ? CA  GLY 391  A 1 1 
ATOM   2971 C  C   . GLY A 1 391 ?  10.694   29.2 21.404 1  21.717 ? C   GLY 391  A 1 1 
ATOM   2972 O  O   . GLY A 1 391 ?  10.275 28.473 22.311 1 21.9713 ? O   GLY 391  A 1 1 
ATOM   2973 N  N   . VAL A 1 392 ?   11.98 29.275 21.034 1 21.2707 ? N   VAL 392  A 1 1 
ATOM   2974 C  CA  . VAL A 1 392 ?  13.009 28.514  21.71 1  21.496 ? CA  VAL 392  A 1 1 
ATOM   2975 C  CB  . VAL A 1 392 ?  13.614 27.476 20.762 1 22.0215 ? CB  VAL 392  A 1 1 
ATOM   2976 C  CG1 . VAL A 1 392 ?  12.611 26.355 20.453 1  23.169 ? CG1 VAL 392  A 1 1 
ATOM   2977 C  CG2 . VAL A 1 392 ?  14.125 28.093 19.459 1 21.5857 ? CG2 VAL 392  A 1 1 
ATOM   2978 C  C   . VAL A 1 392 ?  14.036 29.482 22.291 1 20.8369 ? C   VAL 392  A 1 1 
ATOM   2979 O  O   . VAL A 1 392 ?  14.357 30.501 21.665 1 19.9571 ? O   VAL 392  A 1 1 
ATOM   2980 N  N   . HIS A 1 393 ?  14.562 29.151 23.482 1 21.8989 ? N   HIS 393  A 1 1 
ATOM   2981 C  CA  . HIS A 1 393 ?   15.56 30.002 24.109 1 21.9153 ? CA  HIS 393  A 1 1 
ATOM   2982 C  CB  . HIS A 1 393 ?  15.609 29.797 25.636 1 22.6482 ? CB  HIS 393  A 1 1 
ATOM   2983 C  CG  . HIS A 1 393 ?  14.505 30.442 26.436 1 21.8177 ? CG  HIS 393  A 1 1 
ATOM   2984 N  ND1 . HIS A 1 393 ?  14.466  31.81  26.66 1 21.9451 ? ND1 HIS 393  A 1 1 
ATOM   2985 C  CE1 . HIS A 1 393 ?   13.39 32.033 27.415 1 21.3732 ? CE1 HIS 393  A 1 1 
ATOM   2986 N  NE2 . HIS A 1 393 ?  12.744 30.887 27.668 1 22.4047 ? NE2 HIS 393  A 1 1 
ATOM   2987 C  CD2 . HIS A 1 393 ?  13.433 29.877 27.069 1 22.4051 ? CD2 HIS 393  A 1 1 
ATOM   2988 C  C   . HIS A 1 393 ?  16.938 29.723 23.515 1 22.8201 ? C   HIS 393  A 1 1 
ATOM   2989 O  O   . HIS A 1 393 ?  17.872 30.514 23.703 1 24.2458 ? O   HIS 393  A 1 1 
ATOM   2990 N  N   . GLU A 1 394 ?  17.059 28.597 22.815 1 21.9537 ? N   GLU 394  A 1 1 
ATOM   2991 C  CA  . GLU A 1 394 ?   18.33 28.119 22.308 1 23.9762 ? CA  GLU 394  A 1 1 
ATOM   2992 C  CB  . GLU A 1 394 ?  19.022 27.332 23.434 1 27.5371 ? CB  GLU 394  A 1 1 
ATOM   2993 C  CG  . GLU A 1 394 ?  20.363 26.737 23.126 1 30.9222 ? CG  GLU 394  A 1 1 
ATOM   2994 C  CD  . GLU A 1 394 ?  20.841 25.661 24.106 1 35.0526 ? CD  GLU 394  A 1 1 
ATOM   2995 O  OE1 . GLU A 1 394 ?  19.993 24.937 24.704 1 36.2833 ? OE1 GLU 394  A 1 1 
ATOM   2996 O  OE2 . GLU A 1 394 ?  22.086  25.58 24.301 1 33.9846 ? OE2 GLU 394  A 1 1 
ATOM   2997 C  C   . GLU A 1 394 ?   18.04 27.217 21.118 1 23.1072 ? C   GLU 394  A 1 1 
ATOM   2998 O  O   . GLU A 1 394 ?  17.053 26.481 21.147 1 22.1177 ? O   GLU 394  A 1 1 
ATOM   2999 N  N   . LEU A 1 395 ?   18.92 27.246 20.105 1 22.0805 ? N   LEU 395  A 1 1 
ATOM   3000 C  CA  . LEU A 1 395 ?  18.798 26.309 18.991 1 21.3622 ? CA  LEU 395  A 1 1 
ATOM   3001 C  CB  . LEU A 1 395 ?  17.917 26.915 17.861 1 22.2975 ? CB  LEU 395  A 1 1 
ATOM   3002 C  CG  . LEU A 1 395 ?  17.531 25.922 16.753 1 22.2061 ? CG  LEU 395  A 1 1 
ATOM   3003 C  CD1 . LEU A 1 395 ?  16.705  24.79 17.318 1 23.6165 ? CD1 LEU 395  A 1 1 
ATOM   3004 C  CD2 . LEU A 1 395 ?  16.777 26.616 15.653 1 22.3121 ? CD2 LEU 395  A 1 1 
ATOM   3005 C  C   . LEU A 1 395 ?   20.15 25.887 18.431 1   20.72 ? C   LEU 395  A 1 1 
ATOM   3006 O  O   . LEU A 1 395 ?  20.613 26.447 17.437 1 20.1181 ? O   LEU 395  A 1 1 
ATOM   3007 N  N   . PRO A 1 396 ?   20.83 24.898 19.068 1 20.6179 ? N   PRO 396  A 1 1 
ATOM   3008 C  CA  . PRO A 1 396 ?  22.093 24.391 18.573 1  20.534 ? CA  PRO 396  A 1 1 
ATOM   3009 C  CB  . PRO A 1 396 ?  22.569 23.478 19.678 1 21.0281 ? CB  PRO 396  A 1 1 
ATOM   3010 C  CG  . PRO A 1 396 ?  21.826 23.903 20.901 1   21.37 ? CG  PRO 396  A 1 1 
ATOM   3011 C  CD  . PRO A 1 396 ?  20.458 24.266 20.346 1  21.593 ? CD  PRO 396  A 1 1 
ATOM   3012 C  C   . PRO A 1 396 ?  21.929 23.632 17.271 1 21.0534 ? C   PRO 396  A 1 1 
ATOM   3013 O  O   . PRO A 1 396 ?  21.113 22.711 17.216 1 21.6875 ? O   PRO 396  A 1 1 
ATOM   3014 N  N   . VAL A 1 397 ?  22.723 24.031 16.266 1 19.7975 ? N   VAL 397  A 1 1 
ATOM   3015 C  CA  . VAL A 1 397 ?  22.672 23.427 14.951 1 19.6687 ? CA  VAL 397  A 1 1 
ATOM   3016 C  CB  . VAL A 1 397 ?  21.958 24.366 13.918 1 19.7436 ? CB  VAL 397  A 1 1 
ATOM   3017 C  CG1 . VAL A 1 397 ?  20.512  24.62 14.316 1  19.557 ? CG1 VAL 397  A 1 1 
ATOM   3018 C  CG2 . VAL A 1 397 ?  22.706 25.682 13.736 1 19.7112 ? CG2 VAL 397  A 1 1 
ATOM   3019 C  C   . VAL A 1 397 ?  24.079 23.064  14.49 1 20.1482 ? C   VAL 397  A 1 1 
ATOM   3020 O  O   . VAL A 1 397 ?  25.061 23.639 14.952 1 19.7899 ? O   VAL 397  A 1 1 
ATOM   3021 N  N   . THR A 1 398 ?  24.149 22.097 13.562 1 19.9604 ? N   THR 398  A 1 1 
ATOM   3022 C  CA  . THR A 1 398 ?   25.37 21.776 12.861 1 19.3741 ? CA  THR 398  A 1 1 
ATOM   3023 C  CB  . THR A 1 398 ?  26.026 20.518  13.41 1 20.5036 ? CB  THR 398  A 1 1 
ATOM   3024 O  OG1 . THR A 1 398 ?  27.206 20.317 12.695 1 20.3351 ? OG1 THR 398  A 1 1 
ATOM   3025 C  CG2 . THR A 1 398 ?  25.199 19.286 13.274 1  20.401 ? CG2 THR 398  A 1 1 
ATOM   3026 C  C   . THR A 1 398 ?  24.968 21.691 11.391 1 19.1099 ? C   THR 398  A 1 1 
ATOM   3027 O  O   . THR A 1 398 ?   23.78 21.765 11.065 1 19.0036 ? O   THR 398  A 1 1 
ATOM   3028 N  N   . TRP A 1 399 ?  25.976 21.584 10.524 1  18.892 ? N   TRP 399  A 1 1 
ATOM   3029 C  CA  . TRP A 1 399 ?  25.748 21.489    9.1 1 19.1281 ? CA  TRP 399  A 1 1 
ATOM   3030 C  CB  . TRP A 1 399 ?  25.365 22.868  8.488 1 18.8377 ? CB  TRP 399  A 1 1 
ATOM   3031 C  CG  . TRP A 1 399 ?  26.444 23.907  8.546 1 18.8451 ? CG  TRP 399  A 1 1 
ATOM   3032 C  CD1 . TRP A 1 399 ?  27.313  24.26   7.56 1 19.5532 ? CD1 TRP 399  A 1 1 
ATOM   3033 N  NE1 . TRP A 1 399 ?  28.121 25.283  7.985 1 19.6167 ? NE1 TRP 399  A 1 1 
ATOM   3034 C  CE2 . TRP A 1 399 ?  27.792 25.592  9.276 1  19.358 ? CE2 TRP 399  A 1 1 
ATOM   3035 C  CZ2 . TRP A 1 399 ?  28.358 26.512 10.155 1 19.4269 ? CZ2 TRP 399  A 1 1 
ATOM   3036 C  CH2 . TRP A 1 399 ?  27.785 26.626 11.391 1 19.6343 ? CH2 TRP 399  A 1 1 
ATOM   3037 C  CZ3 . TRP A 1 399 ?  26.734  25.81 11.783 1 19.2947 ? CZ3 TRP 399  A 1 1 
ATOM   3038 C  CE3 . TRP A 1 399 ?  26.196 24.879  10.92 1 19.6283 ? CE3 TRP 399  A 1 1 
ATOM   3039 C  CD2 . TRP A 1 399 ?  26.757 24.725  9.667 1 19.0344 ? CD2 TRP 399  A 1 1 
ATOM   3040 C  C   . TRP A 1 399 ?  26.992 20.813  8.518 1 19.8753 ? C   TRP 399  A 1 1 
ATOM   3041 O  O   . TRP A 1 399 ?  27.905 20.428  9.245 1 20.1653 ? O   TRP 399  A 1 1 
ATOM   3042 N  N   . HIS A 1 400 ?  26.978 20.531  7.214 1 20.2058 ? N   HIS 400  A 1 1 
ATOM   3043 C  CA  . HIS A 1 400 ?  28.089 19.839  6.591 1 20.5837 ? CA  HIS 400  A 1 1 
ATOM   3044 C  CB  . HIS A 1 400 ?  27.796 19.587  5.126 1 20.9181 ? CB  HIS 400  A 1 1 
ATOM   3045 C  CG  . HIS A 1 400 ?  26.671  18.62  4.947 1 21.4282 ? CG  HIS 400  A 1 1 
ATOM   3046 N  ND1 . HIS A 1 400 ?  25.894 18.573  3.764 1 22.5833 ? ND1 HIS 400  A 1 1 
ATOM   3047 C  CE1 . HIS A 1 400 ?  25.035 17.589  3.961 1 21.0668 ? CE1 HIS 400  A 1 1 
ATOM   3048 N  NE2 . HIS A 1 400 ?  25.197 17.055  5.172 1 22.2943 ? NE2 HIS 400  A 1 1 
ATOM   3049 C  CD2 . HIS A 1 400 ?  26.221 17.703  5.796 1 20.5585 ? CD2 HIS 400  A 1 1 
ATOM   3050 C  C   . HIS A 1 400 ?  29.382 20.624  6.664 1 21.2224 ? C   HIS 400  A 1 1 
ATOM   3051 O  O   . HIS A 1 400 ?  29.361 21.842  6.493 1 20.4426 ? O   HIS 400  A 1 1 
ATOM   3052 N  N   . HIS A 1 401 ?  30.484 19.901  6.874 1 21.3967 ? N   HIS 401  A 1 1 
ATOM   3053 C  CA  . HIS A 1 401 ?  31.769 20.528  7.081 1 21.7507 ? CA  HIS 401  A 1 1 
ATOM   3054 C  CB  . HIS A 1 401 ?   32.78 19.515   7.64 1 22.5267 ? CB  HIS 401  A 1 1 
ATOM   3055 C  CG  . HIS A 1 401 ?  34.107 20.145  7.905 1 23.5507 ? CG  HIS 401  A 1 1 
ATOM   3056 N  ND1 . HIS A 1 401 ?  34.258 21.059  8.926 1 23.5372 ? ND1 HIS 401  A 1 1 
ATOM   3057 C  CE1 . HIS A 1 401 ?  35.543 21.429  8.898 1 23.9958 ? CE1 HIS 401  A 1 1 
ATOM   3058 N  NE2 . HIS A 1 401 ?  36.199 20.819  7.934 1  23.776 ? NE2 HIS 401  A 1 1 
ATOM   3059 C  CD2 . HIS A 1 401 ?  35.304 19.974  7.293 1 24.2486 ? CD2 HIS 401  A 1 1 
ATOM   3060 C  C   . HIS A 1 401 ?  32.292 21.065   5.75 1   22.12 ? C   HIS 401  A 1 1 
ATOM   3061 O  O   . HIS A 1 401 ?  32.158 20.385  4.723 1 22.9182 ? O   HIS 401  A 1 1 
ATOM   3062 N  N   . HIS A 1 402 ?  32.867 22.279   5.77 1 21.9569 ? N   HIS 402  A 1 1 
ATOM   3063 C  CA  . HIS A 1 402 ?  33.503 22.823  4.586 1 22.8641 ? CA  HIS 402  A 1 1 
ATOM   3064 C  CB  . HIS A 1 402 ?  33.366 24.359  4.553 1   24.07 ? CB  HIS 402  A 1 1 
ATOM   3065 C  CG  . HIS A 1 402 ?  33.766 24.954  3.239 1  24.244 ? CG  HIS 402  A 1 1 
ATOM   3066 N  ND1 . HIS A 1 402 ?  35.089 25.191  2.924 1 26.7506 ? ND1 HIS 402  A 1 1 
ATOM   3067 C  CE1 . HIS A 1 402 ?  35.079 25.694   1.69 1  25.893 ? CE1 HIS 402  A 1 1 
ATOM   3068 N  NE2 . HIS A 1 402 ?  33.831 25.779  1.228 1 25.9405 ? NE2 HIS 402  A 1 1 
ATOM   3069 C  CD2 . HIS A 1 402 ?  32.997 25.305  2.196 1 23.8735 ? CD2 HIS 402  A 1 1 
ATOM   3070 C  C   . HIS A 1 402 ?   34.94 22.325   4.51 1 23.4568 ? C   HIS 402  A 1 1 
ATOM   3071 O  O   . HIS A 1 402 ?  35.846 22.878  5.131 1 22.5111 ? O   HIS 402  A 1 1 
ATOM   3072 N  N   . HIS A 1 403 ?  35.137 21.221  3.782 1 23.9921 ? N   HIS 403  A 1 1 
ATOM   3073 C  CA  . HIS A 1 403 ?  36.444 20.604  3.665 1 24.3049 ? CA  HIS 403  A 1 1 
ATOM   3074 C  CB  . HIS A 1 403 ?  36.343  19.23  2.993 1 24.5838 ? CB  HIS 403  A 1 1 
ATOM   3075 C  CG  . HIS A 1 403 ?   35.53  18.23  3.766 1 25.0272 ? CG  HIS 403  A 1 1 
ATOM   3076 N  ND1 . HIS A 1 403 ?  36.055  17.55  4.848 1 26.7166 ? ND1 HIS 403  A 1 1 
ATOM   3077 C  CE1 . HIS A 1 403 ?  35.082 16.747  5.288 1 26.0571 ? CE1 HIS 403  A 1 1 
ATOM   3078 N  NE2 . HIS A 1 403 ?  33.966 16.903  4.551 1 24.9424 ? NE2 HIS 403  A 1 1 
ATOM   3079 C  CD2 . HIS A 1 403 ?  34.259 17.818   3.57 1 25.0247 ? CD2 HIS 403  A 1 1 
ATOM   3080 C  C   . HIS A 1 403 ?  37.443 21.512  2.872 1 24.8323 ? C   HIS 403  A 1 1 
ATOM   3081 O  O   . HIS A 1 403 ?  38.657 21.338  3.034 1  24.756 ? O   HIS 403  A 1 1 
ATOM   3082 O  OXT . HIS A 1 403 ?  37.041 22.343  2.054 1 23.1517 ? OXT HIS 403  A 1 1 
HETATM 3083 C  CHA . HEM B 2   . ?   0.464 44.536 16.438 1  23.285 ? CHA HEM 1408 A 1 ? 
HETATM 3084 C  CHB . HEM B 2   . ?   2.062 40.064 15.771 1  23.035 ? CHB HEM 1408 A 1 ? 
HETATM 3085 C  CHC . HEM B 2   . ?   6.045 41.847 13.687 1  21.475 ? CHC HEM 1408 A 1 ? 
HETATM 3086 C  CHD . HEM B 2   . ?   4.642  46.28 14.896 1  21.529 ? CHD HEM 1408 A 1 ? 
HETATM 3087 C  C1A . HEM B 2   . ?   0.484 43.161 16.392 1   23.26 ? C1A HEM 1408 A 1 ? 
HETATM 3088 C  C2A . HEM B 2   . ?  -0.519 42.299 16.816 1  23.603 ? C2A HEM 1408 A 1 ? 
HETATM 3089 C  C3A . HEM B 2   . ?  -0.044 41.038 16.619 1  23.689 ? C3A HEM 1408 A 1 ? 
HETATM 3090 C  C4A . HEM B 2   . ?   1.227 41.139 16.105 1  22.264 ? C4A HEM 1408 A 1 ? 
HETATM 3091 C  CMA . HEM B 2   . ?  -0.767 39.761 16.943 1  23.086 ? CMA HEM 1408 A 1 ? 
HETATM 3092 C  CAA . HEM B 2   . ?  -1.877  42.66 17.364 1  23.782 ? CAA HEM 1408 A 1 ? 
HETATM 3093 C  CBA . HEM B 2   . ?  -2.053 42.553  18.88 1  23.865 ? CBA HEM 1408 A 1 ? 
HETATM 3094 C  CGA . HEM B 2   . ?   -3.46 42.872 19.383 1  25.774 ? CGA HEM 1408 A 1 ? 
HETATM 3095 O  O1A . HEM B 2   . ?  -4.372 42.977 18.553 1   23.07 ? O1A HEM 1408 A 1 ? 
HETATM 3096 O  O2A . HEM B 2   . ?  -3.644 43.059 20.599 1  25.984 ? O2A HEM 1408 A 1 ? 
HETATM 3097 C  C1B . HEM B 2   . ?   3.298 40.098 15.109 1  22.109 ? C1B HEM 1408 A 1 ? 
HETATM 3098 C  C2B . HEM B 2   . ?   4.047 39.017 14.671 1  21.684 ? C2B HEM 1408 A 1 ? 
HETATM 3099 C  C3B . HEM B 2   . ?   5.205 39.553 14.132 1   21.82 ? C3B HEM 1408 A 1 ? 
HETATM 3100 C  C4B . HEM B 2   . ?   5.118 40.932 14.194 1   21.72 ? C4B HEM 1408 A 1 ? 
HETATM 3101 C  CMB . HEM B 2   . ?   3.754 37.547 14.848 1  21.103 ? CMB HEM 1408 A 1 ? 
HETATM 3102 C  CAB . HEM B 2   . ?   6.321 38.862 13.501 1  21.903 ? CAB HEM 1408 A 1 ? 
HETATM 3103 C  CBB . HEM B 2   . ?   6.324 37.721 12.938 1  23.707 ? CBB HEM 1408 A 1 ? 
HETATM 3104 C  C1C . HEM B 2   . ?   6.015 43.219 13.763 1   20.83 ? C1C HEM 1408 A 1 ? 
HETATM 3105 C  C2C . HEM B 2   . ?   6.952 44.084 13.211 1  20.717 ? C2C HEM 1408 A 1 ? 
HETATM 3106 C  C3C . HEM B 2   . ?   6.562  45.35 13.595 1  21.915 ? C3C HEM 1408 A 1 ? 
HETATM 3107 C  C4C . HEM B 2   . ?   5.392 45.232 14.329 1  21.704 ? C4C HEM 1408 A 1 ? 
HETATM 3108 C  CMC . HEM B 2   . ?   8.138 43.722 12.357 1  19.982 ? CMC HEM 1408 A 1 ? 
HETATM 3109 C  CAC . HEM B 2   . ?   7.121  46.65  13.26 1  22.494 ? CAC HEM 1408 A 1 ? 
HETATM 3110 C  CBC . HEM B 2   . ?   7.953 47.013 12.339 1  24.455 ? CBC HEM 1408 A 1 ? 
HETATM 3111 C  C1D . HEM B 2   . ?   3.361  46.21 15.474 1  22.341 ? C1D HEM 1408 A 1 ? 
HETATM 3112 C  C2D . HEM B 2   . ?   2.646 47.296 15.933 1  23.806 ? C2D HEM 1408 A 1 ? 
HETATM 3113 C  C3D . HEM B 2   . ?   1.438 46.832 16.366 1  24.595 ? C3D HEM 1408 A 1 ? 
HETATM 3114 C  C4D . HEM B 2   . ?   1.468 45.451 16.182 1  24.683 ? C4D HEM 1408 A 1 ? 
HETATM 3115 C  CMD . HEM B 2   . ?   3.131 48.719 15.929 1  23.684 ? CMD HEM 1408 A 1 ? 
HETATM 3116 C  CAD . HEM B 2   . ?   0.303 47.658 16.913 1  24.057 ? CAD HEM 1408 A 1 ? 
HETATM 3117 C  CBD . HEM B 2   . ?   -0.77 48.043 15.887 1  23.916 ? CBD HEM 1408 A 1 ? 
HETATM 3118 C  CGD . HEM B 2   . ?  -2.074 48.644 16.441 1  23.847 ? CGD HEM 1408 A 1 ? 
HETATM 3119 O  O1D . HEM B 2   . ?  -2.848 49.242 15.656 1   24.76 ? O1D HEM 1408 A 1 ? 
HETATM 3120 O  O2D . HEM B 2   . ?   -2.32 48.533 17.643 1  24.903 ? O2D HEM 1408 A 1 ? 
HETATM 3121 N  NA  . HEM B 2   . ?   1.574 42.432 15.986 1  22.307 ? NA  HEM 1408 A 1 ? 
HETATM 3122 N  NB  . HEM B 2   . ?   3.933 41.272 14.812 1  22.766 ? NB  HEM 1408 A 1 ? 
HETATM 3123 N  NC  . HEM B 2   . ?   5.059   43.9 14.469 1  21.493 ? NC  HEM 1408 A 1 ? 
HETATM 3124 N  ND  . HEM B 2   . ?   2.639 45.103 15.613 1  21.987 ? ND  HEM 1408 A 1 ? 
HETATM 3125 FE FE  . HEM B 2   . ?   3.203 43.186 15.029 1  22.684 ? FE  HEM 1408 A 1 ? 
HETATM 3126 C  C1  . FLI C 3   . ?   1.819 42.591 22.516 1  25.784 ? C1  FLI 404  A 1 ? 
HETATM 3127 O  O1  . FLI C 3   . ?   0.954 43.424 22.406 1  26.675 ? O1  FLI 404  A 1 ? 
HETATM 3128 C  C2  . FLI C 3   . ?   1.911 41.674 23.711 1  25.715 ? C2  FLI 404  A 1 ? 
HETATM 3129 C  C3  . FLI C 3   . ?    2.01 42.451 25.029 1  24.322 ? C3  FLI 404  A 1 ? 
HETATM 3130 C  C4  . FLI C 3   . ?    3.19 43.422  25.18 1  24.332 ? C4  FLI 404  A 1 ? 
HETATM 3131 C  C5  . FLI C 3   . ?   3.267 44.125 26.522 1  24.195 ? C5  FLI 404  A 1 ? 
HETATM 3132 C  C6  . FLI C 3   . ?   4.412 45.112   26.6 1  23.428 ? C6  FLI 404  A 1 ? 
HETATM 3133 C  C7  . FLI C 3   . ?   4.551 45.858  27.91 1  24.068 ? C7  FLI 404  A 1 ? 
HETATM 3134 C  C8  . FLI C 3   . ?   5.341 47.152  27.73 1  25.191 ? C8  FLI 404  A 1 ? 
HETATM 3135 C  C9  . FLI C 3   . ?   5.484 47.999 28.969 1  25.839 ? C9  FLI 404  A 1 ? 
HETATM 3136 C  C10 . FLI C 3   . ?   6.251 49.307 28.758 1  25.379 ? C10 FLI 404  A 1 ? 
HETATM 3137 C  C11 . FLI C 3   . ?   6.141 50.285 29.941 1   26.37 ? C11 FLI 404  A 1 ? 
HETATM 3138 C  C12 . FLI C 3   . ?   6.918 51.582 29.745 1    27.5 ? C12 FLI 404  A 1 ? 
HETATM 3139 C  C13 . FLI C 3   . ?   6.238 52.656 28.903 1  27.546 ? C13 FLI 404  A 1 ? 
HETATM 3140 C  C14 . FLI C 3   . ?   7.108 53.892 28.671 1  28.127 ? C14 FLI 404  A 1 ? 
HETATM 3141 C  C15 . FLI C 3   . ?    8.28   53.7 27.708 1   28.43 ? C15 FLI 404  A 1 ? 
HETATM 3142 C  C16 . FLI C 3   . ?   7.884 53.121 26.364 1  30.032 ? C16 FLI 404  A 1 ? 
HETATM 3143 C  C17 . FLI C 3   . ?   7.833 51.779 26.222 1  29.384 ? C17 FLI 404  A 1 ? 
HETATM 3144 C  C18 . FLI C 3   . ?   7.278 50.997 25.155 1  29.247 ? C18 FLI 404  A 1 ? 
HETATM 3145 C  C19 . FLI C 3   . ?   7.313 49.635 24.952 1  28.876 ? C19 FLI 404  A 1 ? 
HETATM 3146 C  C1P . FLI C 3   . ?   0.734  40.68 23.664 1  27.077 ? C1P FLI 404  A 1 ? 
HETATM 3147 C  C20 . FLI C 3   . ?   6.609 48.937 23.991 1  27.469 ? C20 FLI 404  A 1 ? 
HETATM 3148 C  C21 . FLI C 3   . ?   6.652 47.587 23.746 1  27.324 ? C21 FLI 404  A 1 ? 
HETATM 3149 C  C22 . FLI C 3   . ?   5.906 46.931 22.794 1  27.527 ? C22 FLI 404  A 1 ? 
HETATM 3150 C  C23 . FLI C 3   . ?    6.02 45.632 22.388 1  26.428 ? C23 FLI 404  A 1 ? 
HETATM 3151 C  C24 . FLI C 3   . ?    5.23 45.061 21.326 1  27.129 ? C24 FLI 404  A 1 ? 
HETATM 3152 C  C25 . FLI C 3   . ?   5.134 43.782 21.008 1  25.924 ? C25 FLI 404  A 1 ? 
HETATM 3153 C  C26 . FLI C 3   . ?   4.231  43.28 19.929 1  25.294 ? C26 FLI 404  A 1 ? 
HETATM 3154 C  C27 . FLI C 3   . ?   2.793 43.194 20.394 1  25.697 ? C27 FLI 404  A 1 ? 
HETATM 3155 C  C28 . FLI C 3   . ?   1.878 42.554 19.378 1  25.119 ? C28 FLI 404  A 1 ? 
HETATM 3156 C  C29 . FLI C 3   . ?   7.549 54.121 25.278 1  28.706 ? C29 FLI 404  A 1 ? 
HETATM 3157 C  C2P . FLI C 3   . ?   0.498 40.038   22.3 1  28.092 ? C2P FLI 404  A 1 ? 
HETATM 3158 O  O30 . FLI C 3   . ?    2.78 42.361 21.599 1  24.958 ? O30 FLI 404  A 1 ? 
HETATM 3159 C  C3P . FLI C 3   . ?   -0.73 39.201 22.138 1  30.003 ? C3P FLI 404  A 1 ? 
HETATM 3160 C  C4P . FLI C 3   . ?  -0.731 38.442 20.849 1  30.758 ? C4P FLI 404  A 1 ? 
HETATM 3161 C  C5P . FLI C 3   . ?  -1.991 37.684  20.51 1  31.282 ? C5P FLI 404  A 1 ? 
HETATM 3162 C  C6P . FLI C 3   . ?  -3.004 38.507 19.754 1  30.035 ? C6P FLI 404  A 1 ? 
HETATM 3163 O  OA3 . FLI C 3   . ?   2.113  41.49 26.085 1  25.081 ? OA3 FLI 404  A 1 ? 
HETATM 3164 O  OA5 . FLI C 3   . ?    3.42 43.144 27.553 1  23.854 ? OA5 FLI 404  A 1 ? 
HETATM 3165 O  OA7 . FLI C 3   . ?   5.216 45.022 28.836 1  23.412 ? OA7 FLI 404  A 1 ? 
HETATM 3166 O  OA9 . FLI C 3   . ?   6.151 47.232  29.95 1   26.81 ? OA9 FLI 404  A 1 ? 
HETATM 3167 O  OB1 . FLI C 3   . ?   6.591 49.619 31.135 1  26.355 ? OB1 FLI 404  A 1 ? 
HETATM 3168 O  OB3 . FLI C 3   . ?   5.029 53.034  29.56 1  26.859 ? OB3 FLI 404  A 1 ? 
HETATM 3169 O  OB5 . FLI C 3   . ?   8.944 54.973 27.586 1  28.488 ? OB5 FLI 404  A 1 ? 
HETATM 3170 S  S   . SO4 D 4   . ?  -3.022 21.636 31.381 1    44.2 ? S   SO4 405  A 1 ? 
HETATM 3171 O  O1  . SO4 D 4   . ?  -3.278 20.862 30.217 1  46.433 ? O1  SO4 405  A 1 ? 
HETATM 3172 O  O2  . SO4 D 4   . ?  -4.269 22.192 31.829 1  44.443 ? O2  SO4 405  A 1 ? 
HETATM 3173 O  O3  . SO4 D 4   . ?  -2.446  20.81 32.391 1  43.954 ? O3  SO4 405  A 1 ? 
HETATM 3174 O  O4  . SO4 D 4   . ?  -2.118 22.715 31.088 1  43.907 ? O4  SO4 405  A 1 ? 
HETATM 3175 S  S   . SO4 E 4   . ?   7.385 15.863   8.01 1  43.013 ? S   SO4 406  A 1 ? 
HETATM 3176 O  O1  . SO4 E 4   . ?   7.684 17.123  7.395 1   43.43 ? O1  SO4 406  A 1 ? 
HETATM 3177 O  O2  . SO4 E 4   . ?   6.077 15.444  7.548 1  43.956 ? O2  SO4 406  A 1 ? 
HETATM 3178 O  O3  . SO4 E 4   . ?   8.377 14.867   7.66 1  38.713 ? O3  SO4 406  A 1 ? 
HETATM 3179 O  O4  . SO4 E 4   . ?   7.394 15.995  9.442 1  42.296 ? O4  SO4 406  A 1 ? 
HETATM 3180 S  S   . SO4 F 4   . ?  19.745 49.516 -1.187 1  53.354 ? S   SO4 407  A 1 ? 
HETATM 3181 O  O1  . SO4 F 4   . ?  20.702 48.714 -1.928 1  49.763 ? O1  SO4 407  A 1 ? 
HETATM 3182 O  O2  . SO4 F 4   . ?  18.427 49.305 -1.747 1  53.008 ? O2  SO4 407  A 1 ? 
HETATM 3183 O  O3  . SO4 F 4   . ?  19.743 49.141   0.21 1  48.526 ? O3  SO4 407  A 1 ? 
HETATM 3184 O  O4  . SO4 F 4   . ?    20.1 50.911 -1.309 1  55.725 ? O4  SO4 407  A 1 ? 
HETATM 3185 C  C1  . GOL H 6   . ?  16.006 38.997  23.13 1  33.999 ? C1  GOL 1    H 1 ? 
HETATM 3186 O  O1  . GOL H 6   . ?  16.712 39.485 21.983 1  39.635 ? O1  GOL 1    H 1 ? 
HETATM 3187 C  C2  . GOL H 6   . ?  15.059 37.848 22.785 1  31.912 ? C2  GOL 1    H 1 ? 
HETATM 3188 O  O2  . GOL H 6   . ?  14.387 37.418 23.982 1  26.929 ? O2  GOL 1    H 1 ? 
HETATM 3189 C  C3  . GOL H 6   . ?  14.069  38.23 21.693 1  31.261 ? C3  GOL 1    H 1 ? 
HETATM 3190 O  O3  . GOL H 6   . ?  13.121 37.205 21.382 1   28.78 ? O3  GOL 1    H 1 ? 
HETATM 3191 C  C1  . GOL I 6   . ?  32.722 13.971  7.837 1  30.795 ? C1  GOL 1    I 1 ? 
HETATM 3192 O  O1  . GOL I 6   . ?  34.024 14.528  7.933 1  32.512 ? O1  GOL 1    I 1 ? 
HETATM 3193 C  C2  . GOL I 6   . ?  31.865 14.841  6.945 1  31.163 ? C2  GOL 1    I 1 ? 
HETATM 3194 O  O2  . GOL I 6   . ?  30.755 14.067  6.529 1  34.838 ? O2  GOL 1    I 1 ? 
HETATM 3195 C  C3  . GOL I 6   . ?  31.413  16.14  7.586 1  27.601 ? C3  GOL 1    I 1 ? 
HETATM 3196 O  O3  . GOL I 6   . ?  30.515 16.882  6.753 1  21.702 ? O3  GOL 1    I 1 ? 
HETATM 3197 C  C1  . GOL J 6   . ?  30.595 26.831  0.004 1   37.52 ? C1  GOL 1    J 1 ? 
HETATM 3198 O  O1  . GOL J 6   . ?   30.54   27.3 -1.333 1  30.655 ? O1  GOL 1    J 1 ? 
HETATM 3199 C  C2  . GOL J 6   . ?  29.219 26.818   0.64 1    36.7 ? C2  GOL 1    J 1 ? 
HETATM 3200 O  O2  . GOL J 6   . ?  28.845 25.486  0.953 1  34.109 ? O2  GOL 1    J 1 ? 
HETATM 3201 C  C3  . GOL J 6   . ?  29.148 27.723   1.86 1  38.989 ? C3  GOL 1    J 1 ? 
HETATM 3202 O  O3  . GOL J 6   . ?  27.822 27.958  2.322 1  30.927 ? O3  GOL 1    J 1 ? 
HETATM 3203 C  C1  . GOL K 6   . ?   38.26 17.947  9.636 1  44.947 ? C1  GOL 1    K 1 ? 
HETATM 3204 O  O1  . GOL K 6   . ?   38.95 17.145  8.679 1  45.828 ? O1  GOL 1    K 1 ? 
HETATM 3205 C  C2  . GOL K 6   . ?  37.004 17.258 10.108 1  48.868 ? C2  GOL 1    K 1 ? 
HETATM 3206 O  O2  . GOL K 6   . ?  36.247 18.088 10.993 1  47.267 ? O2  GOL 1    K 1 ? 
HETATM 3207 C  C3  . GOL K 6   . ?  36.108  16.82  8.974 1  46.758 ? C3  GOL 1    K 1 ? 
HETATM 3208 O  O3  . GOL K 6   . ?   34.95 16.188  9.497 1  46.344 ? O3  GOL 1    K 1 ? 
HETATM 3209 C  C1  . GOL L 6   . ?  12.443 58.391  34.85 1  43.372 ? C1  GOL 1    L 1 ? 
HETATM 3210 O  O1  . GOL L 6   . ?  12.767 58.154 33.474 1  38.015 ? O1  GOL 1    L 1 ? 
HETATM 3211 C  C2  . GOL L 6   . ?  10.963 58.198 35.151 1  45.649 ? C2  GOL 1    L 1 ? 
HETATM 3212 O  O2  . GOL L 6   . ?  10.548 58.836 36.372 1  44.762 ? O2  GOL 1    L 1 ? 
HETATM 3213 C  C3  . GOL L 6   . ?  10.077 58.682  34.03 1  45.646 ? C3  GOL 1    L 1 ? 
HETATM 3214 O  O3  . GOL L 6   . ?   8.718 58.361 34.302 1  51.627 ? O3  GOL 1    L 1 ? 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
1    N 0.673041 0.677089 0.725354   -0.0939122     0.280046   -0.0433848 
2    C 0.665629 0.669024  0.71393    -0.086976     0.262054   -0.0424986 
3    C  0.70528 0.683306 0.722189   -0.0801031     0.258511   -0.0335525 
4    C 0.724833 0.701753 0.727147    -0.068467     0.250659   -0.0320181 
5    O 0.723407 0.699734 0.718391   -0.0657475      0.25955   -0.0318164 
6    O 0.742842 0.719753 0.741465    -0.062291      0.23571   -0.0313986 
7    C 0.621173 0.632182  0.68741   -0.0938372     0.255185   -0.0461687 
8    O 0.617565 0.618679 0.683664    -0.102383      0.26271   -0.0446645 
9    N 0.579103 0.606649 0.659374   -0.0895849     0.240756   -0.0509018 
10   C 0.534146 0.569412   0.6295   -0.0941253     0.231755    -0.054478 
11   C 0.506166 0.562343 0.617533   -0.0882596     0.217901   -0.0601632 
12   C 0.520639 0.534422 0.596228   -0.0924359     0.225995   -0.0477349 
13   O 0.522382 0.522999 0.576921   -0.0840606     0.221327   -0.0419281 
14   N 0.496396 0.506722 0.578564    -0.100038     0.225774   -0.0487448 
15   C 0.497624 0.486919 0.561116   -0.0984969     0.221716   -0.0423352 
16   C 0.495853 0.488608 0.574741    -0.108201     0.221781    -0.046691 
17   C 0.499869 0.510052 0.601521    -0.117198     0.231881   -0.0539774 
18   C 0.496153  0.52332  0.60439    -0.110194     0.229001   -0.0566245 
19   C 0.472082 0.460626 0.526218    -0.088176     0.205956   -0.0398639 
20   O 0.445824 0.451926  0.51385    -0.084901     0.195747   -0.0447031 
21   N  0.47633 0.444479 0.506946   -0.0830453     0.204218   -0.0323281 
22   C 0.463768 0.430483 0.485313   -0.0740048     0.189946    -0.029868 
23   C 0.490776 0.434719 0.484868    -0.068334     0.191108    -0.021322 
24   O 0.505927 0.434302 0.493542   -0.0735558     0.196917    -0.017969 
25   C 0.510327 0.446967 0.490092   -0.0652188     0.200472   -0.0181583 
26   C 0.445228 0.419905 0.480184   -0.0764224     0.179753   -0.0333729 
27   O 0.429872 0.400678 0.470578   -0.0838964     0.183926    -0.034556 
28   N 0.417984  0.40295 0.457174   -0.0701371     0.166591   -0.0350862 
29   C 0.404469 0.395792 0.453631   -0.0712987     0.156545   -0.0377569 
30   C 0.380031 0.383087 0.433149   -0.0636325     0.143154   -0.0394365 
31   C 0.376197 0.383371  0.43589   -0.0637352     0.132421   -0.0410445 
32   C 0.369375 0.390811 0.438012   -0.0630674     0.143957   -0.0451538 
33   C 0.420421 0.392875 0.454314   -0.0713598     0.156023     -0.03217 
34   O 0.424269 0.383223 0.439043    -0.065198     0.154973   -0.0260113 
35   N 0.419375 0.390447 0.460933   -0.0778713     0.156534   -0.0343823 
36   C  0.43476 0.388348 0.462342   -0.0769995     0.155161   -0.0294044 
37   C 0.425736 0.382072 0.467026   -0.0859924     0.157217   -0.0344159 
38   C   0.4225 0.395098 0.483076    -0.092985     0.163498   -0.0412515 
39   C 0.409682 0.395772 0.473362   -0.0862496     0.158694   -0.0420712 
40   C 0.429932 0.382935 0.449524   -0.0684485     0.142262   -0.0264943 
41   O 0.409126 0.376726 0.440033   -0.0664095     0.132657   -0.0303535 
42   N  0.46809  0.40399 0.467972   -0.0634274     0.142467   -0.0196039 
43   C  0.49394 0.428241 0.485026   -0.0554272       0.1314   -0.0163694 
44   C 0.543048 0.471699 0.518531    -0.048113     0.131103    -0.011732 
45   C 0.592429 0.534782 0.575642   -0.0466454      0.12992   -0.0153206 
46   C 0.647435 0.581505 0.613609   -0.0409773      0.13312   -0.0111278 
47   C 0.692492  0.61847  0.64329   -0.0333988     0.124922  -0.00632297 
48   N  0.74736 0.664217 0.680149   -0.0280549     0.128195  -0.00237506 
49   C 0.476341 0.396917 0.457813   -0.0544872      0.12981   -0.0125778 
50   O 0.464595 0.388312 0.446109   -0.0503568     0.120046   -0.0121906 
51   N 0.473359 0.378084  0.44588   -0.0579371     0.139849  -0.00955903 
52   C 0.487768 0.376827 0.448588   -0.0559695     0.139538  -0.00524336 
53   C 0.504694 0.374056  0.45161   -0.0581493     0.152103 -0.000612848 
54   C 0.464509 0.358321 0.438031    -0.060924     0.135797  -0.00989466 
55   O 0.456075 0.356593 0.443793   -0.0691794     0.140136   -0.0155226 
56   N  0.44995 0.340589 0.418054   -0.0556768     0.127764  -0.00769478 
57   C  0.43673 0.330535 0.413846   -0.0587711     0.123302   -0.0114958 
58   C 0.399057 0.306024 0.381281   -0.0532693     0.110446   -0.0126975 
59   C 0.380336 0.305352 0.374062   -0.0529991     0.105543   -0.0163952 
60   C 0.352647 0.286342  0.34682   -0.0465116    0.0941004   -0.0157325 
61   N 0.325395 0.275451 0.331081    -0.046416    0.0893767   -0.0196708 
62   C 0.308381 0.270426 0.323809   -0.0456646    0.0811069   -0.0230288 
63   N 0.317312 0.280598 0.338267   -0.0484405    0.0786932   -0.0257258 
64   N 0.290014 0.261987 0.308574   -0.0417553    0.0752115   -0.0235887 
65   C 0.466061 0.339747 0.429068   -0.0571863      0.12742  -0.00683525 
66   O 0.477494 0.343466 0.426851   -0.0490674     0.123846  -0.00114364 
67   N  0.47859 0.343956 0.445094   -0.0648484     0.134963  -0.00949979 
68   C 0.519108 0.364378 0.472824   -0.0636296     0.139168  -0.00567658 
69   C 0.535882 0.369848 0.492379   -0.0735992     0.150883  -0.00841027 
70   O 0.530279 0.374931 0.503393   -0.0808928     0.147909   -0.0164138 
71   C 0.509826 0.359043 0.466347   -0.0603075     0.129726  -0.00728932 
72   O 0.532121 0.367638 0.476011   -0.0548149     0.129354  -0.00275385 
73   N 0.505062 0.372868 0.477832   -0.0633715     0.122477   -0.0137398 
74   C 0.490341 0.364574 0.466491   -0.0600076     0.112975   -0.0155267 
75   C 0.517568 0.397269 0.506746    -0.067972     0.112698   -0.0232122 
76   S 0.622471 0.482291 0.608127   -0.0767863     0.125374   -0.0248909 
77   C 0.440921 0.332159 0.421878   -0.0544725     0.103255   -0.0153098 
78   O  0.41004 0.315883 0.402666   -0.0575231     0.101491   -0.0193028 
79   N 0.419028 0.308697 0.391023   -0.0459814    0.0969619   -0.0105776 
80   C 0.389743 0.292686 0.364119   -0.0409144    0.0892779  -0.00959554 
81   C 0.394843 0.290782 0.356498   -0.0323413     0.085404  -0.00365389 
82   C 0.407295 0.290932 0.364343   -0.0327184    0.0879258  -0.00328266 
83   C 0.420275 0.295596 0.379993   -0.0410015    0.0973121   -0.0062607 
84   C 0.360294 0.280441 0.348933   -0.0427546     0.081546   -0.0150497 
85   O 0.353328  0.28485 0.346112   -0.0402573    0.0764394   -0.0153456 
86   N 0.364744 0.286115 0.360183   -0.0470203    0.0808663   -0.0194882 
87   C 0.350155 0.286944 0.357764   -0.0483697    0.0735731   -0.0246254 
88   C 0.339375 0.273526 0.345966   -0.0475925    0.0698798   -0.0259809 
89   C 0.339719 0.267743 0.335658   -0.0400509    0.0664146   -0.0204165 
90   C 0.321135 0.257983 0.316874   -0.0344998    0.0596406   -0.0178788 
91   C 0.348262 0.261786 0.334741   -0.0384683    0.0700584    -0.017939 
92   C 0.325728 0.258686 0.313379   -0.0280595    0.0564072   -0.0134031 
93   C 0.349372 0.259009 0.327333   -0.0311579    0.0667445   -0.0131876 
94   C 0.334208 0.254188 0.313234   -0.0261723    0.0599503   -0.0110272 
95   C  0.37262  0.31935 0.393788   -0.0557028    0.0759745   -0.0311289 
96   O 0.368977 0.328912 0.400501   -0.0568218    0.0700423   -0.0358512 
97   N 0.382645 0.323266 0.403551   -0.0603942    0.0847863   -0.0312735 
98   C  0.37939 0.330261 0.413991   -0.0675464    0.0880887   -0.0374214 
99   C 0.396936 0.336834 0.432117    -0.075514    0.0970235    -0.040078 
100  C 0.416204 0.354743 0.454254    -0.078256     0.093892   -0.0443125 
101  C 0.450661 0.373844 0.486204   -0.0858569     0.103664   -0.0461237 
102  C 0.399239 0.357138 0.453109   -0.0811692    0.0872237   -0.0518166 
103  C 0.364432 0.320328 0.400462   -0.0667957    0.0914154   -0.0359837 
104  O 0.350617 0.298385 0.374879   -0.0617752    0.0931316   -0.0300049 
105  N 0.361768 0.331818 0.412364   -0.0715128    0.0923119   -0.0417864 
106  C 0.358667 0.333494 0.411436   -0.0713817    0.0968235   -0.0411242 
107  C 0.361795 0.353961 0.433564   -0.0772886    0.0968357   -0.0491073 
108  C 0.358256 0.357843 0.436523   -0.0773465    0.0881556   -0.0532191 
109  C 0.355986  0.33907 0.421511   -0.0764281    0.0884702   -0.0494373 
110  C 0.369364 0.328508  0.41186   -0.0739111     0.108134   -0.0370835 
111  O 0.373942 0.319788 0.411112    -0.077761     0.113612   -0.0362764 
112  N 0.387178 0.346521 0.425783   -0.0716739     0.112274   -0.0344429 
113  C 0.410199 0.355541 0.439646   -0.0746231     0.124031   -0.0310583 
114  C 0.410271 0.362231  0.43894   -0.0712149     0.125667   -0.0299017 
115  C  0.38268 0.344988  0.41211   -0.0635383     0.113442   -0.0296058 
116  C 0.375163  0.34706 0.416944   -0.0660481     0.106207   -0.0345781 
117  C 0.433951 0.378402 0.473587   -0.0850068     0.132978   -0.0359959 
118  O 0.412699 0.373453 0.470135   -0.0901507     0.131631   -0.0430975 
119  N 0.452825 0.377831 0.480812   -0.0878387      0.14185   -0.0322581 
120  C  0.47971 0.399763 0.515147   -0.0980094     0.149985   -0.0366288 
121  C 0.503138  0.39727 0.520173   -0.0985216      0.15991   -0.0301472 
122  C 0.506583  0.38793 0.509436   -0.0913657     0.153513    -0.025291 
123  O  0.48771 0.369888 0.481022   -0.0818689     0.146475   -0.0203884 
124  O 0.523892 0.395586 0.526238   -0.0953698     0.155265   -0.0269873 
125  C 0.479745 0.414046 0.532615    -0.106232     0.156448   -0.0430456 
126  O 0.478343 0.422361 0.547158    -0.114086      0.15646   -0.0505329 
127  N 0.479708 0.415822 0.529462    -0.104083     0.161654    -0.040351 
128  C 0.482249 0.430821  0.54713    -0.111257      0.16951   -0.0455901 
129  C 0.456949 0.432349 0.543146     -0.11154     0.161339   -0.0533067 
130  O 0.425373 0.413749 0.527285     -0.11805     0.167297   -0.0589288 
131  N 0.427795 0.411409  0.51421    -0.104117     0.148073   -0.0533559 
132  C 0.412322 0.419665 0.516637    -0.102851     0.139319   -0.0599055 
133  C 0.409141 0.418508 0.506929   -0.0934513     0.125807   -0.0572907 
134  C  0.42114 0.425196 0.505318   -0.0847851     0.124766   -0.0507855 
135  C 0.398641 0.429639 0.513517   -0.0924524     0.115582   -0.0641459 
136  C 0.410513 0.430672  0.50469   -0.0824171     0.125053   -0.0536469 
137  C 0.400832 0.421678 0.525076    -0.111886     0.139416   -0.0689597 
138  O  0.39445 0.434957 0.536134    -0.114124     0.139082    -0.075114 
139  N 0.397381 0.407841 0.519047    -0.116915     0.139936   -0.0700733 
140  C 0.400809 0.423767 0.540158    -0.125007     0.138077   -0.0791656 
141  C 0.420378 0.426112 0.551188    -0.129132     0.139246    -0.078697 
142  C 0.408341 0.442515 0.564773    -0.134654     0.147978   -0.0854491 
143  O 0.400659 0.457031 0.576963    -0.137641     0.143689   -0.0936677 
144  N 0.413757 0.432643 0.562302    -0.139398     0.161431   -0.0815562 
145  C 0.427546 0.455298 0.591484    -0.149315     0.172682   -0.0869875 
146  C 0.456241 0.459991 0.606171    -0.154718     0.188029   -0.0812547 
147  C 0.478104 0.461454 0.619107    -0.160433     0.191287   -0.0805212 
148  O 0.470153 0.459328 0.617956    -0.161776      0.18233   -0.0857221 
149  O 0.515004 0.475926 0.641235    -0.162972     0.202624   -0.0746446 
150  C 0.402982 0.451585 0.579066    -0.145748     0.172295    -0.089171 
151  O  0.39796 0.464568 0.594537    -0.152918      0.17645    -0.096846 
152  N 0.389232 0.435563 0.552976    -0.134691      0.16749   -0.0827392 
153  C 0.378251 0.443457 0.552283    -0.130004     0.165978   -0.0848372 
154  C  0.38156 0.437123 0.536879    -0.118769     0.163279   -0.0765121 
155  C 0.405827 0.438247 0.542115    -0.120178     0.175794   -0.0689953 
156  C 0.372151  0.44736 0.538349    -0.113223     0.160373   -0.0793687 
157  C 0.399773 0.418932 0.513734     -0.10895     0.172035   -0.0602541 
158  C 0.359199 0.449186 0.552652    -0.128369     0.153942   -0.0928328 
159  O 0.348787 0.459723 0.562034    -0.131516     0.155741   -0.0997251 
160  N 0.354012 0.441495 0.541124    -0.122875     0.141791   -0.0916563 
161  C 0.339788  0.44812 0.541732    -0.120115       0.1295   -0.0982658 
162  C 0.336847 0.435737 0.526337    -0.114523     0.118291   -0.0950657 
163  C 0.330149 0.448418  0.53115     -0.10982     0.105023     -0.10051 
164  C 0.326959 0.435148 0.515196    -0.104922    0.0954286   -0.0972177 
165  N 0.336611 0.431974 0.521011    -0.112835    0.0992778   -0.0984911 
166  C  0.35247 0.425804 0.518614    -0.111668     0.101416   -0.0917961 
167  N 0.350341  0.41456 0.501229    -0.102374    0.0963471   -0.0842915 
168  N 0.364218 0.424402 0.527565    -0.119951     0.108775   -0.0928634 
169  C  0.33425 0.458596 0.558094    -0.130676     0.132092     -0.10837 
170  O 0.313947 0.462095 0.556524        -0.13     0.127764    -0.115251 
171  N 0.345222 0.455928  0.56629    -0.140277     0.139371     -0.10925 
172  C 0.355505 0.478475  0.59625    -0.152003     0.143027    -0.119053 
173  C 0.376084 0.476701 0.607157    -0.160934      0.15073    -0.117834 
174  C 0.357451 0.496896 0.616603    -0.158076     0.152707    -0.124133 
175  O 0.354582 0.517938 0.636284    -0.162469     0.149561    -0.133766 
176  N 0.365406 0.492556 0.614959    -0.158209     0.164544    -0.117859 
177  C 0.370696 0.511103  0.63596    -0.164326     0.175802    -0.121911 
178  C  0.38822 0.505126 0.637343    -0.167972     0.191303    -0.114341 
179  C 0.354988 0.517663  0.63091    -0.155572     0.170792    -0.123638 
180  O 0.351481 0.535926 0.649172    -0.160313     0.174952    -0.131056 
181  N 0.354591  0.51156 0.615307    -0.142862     0.162406    -0.116891 
182  C 0.342112 0.515016 0.608735    -0.133795     0.159196    -0.117112 
183  C 0.360083 0.524384 0.619419    -0.134349     0.172939    -0.112452 
184  C 0.328679 0.496962 0.581163    -0.120822     0.145778    -0.111818 
185  O 0.325951 0.477545 0.558886    -0.114311      0.14727    -0.103629 
186  N 0.314204 0.496869 0.575576    -0.116584     0.132281     -0.11632 
187  C 0.301122 0.477082 0.548019    -0.105256     0.120227    -0.110949 
188  C    0.292 0.484022  0.55138    -0.104457     0.107918    -0.117569 
189  C 0.297138 0.512941 0.582381    -0.112109     0.112032    -0.127641 
190  C 0.310887 0.516307 0.595689    -0.122429      0.12805    -0.126678 
191  C 0.293875 0.474168  0.53704   -0.0948757     0.118521    -0.107725 
192  O 0.282346 0.454408 0.511685   -0.0857749     0.110218    -0.102466 
193  N 0.299369 0.493327 0.555902   -0.0965838     0.126482    -0.111498 
194  C  0.29947 0.493756 0.550566   -0.0883705     0.128867    -0.108171 
195  C 0.295777 0.515635 0.565497   -0.0819591     0.122667    -0.114532 
196  C 0.293118 0.511939 0.556363   -0.0731588     0.125583    -0.111296 
197  C 0.293465 0.520373 0.565182   -0.0758767     0.107403    -0.116215 
198  C 0.307002 0.494232 0.555964   -0.0946715     0.144704    -0.106586 
199  O 0.301878 0.503483 0.569008    -0.102243     0.152704     -0.11279 
200  N 0.305787 0.471306  0.53249   -0.0914125      0.14923   -0.0983919 
201  C 0.325782 0.480258 0.545815   -0.0970831      0.16439   -0.0955551 
202  C 0.333103 0.471263 0.546482    -0.107076     0.170614   -0.0935265 
203  O 0.340944 0.475677 0.556636    -0.115069     0.186437   -0.0937714 
204  C 0.340288  0.45287 0.527474    -0.102547     0.166516   -0.0846361 
205  C 0.336929 0.475979 0.535602   -0.0887136     0.166396   -0.0881364 
206  O 0.332652 0.464717 0.518787   -0.0800741     0.156168   -0.0842065 
207  N 0.341454 0.475683 0.536385   -0.0916397     0.179979    -0.086633 
208  C 0.353226 0.471542 0.526558   -0.0847791     0.183451    -0.079869 
209  C 0.365265 0.487509 0.542104   -0.0874245      0.19825   -0.0810964 
210  C 0.357458 0.506134 0.557473   -0.0852331     0.197626   -0.0888475 
211  C 0.346828 0.500854 0.543422   -0.0729373     0.186136   -0.0887439 
212  N 0.354442 0.493413 0.529969   -0.0662562     0.190194   -0.0832317 
213  C 0.349197 0.487283 0.516711   -0.0558306     0.181974   -0.0821027 
214  N 0.343869 0.492596 0.520211   -0.0503372     0.168922   -0.0848868 
215  N 0.359372 0.484337 0.508329   -0.0507757     0.186932   -0.0779792 
216  C 0.363918  0.45614 0.513718   -0.0858914     0.184722   -0.0719775 
217  O 0.360847 0.444753 0.510418   -0.0944585     0.191244   -0.0713385 
218  N 0.367161 0.446502 0.497193   -0.0770021     0.178528   -0.0661697 
219  C 0.383347 0.438963 0.490477   -0.0765537     0.179289   -0.0585725 
220  C 0.384596 0.436948 0.491051   -0.0762896      0.16768   -0.0577893 
221  C 0.397921  0.44234 0.484703   -0.0674785     0.177957   -0.0533242 
222  O 0.389701 0.444339 0.480347    -0.061206     0.174222    -0.055782 
223  N 0.414313 0.437447 0.479313   -0.0669541      0.18175   -0.0463633 
224  C 0.415568 0.426479 0.459195   -0.0586489      0.17984   -0.0412283 
225  C  0.44388 0.438545 0.469901     -0.06002     0.193041   -0.0362463 
226  O  0.44577 0.450349 0.483681   -0.0647059     0.205092   -0.0402063 
227  C 0.452473 0.435198 0.455629   -0.0508825      0.18984   -0.0314645 
228  C 0.413484   0.4157 0.446577   -0.0541069     0.167405   -0.0375264 
229  O 0.417642 0.411284 0.447813   -0.0577683     0.166545   -0.0351068 
230  N 0.402341 0.407369 0.430598   -0.0461594     0.157988    -0.037535 
231  C 0.391477 0.391594  0.41249   -0.0415781     0.145605   -0.0349776 
232  C 0.369815 0.384459 0.402614   -0.0369654     0.135231   -0.0394031 
233  C 0.354282 0.385559  0.40976   -0.0413062     0.133163   -0.0450894 
234  C 0.364152 0.408161 0.434728   -0.0449833     0.140985   -0.0499854 
235  C 0.336682 0.371103 0.398251   -0.0418836     0.123778   -0.0456605 
236  C 0.347543 0.408252 0.439491   -0.0487818     0.138404   -0.0557249 
237  C  0.32983  0.37959 0.411138   -0.0455053     0.121398   -0.0510992 
238  C 0.334164 0.397397 0.430871   -0.0489702     0.128471   -0.0562651 
239  C 0.402941 0.386163 0.399775   -0.0360225     0.145015   -0.0288668 
240  O 0.406911 0.382215 0.391929   -0.0351896      0.15385   -0.0266887 
241  N 0.402185 0.380457 0.391895   -0.0322183     0.134503   -0.0262585 
242  C 0.411807 0.375824  0.37992   -0.0267381     0.132059   -0.0209006 
243  C 0.397241 0.361539 0.364244   -0.0232195      0.11912   -0.0198244 
244  O 0.388037 0.351248 0.361468    -0.027647     0.118437   -0.0189931 
245  C 0.403078 0.355641 0.349774   -0.0171101     0.114896    -0.015235 
246  C 0.411806 0.373615 0.368721    -0.021612     0.134543   -0.0210011 
247  O   0.4305 0.379438 0.368778   -0.0189906     0.138767   -0.0167212 
248  N 0.401257 0.375148 0.368819   -0.0198366     0.132249   -0.0259674 
249  C 0.413188 0.385345 0.370791   -0.0148092      0.13443   -0.0269132 
250  C  0.40283 0.388135 0.373545   -0.0119593     0.127987   -0.0323864 
251  O 0.410398 0.409194 0.400926   -0.0160725     0.132953   -0.0367375 
252  C  0.42005 0.389416 0.373696   -0.0169899     0.148326    -0.026784 
253  O 0.441048 0.406099 0.382526   -0.0126875     0.151586   -0.0267785 
254  N 0.415134 0.387802 0.380103   -0.0239681     0.156683   -0.0272965 
255  C 0.430506 0.401329 0.394058   -0.0273761     0.171046   -0.0273205 
256  C 0.432216 0.420616 0.415619   -0.0290068      0.17501   -0.0339061 
257  O 0.456609  0.44634 0.441604   -0.0318785     0.187244   -0.0348588 
258  N 0.418517 0.420218 0.416371    -0.026587     0.164769   -0.0383194 
259  C 0.403846 0.423446 0.421709    -0.027149     0.167091   -0.0447061 
260  C 0.398307 0.426658 0.422494   -0.0207151     0.155025   -0.0480871 
261  C 0.405842 0.425388 0.412653   -0.0131137     0.151783   -0.0469626 
262  N 0.410201 0.418797 0.402587  -0.00945892     0.141929   -0.0435339 
263  C 0.407531 0.410836 0.387169  -0.00349594     0.141355   -0.0441601 
264  N 0.419985 0.429578 0.404333  -0.00269727     0.150318     -0.04753 
265  C 0.417674 0.438178 0.419821    -0.008836     0.157135   -0.0492682 
266  C 0.403703 0.433281 0.441058     -0.03539     0.170114   -0.0471359 
267  O 0.379533 0.403889 0.416222   -0.0385625     0.165387    -0.044765 
268  N 0.398401 0.442103  0.45252   -0.0388382     0.178446   -0.0520628 
269  C 0.397123 0.455383 0.474022   -0.0460779     0.179634   -0.0565225 
270  C 0.424862 0.491163 0.512651   -0.0521129     0.194257   -0.0596169 
271  C 0.467005 0.518655 0.545042   -0.0598124     0.205966   -0.0553155 
272  C 0.500203 0.561278 0.591657   -0.0669941     0.221077   -0.0589505 
273  O 0.500746 0.583149 0.617275   -0.0704563     0.220727   -0.0659594 
274  O 0.539293 0.586372 0.615965   -0.0691977     0.233363   -0.0547243 
275  C 0.368639 0.444984 0.463502   -0.0422381     0.168634   -0.0620212 
276  O  0.37153 0.454535 0.467881   -0.0354751     0.166344   -0.0644392 
277  N 0.340123 0.423674  0.44778   -0.0462391     0.162029   -0.0640007 
278  C 0.316686 0.416937 0.440704   -0.0425747     0.151391   -0.0689004 
279  C 0.309452 0.401009 0.420997   -0.0352656     0.138642   -0.0655722 
280  C 0.311537  0.42293 0.453517    -0.050256     0.150305   -0.0727143 
281  O  0.31921 0.424874 0.460961   -0.0584695     0.158619   -0.0717635 
282  N 0.293512 0.420388 0.450535    -0.047503     0.140402   -0.0772118 
283  C 0.294544 0.432242 0.467578   -0.0539814     0.137293   -0.0812841 
284  C 0.284176 0.445361 0.478249   -0.0502625     0.130483   -0.0882294 
285  C 0.287406 0.464144 0.495734   -0.0503376     0.139157   -0.0931676 
286  C 0.287388 0.469825 0.495928   -0.0418573     0.138988   -0.0941639 
287  N 0.295895 0.493989 0.520411   -0.0446635      0.14887   -0.0993368 
288  C 0.295128 0.497816  0.53041   -0.0557811     0.155707    -0.101843 
289  C 0.303274 0.521577 0.557217   -0.0630309     0.166593    -0.107451 
290  C 0.306332 0.524982 0.567992     -0.07463     0.171534    -0.109283 
291  C 0.298658 0.502424 0.549488    -0.078364     0.165707    -0.105664 
292  C 0.291197 0.480771 0.524143   -0.0706063     0.154716    -0.100111 
293  C 0.293339 0.482535 0.518688   -0.0594421     0.149528   -0.0982009 
294  C 0.285044 0.410322 0.447441   -0.0544192     0.128498   -0.0773364 
295  O 0.298189 0.418838 0.451951   -0.0472887     0.118606   -0.0747387 
296  N 0.290763 0.410648 0.454229    -0.063025     0.132708     -0.07714 
297  C 0.289578 0.400091 0.446263   -0.0645111     0.125411    -0.074644 
298  C 0.310574 0.402222 0.454203   -0.0710542     0.134339   -0.0700149 
299  C 0.325818 0.407364 0.463331   -0.0736509     0.128957   -0.0678885 
300  C  0.31811 0.389375 0.439666   -0.0651692     0.118912   -0.0623814 
301  C 0.349485 0.415163 0.478541   -0.0811473     0.139309   -0.0649097 
302  C 0.279977  0.40794  0.45634   -0.0680545     0.119379   -0.0814506 
303  O 0.283573 0.422309 0.475336   -0.0757569     0.125951   -0.0868191 
304  N 0.267386 0.398162 0.442974   -0.0625126     0.106943    -0.081372 
305  C 0.260402  0.40636 0.451757   -0.0647811    0.0998021   -0.0874068 
306  C 0.253052 0.415641 0.454078   -0.0562373    0.0906161   -0.0907557 
307  C 0.247146 0.428311 0.466143   -0.0585051    0.0840305   -0.0979536 
308  C 0.251692  0.42325 0.459213    -0.053138    0.0968641   -0.0925628 
309  C 0.258973 0.393188 0.440928   -0.0666046    0.0938136    -0.084724 
310  O 0.258006  0.38279 0.426916   -0.0601875    0.0864257   -0.0799054 
311  N  0.26401  0.39853 0.452809   -0.0757902    0.0979483   -0.0880804 
312  C 0.271107 0.392852 0.450955   -0.0789853    0.0949451   -0.0859527 
313  C 0.282008 0.388141 0.454774   -0.0871837      0.10685   -0.0835035 
314  O 0.267932   0.3857 0.457337   -0.0955114     0.115584   -0.0897703 
315  C  0.29221 0.381142 0.446354   -0.0829696     0.112561   -0.0754655 
316  C 0.272408 0.406209 0.464581   -0.0820142    0.0874462   -0.0923686 
317  O 0.282173 0.405999 0.465852   -0.0826254     0.083044    -0.090528 
318  N 0.281837 0.437233 0.493888   -0.0839079    0.0862402    -0.100139 
319  C 0.279907 0.448521 0.504562   -0.0871116    0.0791421    -0.107244 
320  C 0.286741 0.460966 0.507941   -0.0770556    0.0657808    -0.106255 
321  O 0.268872 0.444771 0.486163    -0.068477    0.0628868    -0.102906 
322  N  0.28183 0.456696 0.502656   -0.0782041    0.0582833    -0.108768 
323  C 0.280895 0.459535 0.497066   -0.0692106    0.0460765    -0.107625 
324  C 0.276446 0.452529 0.490283   -0.0725269    0.0402346    -0.110395 
325  C 0.270616 0.450356 0.478979   -0.0635237    0.0280316    -0.109301 
326  C   0.2657  0.42897 0.455927   -0.0578385    0.0247959    -0.101479 
327  C 0.273615 0.473632  0.49487   -0.0602598    0.0199367    -0.115926 
328  C 0.261652 0.427501 0.446424   -0.0498515    0.0145512    -0.100168 
329  C 0.265937 0.468125 0.480693   -0.0515417   0.00919149    -0.114437 
330  C 0.260836 0.445449 0.457188   -0.0465309   0.00692065    -0.106393 
331  O 0.252304 0.438927 0.442346   -0.0381915  -0.00287083    -0.104864 
332  C   0.2729 0.473557 0.503505   -0.0630324    0.0402417    -0.112478 
333  O 0.257381   0.4576 0.481852   -0.0535222    0.0352346     -0.10849 
334  N 0.275164 0.495084 0.525232   -0.0684391    0.0410637    -0.121294 
335  C 0.274426 0.517226 0.539772   -0.0624062    0.0352569    -0.126678 
336  C 0.307334 0.570948 0.594775   -0.0708779    0.0366093    -0.137312 
337  C 0.333497 0.623565 0.640379   -0.0657595    0.0330288    -0.143784 
338  C  0.36957 0.682091 0.700259   -0.0749322    0.0348822     -0.15496 
339  O   0.4003 0.706792 0.732712   -0.0864417    0.0401778    -0.157915 
340  O  0.40255 0.738965 0.750584   -0.0705519    0.0310646    -0.161033 
341  C 0.255787 0.499645  0.52127   -0.0566424    0.0401791     -0.12324 
342  O 0.236015 0.488242 0.502818   -0.0467372    0.0336325    -0.122784 
343  N 0.251187 0.484862 0.513627   -0.0624759    0.0519296    -0.120501 
344  C  0.24674 0.481659 0.509766   -0.0582188    0.0579937    -0.118147 
345  C 0.256765 0.485892 0.522023   -0.0677596    0.0719716    -0.118161 
346  C 0.267301  0.51522  0.55476    -0.077276    0.0766836     -0.12738 
347  C 0.277356 0.523681 0.567822   -0.0862544    0.0748725    -0.131338 
348  O 0.289861 0.516741 0.563348   -0.0867467    0.0726431    -0.126086 
349  O 0.297044 0.562373 0.607605   -0.0929088    0.0756465    -0.140256 
350  C 0.240669 0.458331 0.483664   -0.0490825    0.0547142    -0.109442 
351  O 0.237453 0.460014 0.480983   -0.0408912    0.0530139    -0.108456 
352  N 0.244019 0.441825 0.469758   -0.0503825    0.0536572    -0.103488 
353  C 0.237965 0.420632 0.445828   -0.0423499    0.0497062   -0.0958956 
354  C  0.23879 0.400376 0.429402   -0.0455626    0.0507317   -0.0898292 
355  C  0.23434 0.383461 0.408841   -0.0372985    0.0446914   -0.0830886 
356  C 0.249893 0.400128 0.435541   -0.0523851     0.062439   -0.0874695 
357  C 0.239472 0.430804 0.448759   -0.0328953    0.0382447    -0.096646 
358  O 0.220262 0.408799 0.423678   -0.0248284    0.0360556   -0.0934336 
359  N 0.249989 0.452264 0.467385   -0.0337825    0.0311725    -0.101357 
360  C 0.265185 0.475119 0.482773    -0.024405    0.0203197    -0.101836 
361  C 0.292796  0.51212 0.516414   -0.0265215    0.0129877    -0.106736 
362  C 0.324521 0.527035 0.534351   -0.0308742    0.0124131    -0.102849 
363  C 0.354535 0.565159 0.567631   -0.0309256   0.00406067     -0.10721 
364  N 0.378639 0.587797 0.582845   -0.0207464  -0.00541506    -0.103865 
365  C 0.369831 0.587154 0.575337   -0.0177942   -0.0142661    -0.107182 
366  N 0.389227 0.626073 0.610609   -0.0201321   -0.0173111    -0.115718 
367  N  0.37103 0.577185 0.561565   -0.0121628   -0.0202185    -0.101956 
368  C 0.253377 0.479423 0.482941   -0.0175745    0.0194793    -0.105251 
369  O 0.250325 0.473316 0.473051  -0.00805578     0.014524    -0.101902 
370  N 0.250134 0.492617 0.497451   -0.0226461     0.024963    -0.111883 
371  C  0.25091 0.510541 0.511558    -0.016472    0.0251317    -0.115807 
372  C 0.258906 0.539041 0.541572    -0.024214    0.0307846    -0.124331 
373  C 0.247349 0.494803 0.497883   -0.0119154    0.0311146    -0.110297 
374  O 0.236435 0.488439 0.487538  -0.00225296    0.0277616    -0.109895 
375  N 0.251194 0.482508  0.49163    -0.018472    0.0399116    -0.106111 
376  C 0.264971 0.482728 0.492952   -0.0140713     0.044606    -0.100666 
377  C 0.271832 0.472385 0.488432   -0.0219576     0.053888    -0.096379 
378  C 0.283841 0.467077 0.483478   -0.0177136    0.0572946   -0.0900572 
379  C 0.294493 0.486126 0.500304   -0.0121055     0.061601   -0.0922986 
380  C  0.29389 0.461497 0.482713   -0.0255363    0.0659759   -0.0861897 
381  C 0.259208 0.465744 0.472757  -0.00457616     0.035966   -0.0954088 
382  O 0.254775 0.462388 0.467104   0.00357818      0.03485   -0.0947522 
383  N 0.264577 0.459861   0.4671  -0.00570407    0.0302953   -0.0917471 
384  C 0.262929  0.44438 0.449971   0.00158791    0.0240433   -0.0859177 
385  C 0.253623  0.42108  0.42848  -0.00285456    0.0215898   -0.0816761 
386  C 0.253609 0.406166   0.4187  -0.00985767    0.0299244   -0.0778622 
387  C 0.245153 0.385093 0.399219   -0.0134727    0.0274756   -0.0739785 
388  C 0.262677 0.403449 0.416551  -0.00565315    0.0333929   -0.0735273 
389  C 0.282131 0.473387 0.473581     0.011304    0.0150929    -0.087643 
390  O 0.284482 0.465802 0.465188    0.0186452    0.0114629   -0.0834989 
391  N 0.293608 0.504157 0.500683    0.0113231    0.0115638   -0.0939023 
392  C 0.318551   0.5399 0.530225    0.0210197   0.00262131   -0.0958913 
393  C 0.357963 0.595644 0.581691    0.0179613  -0.00279509    -0.101743 
394  C 0.409182 0.663421 0.641467    0.0278227   -0.0119498    -0.105562 
395  C 0.450279 0.717137 0.689928    0.0247875   -0.0188747    -0.110594 
396  N  0.47531 0.750811 0.727333    0.0126938    -0.012826    -0.116106 
397  C 0.507487  0.78145 0.758537   0.00495162   -0.0144141    -0.117963 
398  N 0.514188  0.78583 0.757216   0.00872102   -0.0235467     -0.11707 
399  N 0.519106 0.793724 0.777237  -0.00671197  -0.00634977    -0.121005 
400  C 0.309828 0.542563 0.531149    0.0283033   0.00451518   -0.0988366 
401  O 0.319968 0.557653  0.54174    0.0383701  -0.00229796    -0.099061 
402  N 0.293596 0.530157 0.522182    0.0235735    0.0140592    -0.101029 
403  C 0.298841 0.547844 0.538204    0.0298205    0.0171109    -0.104577 
404  C 0.295668  0.55599 0.549022    0.0213354    0.0273782    -0.109341 
405  C 0.291346 0.566755 0.558105    0.0264525    0.0323118    -0.113797 
406  O 0.283522 0.556447 0.545596     0.037337     0.029055     -0.11223 
407  O  0.27688 0.565017 0.557773    0.0195717    0.0399605    -0.118555 
408  C 0.310271 0.542857 0.535291    0.0367495    0.0191307   -0.0994054 
409  O 0.295648  0.51365 0.510404    0.0320817    0.0261407     -0.09589 
410  N 0.325377 0.560706 0.549913    0.0481792    0.0131545    -0.099363 
411  C 0.344716 0.561942 0.553787    0.0547436    0.0138026   -0.0943523 
412  C 0.353135 0.568479 0.557348    0.0662436   0.00439442   -0.0926782 
413  O 0.340007 0.574813 0.559222    0.0745009   0.00234585   -0.0979854 
414  C 0.358907 0.578473 0.572003    0.0563209    0.0225931   -0.0964719 
415  O 0.380857 0.585673 0.581615    0.0612311    0.0242166   -0.0932275 
416  N 0.359282 0.596612 0.589127    0.0515314    0.0289104     -0.10204 
417  C 0.377912 0.616618 0.610543    0.0521174    0.0385076    -0.103805 
418  C 0.387819 0.652524 0.643726    0.0507139    0.0430181    -0.111295 
419  O  0.40631  0.67729  0.67011    0.0384619    0.0474896    -0.113297 
420  C 0.371847 0.593218 0.591366    0.0433457     0.046824   -0.0998922 
421  O 0.397781 0.617755 0.616719    0.0431243    0.0554592    -0.100778 
422  N 0.345414 0.553475 0.553746    0.0368279    0.0442216   -0.0955302 
423  C 0.331806 0.520958 0.524504    0.0306695    0.0502356   -0.0908611 
424  C 0.333869 0.519636 0.525247    0.0200925    0.0511776   -0.0892914 
425  C 0.337749 0.538935  0.54527    0.0123373    0.0587021   -0.0942557 
426  C 0.339894  0.53723 0.545512   0.00708473    0.0698629   -0.0940878 
427  C 0.347968 0.567802 0.572634    0.0104671    0.0547812   -0.0994033 
428  C 0.344089 0.554939 0.564692 -0.000517183    0.0776168   -0.0986002 
429  C 0.344468 0.578812 0.585001   0.00263296    0.0619644    -0.104535 
430  C 0.349923 0.579542 0.588648  -0.00301374    0.0737372    -0.104025 
431  C  0.31929 0.488626 0.493234    0.0364229    0.0456313   -0.0855729 
432  O 0.303784 0.470594   0.4746     0.041886    0.0369784    -0.084021 
433  N 0.303526 0.458979 0.464993    0.0350323    0.0517806   -0.0830649 
434  C 0.298031 0.434351 0.441708    0.0390103    0.0486813   -0.0787198 
435  C  0.30402 0.436632 0.443551    0.0441744    0.0544634     -0.08033 
436  O 0.303538 0.416837 0.425252    0.0465218     0.052648   -0.0767761 
437  C 0.290884 0.412478 0.421223    0.0314208    0.0497386   -0.0740344 
438  O 0.291731 0.415592 0.424394    0.0240876    0.0556851   -0.0741819 
439  N 0.276184  0.38267 0.392719    0.0333023      0.04415   -0.0699124 
440  C 0.287916 0.380164 0.390912    0.0275394    0.0449481   -0.0655764 
441  C 0.279523 0.362702 0.374947    0.0281803    0.0364638   -0.0617504 
442  C 0.273631  0.36673 0.378743    0.0259716     0.032185   -0.0621963 
443  C 0.284545 0.361153  0.37483    0.0359739    0.0316364   -0.0614673 
444  C 0.308231 0.388503 0.398507    0.0286365    0.0497219   -0.0647089 
445  O 0.321425 0.389903 0.399539    0.0248266     0.050203   -0.0613394 
446  N 0.315293 0.398602  0.40794    0.0343993      0.05276   -0.0679189 
447  C 0.340339 0.412193 0.420309    0.0362083    0.0569166   -0.0677994 
448  C 0.367738 0.438516 0.447667    0.0448006    0.0556393   -0.0705522 
449  C 0.393679  0.45466 0.467297    0.0487225    0.0469899   -0.0684327 
450  C 0.423313 0.480957  0.49528     0.057083    0.0469722   -0.0711388 
451  O 0.487752 0.537427 0.550829    0.0584995    0.0513986    -0.072605 
452  N 0.426913  0.49104 0.507337    0.0633362    0.0425656   -0.0722356 
453  C 0.336073 0.412098 0.417324     0.032205    0.0668271   -0.0691978 
454  O 0.345118 0.427471 0.431268    0.0356076    0.0725851   -0.0727309 
455  N 0.317889 0.389481 0.393925    0.0251821    0.0691287   -0.0661769 
456  C 0.315646 0.391954 0.394688    0.0201503    0.0786828   -0.0669021 
457  C  0.30722 0.383484  0.38789    0.0125501    0.0784741   -0.0640511 
458  C 0.290818 0.379476 0.386822    0.0119017    0.0726053   -0.0657808 
459  C 0.303546 0.363986 0.367606    0.0108536    0.0742043   -0.0590417 
460  C 0.320234 0.384922  0.38379    0.0208268    0.0847472   -0.0659147 
461  O 0.324867 0.376589  0.37407    0.0230573    0.0804952   -0.0638779 
462  N 0.322523 0.391818 0.388558    0.0187961    0.0949305   -0.0675614 
463  C 0.336064 0.394862 0.386764    0.0199776     0.101496   -0.0668853 
464  C 0.341249 0.411925 0.402948    0.0193652     0.112183   -0.0705017 
465  C 0.331511 0.415993 0.411289    0.0142059     0.112643    -0.071561 
466  C 0.314638 0.400646 0.399238     0.015928     0.100658   -0.0708993 
467  C 0.347759 0.393027 0.382165    0.0154943     0.102945   -0.0620099 
468  O 0.358676 0.392529 0.376647    0.0177987     0.104619   -0.0609715 
469  N 0.329905 0.376379 0.368385   0.00953749     0.102352   -0.0592724 
470  C 0.336923 0.371271 0.361017   0.00566792     0.104352   -0.0544923 
471  C 0.341822 0.379005 0.369822 -0.000117638     0.115194   -0.0538653 
472  C 0.357409 0.400725 0.389481  0.000753622     0.125537    -0.057153 
473  N 0.376136  0.41111 0.393358   0.00500003     0.129857   -0.0571139 
474  C 0.379965 0.423877 0.405871   0.00464106     0.139555   -0.0604107 
475  N 0.367758 0.425943 0.414002  6.89634e-05     0.141424    -0.062736 
476  C 0.359067 0.416542 0.408676   -0.0022848     0.132417   -0.0607767 
477  C 0.325809 0.356336 0.348949   0.00335362    0.0956119   -0.0512039 
478  O 0.304424 0.343638 0.340789   0.00259424    0.0902404   -0.0525567 
479  N  0.32393 0.341703 0.330973   0.00269552    0.0941671   -0.0469543 
480  C 0.317978 0.332016 0.323709   -0.0002042    0.0882898   -0.0434255 
481  C 0.324095 0.327464 0.315002   0.00272243     0.081083   -0.0407676 
482  C  0.32281 0.333689 0.326602  -0.00550187    0.0961508   -0.0407039 
483  O 0.331484 0.331518 0.320067   -0.0053993     0.100131   -0.0373545 
484  N 0.320043 0.340258 0.339134   -0.0100228    0.0984726   -0.0423857 
485  C 0.325293  0.34344 0.345187   -0.0158502     0.107602   -0.0409262 
486  C 0.317343 0.349652 0.357882   -0.0205444     0.109499   -0.0450233 
487  C 0.322055 0.368258 0.376355   -0.0191183     0.112878   -0.0504002 
488  C 0.313088 0.374653 0.388738   -0.0242136     0.113568    -0.054751 
489  C 0.345563 0.388485 0.393569   -0.0194851     0.124358   -0.0504117 
490  C 0.326637 0.332832  0.33514    -0.017803     0.105658   -0.0357577 
491  O 0.328639 0.327603   0.3313   -0.0214669     0.113571   -0.0331568 
492  N 0.331351 0.335424 0.337035   -0.0152841    0.0954792   -0.0342703 
493  C 0.340505 0.335244 0.337586   -0.0165659    0.0927195   -0.0298063 
494  C 0.323742  0.32428 0.330292   -0.0169693    0.0834436   -0.0305893 
495  C 0.320051 0.333203 0.344914   -0.0205703     0.084313   -0.0349085 
496  N 0.318499 0.334212 0.350194   -0.0259978    0.0931683    -0.036367 
497  C 0.308044 0.337213 0.356639   -0.0278523    0.0911098   -0.0409841 
498  N 0.295733 0.329952 0.347517   -0.0235251    0.0817699   -0.0420321 
499  C 0.308621 0.332512 0.345724   -0.0192474    0.0776601   -0.0382382 
500  C 0.367757 0.350257 0.345512   -0.0123207    0.0904905    -0.025673 
501  O 0.364241 0.339183 0.334318   -0.0125025    0.0881777   -0.0218249 
502  N 0.384584 0.365246 0.354316  -0.00839514    0.0915539   -0.0266965 
503  C 0.405991  0.37595  0.35702  -0.00428446    0.0896617   -0.0235642 
504  C  0.41636 0.388072 0.364417  0.000301078      0.08225   -0.0261387 
505  O  0.42859 0.403955 0.378812   0.00170688    0.0873018   -0.0298192 
506  C 0.399293 0.377986 0.359045  8.42841e-05    0.0729956   -0.0277725 
507  C 0.426226 0.389007  0.36608  -0.00428708     0.100228   -0.0220135 
508  O 0.420221 0.388199 0.368262  -0.00683325     0.108127    -0.024498 
509  N 0.430896 0.382191 0.352172  -0.00124485     0.100333   -0.0179237 
510  C 0.473522 0.415937 0.381511 -0.000854577      0.11063   -0.0155101 
511  C 0.530703 0.460316  0.41849   0.00288489     0.109145   -0.0102265 
512  C 0.578646 0.503871  0.46788  0.000491889     0.108103  -0.00620026 
513  C 0.649978 0.560513 0.519023    0.0033355     0.112743 -0.000274463 
514  O 0.724758  0.62913 0.592269   0.00201223     0.113606   0.00349161 
515  N 0.682838 0.586663 0.535092   0.00766576     0.116154  0.000749463 
516  C  0.44995 0.394921 0.354887   0.00194306     0.113829   -0.0191343 
517  O  0.43385 0.378368   0.3385   0.00028699     0.124327   -0.0197141 
518  N 0.416886 0.364515 0.319977   0.00600753     0.104999   -0.0218555 
519  C 0.422239 0.370568 0.320255   0.00938009     0.107452    -0.025469 
520  C   0.4305 0.375125 0.317123    0.0143365    0.0975427   -0.0266515 
521  C 0.427259 0.378579 0.325258    0.0143701    0.0864437   -0.0293549 
522  O 0.402642  0.36231 0.318228    0.0110555    0.0852686   -0.0302982 
523  O 0.421178 0.369336 0.310432     0.017541    0.0789026    -0.030616 
524  C 0.395688 0.355892 0.311968   0.00781015     0.110028   -0.0306251 
525  O 0.375538 0.336863 0.289249    0.0103176     0.114523   -0.0337644 
526  N 0.380161 0.349477 0.314495   0.00431706     0.106679   -0.0317216 
527  C 0.380597 0.362418 0.333291   0.00318053     0.108577   -0.0364504 
528  C 0.391655  0.37786 0.348097   0.00764942     0.101238   -0.0406109 
529  O 0.377881 0.374085 0.348193   0.00820095     0.102629   -0.0446356 
530  N 0.393414 0.372188 0.337935    0.0107855    0.0932358   -0.0397016 
531  C 0.398791  0.37794 0.342514    0.0150256     0.087456   -0.0435383 
532  C 0.415382 0.383796 0.339794    0.0183808    0.0836593   -0.0431475 
533  C 0.408396 0.376423 0.333255    0.0218209    0.0768492   -0.0474755 
534  C 0.444544 0.406652  0.35437    0.0200511     0.092728   -0.0426244 
535  C 0.376887 0.362076 0.333813    0.0143226    0.0786909   -0.0443713 
536  O 0.342901 0.326297 0.299571    0.0123286    0.0727411   -0.0414391 
537  N 0.369956 0.362554 0.338536    0.0163166    0.0784701   -0.0482905 
538  C 0.361564 0.358978 0.341188    0.0167754    0.0704889   -0.0492339 
539  C 0.370149 0.377682 0.364054    0.0192312    0.0728948   -0.0532764 
540  C 0.369571  0.38139 0.373708    0.0202834    0.0647028   -0.0537281 
541  C 0.366802 0.383619 0.370879    0.0161254    0.0814633   -0.0536793 
542  C 0.349632 0.339074 0.320231    0.0193746    0.0624867    -0.049797 
543  O 0.362611  0.34832 0.327901    0.0231508     0.062585   -0.0530693 
544  N 0.355569 0.342519 0.324986    0.0171294    0.0557711   -0.0469014 
545  C  0.35891 0.339742 0.322618    0.0183481     0.047904     -0.04744 
546  C 0.356363 0.337354 0.322107    0.0150989    0.0419419   -0.0437579 
547  O 0.330397 0.319413 0.309831    0.0134668    0.0421556   -0.0428086 
548  C 0.369583 0.347013 0.325837    0.0130882    0.0433385   -0.0402625 
549  C 0.367837 0.350355 0.338996    0.0214579    0.0453243   -0.0508075 
550  O 0.376989 0.367424 0.360691    0.0219817    0.0464444   -0.0513485 
551  N 0.383472 0.358293 0.346688    0.0236037    0.0416323   -0.0531529 
552  C 0.408362 0.381908 0.376737    0.0266755    0.0385816   -0.0558255 
553  C 0.438199 0.400943 0.394807     0.028169    0.0355582   -0.0588228 
554  C 0.471728 0.430939  0.43158    0.0322584    0.0344107   -0.0621116 
555  C 0.498942 0.446683 0.446621    0.0332009    0.0322496   -0.0657395 
556  O 0.516499 0.460692 0.453474    0.0337734    0.0350952   -0.0679194 
557  N 0.529954 0.471118 0.478515    0.0331435    0.0271456   -0.0664929 
558  C 0.381989 0.358122 0.359124    0.0249184     0.032742    -0.053296 
559  O  0.37463 0.346594  0.34772    0.0221072     0.027773   -0.0513655 
560  N 0.378744 0.362157 0.367668    0.0269153    0.0334189    -0.053564 
561  C  0.37799 0.364556 0.374903     0.025832    0.0284809   -0.0511247 
562  C 0.368873 0.367345 0.378802    0.0268326    0.0309312   -0.0512312 
563  C 0.356767 0.361928 0.369111    0.0233259     0.036347   -0.0503988 
564  C 0.343393 0.345494 0.350615    0.0184009    0.0344655    -0.046674 
565  C 0.335332 0.343062  0.34568    0.0150687     0.039899   -0.0455728 
566  N  0.32772 0.335105 0.334034    0.0161466    0.0470339    -0.047587 
567  C 0.382249 0.361733 0.378046    0.0287744    0.0238649    -0.052125 
568  O 0.415993 0.391529 0.409668    0.0330875    0.0254202   -0.0553272 
569  N 0.386273 0.363482 0.383365    0.0267129    0.0186139   -0.0493543 
570  C 0.394836 0.364674 0.391153      0.02942    0.0149656   -0.0497365 
571  C 0.384423 0.352903 0.381182     0.025287    0.0103716   -0.0459483 
572  C 0.383346 0.361503 0.385193    0.0223594    0.0115112   -0.0437367 
573  C 0.374273 0.355686 0.373847     0.022098    0.0165413   -0.0456408 
574  C 0.380275 0.355361 0.384856    0.0352258     0.015849    -0.050854 
575  O 0.358231  0.34479 0.371325    0.0359108    0.0182304   -0.0509624 
576  N 0.392248 0.358695 0.394118     0.039461    0.0140469   -0.0519613 
577  C 0.378409 0.348436 0.386745     0.046402    0.0143164   -0.0530911 
578  C 0.362338 0.333358 0.374964    0.0477964     0.009824   -0.0497335 
579  O 0.350295   0.3273 0.366432    0.0436433   0.00786204   -0.0468377 
580  N 0.360281 0.324145 0.371351    0.0540535   0.00835457   -0.0500839 
581  C 0.359964 0.324895 0.374404    0.0574747    0.0044947   -0.0470752 
582  C 0.373595 0.328527 0.384391    0.0656364   0.00389127   -0.0478631 
583  C 0.379659 0.343378 0.396858    0.0728626   0.00698792   -0.0520144 
584  C 0.394414 0.350117 0.409196    0.0823172   0.00603931   -0.0524885 
585  N 0.387504 0.348377 0.406636     0.086693    0.0017389   -0.0493178 
586  C 0.406763 0.363758 0.425184    0.0963777 -4.60878e-05   -0.0488901 
587  N 0.417741 0.365693 0.432056      0.10294   0.00237731   -0.0515472 
588  N 0.394583 0.356179 0.415561      0.10002  -0.00440849   -0.0457172 
589  C 0.355285 0.314676 0.365624    0.0513919   0.00130097   -0.0429318 
590  O 0.342911 0.291317 0.345572    0.0468846   0.00121043   -0.0425359 
591  N 0.344985 0.312772 0.360874    0.0513899  -0.00130676   -0.0402377 
592  C 0.336231 0.301652 0.349653    0.0457179  -0.00375999    -0.036404 
593  C 0.321129 0.297807 0.339519    0.0397286  -0.00306768   -0.0360476 
594  O 0.314402 0.293843 0.333896    0.0369898  -0.00528578   -0.0331371 
595  N 0.316689 0.298377 0.336838    0.0377112  0.000384242   -0.0388637 
596  C  0.31175 0.301335 0.334749    0.0320123   0.00172861   -0.0383054 
597  C 0.331269 0.320067 0.351084    0.0297252   0.00571713   -0.0407165 
598  O 0.366825 0.361735  0.39145    0.0339107   0.00911783   -0.0441042 
599  C  0.30048 0.303829 0.333399    0.0329819   0.00183137    -0.038817 
600  O 0.284558 0.293038  0.31966    0.0283524   0.00205627   -0.0375668 
601  N 0.292915 0.302372 0.331954    0.0390077   0.00181748   -0.0411067 
602  C 0.292076 0.315858 0.341798     0.040638   0.00123019   -0.0425772 
603  C 0.300728 0.327064 0.351502    0.0390403  -0.00307328   -0.0397759 
604  C 0.309935 0.326653 0.354033    0.0426686  -0.00739579   -0.0365693 
605  C 0.310996  0.33229 0.356583    0.0414321   -0.0110464    -0.034336 
606  C 0.316526 0.331675 0.361074    0.0508253  -0.00852587   -0.0378827 
607  C  0.27771 0.312381 0.334699    0.0368677   0.00586548   -0.0452787 
608  O 0.274275 0.319797 0.340399    0.0399977   0.00761366   -0.0486582 
609  N 0.283535 0.315465 0.336676     0.030306    0.0080216   -0.0437574 
610  C 0.282433 0.322673 0.341084    0.0260436    0.0128344   -0.0454996 
611  C 0.293254 0.326158 0.343833    0.0201237    0.0144953   -0.0427962 
612  C 0.298291 0.330227 0.347729    0.0165604    0.0111867   -0.0397521 
613  C 0.310216 0.333845 0.350642    0.0124922    0.0122154   -0.0370898 
614  C 0.294798 0.337549 0.353522    0.0136981    0.0124664    -0.041111 
615  C 0.282346  0.32647 0.344092    0.0282055     0.018259   -0.0490537 
616  O 0.279207 0.333309 0.349065    0.0261437    0.0224404   -0.0513865 
617  N 0.279531 0.314771 0.334007     0.031707    0.0187082   -0.0494873 
618  C 0.301683 0.338209 0.356342    0.0337918    0.0242878   -0.0526652 
619  C 0.311605 0.336346 0.353626    0.0311397    0.0266083   -0.0516395 
620  C 0.321046 0.345169  0.36015    0.0246225     0.027458   -0.0489041 
621  C 0.321475 0.352266 0.364681    0.0207536    0.0325112   -0.0491859 
622  N 0.305367 0.331966 0.343387    0.0158836    0.0315389    -0.045889 
623  C 0.316463 0.335103 0.347985    0.0163687     0.025762    -0.043636 
624  C 0.321773 0.335264 0.347688    0.0129527    0.0227624   -0.0402879 
625  C 0.328716 0.335345 0.349835    0.0138925    0.0175322   -0.0388799 
626  C 0.349817 0.353329 0.371028    0.0181065    0.0153183   -0.0404832 
627  C  0.33944 0.347192 0.365443     0.022241    0.0180241   -0.0436623 
628  C 0.330026 0.346594 0.362139    0.0214342    0.0231947    -0.045399 
629  C 0.292222 0.330336  0.35049    0.0415995    0.0230648   -0.0552256 
630  O 0.311378 0.347015 0.367186    0.0448107    0.0268093   -0.0577478 
631  N 0.283914 0.326813 0.348112    0.0451462    0.0180399   -0.0547172 
632  C  0.28619 0.331706 0.354494    0.0535703    0.0164961   -0.0569103 
633  C  0.29224 0.328124 0.354462    0.0572903    0.0102232   -0.0538782 
634  C 0.307157 0.325039 0.355554    0.0549164   0.00956056   -0.0513198 
635  C  0.31591 0.324411 0.359267    0.0591795   0.00441287   -0.0485761 
636  O 0.330261  0.33721 0.374443    0.0672405   0.00328516   -0.0496972 
637  N 0.297392 0.299424  0.33537    0.0543836    0.0015989   -0.0448939 
638  C 0.280701 0.344739 0.364182    0.0558602    0.0167631   -0.0599876 
639  O 0.258692 0.330518 0.347882    0.0520695    0.0145471   -0.0592542 
640  N 0.291169 0.362021 0.381085    0.0627274    0.0187688   -0.0636215 
641  C   0.2962 0.385718 0.401474     0.066391    0.0177742   -0.0670047 
642  C 0.301747 0.402372 0.416238     0.067937    0.0247685   -0.0717653 
643  C 0.296283 0.399381 0.411781    0.0590815    0.0318676    -0.072413 
644  O 0.263638 0.369331 0.380883    0.0518766    0.0310271   -0.0708434 
645  O 0.295412 0.397916 0.409871    0.0597481    0.0387039   -0.0746314 
646  C 0.319245 0.407816 0.424536     0.076091    0.0114812    -0.066546 
647  O 0.324396 0.397227  0.41818      0.08025    0.0097358   -0.0642004 
648  N 0.328887 0.434237 0.446972    0.0797814   0.00812958   -0.0689751 
649  C 0.347237 0.454238   0.4665    0.0905299   0.00241934   -0.0690414 
650  C 0.356204 0.485622 0.491498    0.0926951  -0.00132495   -0.0725568 
651  C 0.373678 0.522993 0.525719    0.0932434   0.00392937   -0.0787748 
652  C 0.407172 0.562456 0.564631     0.105083   0.00416095   -0.0818488 
653  O 0.432808 0.579157 0.582602     0.114485  -0.00127392   -0.0794171 
654  O 0.434766 0.603247 0.603888     0.105193    0.0102352   -0.0866196 
655  C 0.359556 0.461899 0.476975    0.0986858   0.00582965   -0.0711049 
656  O 0.362549 0.469736  0.48448     0.096647    0.0125489   -0.0743467 
657  N 0.350533 0.442437 0.460555     0.108355   0.00190726   -0.0693248 
658  C 0.353644 0.439582 0.457709     0.112128  -0.00561764   -0.0653231 
659  C 0.363408 0.450073  0.46869     0.125684  -0.00797099   -0.0665824 
660  C 0.376054 0.453817 0.477397      0.12735  -0.00138119   -0.0687108 
661  C 0.368991 0.454301 0.475948     0.116815   0.00504953   -0.0712923 
662  C 0.348805  0.41198  0.43596     0.107205  -0.00661719   -0.0598238 
663  O 0.344952 0.402422 0.426279     0.107816   -0.0118606   -0.0559426 
664  N 0.347939 0.399097 0.427553     0.101906  -0.00145601   -0.0597406 
665  C 0.350072  0.38128 0.415167    0.0965781  -0.00210698   -0.0553629 
666  C  0.36229 0.382519 0.420291    0.0927017   0.00345894   -0.0567991 
667  C 0.382398   0.3931 0.435756     0.101821   0.00487722    -0.058617 
668  C 0.389579 0.390236  0.43593    0.0992521    0.0103172   -0.0610588 
669  O 0.374882 0.372163 0.416923    0.0901321    0.0122839   -0.0604316 
670  O 0.406244 0.401937 0.450706     0.106963     0.012419   -0.0636733 
671  C 0.326345 0.360635 0.391599    0.0877204  -0.00435432   -0.0525375 
672  O 0.326851 0.350012 0.383453    0.0864661  -0.00781914   -0.0482915 
673  N 0.309014 0.357892  0.38391    0.0815699  -0.00195582   -0.0548766 
674  C 0.299327 0.351628 0.374898    0.0740942  -0.00417508   -0.0525519 
675  C 0.286006  0.35545  0.37384    0.0684082  -0.00104251   -0.0559573 
676  C 0.271459 0.345724 0.361202    0.0623679  -0.00393557   -0.0542582 
677  N 0.273774 0.338749 0.355789    0.0544366  -0.00263209   -0.0511726 
678  C 0.254415 0.325957  0.33995    0.0511029  -0.00554494   -0.0505188 
679  N 0.280741 0.365718 0.375861    0.0560731  -0.00889856   -0.0533022 
680  C 0.258863 0.346307 0.357209    0.0634431  -0.00793368   -0.0556598 
681  C 0.298268 0.352138 0.373424    0.0786771    -0.010796   -0.0501508 
682  O 0.306069 0.351543 0.373689    0.0749467   -0.0133626   -0.0461866 
683  N   0.3052 0.370817 0.388653    0.0870217   -0.0135172   -0.0527194 
684  C 0.314323 0.383686 0.397697    0.0921988   -0.0201664   -0.0509482 
685  C 0.326918 0.414055 0.422746     0.101362   -0.0226641   -0.0553788 
686  O 0.315254 0.418758 0.425052    0.0971967   -0.0179774   -0.0607721 
687  C  0.32871 0.425062 0.427033     0.104918   -0.0297405   -0.0548253 
688  C 0.329857 0.379188 0.398051    0.0962964   -0.0229557   -0.0454971 
689  O 0.342647 0.387606  0.40499    0.0941361   -0.0263889    -0.041895 
690  N 0.344573 0.381163 0.406159     0.101853   -0.0209309   -0.0450292 
691  C 0.356494  0.37286 0.403842     0.106077   -0.0227796   -0.0401781 
692  C 0.376473 0.383087 0.419957     0.114443   -0.0207235   -0.0413587 
693  O 0.378038 0.381396 0.422152     0.109893   -0.0150393    -0.044375 
694  C 0.354017 0.355235 0.391207    0.0964664   -0.0209233   -0.0364206 
695  O 0.351825 0.341861 0.379771    0.0965242   -0.0233752   -0.0318013 
696  N 0.340342 0.342271  0.37957    0.0882607    -0.016525   -0.0384725 
697  C 0.335724 0.326305 0.367163    0.0790982   -0.0149486   -0.0356922 
698  C 0.324414 0.315053 0.357196    0.0732653   -0.0100029   -0.0388186 
699  C 0.334414 0.314008 0.362062    0.0780887  -0.00744035   -0.0407596 
700  O 0.356461 0.326396 0.378854    0.0856004  -0.00931656   -0.0392553 
701  O 0.327254 0.306808 0.355123    0.0747624  -0.00346985   -0.0437053 
702  C 0.324146 0.321603 0.357498    0.0731284   -0.0172863   -0.0334277 
703  O 0.319512 0.306502 0.344903    0.0693406   -0.0182002    -0.029481 
704  N 0.320037 0.335109 0.364135    0.0722263   -0.0180748    -0.036124 
705  C 0.317036 0.337893 0.362354    0.0674365   -0.0205345   -0.0343249 
706  C 0.320981 0.360929 0.379068    0.0652798   -0.0203256   -0.0384878 
707  C 0.317705 0.362393 0.376233    0.0604423   -0.0228499   -0.0370126 
708  C 0.311521 0.371768  0.38149      0.05533   -0.0211189    -0.041138 
709  N 0.312261  0.37672 0.382351    0.0516218   -0.0239512   -0.0402384 
710  C 0.300481 0.371493 0.375743    0.0442465   -0.0216384   -0.0420267 
711  N 0.286408 0.359163 0.365814    0.0394025   -0.0162349   -0.0439814 
712  N 0.307605 0.382215 0.382703    0.0417877   -0.0245103   -0.0416803 
713  C 0.330012 0.346086 0.369104    0.0728517   -0.0254176   -0.0306688 
714  O 0.316379 0.326478 0.349284    0.0687194   -0.0265012   -0.0270814 
715  N  0.35844 0.376417  0.39832    0.0826103    -0.028126   -0.0313691 
716  C 0.391685 0.402904 0.423401    0.0891398   -0.0325517   -0.0274246 
717  C 0.424052 0.440051 0.458554     0.100954   -0.0353645   -0.0292025 
718  C 0.456443 0.466869  0.48224     0.109487   -0.0404718   -0.0252408 
719  C 0.486254 0.506198 0.517337     0.121806   -0.0440619   -0.0278951 
720  C 0.519087 0.527652 0.537765     0.132158   -0.0482695   -0.0230282 
721  N 0.533576 0.553662 0.558184     0.144906   -0.0525161    -0.025867 
722  C 0.390088 0.379677 0.407818    0.0871608   -0.0309166   -0.0220783 
723  O 0.373751 0.357485 0.384208    0.0862112   -0.0328153   -0.0179918 
724  N 0.412505 0.390433  0.42663    0.0861333      -0.0271   -0.0224498 
725  C 0.433429 0.391385 0.435847    0.0825552   -0.0249139   -0.0183869 
726  C 0.454542 0.402976 0.455303    0.0810255   -0.0208582    -0.020768 
727  C 0.501667 0.432216 0.493185    0.0878369   -0.0199195   -0.0193707 
728  C 0.518003 0.447639 0.506524    0.0989693   -0.0233913   -0.0171661 
729  C 0.502016 0.431871 0.496555    0.0893955   -0.0167948   -0.0241746 
730  C 0.412863 0.370133 0.413689    0.0724934   -0.0239762   -0.0161842 
731  O 0.422786 0.369424 0.415149    0.0711638   -0.0243569   -0.0116788 
732  N 0.388191 0.356131 0.396779    0.0655909   -0.0222495   -0.0192715 
733  C 0.378764 0.347427 0.386681    0.0567583   -0.0213912   -0.0175436 
734  C 0.374203  0.35396 0.390213    0.0507615   -0.0192269   -0.0211545 
735  C  0.40252 0.377192 0.417955    0.0480935   -0.0157852   -0.0235304 
736  C 0.395473 0.377943 0.415263    0.0403002   -0.0136271   -0.0250347 
737  C 0.413901  0.37046 0.419416    0.0469645   -0.0147769   -0.0211335 
738  C 0.367886 0.342095  0.37518    0.0575121   -0.0245562   -0.0150438 
739  O 0.363635   0.3306 0.364814    0.0534923   -0.0241916   -0.0113715 
740  N 0.349165 0.336699 0.362994    0.0625959   -0.0275832   -0.0174105 
741  C 0.341892 0.336887  0.35588    0.0632294   -0.0310141   -0.0162644 
742  C 0.344918  0.35771 0.369407    0.0674064    -0.034029   -0.0209135 
743  C 0.356355 0.339982 0.359112    0.0686018   -0.0332888   -0.0113275 
744  O 0.364647 0.349976 0.363899    0.0678877   -0.0352771  -0.00920201 
745  N 0.388211 0.359586 0.384696    0.0742783   -0.0326856  -0.00956276 
746  C 0.413411 0.370027 0.397364    0.0792158   -0.0335547  -0.00421184 
747  C 0.458764 0.401959 0.437589    0.0853157   -0.0320854  -0.00354176 
748  C 0.513883  0.43906 0.478586    0.0909021   -0.0321712   0.00230375 
749  C 0.550866 0.481318 0.511447    0.0997704   -0.0371884   0.00434506 
750  C 0.591453 0.501219 0.536107     0.106176   -0.0364807    0.0106993 
751  N 0.621046 0.535625 0.560232      0.11591   -0.0417734    0.0127673 
752  C 0.400038 0.345963 0.376666    0.0714872   -0.0307008  3.40017e-05 
753  O 0.418064 0.358089 0.386156    0.0736032   -0.0317756   0.00425422 
754  N 0.373571 0.317256 0.353364    0.0628784   -0.0269968  -0.00115386 
755  C 0.374783 0.310507 0.349822    0.0550469   -0.0241328   0.00212064 
756  C 0.365973 0.289812 0.339274    0.0501849   -0.0203214   0.00180854 
757  C 0.387919 0.296538 0.353512     0.056434   -0.0196285   0.00341702 
758  C 0.410638  0.30608 0.364753    0.0606683   -0.0195331   0.00913374 
759  O 0.411911 0.306115 0.362587    0.0563701   -0.0185583    0.0124594 
760  O 0.425349 0.311289 0.373372    0.0688499   -0.0201963    0.0103909 
761  C 0.348078 0.296147 0.329613    0.0480972    -0.024067  0.000660496 
762  O 0.344783 0.290313 0.322526    0.0440384   -0.0230307   0.00365246 
763  N 0.343209 0.303954 0.334381    0.0464634   -0.0245359  -0.00392387 
764  C  0.32921 0.300212  0.32587    0.0402945   -0.0241457  -0.00526142 
765  C 0.318717 0.295994 0.323076     0.036052   -0.0221542  -0.00922438 
766  C 0.311498 0.297513 0.320838    0.0298136   -0.0211168   -0.0104866 
767  C  0.31991 0.302595 0.325753    0.0249587   -0.0200203   -0.0076013 
768  C   0.3098 0.306918  0.32719     0.028929   -0.0208042   -0.0144745 
769  C 0.320682 0.310617 0.330545    0.0201058   -0.0190157  -0.00866527 
770  C 0.313871 0.317281 0.334786    0.0235563   -0.0194984   -0.0153537 
771  C 0.306934 0.306478 0.323852    0.0194789   -0.0187474   -0.0124452 
772  C 0.329021 0.311016 0.328222    0.0445052   -0.0278036  -0.00644429 
773  O 0.336113 0.329901 0.343632    0.0457738   -0.0290961   -0.0106599 
774  N 0.360507 0.338621 0.352406    0.0464383   -0.0292759  -0.00293604 
775  C 0.351404 0.338742  0.34373    0.0512888   -0.0334708  -0.00406282 
776  C 0.365046 0.342676 0.345708    0.0580319   -0.0354277  0.000490923 
777  O 0.367108 0.335182 0.339976    0.0536234   -0.0325187   0.00492587 
778  C 0.380053 0.347102 0.356313    0.0639274   -0.0351242   0.00213465 
779  C 0.359444  0.35507 0.354773    0.0457946   -0.0334072  -0.00529417 
780  O 0.344331  0.33595 0.338289    0.0394111   -0.0301831  -0.00350592 
781  N 0.352614 0.360009 0.352077    0.0485603   -0.0371406  -0.00862204 
782  C 0.348987 0.363246 0.350275    0.0440326   -0.0373251   -0.0101475 
783  C 0.358688 0.387208 0.366597    0.0468192   -0.0417156   -0.0153234 
784  C 0.363443 0.396384 0.370299    0.0428247   -0.0421921   -0.0165818 
785  C 0.343893 0.382273 0.364512     0.044847   -0.0407215   -0.0204022 
786  C  0.35466 0.360065 0.344891    0.0437834   -0.0366634   -0.0053512 
787  O 0.341781  0.34667 0.331749    0.0380367   -0.0340418  -0.00468148 
788  N 0.383158 0.381225 0.363891    0.0503526   -0.0386707  -0.00185825 
789  C 0.406061 0.394363 0.375173    0.0503998   -0.0371823   0.00323511 
790  C 0.465399  0.44531 0.423678    0.0589914   -0.0395915   0.00693078 
791  C 0.524815 0.491977 0.469825    0.0588552   -0.0366709    0.0130665 
792  C 0.578371 0.534865 0.511312    0.0676348    -0.038366    0.0173564 
793  N 0.644864 0.585037  0.56665    0.0657075   -0.0330913    0.0238476 
794  C 0.651806 0.579196 0.571798    0.0637852    -0.028934    0.0268641 
795  N  0.59075 0.520493 0.521283    0.0592191   -0.0275674    0.0237765 
796  N 0.678771 0.590059 0.585563    0.0659981   -0.0256612    0.0330433 
797  C 0.396958 0.375829 0.364729    0.0435372   -0.0314669   0.00660957 
798  O 0.390626 0.367954 0.355161     0.039558   -0.0290921   0.00847003 
799  N 0.369022 0.342465 0.339849    0.0421168   -0.0293324   0.00687981 
800  C 0.367268 0.333881 0.338638    0.0352158   -0.0245749   0.00889862 
801  C 0.373484 0.332461 0.345885     0.035527   -0.0232084   0.00895624 
802  C 0.395308 0.340628 0.357298    0.0404345   -0.0227427    0.0133328 
803  C 0.404508 0.341482 0.366976    0.0414716   -0.0215811    0.0128337 
804  N 0.441958 0.362438 0.393555    0.0441002   -0.0194953    0.0176929 
805  C 0.457419 0.367149 0.406068    0.0470328    -0.018643    0.0180596 
806  N   0.4423 0.355562 0.398256    0.0465164   -0.0190576    0.0138215 
807  N  0.48253 0.376637 0.419858    0.0506827   -0.0169294    0.0228565 
808  C  0.33594 0.311388 0.315427    0.0285301   -0.0230626   0.00607474 
809  O 0.346457 0.318856 0.325121    0.0233895   -0.0198225   0.00807105 
810  N 0.317576 0.303924 0.305032     0.028674   -0.0251472    0.0014313 
811  C 0.311497 0.305089 0.305464    0.0230848   -0.0235922  -0.00106027 
812  C 0.309522 0.313314 0.312109    0.0237063   -0.0253489  -0.00615405 
813  C  0.31499 0.317695 0.321749    0.0245363   -0.0247037  -0.00765723 
814  S  0.33031 0.346744 0.347904    0.0251889   -0.0261055   -0.0138428 
815  C 0.304248  0.31856 0.323075    0.0314017   -0.0272829   -0.0147355 
816  C 0.316887 0.312113 0.306726    0.0222282   -0.0235859  0.000121044 
817  O 0.326134 0.320838 0.316346    0.0176816   -0.0207858   0.00116875 
818  N 0.320186 0.317099  0.30535    0.0271904   -0.0268215  8.28051e-06 
819  C 0.329357  0.32718 0.309105    0.0271122   -0.0269899  0.000861406 
820  C 0.351162 0.352042 0.325978    0.0336857   -0.0317905 -0.000260486 
821  C 0.340571 0.354074  0.32498    0.0340971   -0.0353598  -0.00668143 
822  C 0.349238 0.366987 0.330102    0.0411394   -0.0408187  -0.00820389 
823  O 0.373627 0.384088 0.343992    0.0461667   -0.0419261  -0.00418706 
824  N 0.329911 0.359579 0.319219    0.0417524    -0.044281   -0.0140352 
825  C 0.325207 0.313761 0.297714    0.0249969   -0.0230778   0.00603687 
826  O 0.302147 0.292022 0.273733     0.021923   -0.0209383   0.00644596 
827  N  0.32605 0.305217 0.293965    0.0264581   -0.0217715   0.00972679 
828  C 0.334956 0.305004 0.296728    0.0239225    -0.017503    0.0145615 
829  C 0.349784 0.308217  0.30523    0.0267852   -0.0167109    0.0181927 
830  C  0.31528  0.28709 0.283883     0.016869   -0.0137654    0.0142636 
831  O 0.317323  0.28477  0.28297    0.0138797   -0.0100195    0.0174542 
832  N 0.299495 0.278256 0.277063     0.014412   -0.0146608    0.0104263 
833  C 0.292773 0.273916 0.276224   0.00874296   -0.0118543   0.00996738 
834  C 0.286487 0.271275 0.277201   0.00744864   -0.0129377   0.00658555 
835  C 0.297944  0.27623 0.287911   0.00877451   -0.0134094    0.0069395 
836  C 0.300164 0.282251 0.296846   0.00716549   -0.0138273   0.00344759 
837  C 0.301317 0.270305 0.287454    0.0061359   -0.0105244    0.0104981 
838  C 0.302333 0.289401 0.287163   0.00676654   -0.0106457   0.00924018 
839  O 0.298319 0.287292 0.287126   0.00286817  -0.00827449   0.00942789 
840  N 0.310729 0.300597 0.291935   0.00978389   -0.0124217   0.00823128 
841  C 0.334933 0.329528 0.316736   0.00839621   -0.0113399   0.00694939 
842  C 0.359466 0.355769 0.335623    0.0122954    -0.013997   0.00551743 
843  C 0.418637 0.418384 0.393788    0.0112431   -0.0127842   0.00387423 
844  C 0.451218 0.454917 0.423477      0.01441   -0.0167329  1.75058e-06 
845  N 0.475126 0.483547 0.453267    0.0154072   -0.0204782  -0.00368484 
846  C 0.496236 0.510876 0.481006    0.0135422   -0.0216667  -0.00860471 
847  N  0.50412 0.519667  0.49127    0.0101179   -0.0190265   -0.0101339 
848  N 0.524503 0.544359 0.513819    0.0151922   -0.0252398   -0.0120427 
849  C 0.325604 0.318186 0.306184   0.00550516  -0.00714615    0.0100787 
850  O 0.309206 0.305742 0.294532   0.00287806  -0.00551995   0.00899402 
851  N 0.340618 0.327199 0.315063   0.00595378  -0.00494004    0.0140557 
852  C 0.338509 0.324798 0.313382   0.00279172 -0.000479651    0.0166171 
853  C 0.374618 0.352678 0.341399   0.00387143   0.00173513    0.0209152 
854  C 0.381594 0.356434 0.341222   0.00939533  -0.00233204    0.0204389 
855  C 0.364631 0.344225 0.331593   0.00953906  -0.00617733    0.0164201 
856  C 0.312507 0.301609 0.296031  -0.00162018  0.000896163    0.0160571 
857  O 0.293328 0.287212 0.280934  -0.00379474   0.00309222    0.0158743 
858  N 0.316481 0.302783 0.302568  -0.00251829 -0.000597521    0.0155593 
859  C 0.312559 0.301461 0.305965  -0.00647218  7.13753e-05    0.0145409 
860  C 0.320891 0.304124 0.314663  -0.00714851  -0.00115557    0.0142969 
861  C 0.325092 0.310397 0.325233   -0.0116702 -0.000274295    0.0133093 
862  O  0.32465 0.312233 0.327453   -0.0150109   0.00242641    0.0146128 
863  N 0.327541 0.313182 0.330565    -0.011839  -0.00250028    0.0106971 
864  C 0.296186 0.292176 0.294954  -0.00658891  -0.00142951    0.0113686 
865  O 0.289567 0.289885 0.293259  -0.00904388 -0.000294614    0.0109675 
866  N 0.271403 0.268593 0.269166   -0.0038286  -0.00391445   0.00906258 
867  C 0.250605 0.252872 0.252475  -0.00408956   -0.0046059   0.00624648 
868  C 0.253255 0.256379 0.254859  -0.00177451  -0.00716004   0.00340016 
869  C 0.269196 0.269881 0.271944  -0.00108155  -0.00897436    0.0026515 
870  C 0.250671 0.257811   0.2556  -0.00248308  -0.00683431  0.000711348 
871  C 0.284474 0.286203 0.286289   0.00223069   -0.0116698   0.00054048 
872  C 0.246764 0.252322 0.248546  -0.00429303  -0.00251869   0.00664362 
873  O 0.250813 0.259611 0.256294   -0.0054494  -0.00162526   0.00601044 
874  N 0.242164 0.246413 0.238937  -0.00266368  -0.00168262    0.0078301 
875  C 0.250582 0.257155 0.246227  -0.00230833  0.000683513    0.0081927 
876  C 0.258518 0.262487 0.246698  4.45304e-05   0.00114136    0.0091926 
877  C 0.262279 0.268029 0.248128   0.00100551    0.0036099   0.00892964 
878  C 0.257334 0.264954 0.244734   0.00158564   0.00250504   0.00526735 
879  O 0.279539 0.289308 0.270485  0.000998354   0.00436618   0.00483458 
880  N 0.230821 0.237722 0.215934   0.00275649 -0.000406592   0.00238457 
881  C 0.254532 0.263696 0.254125  -0.00449427   0.00344618    0.0102274 
882  O 0.264779 0.277721 0.267286   -0.0043958    0.0045724   0.00949181 
883  N 0.268063 0.275232 0.268046  -0.00643124   0.00451414     0.012562 
884  C 0.284041 0.295045 0.289403  -0.00925963   0.00686588    0.0138401 
885  C 0.333079 0.340044 0.338102   -0.0120599   0.00831605    0.0160809 
886  C 0.389762 0.392586  0.38827    -0.011266    0.0115663    0.0190679 
887  C 0.416837 0.414611 0.414807   -0.0146766    0.0144449    0.0218187 
888  N 0.454583 0.445732  0.45128   -0.0152645    0.0119729    0.0214643 
889  C 0.460556 0.443173 0.449308   -0.0125905     0.011088    0.0229757 
890  N 0.476066 0.456028 0.456758  -0.00881776    0.0116056    0.0246168 
891  N 0.462209 0.438804  0.45066   -0.0132144    0.0094066    0.0226288 
892  C 0.258878  0.27449 0.270619   -0.0103393   0.00511317    0.0118253 
893  O 0.258927 0.280387  0.27499   -0.0106134   0.00627773    0.0117654 
894  N 0.248918 0.262005 0.260878   -0.0104897   0.00230893    0.0101843 
895  C 0.233705 0.250025 0.249843     -0.01108  0.000650177   0.00833891 
896  C 0.242192 0.254399 0.257394   -0.0112655  -0.00178601   0.00673661 
897  C 0.249818 0.258278 0.265315   -0.0137776  -0.00183866   0.00757239 
898  C  0.23112 0.245597 0.248479   -0.0110487  -0.00323255   0.00471626 
899  C 0.251909 0.254689 0.265261   -0.0129614  -0.00400934   0.00605813 
900  C 0.231706 0.250989 0.247865  -0.00870917  0.000898738   0.00732226 
901  O  0.23736 0.261007 0.256615  -0.00842742  0.000996915   0.00712574 
902  N  0.23727 0.253845 0.249619  -0.00678111  0.000928513   0.00650215 
903  C 0.229292 0.246676 0.240861  -0.00489265    0.0017218   0.00538001 
904  C 0.229473 0.243559 0.237347  -0.00383602   0.00124542   0.00358771 
905  C 0.235657 0.249167 0.241973  -0.00236174   0.00282146   0.00235554 
906  C 0.225357  0.23781  0.23414  -0.00455545 -0.000868821   0.00170876 
907  C 0.234977 0.255882 0.247379  -0.00378523   0.00411481   0.00682828 
908  O 0.235913  0.25908 0.249848    -0.002373   0.00465526   0.00667953 
909  N 0.234552 0.255743 0.245526  -0.00398426   0.00577965   0.00834304 
910  C 0.235506 0.260592 0.247547  -0.00272072   0.00861041   0.00954037 
911  C 0.238222 0.261914 0.246587  -0.00281407    0.0109602    0.0111394 
912  C  0.24746 0.266788 0.248828 -0.000440669    0.0112317    0.0099174 
913  O 0.236032 0.255226 0.236496   0.00157666    0.0117738   0.00829878 
914  O 0.252264 0.267963 0.248572 -0.000465854    0.0109032    0.0105321 
915  C 0.234634 0.266378 0.253383  -0.00373207   0.00878386    0.0103314 
916  O 0.243863 0.280146 0.264897  -0.00151865    0.0101211    0.0104924 
917  N 0.247992  0.28045  0.26991   -0.0068323   0.00723655    0.0105015 
918  C  0.26422 0.303631 0.292957  -0.00843327   0.00663746     0.010432 
919  C 0.312154 0.349635 0.342811   -0.0126893   0.00526087    0.0102331 
920  C 0.359731 0.404676  0.39779   -0.0151526   0.00405844   0.00925106 
921  C 0.422956 0.466419 0.463789   -0.0202902   0.00456571   0.00929964 
922  O 0.467614 0.504004 0.504151   -0.0214602   0.00661113    0.0109502 
923  O 0.459308 0.508365 0.506209   -0.0230353   0.00292344   0.00759476 
924  C 0.239586 0.281547 0.269403  -0.00586625   0.00450041   0.00914542 
925  O 0.223926 0.273152   0.2582  -0.00441337   0.00453728   0.00920227 
926  N  0.23429 0.270504 0.259991  -0.00509458   0.00274674   0.00803497 
927  C 0.235744 0.272517 0.260769  -0.00263826   0.00129197   0.00723716 
928  C  0.24902 0.279393 0.270239  -0.00323812 -0.000173326   0.00591663 
929  C 0.268456 0.299307 0.291672  -0.00609376  -0.00250468   0.00500673 
930  N 0.280648 0.309808 0.304897  -0.00906194  -0.00253672   0.00512468 
931  C 0.295717 0.324973 0.321436   -0.0111028  -0.00459458   0.00390949 
932  N 0.270464 0.301736 0.295669  -0.00944325  -0.00612696   0.00293354 
933  C 0.276757 0.308961 0.300313  -0.00609646  -0.00469534   0.00394025 
934  C 0.230597 0.267292 0.253444   0.00145234   0.00332998   0.00783192 
935  O 0.230792  0.27077 0.254504   0.00438995   0.00276403   0.00809885 
936  N 0.228232 0.260783 0.247634   0.00201809   0.00555661   0.00790522 
937  C 0.238726 0.270353 0.255743   0.00577411   0.00793109   0.00817694 
938  C 0.249114 0.274307 0.260981   0.00562072   0.00956485   0.00716251 
939  C 0.240331 0.258892 0.248805   0.00442515   0.00847446   0.00532277 
940  C 0.232889 0.247376 0.237656   0.00355021   0.00906148   0.00368961 
941  C 0.253153 0.267846 0.259193   0.00685231   0.00953692   0.00498546 
942  C 0.241626 0.281173  0.26311   0.00765813   0.00948452   0.00943992 
943  O 0.247421 0.288521  0.26871    0.0117855    0.0104235   0.00980689 
944  N 0.236616  0.28147 0.262542   0.00478894   0.00995965    0.0101444 
945  C 0.252971 0.307411 0.285236   0.00590172    0.0114643    0.0109843 
946  C 0.258511 0.317509 0.295623   0.00137843    0.0127435     0.011707 
947  C 0.279916 0.333303 0.312012  5.22137e-05    0.0157314    0.0126874 
948  O 0.272982 0.321535 0.299055   0.00314949    0.0173125    0.0125116 
949  O 0.269726 0.323078 0.303354  -0.00402248    0.0165982    0.0135848 
950  C 0.244827 0.306145 0.281771   0.00804596   0.00883277    0.0105998 
951  O 0.235664 0.302958 0.275282    0.0122372   0.00981627    0.0109855 
952  N 0.254238 0.314804 0.291711   0.00569889   0.00539981   0.00973528 
953  C 0.251743 0.318452 0.292297   0.00775272   0.00218542   0.00910107 
954  C 0.254476 0.318693 0.294365   0.00410864  -0.00119013   0.00778472 
955  C 0.251593 0.314423 0.286585     0.013903   0.00221986   0.00973922 
956  O 0.240834  0.31066 0.278508     0.018173  0.000992852    0.0100045 
957  N  0.24842 0.300046 0.275754    0.0142667   0.00359543   0.00986276 
958  C 0.256502 0.301311 0.277287    0.0192261   0.00471252    0.0105298 
959  C 0.266455 0.299614 0.280654     0.016986    0.0061589   0.00979858 
960  C 0.266057 0.296737 0.278862    0.0143441   0.00366203   0.00907825 
961  C 0.272098 0.296787 0.279783    0.0209922   0.00893448    0.0102415 
962  C 0.263934 0.287328 0.273905    0.0107425   0.00456793   0.00781153 
963  C 0.262954 0.310267 0.284367    0.0239409   0.00747922    0.0114207 
964  O 0.274221  0.32221 0.293924      0.02964   0.00738448    0.0123637 
965  N 0.267224 0.315829 0.290562    0.0221468    0.0100749      0.01122 
966  C 0.274637 0.325663  0.29838    0.0268224    0.0131599    0.0118166 
967  C  0.28173 0.331012 0.304668     0.024285    0.0163692    0.0113956 
968  C 0.278871 0.315816 0.293576    0.0226827    0.0175479    0.0102308 
969  C 0.279482 0.314898 0.291649     0.022909    0.0210073   0.00973591 
970  O 0.261223 0.298217 0.274202    0.0190734    0.0211524   0.00977012 
971  O 0.277762 0.310616 0.286869    0.0274099     0.023762   0.00948717 
972  C 0.282352 0.346924 0.314357    0.0298551     0.011941     0.012377 
973  O 0.268458  0.33524 0.300212    0.0361958    0.0129667    0.0130543 
974  N 0.300042 0.373893 0.339684    0.0253961   0.00962568    0.0118299 
975  C 0.306284 0.394907  0.35555    0.0271448   0.00806129    0.0115576 
976  C 0.293627 0.390042 0.350908    0.0200888   0.00652416    0.0104231 
977  C  0.31523 0.406659 0.363461    0.0328448   0.00429395    0.0116869 
978  O  0.29005 0.391508 0.343388    0.0381574   0.00385798    0.0118271 
979  N 0.322258 0.404705 0.363323    0.0323554   0.00182549    0.0117434 
980  C 0.341698 0.425115 0.379532    0.0381909  -0.00151261     0.012274 
981  C 0.356512 0.435057 0.389989    0.0350197  -0.00504807    0.0115566 
982  C  0.38704 0.450205 0.411466    0.0324869  -0.00263857    0.0120717 
983  C 0.408359 0.468611 0.430807    0.0278837  -0.00542745    0.0108576 
984  N 0.427461 0.488039 0.445219    0.0323958  -0.00861786    0.0112962 
985  C  0.44553 0.507534 0.462506    0.0299847   -0.0121316   0.00988512 
986  N 0.437483 0.497526 0.456481     0.023247   -0.0122967   0.00818241 
987  N 0.445021 0.510769 0.458869    0.0348838   -0.0157551    0.0100547 
988  C 0.324098 0.397467 0.353025     0.045396   0.00117741    0.0141963 
989  O 0.323754 0.399104 0.350314    0.0521704 -0.000760604    0.0152328 
990  N 0.311106 0.373416 0.334739    0.0440773   0.00554887    0.0145158 
991  C 0.307337 0.358211 0.322207    0.0498921   0.00875117    0.0158546 
992  C 0.297748 0.335396 0.302541    0.0505618   0.00844923    0.0167655 
993  O 0.317398 0.356429 0.321796    0.0483819    0.0051721     0.016621 
994  N 0.282204 0.306524 0.278491    0.0536539    0.0123245    0.0176024 
995  C 0.278742 0.289159 0.265269    0.0537176    0.0134419    0.0185259 
996  C 0.278608  0.28668 0.258982    0.0618349    0.0122652    0.0211774 
997  O 0.272484 0.288362 0.255571    0.0685909    0.0110935    0.0221925 
998  N 0.275822 0.273336 0.247505    0.0618339    0.0126577      0.02245 
999  C 0.285783 0.275737 0.255429     0.054004    0.0140823    0.0210064 
1000 C 0.299806 0.274977 0.257383    0.0573935    0.0168389    0.0234181 
1001 C 0.299593 0.280848 0.254693    0.0658933      0.01323    0.0259676 
1002 C 0.295238 0.287848 0.258284    0.0699322    0.0119027    0.0254844 
1003 C 0.289021 0.289376 0.265007    0.0486956   0.00962776    0.0194692 
1004 O 0.286325  0.29863 0.267015    0.0509743   0.00519269    0.0195661 
1005 N 0.293042 0.289164 0.269631    0.0415148    0.0107669    0.0176465 
1006 C 0.301939 0.304926 0.282795    0.0367343   0.00721268    0.0161929 
1007 C  0.29603 0.308172 0.286497    0.0312476   0.00562973    0.0139613 
1008 C 0.302458 0.325319 0.299444     0.034304   0.00432907    0.0142974 
1009 C 0.298369 0.303699 0.288822    0.0262786   0.00885639    0.0123498 
1010 C 0.305877 0.298632 0.280981    0.0330073   0.00946269    0.0157447 
1011 O 0.302189 0.284203  0.27278    0.0320354     0.013884     0.015762 
1012 N 0.289572 0.286303 0.265426    0.0307698   0.00650891    0.0149789 
1013 C 0.296272 0.286465 0.269162    0.0263769   0.00828614    0.0138926 
1014 C 0.305727 0.297777 0.274742    0.0275744   0.00546582    0.0141662 
1015 C 0.332812 0.319194 0.299782    0.0228459   0.00768777    0.0126971 
1016 O 0.291057 0.272051 0.259528     0.019071     0.011472    0.0116269 
1017 O  0.37864  0.36691 0.343186    0.0228281   0.00547727    0.0121636 
1018 C 0.278821 0.273649 0.259706    0.0200287   0.00752039    0.0111216 
1019 O  0.27779 0.281271 0.264274    0.0182262   0.00382673    0.0100071 
1020 N 0.282481   0.2714 0.263685    0.0168306    0.0109393   0.00991216 
1021 C 0.271278 0.264282  0.25906    0.0118772    0.0100075    0.0074791 
1022 C 0.294185 0.281385 0.281894    0.0093729    0.0133599   0.00588303 
1023 C 0.317423 0.305124 0.306517    0.0102803     0.014151   0.00563523 
1024 C 0.325106 0.308762 0.315231   0.00611106    0.0161937   0.00262766 
1025 C 0.302693 0.300054 0.297219    0.0107673    0.0109945   0.00605305 
1026 C 0.273751 0.268658 0.263319   0.00846208   0.00838803   0.00593468 
1027 O 0.271116 0.270878 0.266091   0.00551539   0.00643602   0.00442941 
1028 N 0.277454 0.268173 0.261905   0.00923646   0.00934954   0.00641896 
1029 C 0.289935 0.282503 0.275676    0.0065718   0.00796737   0.00477344 
1030 C 0.298735 0.284318  0.27721   0.00750456     0.010926   0.00540885 
1031 C 0.303048 0.290646 0.282076   0.00552729     0.009607   0.00361358 
1032 C 0.303001  0.28089 0.279925   0.00561567    0.0162462   0.00504122 
1033 C 0.290938 0.291436 0.279987   0.00683085   0.00318331   0.00444812 
1034 O 0.288656 0.292775 0.282713   0.00374905   0.00138594   0.00271472 
1035 N 0.298456 0.301747 0.284983    0.0105618   0.00108918   0.00597837 
1036 C 0.321913 0.333368 0.312224    0.0102157  -0.00350103    0.0050179 
1037 C 0.368113 0.382386 0.354203    0.0149911  -0.00591635   0.00628208 
1038 C 0.425298 0.433734 0.402317    0.0172461  -0.00531941   0.00670654 
1039 C  0.48254 0.494498 0.454836    0.0231027  -0.00840161    0.0081714 
1040 C 0.530532 0.538961 0.493688    0.0251874  -0.00945603   0.00793372 
1041 N 0.573644 0.584483 0.530547    0.0320536   -0.0123418   0.00978417 
1042 C 0.311897 0.330043 0.310279   0.00816255  -0.00489596   0.00460174 
1043 O 0.304619 0.327191 0.307617   0.00509969  -0.00730833   0.00303114 
1044 N 0.289851 0.307799 0.289287   0.00979304  -0.00291751   0.00598741 
1045 C 0.278445 0.303021 0.284588   0.00859191  -0.00370834   0.00598157 
1046 C 0.276837 0.302939 0.282758    0.0127119  -0.00225698   0.00772012 
1047 O 0.274886 0.292297 0.276168    0.0135783   0.00151334   0.00824637 
1048 C 0.298065 0.327652 0.301681    0.0177256  -0.00418834   0.00886753 
1049 C 0.266543 0.288969  0.27541   0.00476801  -0.00221406   0.00509101 
1050 O  0.25321 0.280098  0.26675    0.0031915  -0.00254576   0.00516743 
1051 N 0.258312 0.274146 0.264158   0.00341081  -0.00045532   0.00421451 
1052 C 0.260011 0.274076 0.267676   0.00098744  0.000738563   0.00329807 
1053 C 0.254203 0.264961 0.259693   0.00275953    0.0035486   0.00379914 
1054 C 0.249467 0.259761 0.256421  0.000937834   0.00422592   0.00273918 
1055 C 0.244627 0.259416 0.254529  0.000233868   0.00318358   0.00338467 
1056 C 0.258722 0.264187 0.263845 -0.000106686   0.00597676  0.000974825 
1057 C 0.241077 0.254946 0.250645 -0.000698023   0.00373051   0.00268813 
1058 C 0.250383 0.256082 0.256211  -0.00127541   0.00591113 -0.000341719 
1059 C 0.244604 0.254178 0.251928  -0.00119362   0.00471057  0.000698655 
1060 C 0.252093 0.262642 0.259248  -0.00138804  0.000900538   0.00146437 
1061 O 0.265368 0.277346 0.275205  -0.00347365 -0.000559975  0.000556601 
1062 N 0.259941 0.265649 0.263624 -0.000919309    0.0030479  0.000957037 
1063 C 0.248663 0.252205 0.253018   -0.0031203   0.00382086  -0.00110993 
1064 C 0.238609 0.236652 0.239157  -0.00287317   0.00731736  -0.00139245 
1065 C 0.256561 0.262136 0.262167  -0.00407808   0.00148545  -0.00195162 
1066 O 0.247315  0.25335 0.255488  -0.00561267  0.000898507  -0.00358055 
1067 N 0.268924 0.275176 0.272061  -0.00280844   0.00024999   -0.0011773 
1068 C 0.287098 0.294233 0.290421  -0.00375215  -0.00180216  -0.00251096 
1069 C  0.30391 0.310802 0.302476  -0.00185409   -0.0027298  -0.00212876 
1070 C 0.322306 0.323946 0.315177 -0.000399816  0.000630593  -0.00174844 
1071 O 0.330607 0.329335 0.324304  -0.00159847   0.00372576  -0.00233024 
1072 N 0.320042 0.320425   0.3069   0.00211304  0.000171788 -0.000903501 
1073 C 0.289663 0.300375 0.297193  -0.00533846  -0.00457984  -0.00268538 
1074 O  0.31151 0.321424 0.320192  -0.00676827  -0.00572619  -0.00414381 
1075 N 0.273837 0.287908 0.283332  -0.00493889  -0.00513108  -0.00114527 
1076 C  0.26512 0.282867 0.278547    -0.006735   -0.0070459 -0.000951574 
1077 C  0.26722 0.290147 0.282529   -0.0055115  -0.00732752  0.000548998 
1078 C 0.248199 0.264324 0.263648  -0.00832771  -0.00647226 -0.000818531 
1079 O 0.248991   0.2641 0.265766   -0.0102082  -0.00761082  -0.00140615 
1080 N 0.227422 0.242376 0.242231  -0.00735995  -0.00472987 -0.000242196 
1081 C 0.228214 0.242047 0.243809  -0.00808155  -0.00458679   3.0227e-05 
1082 C 0.223805 0.237177 0.238165  -0.00680544  -0.00293918  0.000193734 
1083 C 0.230123 0.242017 0.244045  -0.00690773  -0.00345865 -0.000264867 
1084 C 0.235554 0.251504 0.250126  -0.00590185  -0.00179831   0.00187058 
1085 C  0.22424 0.235069  0.23964  -0.00862284  -0.00559149  -0.00142546 
1086 O 0.235061 0.244477 0.250864    -0.009517  -0.00643745  -0.00088791 
1087 N  0.22753 0.237019 0.242312  -0.00795167   -0.0051622  -0.00324701 
1088 C 0.234902  0.24253 0.250189  -0.00773544  -0.00601478  -0.00481349 
1089 C 0.245055 0.253052 0.260684   -0.0072064   -0.0044783  -0.00680389 
1090 C 0.252899 0.260936 0.266747  -0.00733428  -0.00294355  -0.00600601 
1091 C  0.24339  0.25279 0.257028  -0.00726506  -0.00334016  -0.00386801 
1092 C  0.23362 0.239221 0.248543  -0.00857445  -0.00729602  -0.00514899 
1093 O 0.245347 0.248307 0.260255  -0.00823703  -0.00817731  -0.00555322 
1094 N 0.225621 0.232215 0.239867  -0.00942528  -0.00755841  -0.00509055 
1095 C 0.235232 0.240283 0.249195   -0.0108541  -0.00907143  -0.00594667 
1096 C 0.238495 0.246384 0.251573   -0.0112453  -0.00989935  -0.00628925 
1097 O 0.234903 0.241809 0.247926   -0.0131199   -0.0117787  -0.00791402 
1098 C 0.230116 0.233962 0.245603   -0.0126554  -0.00964839  -0.00465141 
1099 O 0.240339 0.239718 0.255214   -0.0134358   -0.0102219  -0.00538657 
1100 N 0.224618 0.231774 0.241696   -0.0132343  -0.00900863  -0.00264901 
1101 C 0.230475 0.236354 0.248739   -0.0152141  -0.00859261  -0.00106698 
1102 C 0.238966 0.249789  0.25928   -0.0155971  -0.00734789  0.000904356 
1103 C 0.250989 0.268203 0.274178   -0.0161834  -0.00810066  0.000308819 
1104 S 0.284185 0.302683 0.310202   -0.0198473   -0.0102394  -0.00197654 
1105 C 0.288277 0.305446  0.31056   -0.0176947    -0.012269  -0.00449588 
1106 C 0.236593  0.23703 0.252418   -0.0138762  -0.00817549 -0.000255805 
1107 O 0.241012 0.236544 0.255918   -0.0152403  -0.00796922  0.000455826 
1108 N 0.221962 0.223126 0.236575   -0.0111716  -0.00801109 -0.000326089 
1109 C 0.223449  0.22094 0.235698  -0.00910303   -0.0082987  0.000319444 
1110 C 0.222688 0.223326 0.234894  -0.00667045  -0.00851164 -0.000687199 
1111 C 0.231336 0.229591 0.241344  -0.00386477  -0.00972289 -0.000622042 
1112 C 0.220164 0.224343 0.232453  -0.00710095  -0.00726311  0.000401979 
1113 C 0.233021 0.225344 0.244193  -0.00832373  -0.00929027  -0.00093406 
1114 O 0.244602 0.231161 0.253175  -0.00779594  -0.00928559  0.000481724 
1115 N 0.239261 0.232816 0.251684  -0.00790624  -0.00975911  -0.00347074 
1116 C 0.253715 0.242671 0.265071  -0.00645776   -0.0104288  -0.00508635 
1117 C 0.245902 0.237885 0.258754  -0.00496624   -0.0102705  -0.00790303 
1118 C   0.2627 0.251007 0.274932  -0.00198174   -0.0107956  -0.00953368 
1119 C  0.24106 0.234383 0.253806  -0.00705364  -0.00978947  -0.00923829 
1120 C 0.264291 0.253244 0.276729   0.00155375   -0.0118045  -0.00882319 
1121 C  0.25331 0.236867 0.263469  -0.00913591   -0.0104428   -0.0051081 
1122 O 0.275961 0.252741 0.283885   -0.0081499   -0.0106027  -0.00524461 
1123 N  0.24527 0.231853 0.256997   -0.0124074   -0.0103253  -0.00514235 
1124 C 0.255208 0.238146  0.26694   -0.0158437   -0.0105692  -0.00593372 
1125 C 0.253359 0.242629 0.267773   -0.0186346    -0.011245  -0.00682656 
1126 O 0.244974 0.237099  0.25844   -0.0171059   -0.0121741   -0.0090663 
1127 C   0.2653 0.242804 0.275979   -0.0172719  -0.00932201  -0.00333185 
1128 O 0.268007 0.237912 0.276848   -0.0186253  -0.00899951  -0.00385536 
1129 N 0.265975   0.2463 0.276928   -0.0167762   -0.0082437 -0.000498387 
1130 C 0.276476 0.250772 0.285004   -0.0177304  -0.00643047   0.00243104 
1131 C  0.27656 0.255384 0.285049   -0.0170107  -0.00511757   0.00518166 
1132 C  0.27905 0.265053 0.292114   -0.0205452  -0.00383828   0.00565152 
1133 O 0.288998 0.277293 0.306078   -0.0242892   -0.0042288    0.0037868 
1134 O 0.277886 0.267408 0.290576   -0.0194907  -0.00252176   0.00762336 
1135 C 0.279571 0.244717 0.282949   -0.0141925  -0.00658772   0.00320628 
1136 O  0.27635 0.232367 0.276674    -0.015558  -0.00515494   0.00451998 
1137 N 0.279797 0.247209 0.282409  -0.00959087  -0.00823557    0.0021504 
1138 C 0.293566 0.254143 0.291951  -0.00507021  -0.00893029   0.00263374 
1139 C 0.284008 0.251209 0.283864 -0.000449295    -0.010868  0.000998933 
1140 C 0.298281 0.261271 0.295281   0.00519995   -0.0122765  0.000735187 
1141 C 0.295731 0.252408 0.286523   0.00810488   -0.0122329   0.00446965 
1142 C 0.298467 0.270958 0.299789   0.00848433   -0.0140589  -0.00221046 
1143 C 0.287252 0.239889 0.284371  -0.00572141  -0.00881782  0.000774822 
1144 O 0.308701 0.251593 0.301066  -0.00341682  -0.00830511   0.00217857 
1145 N 0.284405 0.240369 0.284852  -0.00860799  -0.00922439  -0.00234253 
1146 C 0.299799 0.248513 0.298749   -0.0095361   -0.0092148  -0.00491802 
1147 C 0.291182 0.246118 0.292556  -0.00876843    -0.010402  -0.00872109 
1148 C 0.289368 0.245287 0.290339  -0.00302975   -0.0109162  -0.00992237 
1149 C 0.302049 0.250661 0.300373 -0.000256293   -0.0107941   -0.0118398 
1150 C 0.291011 0.255326 0.294675 -0.000474918   -0.0113772  -0.00935453 
1151 C 0.302051 0.252889 0.301114   0.00535973   -0.0111478   -0.0130928 
1152 C 0.294454  0.26111 0.299214   0.00448615   -0.0118396   -0.0108973 
1153 C 0.287854 0.248357 0.290648   0.00756816   -0.0117437    -0.012651 
1154 C  0.29898 0.242312 0.297952   -0.0155308  -0.00796677  -0.00504646 
1155 O 0.296443 0.232444 0.293643   -0.0168585  -0.00787664  -0.00749944 
1156 N 0.302216 0.249468 0.303554   -0.0192691  -0.00684184  -0.00280332 
1157 C 0.320402 0.265017 0.323741   -0.0257273  -0.00544947  -0.00330005 
1158 C  0.32451 0.274326 0.331579   -0.0292134  -0.00738517  -0.00780857 
1159 O 0.318489 0.263388 0.326159   -0.0338842  -0.00705164   -0.0101256 
1160 N 0.302478 0.261804 0.311442   -0.0268291  -0.00940378  -0.00919624 
1161 C 0.300841 0.265895  0.31209   -0.0291674   -0.0115078   -0.0130013 
1162 C 0.285025 0.256989 0.295734   -0.0250942   -0.0129023   -0.0138259 
1163 C 0.297412 0.275003 0.309033   -0.0269505   -0.0151287   -0.0172074 
1164 C 0.298129 0.264572 0.304961   -0.0205197   -0.0125298   -0.0144945 
1165 C 0.299993 0.272843 0.316793   -0.0340723   -0.0117324   -0.0129846 
1166 O   0.2779 0.258323 0.297509   -0.0332929   -0.0111949   -0.0104231 
1167 N 0.302795 0.274631 0.321757   -0.0392119   -0.0125882   -0.0162704 
1168 C 0.317337 0.298497 0.343136   -0.0440081   -0.0130564   -0.0169187 
1169 C 0.335115 0.313676 0.361996   -0.0490344   -0.0148401   -0.0220696 
1170 C  0.33903 0.302565 0.359518   -0.0482501   -0.0132721   -0.0225555 
1171 C 0.329049 0.291193 0.344412   -0.0406791    -0.013144   -0.0199321 
1172 C 0.311136 0.305059 0.339557   -0.0411037   -0.0151121   -0.0165155 
1173 O 0.292309 0.287552 0.317111   -0.0372318   -0.0171067   -0.0178688 
1174 N 0.300283  0.30252 0.334312    -0.042587   -0.0140347   -0.0143744 
1175 C 0.307493 0.320141 0.343183   -0.0388591   -0.0152412   -0.0131154 
1176 C 0.299792 0.320879 0.341906   -0.0403878   -0.0132937   -0.0106578 
1177 C 0.296469 0.311292 0.336076   -0.0393622  -0.00937261  -0.00645009 
1178 C 0.316448 0.343221 0.366289    -0.046745   -0.0135497   -0.0132244 
1179 C 0.314726 0.334025 0.350464   -0.0379115   -0.0192723   -0.0167367 
1180 O 0.298864 0.321327 0.331487   -0.0331409   -0.0203235   -0.0159242 
1181 N 0.322173 0.342944 0.360801   -0.0424884   -0.0214411   -0.0208506 
1182 C 0.336025 0.363552  0.37396   -0.0414128   -0.0258471    -0.024635 
1183 C 0.367297 0.399513 0.411578   -0.0479272   -0.0281405   -0.0293452 
1184 C 0.387284 0.407905 0.428687   -0.0522585   -0.0276129   -0.0325896 
1185 C 0.418515 0.430638 0.462532   -0.0569956   -0.0230659    -0.030559 
1186 O 0.407828 0.421938 0.454808    -0.056447   -0.0197847   -0.0259908 
1187 O 0.424266 0.426723 0.466414   -0.0611385    -0.022649    -0.033675 
1188 C 0.327953 0.348643 0.356973   -0.0375555   -0.0272211    -0.026252 
1189 O 0.320939 0.346388  0.34741   -0.0358076   -0.0307002   -0.0290021 
1190 N 0.312538 0.322583  0.33667   -0.0358601   -0.0244595   -0.0245884 
1191 C 0.320757 0.324673 0.337313   -0.0322333   -0.0248482   -0.0260612 
1192 C 0.346981 0.338886 0.360403   -0.0335903   -0.0232029   -0.0275127 
1193 C 0.371018  0.35977 0.386647   -0.0393104   -0.0243508   -0.0312273 
1194 C 0.395176 0.370622 0.406116   -0.0394589   -0.0225887   -0.0326302 
1195 N 0.418262 0.388429 0.432229   -0.0458493   -0.0221393   -0.0348188 
1196 C 0.417112 0.374055 0.427795   -0.0469901   -0.0198897   -0.0353646 
1197 N 0.398828 0.347727 0.404281   -0.0417135   -0.0178662   -0.0331323 
1198 N 0.437408 0.389112 0.450281   -0.0535005   -0.0196152   -0.0384032 
1199 C  0.30078 0.304731 0.314232   -0.0269191   -0.0228255   -0.0225044 
1200 O  0.30287 0.303056 0.310699   -0.0237906   -0.0224922   -0.0234402 
1201 N 0.282413 0.290405 0.299518   -0.0261513   -0.0211579   -0.0187518 
1202 C 0.293684 0.300042 0.308331   -0.0220969   -0.0188383   -0.0158528 
1203 C 0.276931 0.285669 0.295547   -0.0222809   -0.0168292   -0.0122274 
1204 C 0.286454 0.289392 0.306603   -0.0250697    -0.015429    -0.011532 
1205 C 0.271367 0.276496 0.294444   -0.0254015   -0.0133027  -0.00802011 
1206 N 0.291406 0.289417 0.314309   -0.0278639   -0.0116592  -0.00706435 
1207 C 0.290639 0.286482 0.313076   -0.0272601  -0.00936557  -0.00384503 
1208 N  0.29607 0.296819 0.318861   -0.0247316  -0.00857241  -0.00175418 
1209 N 0.313291 0.300994 0.333958   -0.0290265  -0.00771595   -0.0027318 
1210 C 0.286703 0.296773 0.297586    -0.018449   -0.0194916   -0.0158565 
1211 O  0.28994 0.296801 0.297268    -0.015582   -0.0175987   -0.0151099 
1212 N 0.282432 0.299343 0.294177   -0.0184975   -0.0220229   -0.0166786 
1213 C 0.302985 0.322618 0.309947   -0.0144524   -0.0226087   -0.0160999 
1214 C  0.30567 0.334311 0.315094    -0.014222   -0.0259618   -0.0167218 
1215 C 0.316557 0.330694  0.31628   -0.0129844   -0.0227624     -0.01854 
1216 O 0.305401 0.317155 0.299749  -0.00963224   -0.0208268   -0.0173558 
1217 N 0.329726 0.341052 0.329126   -0.0157348   -0.0245174   -0.0220807 
1218 C 0.353416 0.358865 0.345799   -0.0143549   -0.0242745   -0.0247776 
1219 C 0.395845 0.397964 0.388567   -0.0179803   -0.0264795   -0.0291037 
1220 C 0.445698 0.453044 0.437108   -0.0192504   -0.0310041   -0.0326119 
1221 C 0.481951 0.483626 0.472099   -0.0228281   -0.0325352   -0.0376299 
1222 O 0.495392 0.490472 0.478193   -0.0208132   -0.0316825   -0.0398778 
1223 O 0.517106 0.520029 0.513781   -0.0278107   -0.0338274   -0.0391692 
1224 C 0.333451 0.332849 0.324047   -0.0123664   -0.0201357    -0.023329 
1225 O 0.304993 0.302007 0.289596  -0.00954457   -0.0184814   -0.0237148 
1226 N 0.323498 0.320801 0.319226   -0.0137349    -0.018426   -0.0217791 
1227 C 0.322049 0.315656 0.317483   -0.0116341   -0.0151002   -0.0206918 
1228 C 0.316846 0.308345 0.317343    -0.012951   -0.0143974   -0.0192466 
1229 C  0.32746 0.312359 0.327521   -0.0143218   -0.0149439   -0.0214818 
1230 C 0.336301 0.316113 0.334288   -0.0118649   -0.0133192   -0.0229051 
1231 C 0.347123 0.330697 0.348958   -0.0180563   -0.0167819   -0.0223818 
1232 C 0.336221 0.308728 0.333094   -0.0124232   -0.0135795   -0.0247974 
1233 C 0.345736 0.321353 0.346359   -0.0194661   -0.0167851   -0.0244538 
1234 C 0.344143 0.313633  0.34171   -0.0162846   -0.0152338   -0.0255895 
1235 C 0.309043 0.305523  0.30325  -0.00907907   -0.0127809   -0.0182253 
1236 O   0.2985 0.292807 0.290092  -0.00714051   -0.0100687    -0.018621 
1237 N 0.296337 0.297491 0.292574  -0.00918395   -0.0134818    -0.015815 
1238 C 0.306796 0.309281 0.301062  -0.00686851   -0.0112014   -0.0135057 
1239 C  0.30555  0.31303 0.302599  -0.00681138    -0.012416   -0.0110813 
1240 C 0.305055 0.313983 0.308411  -0.00858005   -0.0119797   -0.0095909 
1241 C 0.300698 0.315032 0.307147  -0.00869667   -0.0131562  -0.00780721 
1242 O 0.289102 0.305622 0.293127  -0.00620315   -0.0130383  -0.00653915 
1243 N 0.287195 0.303308 0.298698   -0.0112403   -0.0138249  -0.00747825 
1244 C 0.319034 0.319684 0.305647  -0.00452702    -0.010495   -0.0143071 
1245 O 0.314016  0.31218 0.297733  -0.00295577  -0.00690408   -0.0133746 
1246 N 0.311297 0.313298 0.294398  -0.00439645   -0.0138423   -0.0160929 
1247 C 0.332691 0.332726 0.306848  -0.00162932   -0.0136351   -0.0168091 
1248 C 0.351774  0.35556 0.323303  -0.00159114   -0.0188261   -0.0190802 
1249 C 0.364324 0.375152 0.339408 -0.000899817   -0.0216006    -0.017082 
1250 O 0.385788 0.397065 0.362798  0.000444083   -0.0191056   -0.0136288 
1251 O 0.381629 0.397831   0.3579  -0.00170466   -0.0262234   -0.0193207 
1252 C 0.333412 0.327856 0.303538  -0.00120198    -0.010595   -0.0188658 
1253 O 0.324592 0.315993 0.288117   0.00118028  -0.00728764   -0.0180203 
1254 N 0.319361 0.312012 0.293562  -0.00329439   -0.0109824    -0.021266 
1255 C 0.329311 0.317464 0.301175   -0.0023708  -0.00769385   -0.0231864 
1256 C 0.349486 0.335045 0.325596  -0.00406346  -0.00887404   -0.0258156 
1257 C 0.369675 0.353926 0.343235  -0.00579189   -0.0131073    -0.028914 
1258 C   0.3567  0.33874 0.331775  -0.00224813  -0.00507702   -0.0275738 
1259 C 0.379916 0.362608 0.344597  -0.00410987    -0.013755   -0.0313124 
1260 C  0.30647 0.294544 0.280407  -0.00137766  -0.00273325   -0.0210711 
1261 O 0.284249 0.269902 0.253288  0.000236282  0.000985362   -0.0215638 
1262 N 0.300259 0.291078 0.281167  -0.00253175  -0.00242979   -0.0188958 
1263 C 0.310521 0.301835 0.294188    -0.002249   0.00190295   -0.0176528 
1264 C 0.318173 0.312621 0.309002  -0.00359309   0.00110575   -0.0157943 
1265 C 0.320024 0.309483 0.297087 -0.000891353   0.00517822   -0.0158933 
1266 O 0.321881 0.309756 0.298026 -0.000640518    0.0099595   -0.0161652 
1267 N 0.336104 0.325762 0.308599  0.000123008   0.00276787   -0.0140795 
1268 C 0.357105 0.343641 0.321546    0.0023069    0.0055467   -0.0118614 
1269 C 0.390808 0.379317 0.352566   0.00400377   0.00179512  -0.00968154 
1270 C  0.43792 0.422174 0.389138   0.00754323   0.00391435  -0.00712983 
1271 C 0.480668 0.468374 0.430466   0.00998771 -0.000489243  -0.00527753 
1272 O 0.487692 0.477531 0.443315   0.00941321 -0.000462408  -0.00347889 
1273 O 0.530094 0.519268 0.473615    0.0125026  -0.00430446  -0.00606849 
1274 C 0.331282 0.313793 0.286558   0.00415456   0.00750837   -0.0132841 
1275 O  0.33168 0.310011 0.281102   0.00533917    0.0125176   -0.0117062 
1276 N 0.311181 0.294233  0.26482   0.00422306   0.00402542   -0.0163257 
1277 C 0.313711 0.292853 0.257589   0.00626004   0.00536117    -0.018171 
1278 C 0.319579 0.299879 0.261146   0.00622378 -0.000498134   -0.0215143 
1279 C 0.306175 0.283244 0.252052     0.005647    0.0107064   -0.0199875 
1280 O 0.312524 0.285724 0.250239   0.00740828    0.0145816   -0.0204717 
1281 N 0.296945 0.276991 0.253485   0.00351447    0.0108011   -0.0209952 
1282 C 0.303241  0.28317 0.263503   0.00342782     0.014288   -0.0236034 
1283 C 0.313288 0.295077 0.281019   0.00248439    0.0103616   -0.0257331 
1284 C 0.339869 0.321139 0.310281   0.00364473    0.0131042   -0.0288949 
1285 S 0.366711  0.34681 0.342345   0.00362976     0.008409   -0.0314041 
1286 C 0.329092 0.314402 0.314832   0.00206734   0.00752465   -0.0285492 
1287 C 0.299176 0.280974 0.265031   0.00237172    0.0200315   -0.0223673 
1288 O   0.2967 0.278139 0.262437   0.00284521     0.025005   -0.0239647 
1289 N 0.297748  0.28192 0.269057  0.000726566    0.0195299    -0.019985 
1290 C 0.293226 0.280239 0.272135   -0.0010678    0.0240028   -0.0199682 
1291 C 0.290569 0.281692 0.278104  -0.00261492    0.0204457   -0.0192763 
1292 C  0.28805 0.281665 0.280598  -0.00202451    0.0155723   -0.0211423 
1293 S 0.300098 0.297237 0.299566  -0.00100393    0.0178861   -0.0248014 
1294 C 0.290867 0.293981  0.29973  -0.00320067    0.0206811   -0.0247468 
1295 C 0.291401 0.274623 0.264868  -0.00164194    0.0298614   -0.0176726 
1296 O 0.279872 0.263297  0.25661  -0.00345182    0.0313586   -0.0158943 
1297 N 0.311526 0.290409 0.275958 -1.60169e-05    0.0335292   -0.0178678 
1298 C 0.306519 0.279306 0.262039  0.000267471    0.0393467   -0.0151681 
1299 C  0.31975 0.287147 0.261511   0.00381814    0.0366323   -0.0133892 
1300 C 0.317481 0.287235 0.259662   0.00492785    0.0284823   -0.0127175 
1301 C 0.328952 0.294587 0.257895   0.00859808    0.0258915   -0.0111481 
1302 N 0.334218 0.294121 0.255124    0.0103017    0.0294287  -0.00690599 
1303 C 0.330127 0.290356 0.252525    0.0108319    0.0270942  -0.00411217 
1304 N  0.32236 0.289024 0.253538   0.00977194    0.0210373  -0.00499581 
1305 N 0.343604 0.296852 0.257989    0.0126458     0.031409 -0.000231927 
1306 C 0.318833 0.290616 0.274051 -0.000683642    0.0474407   -0.0166121 
1307 O 0.313999 0.288898 0.272062 -2.18984e-05    0.0481023   -0.0198676 
1308 N 0.316352 0.283083 0.267461  -0.00210165    0.0541702    -0.014126 
1309 C 0.325421 0.290231 0.274692  -0.00324883    0.0629816   -0.0150191 
1310 C 0.319817 0.287432 0.280072  -0.00828879     0.069084   -0.0156163 
1311 C 0.311592 0.290341   0.2882   -0.0102351    0.0651881   -0.0195646 
1312 C 0.320729 0.281739 0.277191  -0.00971824    0.0701012   -0.0118285 
1313 C 0.341628 0.296143 0.273772 -0.000595742    0.0674858   -0.0116757 
1314 O 0.347819 0.298795 0.276576  -0.00182982    0.0761824   -0.0114225 
1315 N 0.340295 0.290379 0.261891   0.00307371    0.0617328  -0.00909411 
1316 C 0.362564 0.302648 0.266642   0.00658763    0.0648252   -0.0053879 
1317 C 0.366142 0.301561 0.264975   0.00834482    0.0615462   -0.0010936 
1318 C 0.356777 0.297827 0.258076    0.0106459    0.0508515  -0.00173889 
1319 O 0.345421 0.293665 0.254001   0.00994798    0.0458935   -0.0055292 
1320 O 0.376391 0.314363 0.272259     0.013207    0.0478833    0.0015588 
1321 C 0.366406 0.305246 0.259111    0.0110507    0.0610118  -0.00675549 
1322 O 0.370169 0.302373 0.248047    0.0151743    0.0597618  -0.00383711 
1323 N 0.361485  0.30638 0.260528    0.0105911    0.0589889   -0.0113592 
1324 C 0.377468 0.320804  0.26587    0.0144498    0.0549465   -0.0134038 
1325 C 0.368117 0.316158 0.259863    0.0153785    0.0439743   -0.0148081 
1326 C 0.344943 0.300638 0.252567    0.0123813    0.0405543   -0.0182401 
1327 C 0.350809 0.310454 0.262729    0.0122638     0.031217   -0.0184853 
1328 O 0.341193 0.299323 0.246042     0.014244    0.0272919     -0.01616 
1329 N 0.338834 0.303785 0.262728    0.0100635    0.0279721   -0.0211269 
1330 C 0.385259 0.331211 0.277354     0.013894    0.0589227   -0.0177454 
1331 O 0.374003 0.324724 0.278553     0.010726    0.0636228   -0.0192863 
1332 N 0.404666 0.348018 0.286037    0.0172858    0.0565086   -0.0201177 
1333 C 0.416104 0.360646 0.298495    0.0178062     0.060446    -0.024358 
1334 C 0.465978 0.402975 0.329123     0.022018    0.0626629   -0.0247041 
1335 C 0.514631 0.449069  0.36603     0.025354    0.0535367   -0.0256101 
1336 O 0.536305 0.475308 0.395463     0.024113    0.0450495   -0.0262661 
1337 O 0.590247 0.518437 0.424529    0.0291829     0.054992   -0.0259302 
1338 C 0.385647 0.336387 0.279389      0.01711    0.0536674   -0.0288289 
1339 O 0.368321 0.321609 0.266806    0.0162826    0.0458133   -0.0286245 
1340 N 0.374329 0.327153 0.272369    0.0176168    0.0571958   -0.0327727 
1341 C 0.367813 0.325207 0.276492    0.0173766    0.0518594   -0.0367187 
1342 C 0.377907 0.336971 0.289922    0.0189713    0.0576218   -0.0407049 
1343 C  0.37027 0.324593 0.272166    0.0186862    0.0429197   -0.0386292 
1344 O  0.35546 0.312804 0.266324    0.0171659    0.0366804   -0.0395893 
1345 N 0.369695 0.318065 0.255589    0.0213474    0.0423844   -0.0392869 
1346 C 0.379111 0.325227 0.258224    0.0222292    0.0339225   -0.0418478 
1347 C 0.402732 0.342687 0.262797    0.0257448    0.0348543   -0.0423589 
1348 C 0.355012 0.304684 0.239985    0.0199617    0.0264257   -0.0394534 
1349 O 0.352373 0.303433 0.241867    0.0185691    0.0197158   -0.0421136 
1350 N 0.355702 0.306412 0.240514    0.0195319    0.0280467   -0.0344127 
1351 C 0.338557 0.293252 0.230036    0.0176637    0.0220603    -0.031877 
1352 C 0.345983 0.299174 0.232707     0.018571    0.0253077    -0.026452 
1353 C 0.317621 0.277513 0.225837    0.0142964    0.0205123   -0.0323707 
1354 O 0.296678 0.259316 0.210585    0.0126343    0.0139808   -0.0332767 
1355 N  0.31273 0.274232 0.228836     0.013335    0.0266138   -0.0320326 
1356 C 0.297892 0.264508 0.228883    0.0108739    0.0251567   -0.0322581 
1357 C 0.301692 0.271149 0.240112    0.0101174    0.0324464    -0.031694 
1358 O 0.300164  0.26798  0.23407    0.0095612    0.0369158   -0.0279951 
1359 C 0.292817 0.268009 0.245495   0.00824368    0.0306841   -0.0319956 
1360 C 0.301109 0.267274 0.235313    0.0110232    0.0207537   -0.0363785 
1361 O 0.286776 0.255073  0.22851   0.00925107    0.0158739   -0.0363283 
1362 N 0.313044 0.275566 0.241082     0.013225    0.0230835   -0.0399562 
1363 C  0.33081 0.290882 0.260473    0.0136894    0.0196357   -0.0441671 
1364 C 0.350324 0.306169 0.272829     0.016755    0.0239168   -0.0481198 
1365 C 0.366756 0.326162  0.29576      0.01813    0.0313478    -0.047972 
1366 C 0.392555 0.348601 0.317618    0.0215014    0.0350738   -0.0525223 
1367 O 0.439589 0.389363 0.352247    0.0230685     0.034078   -0.0552882 
1368 O 0.401744 0.361807 0.336236    0.0228622    0.0388048   -0.0536203 
1369 C 0.330653 0.288246 0.255803    0.0122965    0.0122628   -0.0455552 
1370 O 0.326349 0.282443 0.256314    0.0110194   0.00850209   -0.0477459 
1371 N 0.338949 0.296033 0.254645    0.0126294    0.0102612   -0.0444193 
1372 C 0.344895 0.301778 0.258023     0.010996   0.00289334   -0.0461987 
1373 C 0.358585 0.315199 0.259472    0.0128027  0.000803208   -0.0457182 
1374 C 0.332561 0.294209 0.257105   0.00778024 -0.000872242   -0.0435731 
1375 O 0.325597 0.286905 0.253388   0.00534285  -0.00578149   -0.0458535 
1376 N 0.317781 0.283431 0.248081   0.00754525   0.00177734   -0.0389449 
1377 C 0.303183 0.273118 0.243904   0.00487594  -0.00102676   -0.0364406 
1378 C 0.298934 0.272128 0.242587   0.00522772   0.00245736   -0.0318214 
1379 C 0.297963 0.266806 0.247449   0.00359348 -0.000991033   -0.0379864 
1380 O 0.285514 0.255052 0.240723   0.00111309  -0.00483931    -0.037976 
1381 N 0.303426 0.270938  0.25433   0.00553798    0.0038261   -0.0388928 
1382 C 0.307542 0.273133  0.26473   0.00594152    0.0041341   -0.0408214 
1383 C 0.312849 0.272508 0.266929   0.00496906  0.000140555   -0.0444347 
1384 O 0.306242 0.264102 0.266001   0.00359075  -0.00206762   -0.0443874 
1385 N 0.339542 0.295549 0.283885   0.00552821 -0.000749188   -0.0476573 
1386 C 0.359961 0.309548 0.300789   0.00429642   -0.0040987   -0.0520869 
1387 C 0.384176 0.330152 0.312843   0.00603447  -0.00390889   -0.0560792 
1388 C 0.428492 0.366186 0.352634   0.00585035  -0.00536836   -0.0617097 
1389 S 0.465122 0.397865  0.37398   0.00949923  -0.00314848    -0.066669 
1390 C 0.456604 0.393891 0.365363    0.0130949   0.00340385   -0.0627856 
1391 C 0.345184 0.296472 0.290046 -7.88517e-05  -0.00951367   -0.0513473 
1392 O 0.321758 0.268393 0.270076  -0.00228241    -0.011362   -0.0529827 
1393 N 0.334759 0.292475 0.279213  -0.00114274   -0.0115714   -0.0487559 
1394 C 0.345482 0.307103 0.295039  -0.00501869   -0.0161936   -0.0477418 
1395 C 0.353813 0.322907 0.301927  -0.00452737   -0.0178458   -0.0447843 
1396 C 0.388344 0.357565 0.325476  -0.00250635   -0.0197314   -0.0473693 
1397 C 0.406421 0.383175 0.342768  -0.00221307   -0.0233248   -0.0450287 
1398 N 0.411167 0.391359  0.35088  -0.00050552    -0.020207   -0.0393343 
1399 C 0.440856 0.419075 0.374658   0.00298544   -0.0155702   -0.0367329 
1400 N 0.446448 0.419836 0.370087   0.00562563   -0.0132381   -0.0388692 
1401 N 0.435028 0.415769 0.372773   0.00367621   -0.0128757   -0.0320116 
1402 C 0.316823 0.278842 0.276446  -0.00676382   -0.0154051   -0.0446884 
1403 O 0.306817 0.267131 0.270606   -0.0102887   -0.0179335   -0.0454987 
1404 N 0.294012  0.25778 0.257157  -0.00430951   -0.0116073   -0.0414771 
1405 C 0.287677 0.251714 0.259058  -0.00515987   -0.0110613   -0.0387794 
1406 C 0.284789 0.252591 0.259687  -0.00230018   -0.0071888   -0.0359452 
1407 C 0.283313 0.252038 0.265837  -0.00221502  -0.00679305   -0.0334128 
1408 C  0.27222 0.244244 0.258821  -0.00522067  -0.00925426   -0.0303904 
1409 C 0.290341 0.263837 0.276459  0.000409288  -0.00319297   -0.0318926 
1410 C 0.282733 0.238656 0.254542  -0.00550968   -0.0113061   -0.0413402 
1411 O 0.285944 0.239765 0.262121  -0.00794429   -0.0127247     -0.04008 
1412 N 0.284388 0.234898 0.250956  -0.00286316  -0.00950096   -0.0448692 
1413 C 0.295458 0.236702   0.2612  -0.00235671  -0.00932094   -0.0475343 
1414 C 0.301171 0.237267 0.266267  -0.00728104   -0.0127892   -0.0494925 
1415 O 0.293661 0.223046 0.261158  -0.00836913   -0.0127705   -0.0490731 
1416 N 0.306471 0.245987  0.26844    -0.010322    -0.015741   -0.0515831 
1417 C 0.312371  0.24945  0.27555   -0.0158866    -0.019189   -0.0538565 
1418 C 0.311912 0.251785 0.283339   -0.0191236   -0.0196259   -0.0496123 
1419 O 0.303182 0.236481 0.276738   -0.0228621   -0.0199934   -0.0504466 
1420 N 0.298746 0.247764  0.27424   -0.0178238   -0.0192138    -0.045103 
1421 C 0.310814 0.262936 0.293372   -0.0202993   -0.0192539    -0.040988 
1422 C 0.311441  0.27376 0.297028   -0.0185513    -0.018996   -0.0369427 
1423 C 0.330392   0.3005 0.314085   -0.0189958   -0.0214532   -0.0379135 
1424 C 0.337854 0.315343 0.323118   -0.0160517   -0.0199992   -0.0335714 
1425 C 0.360007 0.333616  0.34727   -0.0240595   -0.0248564   -0.0395795 
1426 C 0.296478 0.240881  0.28066   -0.0186579   -0.0166796   -0.0387868 
1427 O  0.30013 0.240842 0.287307   -0.0218951   -0.0166618   -0.0373408 
1428 N 0.297405  0.23937 0.279302   -0.0134694   -0.0144195   -0.0387287 
1429 C 0.307293 0.243112   0.2904   -0.0103841   -0.0124379   -0.0366951 
1430 C  0.30677  0.24506 0.289437  -0.00449145   -0.0102684   -0.0367747 
1431 C  0.31372 0.263112 0.299847  -0.00341074  -0.00965808   -0.0342626 
1432 C  0.32455 0.276568 0.310437   0.00133212  -0.00699485   -0.0354956 
1433 C 0.312434 0.265674 0.303822  -0.00371606  -0.00994452   -0.0298841 
1434 C 0.312546 0.235415  0.29207   -0.0115872   -0.0122223   -0.0393417 
1435 O 0.316168 0.232169 0.296524   -0.0116293   -0.0113704   -0.0369787 
1436 N  0.31062 0.229174 0.285213     -0.01249   -0.0128384   -0.0443206 
1437 C 0.317219 0.222375 0.287828   -0.0142629   -0.0125519   -0.0476123 
1438 C 0.322821 0.224724 0.287282   -0.0149405   -0.0135181    -0.053835 
1439 C 0.326877 0.214209 0.286906   -0.0175702    -0.013292   -0.0580606 
1440 C 0.332488 0.207794 0.288456   -0.0126885   -0.0105918    -0.058828 
1441 C 0.323991 0.209628 0.283706   -0.0247334   -0.0158008   -0.0619462 
1442 C 0.343632 0.203845 0.294639   -0.0149527  -0.00999311   -0.0628518 
1443 C 0.334152 0.205409 0.289717   -0.0278813   -0.0153096    -0.066418 
1444 C 0.343427 0.201137  0.29411    -0.022926   -0.0122134   -0.0667479 
1445 O 0.364163 0.205974 0.309822   -0.0256386   -0.0112976   -0.0712153 
1446 C 0.324919 0.227008 0.298592   -0.0209178   -0.0135324    -0.046507 
1447 O 0.346787 0.238112 0.319656   -0.0212432   -0.0118232   -0.0450532 
1448 N 0.310744 0.222664 0.288098   -0.0257509    -0.015929   -0.0467432 
1449 C 0.326638  0.23789 0.308301   -0.0326263   -0.0165902   -0.0461941 
1450 C 0.332247 0.257283 0.318326   -0.0365461   -0.0197819   -0.0472266 
1451 C 0.339832 0.266156 0.331759   -0.0440554    -0.020379   -0.0475206 
1452 C 0.367822 0.284116 0.357974   -0.0498275   -0.0207957   -0.0531295 
1453 O 0.369594 0.280367 0.353796   -0.0488103    -0.022031   -0.0582521 
1454 N 0.384454 0.297747 0.379799   -0.0566801   -0.0194093   -0.0525878 
1455 C 0.322831 0.231936  0.30774   -0.0318878   -0.0141614   -0.0401853 
1456 O 0.332632 0.232549 0.317772   -0.0356805   -0.0125505   -0.0394612 
1457 N 0.311703 0.228782 0.298457   -0.0270314   -0.0137351   -0.0360887 
1458 C 0.324239 0.241166 0.313377   -0.0255621   -0.0119944   -0.0305524 
1459 C 0.335649 0.264426 0.327307   -0.0209974   -0.0124214   -0.0277495 
1460 C 0.362296 0.294507 0.356958   -0.0202806    -0.011446   -0.0225627 
1461 C 0.374416 0.311393 0.373337     -0.02659   -0.0117385   -0.0214726 
1462 C 0.362826 0.304495  0.35925   -0.0157282   -0.0117147   -0.0209107 
1463 C 0.320497 0.223636 0.305095   -0.0219565  -0.00975374   -0.0292458 
1464 O 0.330293 0.225778 0.314362   -0.0240525  -0.00803281   -0.0264555 
1465 N 0.318366 0.217296 0.299073   -0.0165373   -0.0094982   -0.0315359 
1466 C  0.32096 0.206479 0.296966   -0.0121047  -0.00759044    -0.030612 
1467 C   0.3206 0.206518 0.294306  -0.00495836  -0.00740779   -0.0330697 
1468 C 0.334409 0.205852   0.3029  0.000473166   -0.0056167   -0.0326334 
1469 C 0.306563 0.206535 0.284992  -0.00096924  -0.00802612   -0.0304355 
1470 C 0.331684 0.201945 0.303773    -0.016731  -0.00620541   -0.0323509 
1471 O 0.341057 0.200744 0.310486   -0.0160043  -0.00417406   -0.0289223 
1472 N 0.329722 0.198472 0.301056   -0.0217646  -0.00723524   -0.0377353 
1473 C  0.34255 0.197737 0.311244   -0.0277884  -0.00596945   -0.0402286 
1474 C 0.346702 0.205093 0.315674   -0.0332561  -0.00835637   -0.0470581 
1475 C 0.360413 0.214404 0.323241   -0.0277758  -0.00872981   -0.0517504 
1476 C 0.381043 0.215684    0.337   -0.0253779  -0.00603296   -0.0533354 
1477 O 0.415555 0.245101 0.367907   -0.0169287   -0.0043664   -0.0516183 
1478 N   0.3798 0.203096 0.333791   -0.0321997  -0.00543561   -0.0569114 
1479 C  0.34575 0.199683 0.317974   -0.0337202  -0.00440184   -0.0362115 
1480 O 0.365596 0.204266 0.334144   -0.0357837  -0.00148721   -0.0350886 
1481 N 0.335176 0.204356 0.314063   -0.0365207  -0.00591781   -0.0342561 
1482 C 0.353326 0.223454 0.336327   -0.0421818  -0.00409979   -0.0306093 
1483 C 0.350106 0.239072  0.34078   -0.0445756  -0.00636351   -0.0297695 
1484 C 0.353726 0.251275 0.348491   -0.0502128  -0.00948063   -0.0356811 
1485 C 0.348411 0.264444 0.349639   -0.0508662   -0.0122479   -0.0352465 
1486 O 0.335244 0.259036 0.337167   -0.0456985   -0.0123564   -0.0312254 
1487 O 0.355602 0.278378 0.361083   -0.0565407   -0.0146019   -0.0395465 
1488 C  0.37034 0.232074 0.349535   -0.0375372  -0.00105281   -0.0241314 
1489 O 0.369737 0.220538 0.347096   -0.0412847    0.0022652   -0.0216694 
1490 N 0.389283 0.256002 0.366944   -0.0292526  -0.00210588   -0.0214731 
1491 C 0.406158 0.266789 0.379907   -0.0239256 -0.000166595   -0.0156009 
1492 C 0.415383 0.288531  0.39097    -0.016563  -0.00247168   -0.0139007 
1493 C  0.42691 0.317999 0.409764   -0.0195046  -0.00458553    -0.014638 
1494 C 0.451373 0.350112 0.437163   -0.0206116  -0.00396526  -0.00993633 
1495 N 0.496885 0.393637 0.484736   -0.0279034  -0.00186499  -0.00865668 
1496 C 0.508501 0.406381 0.500041   -0.0349633  -0.00198442   -0.0122913 
1497 N 0.537492 0.424569 0.527961   -0.0407845  0.000822666   -0.0124372 
1498 N 0.501152 0.412315 0.498012   -0.0366245  -0.00479274   -0.0154266 
1499 C 0.428355 0.269141 0.393835   -0.0207323   0.00226576   -0.0151733 
1500 O 0.440714 0.270318 0.401478   -0.0201653   0.00515832   -0.0105797 
1501 N 0.422161 0.257247 0.384952   -0.0185648   0.00147029   -0.0199547 
1502 C 0.443377 0.258251 0.398293   -0.0166371   0.00400596   -0.0206121 
1503 C 0.460733  0.27205 0.413595   -0.0149097   0.00287096   -0.0270145 
1504 C  0.46834 0.285974 0.420636   -0.0052852   0.00119489   -0.0275704 
1505 C 0.490276 0.291589  0.43482   0.00263739   0.00307648    -0.026785 
1506 N 0.482473 0.292168 0.428192    0.0113585   0.00150626   -0.0285279 
1507 C 0.489623 0.299278 0.433817    0.0209255   0.00133275   -0.0253296 
1508 N 0.500121 0.298802 0.439199    0.0242808   0.00258718   -0.0200694 
1509 N 0.478732 0.299324 0.426291      0.02754  7.00955e-06   -0.0276278 
1510 C 0.449333 0.252201 0.403126    -0.025823   0.00722901   -0.0205137 
1511 O 0.466302 0.252002 0.413221   -0.0246042    0.0107011   -0.0172105 
1512 N 0.429532 0.241202 0.389986   -0.0349003    0.0061534    -0.024433 
1513 C 0.443286 0.244522 0.404199   -0.0447093   0.00918438    -0.025946 
1514 C 0.436884 0.249744 0.405213   -0.0528629   0.00631456   -0.0326284 
1515 C 0.441704 0.242397 0.404146   -0.0482362     0.012608   -0.0197183 
1516 O 0.458263 0.244615  0.41823   -0.0543157    0.0169449   -0.0189116 
1517 N 0.433269 0.249545  0.39972   -0.0447749    0.0109114    -0.015746 
1518 C 0.436723  0.25866  0.40685   -0.0488946    0.0133527   -0.0109885 
1519 C 0.428655 0.268118 0.409732   -0.0568329    0.0113266   -0.0147151 
1520 C  0.42376 0.269242 0.409751   -0.0621246    0.0144541   -0.0107045 
1521 O 0.434547 0.267329 0.415463   -0.0630299    0.0193936  -0.00594011 
1522 N 0.395432 0.259584 0.390898   -0.0656696    0.0118927   -0.0128097 
1523 C 0.427863 0.257936 0.396292    -0.040545    0.0122004  -0.00538108 
1524 O 0.395799 0.243211 0.370914   -0.0410569    0.0100315  -0.00496317 
1525 N  0.44769 0.265171 0.406936   -0.0326943    0.0136157  -0.00104623 
1526 C 0.442279  0.26796 0.399776   -0.0242467    0.0116795   0.00327349 
1527 C 0.461627 0.269477 0.407886   -0.0163378    0.0134702   0.00721723 
1528 C 0.497477 0.287589 0.439531   -0.0196781    0.0160489   0.00430579 
1529 C 0.483456 0.278038 0.433368   -0.0316341      0.01718 -5.75105e-05 
1530 C 0.426432 0.261432 0.387212   -0.0274905    0.0131831   0.00738944 
1531 O 0.417822 0.246906 0.378834   -0.0345296    0.0173467   0.00910289 
1532 N 0.417605 0.266815 0.380873   -0.0223065    0.0100955   0.00869819 
1533 C 0.420603 0.280775 0.387364   -0.0244792    0.0109023    0.0117828 
1534 C 0.416211 0.282542 0.379655   -0.0157337   0.00840678    0.0147821 
1535 O 0.409542 0.269947 0.367448  -0.00814746    0.0066556    0.0152352 
1536 N  0.41725 0.295338 0.384209   -0.0169899   0.00841288    0.0166099 
1537 C 0.422086  0.30706 0.386397   -0.0100553   0.00619582     0.019051 
1538 C 0.447551 0.335694 0.410869   -0.0126413   0.00914211    0.0230058 
1539 C 0.478345 0.374859 0.439295  -0.00656202    0.0068012    0.0248328 
1540 O 0.473836 0.371291 0.432252  0.000479443   0.00313977    0.0239836 
1541 O 0.502271 0.405384 0.464628  -0.00904232   0.00859312    0.0265963 
1542 C  0.40356 0.303852 0.375594  -0.00864367   0.00193079    0.0147047 
1543 O 0.433016 0.345499 0.410868   -0.0114406   0.00143031    0.0139996 
1544 N 0.393261 0.291934 0.364982  -0.00431461 -0.000587698    0.0118668 
1545 C 0.363922 0.274791 0.342429  -0.00373444  -0.00363905   0.00750823 
1546 C 0.373104 0.286009 0.356867   -0.0105702  -0.00320786    0.0037708 
1547 C 0.388402  0.28844 0.368932   -0.0121059  -0.00200817   0.00196021 
1548 O 0.401097 0.298853 0.380441  -0.00803598  -0.00351919 -0.000753862 
1549 O  0.41559 0.307855 0.395067   -0.0177003  0.000746281    0.0029384 
1550 C 0.351591 0.259872 0.327844   0.00340253  -0.00580128   0.00584085 
1551 O 0.364194 0.260048 0.334034    0.0070729  -0.00497888   0.00738183 
1552 N 0.340101 0.260091 0.321824   0.00526335  -0.00819036   0.00263645 
1553 C 0.343299 0.265056 0.324786    0.0124293   -0.0102492   0.00106249 
1554 C 0.337175 0.273912 0.325516    0.0128929   -0.0120278  -0.00159608 
1555 C 0.346683 0.288499  0.33702    0.0196261   -0.0139694  -0.00372981 
1556 C 0.364612 0.304312 0.350742    0.0258656   -0.0156363 -0.000900043 
1557 C 0.343542 0.299324  0.34099     0.018318   -0.0147081  -0.00643502 
1558 C 0.341591 0.254544 0.321218    0.0140637  -0.00974633  -0.00164339 
1559 O 0.345786 0.253047 0.321813    0.0207126   -0.0104101  -0.00126578 
1560 N 0.341372 0.252724 0.322876   0.00839598  -0.00867865  -0.00449236 
1561 C 0.346069 0.246953 0.324437   0.00955405  -0.00789028   -0.0072432 
1562 C   0.3417 0.243542 0.322507   0.00281979  -0.00742839   -0.0110962 
1563 C 0.326599 0.242345 0.312828   0.00298442  -0.00885121   -0.0139261 
1564 C 0.351474 0.239279 0.327363   0.00339388  -0.00624831   -0.0139438 
1565 C 0.326193 0.245584 0.314491    -0.003115  -0.00905966   -0.0169536 
1566 C 0.353885   0.2377 0.324521    0.0112932  -0.00606252  -0.00444078 
1567 O 0.368463 0.243867 0.335097    0.0171405  -0.00599936  -0.00525383 
1568 N 0.352084 0.230583 0.320379   0.00661264  -0.00419753  -0.00090888 
1569 C 0.366757 0.227707 0.326804   0.00761409  -0.00157253   0.00247148 
1570 C 0.366589 0.224213 0.325695  0.000725213   0.00127485   0.00601021 
1571 O 0.363339 0.224462 0.328175  -0.00835586   0.00217065   0.00274644 
1572 C 0.377321 0.234487 0.331583    0.0175579  -0.00275462   0.00577049 
1573 O 0.388414 0.230895 0.335567    0.0220553  -0.00156091   0.00678422 
1574 N 0.369902 0.240208 0.327047    0.0211213  -0.00525164   0.00717703 
1575 C 0.373795 0.243912 0.326643    0.0308712  -0.00745651   0.00947942 
1576 C 0.363192  0.24873 0.320081    0.0318698  -0.00996559    0.0103959 
1577 C 0.374696 0.246422 0.329405    0.0379002  -0.00945403   0.00581602 
1578 O 0.395007 0.258051 0.343524    0.0460632   -0.0100676   0.00751938 
1579 N 0.369744 0.251812 0.332424    0.0350268   -0.0101098  0.000860728 
1580 C 0.369908 0.253919 0.334852    0.0411383   -0.0111489  -0.00298534 
1581 C 0.351615 0.249363 0.325347     0.037046     -0.01145  -0.00786836 
1582 C 0.353867 0.269751 0.335134    0.0371584   -0.0135774  -0.00837852 
1583 C 0.343735 0.269584 0.331441    0.0315296   -0.0128454   -0.0119878 
1584 C  0.35922 0.282414 0.343264    0.0457716   -0.0158037  -0.00944425 
1585 C 0.385548  0.25129 0.343388    0.0430249  -0.00889913  -0.00345531 
1586 O 0.380047 0.241744 0.335593    0.0514255  -0.00957483  -0.00426856 
1587 N 0.390249 0.244781  0.34474    0.0352242   -0.0061412  -0.00313368 
1588 C  0.42784 0.263563 0.375315    0.0357389  -0.00361758  -0.00403035 
1589 C 0.431491 0.259442 0.378294    0.0245512 -0.000904599  -0.00481534 
1590 C 0.414255 0.253647 0.368373    0.0189105  -0.00192392   -0.0105559 
1591 C 0.453525 0.258442  0.39137    0.0238618   0.00247606  -0.00430327 
1592 C 0.413368 0.251234 0.369353   0.00797634 -0.000563995   -0.0118577 
1593 C  0.45998 0.281177 0.398068    0.0441522  -0.00301286  0.000444131 
1594 O  0.49851 0.307479 0.431582    0.0495985  -0.00202497  -0.00089762 
1595 N 0.466697 0.288912 0.401678    0.0457195  -0.00357266   0.00574666 
1596 C 0.509001 0.317171 0.433445    0.0539836  -0.00309977    0.0108559 
1597 C 0.516704 0.317217 0.435037     0.049046 -0.000560639    0.0165814 
1598 O 0.489082  0.30834  0.41424    0.0464702  -0.00300467     0.016981 
1599 C 0.527148 0.315076 0.444116    0.0380222   0.00419487    0.0161269 
1600 C 0.514087 0.333058 0.439424    0.0654376  -0.00743617    0.0116779 
1601 O 0.542133 0.350903 0.458268     0.073526  -0.00782226    0.0160577 
1602 N 0.502334  0.34162 0.438515    0.0662416   -0.0106114   0.00737452 
1603 C 0.500714 0.352832 0.439987    0.0760831   -0.0149045    0.0070762 
1604 C 0.478461 0.353831 0.430999    0.0725787    -0.017199   0.00242711 
1605 O 0.483618 0.372209 0.438952    0.0794049   -0.0213907   0.00304004 
1606 C 0.479542 0.360481 0.439286    0.0729442    -0.016493  -0.00341207 
1607 C 0.524249 0.367992 0.459659    0.0867815   -0.0154107   0.00607728 
1608 O 0.509516 0.342668 0.443438    0.0857307   -0.0126677   0.00351396 
1609 N  0.54483 0.393425  0.47826    0.0975132   -0.0191378    0.0079784 
1610 C 0.578825 0.422001  0.50931     0.109459   -0.0203244   0.00715494 
1611 C 0.621368 0.473828 0.550419     0.120607   -0.0255942   0.00953159 
1612 C 0.689932 0.535962  0.61435     0.134852    -0.027358   0.00973553 
1613 C 0.756899 0.574295 0.666672     0.137902   -0.0231907    0.0136985 
1614 O  0.81624 0.617722 0.716284     0.131267   -0.0199086    0.0184622 
1615 O 0.802016 0.612601 0.709866     0.147202   -0.0229805    0.0121096 
1616 C 0.545608 0.400162 0.487141     0.109589    -0.020045  0.000335456 
1617 O 0.510463 0.386199 0.463752     0.108249   -0.0223392  -0.00337644 
1618 N 0.551617 0.391182 0.488824     0.110738    -0.016725  -0.00137904 
1619 C 0.553377 0.400871  0.49915     0.109426   -0.0153117  -0.00778417 
1620 C 0.541734 0.383523 0.487827    0.0965058   -0.0116181  -0.00998288 
1621 C 0.523486 0.373137 0.476882    0.0952165   -0.0100562    -0.016458 
1622 O 0.516428 0.381406 0.477931     0.101893   -0.0117068   -0.0193559 
1623 O 0.519044 0.359557 0.469879    0.0877678  -0.00709312   -0.0188212 
1624 C 0.597692 0.433027 0.538366     0.120105   -0.0142092  -0.00909696 
1625 O 0.595837 0.415715 0.531454     0.117302   -0.0104387   -0.0110149 
1626 N 0.639136 0.481395 0.581087     0.132946   -0.0176163  -0.00849592 
1627 C 0.658568 0.487723 0.594414     0.144517   -0.0166214  -0.00902582 
1628 C 0.670674 0.514191 0.610368     0.157602   -0.0219432  -0.00796678 
1629 C 0.659885 0.516909 0.602755      0.15216   -0.0255193  -0.00514026 
1630 C 0.629129 0.492036 0.578325      0.13712   -0.0227577  -0.00761144 
1631 C 0.661302 0.491887 0.602654     0.143991   -0.0133897   -0.0155366 
1632 O 0.669563 0.481766  0.60275     0.149328   -0.0106444     -0.01608 
1633 N 0.640523  0.49167 0.594711     0.137663   -0.0133209   -0.0204182 
1634 C 0.639864 0.493548 0.598854     0.137381   -0.0099791   -0.0265995 
1635 C 0.633925 0.515962 0.608831     0.138894   -0.0115058   -0.0309837 
1636 C 0.652895 0.547224 0.633528     0.152551   -0.0151779   -0.0310329 
1637 O 0.681491 0.566354 0.657809     0.163252   -0.0143104   -0.0318176 
1638 O 0.658804 0.572286 0.648231     0.152661   -0.0190508    -0.030566 
1639 C 0.626622 0.469722 0.581806     0.124957  -0.00605539   -0.0287458 
1640 O 0.607716 0.453207 0.565987      0.12352  -0.00323162   -0.0340353 
1641 N 0.607929 0.439979 0.556438     0.116072  -0.00588695   -0.0248532 
1642 C 0.585975 0.408571 0.531116     0.104339  -0.00287068   -0.0269459 
1643 C 0.547981 0.388981 0.503029    0.0966343   -0.0024708   -0.0314234 
1644 O 0.526865 0.363039 0.480317    0.0921541  0.000166826   -0.0357715 
1645 N 0.518988 0.380493 0.483541    0.0951874  -0.00501032   -0.0304419 
1646 C  0.49563 0.373337 0.468719     0.088357  -0.00413909   -0.0342014 
1647 C 0.496043 0.396987 0.481214    0.0923012  -0.00590559   -0.0353364 
1648 C 0.511968 0.415413  0.49873     0.104691  -0.00804353   -0.0344513 
1649 C 0.480421 0.393329 0.470557    0.0854431  -0.00815791   -0.0327122 
1650 C  0.46145 0.337642 0.432905    0.0763829  -0.00423829   -0.0324624 
1651 O 0.439228 0.322716 0.414064    0.0697018  -0.00300334   -0.0354403 
1652 N 0.462429 0.328934 0.428301    0.0739712  -0.00547768   -0.0275817 
1653 C 0.442547 0.310224 0.408474    0.0632286  -0.00567338   -0.0258008 
1654 C 0.442215 0.308826 0.406094    0.0630557  -0.00763421   -0.0198971 
1655 C  0.43537 0.304304 0.400171    0.0522471  -0.00746258   -0.0183152 
1656 C 0.433705 0.316788 0.404371    0.0696112   -0.0105615   -0.0189006 
1657 C 0.441823  0.29404 0.401109    0.0562284  -0.00332442   -0.0277903 
1658 O 0.455046 0.292412 0.407572    0.0533987  -0.00260262   -0.0248862 
1659 N 0.417894 0.273598 0.378909    0.0535251  -0.00199443    -0.032952 
1660 C 0.418046 0.261626 0.373468     0.046581 -0.000407287   -0.0360993 
1661 C 0.428053 0.266685 0.380621    0.0506211   0.00163987   -0.0418294 
1662 C 0.416738 0.272479 0.375958    0.0533957   0.00212934   -0.0451155 
1663 O 0.387616 0.259076 0.353758    0.0505858  0.000878637    -0.043504 
1664 O 0.420145 0.272836 0.377483     0.059043   0.00420849   -0.0491313 
1665 C 0.393327 0.248266 0.353162    0.0371394  -0.00146099   -0.0365887 
1666 O 0.365874 0.235674 0.332173    0.0366351  -0.00290155   -0.0342487 
1667 N 0.385344 0.233579 0.341646    0.0300595 -0.000898543   -0.0400014 
1668 C 0.373872 0.232007 0.333725    0.0215459  -0.00228939   -0.0403017 
1669 C 0.385166  0.23324 0.340129    0.0143335  -0.00212283   -0.0446309 
1670 C 0.400818 0.235007 0.352553   0.00941247  -0.00159797   -0.0426501 
1671 O 0.403871 0.235324 0.355998    0.0118598  -0.00115275   -0.0373233 
1672 O 0.389281 0.215459 0.337991    0.0028314  -0.00153943   -0.0465064 
1673 C 0.364972  0.24014 0.330191    0.0228157  -0.00263953    -0.041895 
1674 O 0.348424 0.235288 0.318464    0.0190906  -0.00392279   -0.0396941 
1675 N 0.375365 0.251256 0.339425    0.0280804  -0.00100028   -0.0456869 
1676 C 0.385177 0.276152 0.353922    0.0292345 -0.000309635    -0.047048 
1677 C 0.418637 0.307566 0.384778    0.0348751   0.00236826    -0.051684 
1678 C 0.456675 0.359824 0.426758    0.0353846   0.00409971   -0.0531948 
1679 S 0.557824 0.457048 0.522397    0.0399057   0.00791128   -0.0594118 
1680 C 0.551256 0.451983   0.5214    0.0503864   0.00965913   -0.0589587 
1681 C 0.357023 0.260953 0.333659    0.0321502 -0.000987906   -0.0430634 
1682 O 0.333623 0.249774 0.314795    0.0291329  -0.00125556   -0.0421635 
1683 N 0.348164  0.24894 0.325898    0.0382422   -0.0013865   -0.0408128 
1684 C 0.334998 0.247692 0.319734    0.0410718  -0.00273022   -0.0375003 
1685 C 0.348245 0.255607  0.33225    0.0493104  -0.00346442    -0.035801 
1686 C 0.345435 0.265019 0.336122    0.0532384  -0.00555498   -0.0330052 
1687 C 0.339938 0.260251 0.330343    0.0500849  -0.00774656   -0.0286461 
1688 C 0.352575 0.283691 0.350132    0.0599306    -0.005284   -0.0351776 
1689 C 0.335458 0.266701 0.331134    0.0538672   -0.0100399   -0.0266028 
1690 C 0.338999 0.282151 0.343106    0.0633273  -0.00776655   -0.0333494 
1691 C 0.332056 0.274851 0.334675    0.0603062    -0.010325   -0.0291404 
1692 C 0.331436 0.248219 0.317792    0.0346809  -0.00467948   -0.0336522 
1693 O 0.296079 0.226041 0.288426    0.0332266  -0.00518833   -0.0326627 
1694 N 0.329966 0.235332 0.311041    0.0302127  -0.00528872   -0.0319421 
1695 C 0.318273 0.227155 0.300853    0.0242073  -0.00665925   -0.0284546 
1696 C 0.334486  0.22886 0.311312    0.0203112  -0.00649757   -0.0267445 
1697 C   0.3617 0.243983 0.333835    0.0258556  -0.00606852   -0.0242067 
1698 C 0.378857 0.244004 0.344436     0.021006  -0.00468266   -0.0234112 
1699 C 0.361901 0.250998 0.336428    0.0294116  -0.00755986   -0.0194847 
1700 C 0.312187 0.230968 0.297721    0.0182667   -0.0067592   -0.0299697 
1701 O 0.309103 0.237503  0.29877    0.0157876  -0.00764395   -0.0275831 
1702 N 0.303032 0.218757 0.285541    0.0162545   -0.0058895   -0.0339724 
1703 C  0.29687 0.220782 0.280443    0.0117392  -0.00607311   -0.0354821 
1704 C 0.303689 0.222095 0.281893    0.0105011  -0.00539583    -0.040252 
1705 C 0.313603 0.220802 0.287307    0.0056572  -0.00660341   -0.0416932 
1706 S 0.338168 0.237489 0.304394   0.00489473  -0.00613628   -0.0484189 
1707 C 0.338008 0.250173 0.304637   0.00359562  -0.00652285   -0.0494671 
1708 C  0.28937 0.226132 0.278189     0.014552  -0.00504006   -0.0350252 
1709 O 0.272406 0.217594 0.264052    0.0113385  -0.00551948   -0.0333569 
1710 N 0.286645 0.224816 0.277103    0.0205068  -0.00341993   -0.0366068 
1711 C 0.292918 0.243507 0.289214    0.0226002  -0.00176484   -0.0370035 
1712 C 0.306622  0.25758 0.304505     0.029215  0.000317088   -0.0398193 
1713 C 0.327903 0.272922  0.32003    0.0297939   0.00269428   -0.0439357 
1714 O 0.340918 0.284798 0.328621    0.0253446   0.00302665   -0.0450238 
1715 N 0.342207 0.283888 0.333966    0.0358175   0.00440821    -0.046538 
1716 C 0.287837 0.246528 0.290021    0.0221894  -0.00331857   -0.0334413 
1717 O 0.268921 0.236927 0.274972    0.0199389  -0.00261269   -0.0328318 
1718 N 0.296687 0.250709 0.298592    0.0245582  -0.00529236   -0.0310908 
1719 C 0.303666 0.264499  0.30987    0.0248864  -0.00703169   -0.0280155 
1720 C 0.314982 0.269282 0.319105    0.0294682  -0.00884083   -0.0258408 
1721 C 0.301853 0.263959 0.307252    0.0185139  -0.00782659   -0.0255647 
1722 O 0.309174 0.280279 0.318703    0.0169051  -0.00793267   -0.0245726 
1723 N 0.310769 0.264044 0.311186    0.0147893  -0.00822694   -0.0249754 
1724 C 0.310765 0.266065 0.311095   0.00903683  -0.00895493   -0.0230132 
1725 C 0.318175 0.263403  0.31394   0.00525489  -0.00939435   -0.0231502 
1726 C 0.310477 0.274156 0.312697   0.00660818  -0.00802314   -0.0243609 
1727 O   0.3077 0.277346 0.312121   0.00408226  -0.00838745   -0.0223861 
1728 N 0.318927 0.281952  0.31923   0.00752642  -0.00655053   -0.0276201 
1729 C 0.315367 0.284571 0.315629    0.0058831  -0.00508592   -0.0286997 
1730 C 0.312879 0.291294 0.318573   0.00691622  -0.00366976   -0.0275795 
1731 O 0.310156 0.293096 0.316508   0.00427368  -0.00336995   -0.0260776 
1732 N 0.318987 0.300203  0.32883    0.0108164  -0.00296148   -0.0284354 
1733 C 0.317188 0.307788 0.333131    0.0113285  -0.00155374   -0.0283933 
1734 C 0.344614 0.339486 0.365741    0.0160249 -0.000787041   -0.0305625 
1735 O 0.380116  0.37246  0.39912    0.0180026   0.00175311   -0.0334794 
1736 C 0.361937 0.367355 0.390317    0.0155226  0.000752585   -0.0312975 
1737 C 0.289605 0.282749 0.307407   0.00928129  -0.00368632   -0.0253476 
1738 O 0.258775 0.256953 0.278436   0.00681027  -0.00256989   -0.0246423 
1739 N 0.275828 0.264714 0.292479    0.0105531   -0.0063218   -0.0235288 
1740 C 0.283117 0.274228 0.300831   0.00913004   -0.0080322    -0.020714 
1741 C 0.300373 0.285496 0.315593     0.011486   -0.0102596   -0.0187027 
1742 C 0.325225 0.311929 0.342715    0.0173681   -0.0112463   -0.0199233 
1743 C 0.341637 0.318367 0.353939    0.0202673   -0.0127068    -0.017897 
1744 C 0.335183 0.331212 0.357569     0.018745   -0.0124967   -0.0199794 
1745 C 0.270099 0.260658  0.28552   0.00448523   -0.0078233   -0.0189273 
1746 O 0.254362 0.249672 0.271731   0.00293722  -0.00772401   -0.0176534 
1747 N 0.277871 0.262853 0.289254   0.00243208  -0.00795536   -0.0190873 
1748 C 0.271264 0.257068 0.281151   -0.0013772  -0.00826619   -0.0176435 
1749 C 0.273942 0.253614 0.280029  -0.00350886  -0.00925972   -0.0185951 
1750 C 0.284301 0.258126  0.28968  -0.00467948    -0.010505    -0.016957 
1751 C 0.289749 0.256484  0.29193  -0.00670278   -0.0110827   -0.0190223 
1752 C 0.280048 0.257284 0.287138  -0.00743895   -0.0110066   -0.0140477 
1753 C 0.271307 0.262379 0.281671  -0.00218656  -0.00647013   -0.0181704 
1754 O 0.276428 0.270755 0.287535  -0.00377866    -0.006416   -0.0163146 
1755 N 0.259432 0.250571 0.268703 -0.000902419  -0.00453278   -0.0205999 
1756 C 0.254431 0.248868 0.262847  -0.00163994  -0.00206508   -0.0207338 
1757 C  0.27315 0.265956  0.27833 -0.000402507  0.000358783   -0.0232877 
1758 C 0.289338 0.276602 0.288703 -0.000823858  -0.00159673   -0.0245367 
1759 C  0.26517 0.260407 0.268791  -0.00112836   0.00372399   -0.0227639 
1760 C 0.295154 0.282607 0.291324  -0.00324102  -0.00381761   -0.0228437 
1761 C 0.243341 0.243122 0.256707  -0.00154908 -0.000423998   -0.0201898 
1762 O 0.236757 0.238241 0.249636  -0.00310602  0.000708452    -0.018749 
1763 N 0.239885  0.24233 0.257956  0.000408004 -0.000415469   -0.0215785 
1764 C 0.239702 0.248169 0.263141  5.84732e-05  0.000760976   -0.0219568 
1765 C 0.233974 0.246449  0.26283   0.00294107 -8.14152e-05   -0.0240558 
1766 C 0.249556 0.258395  0.27278  -0.00150765  -0.00111266   -0.0194365 
1767 O 0.254014 0.265115 0.278235  -0.00330052  0.000534362   -0.0190363 
1768 N 0.251118 0.257018 0.272663 -0.000835762  -0.00412069   -0.0177327 
1769 C  0.26538 0.271951 0.286725  -0.00189913  -0.00551235   -0.0154459 
1770 C  0.27047 0.273442 0.290035 -0.000782536  -0.00807726   -0.0136976 
1771 C 0.274607 0.280334 0.293259  -0.00428762  -0.00453733   -0.0136765 
1772 O 0.297237 0.304757 0.316452  -0.00507558  -0.00438261    -0.012493 
1773 N 0.270703 0.273931 0.286211   -0.0049404  -0.00400617   -0.0137733 
1774 C 0.298823 0.301768 0.311369  -0.00621996  -0.00355272   -0.0122536 
1775 C 0.327678 0.328119 0.336221  -0.00646724  -0.00437887   -0.0128573 
1776 C 0.372223 0.371355 0.380289  -0.00772194  -0.00716038   -0.0123615 
1777 N 0.393576 0.389249 0.402271   -0.0079103  -0.00845735    -0.013349 
1778 C   0.4064  0.40134 0.414884   -0.0100356   -0.0102544   -0.0128168 
1779 N 0.392202  0.39118 0.400488   -0.0107783   -0.0106332   -0.0117552 
1780 C 0.379908 0.380672 0.387105   -0.0089454  -0.00863613    -0.011291 
1781 C 0.291684 0.295798 0.303866  -0.00635374 -0.000422522   -0.0124869 
1782 O 0.285657 0.290448 0.297593  -0.00686242   0.00033216   -0.0109962 
1783 N 0.275365 0.278965 0.287076  -0.00591118    0.0018884   -0.0143864 
1784 C  0.26297 0.265781 0.272628  -0.00640544   0.00574604   -0.0143612 
1785 C 0.273678 0.275258 0.281472  -0.00570931   0.00817459   -0.0163243 
1786 C 0.288826 0.287374 0.291349  -0.00593532    0.0124511   -0.0155543 
1787 O 0.292466 0.288518 0.290296  -0.00568426    0.0122372   -0.0130948 
1788 O 0.301842 0.300389 0.304764  -0.00609375    0.0163027   -0.0172773 
1789 C 0.246281  0.25141 0.260284  -0.00769752   0.00793965   -0.0149276 
1790 O 0.228965  0.23223 0.240868  -0.00851407   0.00997427   -0.0135868 
1791 N 0.249313 0.258408  0.26924  -0.00770007   0.00748816   -0.0172279 
1792 C 0.245616  0.25813 0.270573  -0.00928457   0.00918758   -0.0188837 
1793 C 0.249692 0.268103 0.281448   -0.0083415   0.00771341   -0.0218695 
1794 O 0.270751 0.289088  0.30186  -0.00615343    0.0031654   -0.0207337 
1795 C 0.257723 0.277562 0.291252  -0.00755514     0.010038   -0.0239352 
1796 C  0.24584 0.257771 0.270053  -0.00992829   0.00762576   -0.0173073 
1797 O 0.236232 0.246436 0.259694   -0.0116439    0.0103871   -0.0171984 
1798 N 0.232894  0.24542 0.256751  -0.00850808   0.00367962   -0.0160547 
1799 C  0.24224 0.254457 0.265021  -0.00869123   0.00227973   -0.0145378 
1800 C  0.23709 0.249469 0.259104   -0.0071294  -0.00138665   -0.0130005 
1801 O 0.265261 0.279688 0.290091  -0.00566406  -0.00303833   -0.0147595 
1802 C 0.241524 0.254715 0.263103  -0.00701795  -0.00256694   -0.0122064 
1803 C 0.238197 0.246554 0.256451  -0.00916927   0.00425147   -0.0122237 
1804 O 0.235225 0.242577 0.253029  -0.00995827   0.00573611   -0.0121903 
1805 N 0.237029 0.243122 0.251663  -0.00838791   0.00421867   -0.0106032 
1806 C 0.232189  0.23528 0.242212  -0.00778688   0.00552921  -0.00832405 
1807 C  0.24418 0.246152 0.250432  -0.00663083   0.00452356  -0.00730576 
1808 C 0.237276 0.237037 0.245729  -0.00868593   0.00985249  -0.00881344 
1809 O 0.218619 0.215572 0.224627  -0.00833597    0.0113248  -0.00746456 
1810 N 0.236649 0.236076 0.246109  -0.00976797    0.0123762   -0.0106709 
1811 C 0.244304 0.240052 0.252687   -0.0114638    0.0174099   -0.0113281 
1812 C  0.25113 0.248191 0.261845   -0.0127326    0.0201667   -0.0136007 
1813 S 0.269256 0.262641 0.272487   -0.0105084    0.0212184   -0.0119204 
1814 C 0.249876 0.246005 0.261849   -0.0135442    0.0184624   -0.0129019 
1815 O 0.256413  0.24702 0.265178   -0.0144059    0.0220508   -0.0121847 
1816 N 0.245475 0.247542  0.26354    -0.014222    0.0154738   -0.0152998 
1817 C 0.243226  0.24659 0.264573   -0.0161112    0.0156225   -0.0175581 
1818 C 0.239408 0.250425  0.26708   -0.0160111    0.0116902   -0.0204427 
1819 C 0.248973 0.265122 0.283385   -0.0179046    0.0132438   -0.0242358 
1820 S 0.261842 0.276846 0.299795   -0.0227752    0.0185476   -0.0277271 
1821 C 0.256837 0.271679 0.294043   -0.0231433    0.0157131   -0.0289216 
1822 C  0.24195 0.241647 0.258796   -0.0147436    0.0147431   -0.0152419 
1823 O 0.242479 0.238861 0.258492   -0.0161879    0.0169848   -0.0162535 
1824 N  0.25001 0.250429   0.2643   -0.0120688    0.0116697   -0.0124226 
1825 C 0.238958 0.237094 0.249764   -0.0104539    0.0111959   -0.0102733 
1826 C  0.23857 0.239483 0.248537  -0.00820312   0.00781531  -0.00765888 
1827 C 0.239745 0.245388 0.253374  -0.00849924   0.00444459  -0.00885685 
1828 C 0.232847 0.232212 0.239773  -0.00624575   0.00811725  -0.00540363 
1829 C 0.240458 0.247965 0.253822  -0.00732548   0.00173514  -0.00666856 
1830 C 0.247807 0.239063 0.253469   -0.0097967    0.0150525  -0.00857453 
1831 O  0.24009 0.227532 0.243867  -0.00987744    0.0169235   -0.0088483 
1832 N  0.25658 0.245534 0.258956  -0.00863864    0.0161983  -0.00670668 
1833 C 0.259531 0.241108 0.255468  -0.00702914    0.0197533   -0.0044726 
1834 C 0.262922 0.238344 0.258369  -0.00998724    0.0248252  -0.00636717 
1835 O  0.25926 0.227925 0.250577  -0.00921628      0.02758  -0.00542959 
1836 N 0.260891  0.23869 0.260959   -0.0134612    0.0262718  -0.00928784 
1837 C 0.264519 0.237018 0.265154   -0.0172146    0.0317199   -0.0114838 
1838 C 0.254435 0.230547 0.259801   -0.0202045    0.0337966   -0.0139053 
1839 C 0.260301 0.231517 0.266976   -0.0247651    0.0403538   -0.0161595 
1840 C 0.270744 0.229577 0.267468   -0.0236784    0.0460494    -0.012462 
1841 C 0.257014 0.234965 0.270424   -0.0273507    0.0417389   -0.0189974 
1842 C 0.268293 0.241711 0.273107   -0.0198936    0.0314679   -0.0148771 
1843 O 0.283351 0.249135 0.285677   -0.0218808    0.0358019   -0.0156519 
1844 N 0.265881 0.247656 0.275919   -0.0196499    0.0264136   -0.0167925 
1845 C 0.259057 0.242081 0.271642   -0.0213494    0.0252778   -0.0199933 
1846 C 0.262068 0.238253 0.268196   -0.0188525    0.0260322   -0.0177806 
1847 O 0.254467 0.226218 0.259887   -0.0208743    0.0281478   -0.0202826 
1848 N 0.253346 0.229216 0.255236   -0.0144465    0.0242343   -0.0134943 
1849 C 0.263908 0.233896 0.260014   -0.0112806    0.0253764   -0.0111456 
1850 C 0.264161 0.237679 0.258311  -0.00676961    0.0224331  -0.00711538 
1851 O 0.257226 0.239525 0.256072  -0.00701367    0.0179505  -0.00785163 
1852 C 0.276971 0.245889 0.266008  -0.00269157    0.0235976  -0.00473605 
1853 C 0.277098 0.235729 0.267646   -0.0117064     0.031116   -0.0104085 
1854 O 0.291199 0.243091 0.278661   -0.0117347    0.0335489   -0.0114039 
1855 N 0.266037 0.221466 0.254297   -0.0117922    0.0336213  -0.00852214 
1856 C 0.289467 0.232651 0.270923    -0.011805    0.0396297  -0.00701245 
1857 C  0.28764 0.229076 0.266175   -0.0114056    0.0416548   -0.0046601 
1858 C 0.296797 0.234557 0.280622   -0.0174831    0.0439323   -0.0113648 
1859 O   0.2995 0.226315 0.277901   -0.0173985    0.0481098   -0.0111389 
1860 N 0.292396 0.238278 0.284748   -0.0223371     0.042629   -0.0157147 
1861 C 0.295643 0.238866  0.29211   -0.0283878    0.0460264   -0.0208209 
1862 C 0.295569 0.250555 0.302479   -0.0327322    0.0438372    -0.025334 
1863 C 0.305617 0.261246 0.318795   -0.0391247    0.0458373   -0.0317358 
1864 C 0.322586 0.265825  0.33248   -0.0432854    0.0539902   -0.0320247 
1865 C 0.306196 0.275786 0.330585   -0.0422875     0.042743   -0.0362596 
1866 C 0.292408 0.233328 0.287799   -0.0282084    0.0445986   -0.0232724 
1867 O 0.296682 0.227451 0.289075   -0.0308751    0.0492562   -0.0251829 
1868 N 0.277702 0.227086 0.274829   -0.0251032    0.0386086   -0.0232404 
1869 C 0.293587 0.240774  0.28865   -0.0244395    0.0374267   -0.0255208 
1870 C 0.285684 0.243815  0.28326   -0.0214293    0.0309214   -0.0253044 
1871 C 0.281477 0.250021  0.28684   -0.0250074    0.0270368   -0.0302722 
1872 C 0.280907 0.258917 0.287898   -0.0216209    0.0214611   -0.0283839 
1873 C 0.291934 0.258787 0.297619   -0.0280139    0.0270504   -0.0358725 
1874 C 0.303751 0.238595 0.289661   -0.0204852    0.0411211   -0.0221241 
1875 O 0.318476 0.245482 0.301227   -0.0216054    0.0436004   -0.0247641 
1876 N 0.315197 0.248167 0.296623   -0.0155665    0.0414401   -0.0164696 
1877 C 0.328434 0.250764 0.301233   -0.0105338    0.0444942   -0.0127505 
1878 C 0.323856  0.25053 0.294296  -0.00454757    0.0419383  -0.00717782 
1879 C  0.31442 0.252769 0.288554  -0.00141317    0.0362612  -0.00627255 
1880 C 0.315871 0.257608 0.287638   0.00419175    0.0342575  -0.00124628 
1881 C 0.324001 0.260645 0.296386  0.000650242    0.0362192  -0.00760411 
1882 C 0.362969 0.270341 0.330223   -0.0129341     0.051557   -0.0129092 
1883 O 0.398222 0.294056 0.357538  -0.00912221    0.0549241   -0.0106961 
1884 N 0.367652 0.274902   0.3391   -0.0191984    0.0541932    -0.015578 
1885 C  0.38748 0.280503 0.354683   -0.0230671    0.0616965   -0.0163902 
1886 C  0.39752 0.289601 0.364074   -0.0243346    0.0647651   -0.0136483 
1887 C 0.424563 0.298844 0.382938   -0.0261446    0.0734923   -0.0119875 
1888 O 0.456569 0.318062  0.40514   -0.0212777    0.0760478  -0.00879748 
1889 O 0.423992  0.29693 0.385604    -0.032149     0.078035   -0.0137501 
1890 C 0.381579 0.274506 0.355094   -0.0308776    0.0632793   -0.0236148 
1891 O 0.405499 0.288694 0.378277   -0.0362511    0.0696409   -0.0255859 
1892 N 0.377504 0.281218 0.356899   -0.0314837    0.0575218   -0.0276396 
1893 C 0.375996 0.282317 0.361751   -0.0382559    0.0573054    -0.035167 
1894 C 0.365378 0.288626 0.362202   -0.0415411    0.0522258   -0.0386241 
1895 O 0.370602 0.296356   0.3707   -0.0432553    0.0546113   -0.0365363 
1896 C 0.383927 0.288929 0.366307    -0.035674    0.0544758   -0.0374572 
1897 O  0.34313 0.260297 0.329975   -0.0348408    0.0483244   -0.0396941 
1898 N 0.400459 0.290228 0.374357   -0.0341858    0.0591096   -0.0370869 
1899 C  0.41126 0.299384 0.380491   -0.0300588    0.0567543   -0.0382395 
1900 C 0.442511 0.310944 0.402053   -0.0287778    0.0636633   -0.0373806 
1901 C 0.458333 0.317255 0.416392   -0.0317652    0.0697916   -0.0348182 
1902 C 0.439135 0.311862 0.406754   -0.0358994    0.0671841   -0.0352451 
1903 C 0.400953 0.297481 0.375546   -0.0343261    0.0524905   -0.0457382 
1904 O 0.373437 0.277515 0.347183   -0.0301958    0.0476047    -0.045593 
1905 N 0.405178 0.300746 0.385141   -0.0425053    0.0543334   -0.0523997 
1906 C 0.407593 0.311305 0.392194   -0.0463763    0.0498182   -0.0602082 
1907 C 0.440684 0.341791 0.431616   -0.0560536    0.0530736   -0.0677544 
1908 C 0.483027 0.364394 0.466898   -0.0590579    0.0606151   -0.0697019 
1909 O  0.50781 0.377132 0.481183   -0.0527517    0.0631182   -0.0651755 
1910 O 0.528411 0.406388  0.51743   -0.0676629    0.0640905   -0.0760036 
1911 C 0.383701  0.30624 0.375213   -0.0446795    0.0420092   -0.0603242 
1912 O 0.364011 0.292982 0.354307   -0.0425069    0.0369121   -0.0629657 
1913 N 0.356729 0.286974  0.35453   -0.0453881    0.0414839   -0.0573126 
1914 C 0.352938 0.299248 0.356637   -0.0431791      0.03476   -0.0565291 
1915 C 0.350164 0.302213 0.360792    -0.045144    0.0358869   -0.0542812 
1916 C 0.363024 0.315938 0.381802   -0.0534298    0.0392409   -0.0604429 
1917 C 0.370806 0.332725 0.395617   -0.0572675    0.0346744   -0.0687378 
1918 O 0.373474 0.349358 0.402922   -0.0550276    0.0277792   -0.0701516 
1919 N 0.364115  0.31784 0.388361   -0.0628424    0.0382324   -0.0744959 
1920 C 0.346212 0.294459  0.34379   -0.0353132    0.0315057    -0.050601 
1921 O 0.336128 0.293804 0.334581    -0.033016    0.0258741    -0.051628 
1922 N 0.356524 0.295962  0.34781   -0.0310937    0.0351493   -0.0444575 
1923 C 0.352802 0.295419 0.339847   -0.0241631    0.0323684    -0.039169 
1924 C 0.377857 0.312516 0.359718   -0.0198559    0.0361493   -0.0328273 
1925 C 0.405937 0.345757 0.385215   -0.0131021    0.0333041   -0.0276142 
1926 C 0.407302 0.360684 0.392418   -0.0130299    0.0278017   -0.0267715 
1927 C 0.416076 0.350165 0.391415  -0.00882363    0.0361871   -0.0218717 
1928 C 0.344981 0.286076 0.326837   -0.0217426    0.0308412   -0.0415639 
1929 O 0.351953 0.300836 0.333159   -0.0181129    0.0267405   -0.0399664 
1930 N 0.349108  0.27945 0.326808   -0.0239615    0.0345445   -0.0455772 
1931 C 0.354906 0.283083 0.327242   -0.0223262    0.0333693   -0.0491677 
1932 C 0.379953 0.294061 0.347929   -0.0256017     0.038416   -0.0537406 
1933 C 0.346669 0.286746 0.322642    -0.024231    0.0272074   -0.0539817 
1934 O 0.348792 0.291962 0.320175   -0.0203883    0.0245023   -0.0539617 
1935 N 0.341762 0.288904 0.325712   -0.0296845    0.0250125   -0.0580066 
1936 C 0.335624 0.294463 0.322707   -0.0306209    0.0186332   -0.0626558 
1937 C 0.344661 0.310833  0.34155   -0.0369737    0.0169773   -0.0681431 
1938 C 0.378135 0.336365 0.376685   -0.0440239    0.0209073   -0.0753498 
1939 C 0.386272 0.353509 0.396738   -0.0506175    0.0200787   -0.0801115 
1940 C 0.381396 0.337415  0.37441   -0.0445966    0.0185529   -0.0821495 
1941 C 0.311557 0.279674  0.29825   -0.0251109    0.0143596   -0.0570788 
1942 O 0.304386 0.277654 0.287549   -0.0224186    0.0101845   -0.0583121 
1943 N 0.306597 0.276517  0.29663   -0.0236907    0.0154855   -0.0511462 
1944 C 0.290692 0.268181 0.280639   -0.0191258    0.0120497   -0.0458622 
1945 C 0.289569 0.268546 0.284437   -0.0192679    0.0134871   -0.0411355 
1946 C 0.280767 0.267346 0.276994   -0.0158058    0.0100712   -0.0363816 
1947 C 0.285799 0.281759 0.284854   -0.0159363   0.00452692   -0.0393477 
1948 C 0.278418 0.265812 0.278995   -0.0164269    0.0114678   -0.0329899 
1949 C  0.29889  0.27288 0.281081   -0.0138194    0.0129812   -0.0419069 
1950 O 0.289029 0.268785 0.269079   -0.0106131    0.0097652   -0.0398936 
1951 N 0.314969 0.279294 0.292851   -0.0126224    0.0177893   -0.0405561 
1952 C 0.341925 0.303575 0.313336  -0.00740413    0.0192416   -0.0372508 
1953 C 0.351831 0.302968 0.319747  -0.00543338    0.0247309   -0.0350683 
1954 C 0.356522  0.30896 0.327405  -0.00334664    0.0258902    -0.029033 
1955 C 0.373497 0.314877 0.340294  -0.00108393    0.0310172   -0.0271952 
1956 N 0.354196 0.297855 0.322142   0.00297094    0.0315618    -0.021019 
1957 C 0.341273 0.278357 0.308178   0.00370199    0.0344538   -0.0185327 
1958 N 0.332235 0.273794 0.301077   0.00660466    0.0335374   -0.0136372 
1959 N  0.34459 0.269156  0.30686   0.00264051     0.038776   -0.0206595 
1960 C 0.359306  0.32061  0.32483  -0.00661235      0.01767   -0.0416634 
1961 O 0.373371 0.336863 0.334384    -0.002421    0.0172643   -0.0391101 
1962 N 0.371523 0.330291 0.337021   -0.0108024    0.0169286   -0.0485116 
1963 C 0.390986 0.350112 0.350406   -0.0101715    0.0145935   -0.0535044 
1964 C 0.420332 0.374877 0.380655   -0.0158228     0.014747    -0.061823 
1965 C 0.474812 0.431555 0.429617   -0.0159928    0.0108888   -0.0684839 
1966 C 0.513551 0.468004 0.471225   -0.0226018    0.0101796   -0.0776345 
1967 O 0.536107 0.494652 0.503275    -0.027699   0.00963886   -0.0794458 
1968 O 0.545668 0.494543 0.496249   -0.0228704    0.0102854   -0.0833429 
1969 C 0.357627 0.327915 0.317859  -0.00861691   0.00881073   -0.0527081 
1970 O 0.359014 0.330629 0.312139  -0.00517061    0.0072204   -0.0528326 
1971 N 0.352461 0.330084 0.320654   -0.0109899   0.00588578   -0.0521491 
1972 C 0.344823 0.332286 0.313986  -0.00967504  6.02958e-05   -0.0523796 
1973 C 0.380622 0.372931 0.353176   -0.0135407   -0.0041005    -0.060415 
1974 C 0.412335 0.413741 0.382616   -0.0105752   -0.0106466   -0.0614665 
1975 O 0.409106 0.411989 0.374983  -0.00583711   -0.0114337   -0.0553838 
1976 O 0.483615 0.490371 0.456152    -0.012779   -0.0148219   -0.0681756 
1977 C 0.308626 0.302222 0.284032  -0.00888225  -0.00132437   -0.0470405 
1978 O 0.301649 0.299665 0.284828   -0.0119799  -0.00279794   -0.0488502 
1979 N 0.298128 0.292206 0.270273  -0.00481761  -0.00068511   -0.0406429 
1980 C 0.288409  0.28753 0.265294  -0.00390383  -0.00216728    -0.035783 
1981 C 0.289198 0.287575 0.260164  0.000190001  -0.00108929   -0.0303825 
1982 C 0.302546 0.294478 0.267667   0.00138096   0.00302318   -0.0310906 
1983 C 0.315394  0.30473 0.279458  -0.00125285   0.00219331   -0.0381378 
1984 C  0.26848 0.275232 0.248902  -0.00426773  -0.00756967   -0.0382081 
1985 O 0.256332 0.266527 0.242897  -0.00494046  -0.00836021   -0.0361421 
1986 N 0.277224 0.286721 0.253496  -0.00339472   -0.0113923   -0.0427945 
1987 C 0.287769 0.305312 0.266453  -0.00225238   -0.0171905   -0.0448599 
1988 C 0.282889 0.302363 0.253262  0.000579084   -0.0214134    -0.048467 
1989 O 0.295688 0.315074 0.266942  -0.00285788   -0.0219333   -0.0559838 
1990 C 0.285863 0.308953 0.275159   -0.0065462   -0.0186004   -0.0499547 
1991 O 0.286425 0.317368 0.280289     -0.00551   -0.0229951   -0.0512949 
1992 N 0.279237  0.29778 0.272346   -0.0110856   -0.0142954   -0.0523176 
1993 C 0.292646 0.314915 0.296086     -0.01592   -0.0136233   -0.0561784 
1994 C 0.323734 0.338512 0.327994   -0.0209425  -0.00867725   -0.0599003 
1995 C 0.379622 0.396428 0.385014   -0.0246437   -0.0106559   -0.0685476 
1996 C 0.397927 0.404955 0.403771   -0.0297399  -0.00465436   -0.0712226 
1997 C 0.386681 0.415924 0.402247   -0.0270441   -0.0152207   -0.0738981 
1998 C 0.265979 0.289055 0.275277   -0.0160509   -0.0115088   -0.0512897 
1999 O 0.262775 0.289379  0.28058   -0.0197801   -0.0105551   -0.0541276 
2000 N  0.25803 0.277992 0.262992   -0.0123609    -0.010519   -0.0444167 
2001 C 0.251604 0.271138 0.260991   -0.0126201  -0.00828929   -0.0400637 
2002 C 0.251187 0.266727 0.255177  -0.00909983  -0.00701583   -0.0331854 
2003 C 0.256963 0.276559 0.258639  -0.00534886   -0.0110892   -0.0308111 
2004 C 0.252637 0.265382 0.259852   -0.0101649  -0.00357424   -0.0295149 
2005 C  0.25092 0.278804 0.267623   -0.0126337   -0.0115699   -0.0416521 
2006 O 0.258856 0.287041 0.280916   -0.0142925  -0.00929307   -0.0404066 
2007 N 0.253228 0.287751 0.269589   -0.0102522   -0.0168398   -0.0443535 
2008 C 0.258277 0.301486 0.281693  -0.00925418   -0.0203259    -0.046159 
2009 C 0.258387 0.306931 0.291923   -0.0143926   -0.0189778   -0.0522119 
2010 O 0.226346 0.277637 0.266873   -0.0157141   -0.0171825   -0.0517884 
2011 N 0.252236 0.300898 0.286021   -0.0177918   -0.0188739   -0.0577236 
2012 C 0.253495 0.305463  0.29664   -0.0239861   -0.0162868   -0.0636345 
2013 C 0.258684 0.309434 0.300891    -0.027868   -0.0163582   -0.0700013 
2014 C 0.271505 0.332532 0.315046   -0.0263206   -0.0233816   -0.0760709 
2015 O 0.292636 0.360404 0.343775    -0.031166   -0.0245624   -0.0841221 
2016 N 0.268895 0.330852 0.304949   -0.0199838   -0.0278072   -0.0726311 
2017 C 0.249538 0.293227 0.293843   -0.0273123  -0.00918053    -0.060193 
2018 O 0.239449 0.286681 0.292229   -0.0309537   -0.0065116   -0.0623493 
2019 N 0.245424 0.278389 0.280976   -0.0258735   -0.0060582   -0.0551169 
2020 C  0.24406 0.268338 0.278841   -0.0281687  0.000290151   -0.0517913 
2021 C 0.238124 0.252147 0.263269    -0.025796   0.00267162   -0.0472653 
2022 C 0.231847 0.258569 0.270239   -0.0268505   0.00116848   -0.0479148 
2023 O 0.249389 0.273971 0.291639   -0.0301761   0.00569897   -0.0481677 
2024 N 0.219948 0.250699 0.256745   -0.0221296  -0.00291829   -0.0446393 
2025 C 0.211183 0.243715 0.250706   -0.0205957  -0.00241927   -0.0413466 
2026 C 0.215897 0.249236  0.25088   -0.0153255   -0.0063926   -0.0370044 
2027 C 0.211892 0.248898 0.250857   -0.0136023  -0.00719357   -0.0355318 
2028 C 0.217192  0.24221 0.244177   -0.0137216     -0.00445   -0.0316055 
2029 C 0.217136 0.258055 0.266611   -0.0230597  -0.00233147   -0.0458557 
2030 O 0.206187 0.245837 0.258507   -0.0245539   0.00142071   -0.0446343 
2031 N 0.216983  0.26693 0.271778   -0.0234071  -0.00632914   -0.0513116 
2032 C 0.219936 0.279667 0.285894   -0.0260733   -0.0060616   -0.0564143 
2033 C 0.217138 0.288442 0.288413   -0.0250905   -0.0121593   -0.0624271 
2034 C 0.216526 0.291172 0.283413   -0.0178591   -0.0183733   -0.0595787 
2035 C 0.207766 0.281718 0.275098   -0.0143599   -0.0175928   -0.0549954 
2036 O 0.186082 0.267348 0.262643   -0.0153479   -0.0163985   -0.0576466 
2037 O 0.205277 0.271296 0.263923   -0.0109144   -0.0178071   -0.0490095 
2038 C 0.229801 0.286166 0.300294   -0.0327595  0.000627963   -0.0590178 
2039 O 0.217439 0.277151 0.294577   -0.0347265   0.00397195   -0.0597765 
2040 N 0.241779 0.290664 0.308037    -0.036095   0.00304379   -0.0602689 
2041 C 0.251687 0.294797 0.320613   -0.0424748   0.00999923   -0.0623485 
2042 C 0.264925 0.302606  0.33068   -0.0458979    0.0105466   -0.0661823 
2043 C 0.279555 0.307884 0.345991    -0.052403    0.0184741   -0.0676663 
2044 C 0.289021 0.325176 0.367845   -0.0591214    0.0215064   -0.0739981 
2045 O 0.274161 0.324622 0.362486   -0.0582836    0.0176267   -0.0770047 
2046 O 0.299894 0.327685  0.37904   -0.0653268    0.0279822   -0.0762501 
2047 C 0.248737 0.281299 0.311744   -0.0417899    0.0156993   -0.0559583 
2048 O 0.246192 0.276922 0.313029   -0.0456982    0.0214481   -0.0565954 
2049 N 0.235167 0.261913 0.289285    -0.036634    0.0140312   -0.0498536 
2050 C 0.234346 0.253104 0.283043   -0.0351371    0.0180968   -0.0440704 
2051 C 0.233366 0.247544 0.273398   -0.0298844    0.0152134   -0.0386094 
2052 C 0.244317 0.249513 0.277181   -0.0298343    0.0168951   -0.0374655 
2053 C 0.251396  0.25534 0.277963   -0.0248423    0.0135369   -0.0331113 
2054 C 0.258445 0.253172 0.287103   -0.0315666    0.0233449   -0.0351816 
2055 C 0.233372 0.258226 0.287477   -0.0345506    0.0186675   -0.0436353 
2056 O 0.225873 0.245932 0.279115   -0.0362868    0.0240538   -0.0419886 
2057 N 0.223945  0.25872 0.282671   -0.0315783    0.0131753    -0.045016 
2058 C 0.224644 0.265596 0.288518   -0.0301584    0.0131883   -0.0450117 
2059 C 0.220614 0.270516 0.287408   -0.0256477   0.00638749   -0.0459969 
2060 C 0.215604 0.260467 0.273881   -0.0207324   0.00285667   -0.0407564 
2061 C 0.218368 0.269824 0.277685    -0.016482  -0.00345985    -0.041628 
2062 C  0.21139 0.252145 0.266562   -0.0187121   0.00472339   -0.0366721 
2063 C 0.227514 0.273018 0.300294   -0.0353015    0.0181107    -0.049563 
2064 O 0.240349 0.284158 0.313602   -0.0358589    0.0224907   -0.0480668 
2065 N 0.229876 0.281335 0.309661   -0.0392267    0.0175284   -0.0553606 
2066 C 0.228756 0.285687 0.318619   -0.0451188    0.0224745   -0.0604628 
2067 C 0.238883 0.304216 0.336826   -0.0490358    0.0196635   -0.0677273 
2068 C 0.247731 0.320827 0.358389   -0.0560914    0.0246129   -0.0741246 
2069 C 0.262255 0.339352 0.378681    -0.061765    0.0232491   -0.0813595 
2070 N 0.270196 0.331509 0.376979   -0.0650559    0.0274214   -0.0795096 
2071 C 0.281932 0.333895 0.388728   -0.0717766    0.0359253   -0.0802287 
2072 N 0.293179 0.348003 0.407448   -0.0759498    0.0424694   -0.0812948 
2073 N 0.284175 0.322702  0.38258   -0.0741228     0.038402    -0.079648 
2074 C 0.236015 0.280343 0.320742   -0.0495407    0.0309805   -0.0580849 
2075 O 0.252148 0.296621 0.340397   -0.0521514    0.0368486   -0.0582609 
2076 N 0.237606 0.270751 0.313843   -0.0503843    0.0320504   -0.0561471 
2077 C 0.246868 0.266855  0.31742   -0.0542279    0.0400794    -0.054066 
2078 C 0.250214 0.260069 0.312955   -0.0545206    0.0396697   -0.0534278 
2079 C  0.26381 0.260976 0.323171   -0.0599819    0.0479155   -0.0538072 
2080 C 0.275737  0.27445 0.342409   -0.0670887    0.0504435   -0.0605497 
2081 C  0.27216 0.255014 0.320243   -0.0578047    0.0529531   -0.0474968 
2082 C 0.293527 0.278869 0.356643   -0.0725303    0.0587262   -0.0608796 
2083 C 0.296564 0.265913 0.340158   -0.0622769    0.0609755   -0.0473312 
2084 C 0.297023 0.266836 0.347884   -0.0697857    0.0640652   -0.0539295 
2085 O 0.319269 0.274273  0.36537   -0.0746302    0.0724342   -0.0539114 
2086 C 0.252656 0.265173 0.315404   -0.0509097      0.04364   -0.0476563 
2087 O 0.276564 0.283347 0.338511   -0.0541922    0.0509534   -0.0469413 
2088 N 0.254715 0.267856 0.311978   -0.0445844    0.0385824   -0.0433319 
2089 C 0.264999 0.270844 0.313869    -0.041265    0.0410718   -0.0376396 
2090 C 0.258055 0.259824 0.298392   -0.0357669    0.0359071    -0.033073 
2091 C 0.268712 0.261691 0.303222   -0.0364543    0.0369261   -0.0322229 
2092 C 0.271843 0.262645 0.299706   -0.0313652    0.0324782   -0.0282208 
2093 C  0.27667 0.257248 0.305303    -0.039222    0.0450199   -0.0305073 
2094 C 0.274449 0.287361 0.327516    -0.039772    0.0412965   -0.0377814 
2095 O 0.271966 0.278268 0.318579   -0.0386636    0.0454256   -0.0342568 
2096 N 0.270746  0.29654 0.333954   -0.0394752     0.037071    -0.042004 
2097 C 0.259057  0.29292 0.327686   -0.0375674    0.0368529     -0.04305 
2098 C 0.260109 0.303579 0.341374   -0.0425632    0.0409193   -0.0489995 
2099 O 0.264095 0.315198 0.353346   -0.0451898     0.037287   -0.0540429 
2100 C 0.256965 0.311008 0.345472   -0.0397188    0.0400712   -0.0508411 
2101 C 0.260165 0.285695 0.319538   -0.0350232    0.0401752   -0.0381621 
2102 O 0.263976 0.286388 0.322767   -0.0374892     0.047003   -0.0380827 
2103 N    0.266 0.288286 0.318078   -0.0300958    0.0352662   -0.0343035 
2104 C 0.270793 0.284322 0.312492   -0.0275738    0.0372479   -0.0296605 
2105 C 0.276651 0.287252 0.311805   -0.0234184     0.031211   -0.0261346 
2106 C 0.279446 0.298205  0.32011   -0.0209188    0.0246801   -0.0277865 
2107 C 0.281092 0.285186 0.311416   -0.0242411    0.0312263   -0.0241872 
2108 C 0.281262 0.297142 0.315683   -0.0169985    0.0200974   -0.0243209 
2109 C 0.269779 0.285788 0.312207    -0.026271    0.0397536   -0.0301557 
2110 O 0.267348  0.27594  0.30094   -0.0249311    0.0428098   -0.0270452 
2111 N  0.24798 0.274438 0.300381     -0.02612     0.038322   -0.0341425 
2112 C 0.255394 0.284869 0.309651   -0.0250603    0.0416948   -0.0353654 
2113 C 0.260222 0.288623 0.316968   -0.0298502    0.0504879   -0.0369085 
2114 O 0.251083 0.288983 0.318955   -0.0322625    0.0529777   -0.0413295 
2115 N 0.260396 0.277114 0.306567   -0.0310173    0.0551385   -0.0331335 
2116 C 0.267396 0.279321 0.313436   -0.0361123    0.0638369   -0.0335192 
2117 C 0.283047 0.279988 0.314128   -0.0350496    0.0662699   -0.0279663 
2118 C 0.279687 0.270827 0.298781   -0.0297666     0.065427   -0.0240601 
2119 C 0.287936 0.265426 0.292414   -0.0279308    0.0671396   -0.0187093 
2120 O 0.285954  0.25567 0.287422   -0.0309528    0.0725373   -0.0174693 
2121 N 0.270841 0.245542 0.266422   -0.0227436      0.06207   -0.0157136 
2122 C 0.279566  0.29531 0.329736   -0.0378369      0.07103   -0.0356769 
2123 O 0.278562 0.295513  0.33491   -0.0434342    0.0779004   -0.0381324 
2124 N 0.270647 0.287838 0.317248   -0.0333181    0.0699857   -0.0349425 
2125 C 0.281475 0.301343 0.330336   -0.0343244    0.0774707   -0.0366704 
2126 C 0.305743 0.316961 0.340251   -0.0295055    0.0784912   -0.0329575 
2127 C 0.310025 0.306614 0.328804   -0.0287045    0.0795081   -0.0274206 
2128 C 0.320926 0.308983 0.335377   -0.0328804    0.0873845   -0.0255389 
2129 C 0.312335 0.303938 0.321156   -0.0237367    0.0726368   -0.0242896 
2130 C  0.32937 0.303746 0.328911   -0.0310906    0.0880534   -0.0202494 
2131 C 0.316197 0.295949 0.311385   -0.0222694    0.0730097   -0.0194541 
2132 C 0.329926 0.300988 0.320118    -0.025416    0.0805108   -0.0172864 
2133 C 0.275702 0.311347 0.340243   -0.0341692    0.0759589   -0.0422978 
2134 O 0.275662 0.316548 0.345688   -0.0355718     0.082579   -0.0448323 
2135 N 0.268924 0.312074 0.340041   -0.0317942    0.0672391   -0.0440577 
2136 C 0.263022 0.321473 0.348938   -0.0307731    0.0645539   -0.0493066 
2137 C 0.257849 0.319382 0.342512   -0.0241988    0.0611816   -0.0495358 
2138 O  0.26046 0.312891 0.333471   -0.0213578    0.0626076   -0.0463944 
2139 N 0.256942 0.331235 0.353444   -0.0215706     0.056497   -0.0535299 
2140 C 0.252709 0.330384 0.349465   -0.0149662    0.0531877   -0.0543493 
2141 C 0.259892 0.343643 0.362055   -0.0144108    0.0604326   -0.0573209 
2142 O 0.274052 0.366539 0.386901   -0.0189162    0.0663975   -0.0607399 
2143 N 0.249443 0.328648 0.344425  -0.00900739    0.0601194   -0.0563319 
2144 C 0.259973 0.343819 0.358341  -0.00763922    0.0671773   -0.0589856 
2145 C 0.275704 0.345558 0.357506  -0.00579773    0.0704096   -0.0555397 
2146 C 0.282498 0.340997 0.353338   -0.0109291    0.0750557   -0.0515295 
2147 C 0.295455 0.341301 0.349601  -0.00855863    0.0780616   -0.0485338 
2148 O 0.271199  0.30869 0.314902  -0.00533593    0.0715836   -0.0459737 
2149 O 0.306631 0.352053 0.358829   -0.0094593    0.0866904   -0.0493562 
2150 C 0.257229  0.35258 0.365845  -0.00141096    0.0633809   -0.0629244 
2151 O  0.24642 0.338108 0.350572   0.00394919    0.0559591   -0.0616977 
2152 N 0.268842 0.377753  0.39104  -0.00211791    0.0689671   -0.0675816 
2153 C 0.264159 0.385628 0.397359   0.00433707    0.0664282   -0.0717623 
2154 C 0.266944 0.404595 0.416731   0.00355936    0.0614709   -0.0756363 
2155 C  0.25526 0.388258 0.400719   0.00387955    0.0519104   -0.0730472 
2156 C 0.261726  0.38661 0.397786    0.0119531     0.044414    -0.070385 
2157 N 0.255764 0.379582 0.390492    0.0129382    0.0356712   -0.0687301 
2158 C 0.270113 0.381638 0.393666   0.00997368    0.0328882   -0.0643078 
2159 N 0.275425 0.374458 0.387783    0.0061357    0.0374004   -0.0609181 
2160 N 0.261747 0.373697 0.384948    0.0114008    0.0253597   -0.0632389 
2161 C 0.267041 0.395162 0.405832   0.00452765    0.0760326   -0.0749686 
2162 O  0.27345 0.398802 0.410327  -0.00152071    0.0847313   -0.0744114 
2163 N 0.271405  0.40781 0.416663    0.0118139    0.0748004   -0.0781999 
2164 C 0.285483 0.430818 0.438311    0.0127725    0.0838295   -0.0819616 
2165 C 0.298381 0.429189 0.434679    0.0169384    0.0876798   -0.0796904 
2166 C 0.299939 0.424968 0.429865    0.0261017    0.0797671   -0.0792961 
2167 C 0.311009 0.449387 0.453125    0.0166768    0.0988332   -0.0830649 
2168 C 0.284063  0.44924 0.455504    0.0183682    0.0812484   -0.0876077 
2169 O 0.282895 0.448812 0.454312    0.0257682    0.0726719    -0.087684 
2170 N 0.285961 0.467376 0.473399    0.0149385     0.088974   -0.0923552 
2171 C 0.278082 0.481372 0.485631    0.0196813    0.0864622   -0.0983283 
2172 C 0.279497 0.500487 0.505477    0.0121523    0.0952079    -0.103357 
2173 C 0.285786 0.488699 0.490588    0.0302232    0.0867716    -0.099514 
2174 O 0.288305 0.482515 0.483874    0.0306142    0.0947113   -0.0985411 
2175 N 0.288275 0.499234 0.499568    0.0391937    0.0781544    -0.101457 
2176 C 0.311293 0.522536 0.521276    0.0498155    0.0786625    -0.103119 
2177 C 0.313241 0.515173 0.514351    0.0587143    0.0678958    -0.100585 
2178 O 0.311034  0.52878 0.526262    0.0606254    0.0601134    -0.102977 
2179 C 0.311538   0.4904 0.492173    0.0553901    0.0641816   -0.0943306 
2180 C 0.333723 0.569787 0.565843    0.0535179    0.0824782    -0.109938 
2181 O 0.326513 0.565339 0.559927    0.0622222    0.0848453    -0.112169 
2182 N 0.354216 0.608658 0.604144    0.0468506    0.0830649    -0.113602 
2183 C 0.390841 0.670337 0.663405    0.0476335    0.0888119    -0.120561 
2184 C  0.42355 0.719969 0.709361    0.0586756    0.0793041    -0.124445 
2185 C 0.462314 0.756172  0.74509    0.0593287    0.0666921    -0.122256 
2186 C  0.49104 0.802655  0.78688     0.070495    0.0573506    -0.126155 
2187 N 0.524097 0.843598 0.825796    0.0672886    0.0480252    -0.126911 
2188 C 0.557314   0.8929 0.874507     0.057283    0.0498002    -0.131288 
2189 N 0.565793 0.914077 0.896942    0.0498403    0.0606175    -0.135729 
2190 N 0.553851 0.892483 0.872332    0.0545569    0.0408241    -0.131398 
2191 C 0.378748  0.66909 0.663851    0.0346346    0.0940043    -0.122978 
2192 O  0.35431  0.63334 0.630752    0.0272024    0.0911374     -0.11938 
2193 N 0.385813 0.697341 0.691024    0.0317451     0.102326    -0.129132 
2194 C 0.385917 0.710082 0.706048    0.0192891     0.107433    -0.132609 
2195 C 0.391298 0.740555 0.735009    0.0177435     0.117024    -0.139993 
2196 C 0.405018  0.74713 0.742053    0.0175461     0.130761    -0.138862 
2197 O 0.400911 0.718097 0.714006     0.019208     0.132518     -0.13244 
2198 O 0.417431 0.779305 0.773139    0.0158733     0.139687    -0.144613 
2199 C 0.382379 0.715766 0.710919    0.0179297    0.0955127    -0.134461 
2200 O 0.392104  0.73754 0.728332    0.0275338    0.0858144    -0.137049 
2201 N  0.37875 0.705518 0.704643   0.00651456    0.0963366    -0.133032 
2202 C 0.388371 0.722724 0.721055   0.00407755    0.0858365    -0.135042 
2203 C 0.396094 0.708475 0.706533    0.0090929    0.0750119    -0.127922 
2204 C 0.400518 0.685206 0.687028   0.00712596    0.0805257    -0.120191 
2205 C 0.395891 0.709847 0.708371   0.00321053    0.0670183    -0.128672 
2206 C 0.394155 0.733615  0.73675   -0.0105954    0.0923835    -0.138052 
2207 O 0.416832 0.743916 0.752102   -0.0189519     0.103547    -0.135338 
2208 N 0.377001 0.734874  0.73624   -0.0133965    0.0853459    -0.143977 
2209 C 0.378568 0.740392 0.746743   -0.0272005    0.0893738    -0.147339 
2210 C 0.395851 0.788928 0.791448   -0.0284686    0.0845759    -0.157332 
2211 C 0.423108 0.825669 0.834247   -0.0437812    0.0929922    -0.163092 
2212 C 0.445794 0.869196 0.878614   -0.0476008     0.104611    -0.169463 
2213 O  0.45927 0.875445 0.885237   -0.0436895     0.113462    -0.165837 
2214 O 0.461694 0.909129  0.91865   -0.0547405     0.104982    -0.178447 
2215 C 0.360287 0.702138 0.710722   -0.0300413    0.0820326    -0.142068 
2216 O 0.386124 0.728611 0.732357   -0.0224215    0.0696264    -0.141281 
2217 N 0.331522 0.655457  0.67114   -0.0404477     0.089822    -0.138329 
2218 C 0.313687 0.618779 0.636876   -0.0433005     0.083782    -0.133458 
2219 C  0.31669 0.593658 0.613472   -0.0398531    0.0860524    -0.123703 
2220 C 0.316703 0.574205 0.596236   -0.0420411     0.080176    -0.118309 
2221 C 0.310053 0.574643 0.590925    -0.034705    0.0658258     -0.11958 
2222 C 0.321639 0.552999 0.576582   -0.0393351    0.0835105    -0.109216 
2223 C   0.3001 0.604804 0.629936    -0.057359    0.0898245    -0.136592 
2224 O  0.30122 0.596798 0.628268   -0.0654369      0.10223    -0.134962 
2225 N 0.288545 0.602765 0.626658   -0.0600104    0.0810742    -0.141247 
2226 C 0.296432 0.614844 0.645247   -0.0733396    0.0859633    -0.146493 
2227 C 0.310359 0.643515 0.678038   -0.0812583    0.0986821     -0.15218 
2228 O 0.321077 0.644935 0.688134   -0.0927809     0.109538    -0.152045 
2229 N 0.309769 0.665662 0.694092   -0.0748116    0.0977328    -0.157084 
2230 C 0.312989 0.687093 0.718473   -0.0819787     0.109262    -0.163604 
2231 C 0.318669 0.679367 0.714806   -0.0833096     0.123825     -0.15822 
2232 O  0.33569 0.710298 0.748394   -0.0894854     0.134775    -0.163123 
2233 N 0.319217 0.653705 0.689143    -0.077579      0.12395    -0.148488 
2234 C 0.325288 0.644739 0.682423   -0.0773662     0.136377    -0.142727 
2235 C 0.322186 0.609063 0.651861   -0.0805948     0.139274    -0.133386 
2236 C 0.323133 0.593357  0.63665   -0.0788423     0.150765    -0.126995 
2237 C 0.327479 0.608241 0.659784   -0.0939466     0.143758    -0.135041 
2238 C 0.335112 0.657481 0.687301   -0.0633576     0.132378    -0.140499 
2239 O 0.330241 0.646296 0.671389   -0.0537677     0.120435    -0.137164 
2240 N 0.346002 0.676059 0.704943   -0.0622841     0.143036    -0.142034 
2241 C 0.364511 0.695544 0.717772   -0.0492408     0.140628      -0.1401 
2242 C  0.40491 0.754796 0.775586   -0.0492368     0.151802    -0.145412 
2243 C 0.435346 0.788661 0.802508   -0.0349449     0.148592    -0.144675 
2244 C 0.486596  0.86042 0.872517   -0.0346412      0.15994    -0.150523 
2245 N  0.52793 0.893356 0.901136   -0.0237791     0.163104    -0.147258 
2246 C 0.571058 0.912169 0.921113   -0.0242454     0.171118    -0.140515 
2247 N 0.570161 0.891604 0.905779   -0.0342293     0.176683    -0.135461 
2248 N 0.593555 0.929942  0.93441   -0.0140834      0.17362     -0.13903 
2249 C 0.360768  0.66206 0.684348   -0.0448834     0.142081     -0.13052 
2250 O 0.354907 0.640807 0.666945   -0.0511241     0.153479    -0.126547 
2251 N 0.348281 0.642093 0.659858   -0.0340406     0.130258    -0.127083 
2252 C 0.352629 0.621428 0.638031   -0.0282076     0.129572    -0.119105 
2253 C 0.340442 0.596107 0.612072   -0.0243189     0.116167    -0.114655 
2254 C 0.348741 0.602532 0.623064   -0.0341006     0.113799    -0.114994 
2255 C 0.335843 0.566066 0.581183   -0.0195424      0.11587    -0.106811 
2256 C 0.360657 0.593878 0.619354   -0.0418502     0.121252    -0.109633 
2257 C 0.353402 0.627921 0.639288   -0.0170409     0.130086    -0.120204 
2258 O 0.357428 0.646127 0.653646  -0.00856443     0.121245      -0.1237 
2259 N 0.354637  0.61752 0.628489   -0.0165119     0.140357    -0.117234 
2260 C 0.350479   0.6188 0.625166  -0.00647481     0.142455    -0.118962 
2261 C 0.361541 0.624703 0.631086   -0.0100742     0.157818    -0.118239 
2262 C  0.34958 0.600821 0.604596   0.00378652     0.132673    -0.114123 
2263 O 0.328583 0.559449 0.564776   0.00177644     0.128817    -0.108194 
2264 N 0.349759 0.609581 0.609698    0.0148416      0.12886    -0.116892 
2265 C 0.358517 0.600962 0.599422    0.0244056     0.121926    -0.112756 
2266 C 0.367842  0.62122 0.616349    0.0358416     0.122033    -0.116869 
2267 C 0.384543 0.619377 0.613623    0.0456572     0.116811    -0.113405 
2268 C 0.405034 0.650717 0.642271    0.0571758     0.118166    -0.117946 
2269 C 0.424415 0.650567 0.642487    0.0666154     0.112313     -0.11484 
2270 N 0.449102 0.684632 0.674565    0.0779722      0.11404    -0.119267 
2271 C 0.361036 0.579426 0.578276    0.0212754     0.128362     -0.10706 
2272 O 0.375351 0.593427 0.591469    0.0176849     0.140386    -0.107686 
2273 N 0.348316 0.547267 0.546889    0.0227413     0.120377     -0.10165 
2274 C 0.350828 0.527107 0.525915     0.021592     0.124122   -0.0964497 
2275 C 0.345648 0.510946 0.511985    0.0113839     0.127279   -0.0921094 
2276 O 0.352666 0.498925 0.498768    0.0106004     0.128586   -0.0873382 
2277 N 0.326763 0.504171 0.508358   0.00386157     0.128328   -0.0940646 
2278 C 0.329168 0.496633  0.50395  -0.00587489     0.132134   -0.0904129 
2279 C 0.337415 0.521334 0.532195   -0.0146969      0.13942   -0.0947303 
2280 C  0.34925 0.542902 0.552369   -0.0156255     0.152384   -0.0982607 
2281 C 0.354203 0.560341 0.574201   -0.0262723     0.161985    -0.101787 
2282 O 0.341937 0.561097 0.578114   -0.0305555     0.156648    -0.105306 
2283 O 0.370798 0.573991 0.587982   -0.0303176     0.175218     -0.10138 
2284 C 0.316891 0.474038 0.483138  -0.00639779     0.120839   -0.0864959 
2285 O 0.301688 0.467818 0.477279  -0.00315588     0.111087    -0.088481 
2286 N 0.308894 0.447112 0.456765   -0.0100165     0.122456   -0.0808393 
2287 C 0.307939 0.434603 0.445385   -0.0100116     0.112641   -0.0766136 
2288 C 0.310953 0.416504 0.425056  -0.00940145     0.114138   -0.0707493 
2289 C 0.309517  0.40347 0.412469  -0.00824407     0.103739   -0.0664781 
2290 C 0.309985 0.387312   0.3923  -0.00380328     0.101948   -0.0625068 
2291 O 0.324304  0.39969 0.401208  0.000534523     0.105651   -0.0636913 
2292 N 0.293997 0.360139 0.365331  -0.00462727    0.0959108   -0.0583001 
2293 C 0.299282 0.431284 0.446696    -0.018274     0.112443   -0.0773243 
2294 O  0.29109 0.427556  0.44563   -0.0252507     0.121913   -0.0789846 
2295 N 0.298085 0.429146 0.445692   -0.0175828     0.102003   -0.0762451 
2296 C 0.295655 0.432046  0.45263   -0.0245905     0.100307   -0.0775949 
2297 C 0.299067 0.457023 0.477266   -0.0232196    0.0946455   -0.0839938 
2298 C 0.302151 0.466478 0.490807   -0.0316088    0.0945166    -0.086551 
2299 C 0.309771  0.48369 0.502189   -0.0211525     0.100943   -0.0892162 
2300 C 0.287039 0.408707  0.43003   -0.0246639     0.092815   -0.0724404 
2301 O 0.278451  0.39286 0.411365    -0.018183    0.0856439   -0.0696656 
2302 N 0.278121 0.394561 0.420046   -0.0321958    0.0954606   -0.0711661 
2303 C 0.268526  0.37201 0.398484   -0.0327456     0.089318   -0.0666131 
2304 C 0.274968 0.360993 0.389553   -0.0369878    0.0963598   -0.0614538 
2305 C 0.272114 0.347344 0.377387   -0.0378458    0.0899959   -0.0575686 
2306 C 0.277716 0.353496 0.377569   -0.0320864    0.0997573   -0.0579356 
2307 C 0.257026 0.369436 0.398653   -0.0365083     0.083872   -0.0698008 
2308 O 0.254569 0.373584 0.406853   -0.0436342    0.0893099   -0.0733002 
2309 N 0.248911 0.360855 0.387764   -0.0317783    0.0733668   -0.0686475 
2310 C 0.239437 0.356807 0.385076   -0.0343552    0.0670511   -0.0707591 
2311 C 0.231107 0.354152 0.378063   -0.0268878    0.0563065   -0.0711542 
2312 C 0.228901 0.330825 0.362039   -0.0381304    0.0669583    -0.066224 
2313 O 0.232912 0.325237  0.35429   -0.0338576    0.0610965   -0.0618289 
2314 N 0.228124 0.327564 0.363986   -0.0460186    0.0739096   -0.0673859 
2315 C 0.232778 0.316699 0.356763   -0.0496583     0.075451   -0.0632049 
2316 C 0.247612 0.325251  0.37127   -0.0572063    0.0871199   -0.0632566 
2317 C 0.254351 0.312204 0.361057   -0.0586216    0.0907689   -0.0571252 
2318 N 0.265569 0.316359 0.367658   -0.0599576    0.0865054    -0.055764 
2319 C 0.268034 0.301559 0.355015   -0.0604234     0.091568   -0.0501587 
2320 N 0.268544 0.297782 0.349745   -0.0594679    0.0986009   -0.0478707 
2321 C 0.261429 0.305982 0.355267   -0.0586135     0.098487   -0.0524006 
2322 C 0.221794 0.309805  0.35052   -0.0509251     0.067838   -0.0654871 
2323 O 0.211698 0.305087 0.349962   -0.0573919    0.0699359   -0.0699081 
2324 N 0.217884 0.303518 0.339821   -0.0446173    0.0589413   -0.0627226 
2325 C 0.212979 0.302483 0.337624   -0.0441441    0.0509298   -0.0644182 
2326 C 0.218691 0.306692 0.336326   -0.0361598    0.0421324   -0.0611541 
2327 C 0.214766 0.315328 0.340811   -0.0307172    0.0386296   -0.0639359 
2328 C 0.229751  0.30239 0.331661   -0.0334778    0.0433861   -0.0544899 
2329 C 0.222404  0.30037 0.340216   -0.0493191    0.0531566   -0.0627295 
2330 O 0.230709 0.313168 0.353789   -0.0518544    0.0494539   -0.0661464 
2331 N 0.224194 0.287161 0.329908   -0.0505606    0.0592163    -0.057691 
2332 C 0.240219 0.291087  0.33888   -0.0548561    0.0620828   -0.0558892 
2333 C 0.247823 0.282384 0.331329   -0.0536316    0.0677035   -0.0493709 
2334 C 0.266557 0.286422 0.341262   -0.0574082    0.0721673   -0.0468291 
2335 C 0.264671 0.282714 0.337097    -0.056084    0.0649735   -0.0467975 
2336 C 0.277721 0.282809 0.336541   -0.0540731      0.07613    -0.039989 
2337 C 0.252876 0.308315 0.362586   -0.0632707     0.068116   -0.0615126 
2338 O  0.26765 0.323055 0.380278   -0.0669314    0.0661753   -0.0644096 
2339 N 0.257496   0.3175 0.373925   -0.0665501    0.0756667    -0.063527 
2340 C 0.266408 0.332367 0.395317   -0.0753174     0.082146   -0.0694641 
2341 C 0.267346  0.33769 0.401839   -0.0775964    0.0910558   -0.0704067 
2342 C 0.261942 0.345425  0.40646   -0.0768503    0.0749814   -0.0769606 
2343 O 0.267516 0.351991 0.418117   -0.0835636    0.0761475   -0.0815007 
2344 N 0.250987 0.348089 0.401683   -0.0704595    0.0676884   -0.0784763 
2345 C 0.244827 0.359875 0.409803   -0.0702794    0.0601609   -0.0853981 
2346 C 0.237234 0.363612 0.405421   -0.0614259    0.0533321   -0.0851246 
2347 C 0.242061 0.353064 0.402452    -0.070571    0.0532136   -0.0860936 
2348 O 0.237503 0.359334 0.408986   -0.0747445    0.0502887   -0.0929669 
2349 N  0.24221 0.338236 0.386409   -0.0660613    0.0505461   -0.0793048 
2350 C 0.243527 0.334687  0.38176   -0.0654138       0.0444   -0.0792294 
2351 C 0.237889 0.317356 0.360528   -0.0580212     0.040275   -0.0714954 
2352 C 0.224607 0.313236 0.348299   -0.0501337    0.0318718   -0.0707538 
2353 O 0.232475 0.336564 0.368001   -0.0494787    0.0275217   -0.0763691 
2354 O 0.216302 0.296568  0.32887   -0.0444304    0.0295072   -0.0646194 
2355 C 0.264756 0.346565 0.401621   -0.0734875    0.0497134      -0.0814 
2356 O 0.264753 0.343104 0.397707   -0.0737475     0.045177   -0.0825685 
2357 N 0.273711 0.350118 0.412669   -0.0798512    0.0597782   -0.0816862 
2358 C 0.285574  0.35333 0.425004   -0.0884858     0.066155   -0.0845655 
2359 C 0.299449 0.346969 0.424978   -0.0894714    0.0752564   -0.0775897 
2360 C 0.294196 0.327779 0.403461   -0.0833433    0.0711314   -0.0710759 
2361 C 0.289387 0.323426 0.391226   -0.0746859    0.0655548    -0.065605 
2362 C  0.30518 0.325421 0.406947   -0.0862222    0.0728469   -0.0707284 
2363 C 0.284833 0.307521 0.373081   -0.0694061    0.0618714   -0.0599987 
2364 C  0.29783 0.306829 0.385628   -0.0800693    0.0688974   -0.0649803 
2365 C 0.295981 0.306735 0.377559    -0.071949    0.0636297   -0.0596624 
2366 C 0.287252 0.368648 0.444718   -0.0970982    0.0705178   -0.0931459 
2367 O 0.284544 0.357878 0.443407    -0.105633    0.0785664   -0.0954616 
2368 N 0.281465 0.383315 0.452796   -0.0947625    0.0655659   -0.0978057 
2369 C 0.289006 0.407651 0.479814     -0.10233     0.068438    -0.106786 
2370 C 0.281904 0.421806 0.485331   -0.0966742    0.0633266    -0.109609 
2371 C 0.272497 0.431883  0.49739     -0.10346    0.0674573    -0.118248 
2372 O  0.26741 0.427488 0.500253    -0.113398    0.0719343    -0.124148 
2373 O 0.271161 0.445054 0.505125   -0.0988349     0.066579     -0.11922 
2374 C   0.3071  0.43031 0.503798    -0.107481    0.0634963    -0.114048 
2375 O 0.295917 0.424263 0.489925    -0.101572    0.0530209    -0.114781 
2376 N 0.328214 0.449174  0.53248    -0.118613    0.0709892    -0.119709 
2377 C 0.331032 0.454738 0.539969    -0.124188    0.0666746    -0.127184 
2378 C 0.347035  0.46001 0.559379    -0.136627    0.0789127    -0.130267 
2379 C 0.351182 0.468636 0.570963    -0.138867    0.0885518    -0.128399 
2380 C 0.345103 0.459814 0.552958    -0.126444    0.0843616    -0.119162 
2381 C  0.32872 0.478675 0.555103     -0.12341     0.057046    -0.136447 
2382 O 0.334691 0.488523 0.562925    -0.125384     0.050516    -0.142358 
2383 N   0.3174 0.485114 0.555791    -0.119893    0.0560425    -0.137671 
2384 C 0.303752  0.49665 0.556796    -0.115897    0.0457854    -0.144798 
2385 C 0.312868 0.523076 0.581667     -0.11556    0.0497904     -0.14694 
2386 C 0.294931 0.488351 0.536756    -0.103519    0.0338148    -0.140307 
2387 O 0.279865 0.490982 0.530062   -0.0995492    0.0239569    -0.145955 
2388 N 0.290206 0.464195 0.513004   -0.0975093    0.0348634    -0.130218 
2389 C 0.291584 0.463009 0.502225   -0.0865085    0.0251362    -0.124955 
2390 C 0.280463 0.437237 0.477354    -0.080346     0.029036    -0.114478 
2391 C 0.283208 0.432879 0.465589   -0.0704345    0.0211064    -0.107969 
2392 C 0.284837 0.447503 0.470171   -0.0635681    0.0106633    -0.110487 
2393 C 0.287722 0.417955 0.453531   -0.0678231    0.0242408   -0.0992999 
2394 C 0.276729 0.431876 0.448451   -0.0549868   0.00435149    -0.104277 
2395 C 0.288368 0.412866 0.442083   -0.0594436    0.0175048   -0.0936398 
2396 C  0.28715 0.423595 0.443767   -0.0533748   0.00798132   -0.0960636 
2397 C 0.297262 0.458773 0.497102   -0.0869681    0.0201005    -0.125422 
2398 O 0.275474 0.446978 0.476365   -0.0825171    0.0102886    -0.128936 
2399 N 0.316101 0.457474 0.504727   -0.0917655    0.0269921    -0.121697 
2400 C 0.329165  0.46029 0.508372   -0.0933949    0.0239536    -0.122968 
2401 C 0.335582 0.450674 0.495419   -0.0852156    0.0211438    -0.113655 
2402 C  0.31924  0.44438 0.477185   -0.0747662    0.0118438    -0.110764 
2403 C 0.340383 0.437344 0.489752   -0.0853199    0.0301834    -0.105083 
2404 C 0.349462 0.469258  0.53006    -0.104515    0.0333471    -0.126325 
2405 O   0.3381 0.451125 0.520423    -0.109157    0.0431899    -0.123872 
2406 N 0.361231 0.478756 0.540645     -0.10864    0.0303134    -0.132181 
2407 C 0.397942 0.502406 0.576972    -0.119039    0.0386933    -0.135731 
2408 C 0.448197 0.555871  0.62839    -0.122489    0.0323985    -0.144353 
2409 C 0.514955 0.599468 0.680213    -0.125234    0.0364875    -0.142563 
2410 C 0.569506 0.649883 0.721424    -0.117386    0.0276051    -0.140864 
2411 O 0.650642 0.745855 0.808623    -0.116915    0.0187423    -0.148532 
2412 O 0.614311 0.677323 0.749978    -0.111807    0.0294593    -0.132372 
2413 C 0.387853 0.466648 0.549309    -0.117788     0.046433    -0.126313 
2414 O  0.37008 0.440342 0.517502     -0.10914    0.0424208    -0.119003 
2415 N 0.382483 0.449247 0.544973    -0.126547     0.057596    -0.126814 
2416 C 0.395596 0.437525 0.541854    -0.125934    0.0658188    -0.118517 
2417 C 0.423551 0.449729 0.558823    -0.127451     0.065346    -0.119902 
2418 C 0.466286 0.489935 0.609636    -0.139307    0.0700643     -0.12952 
2419 C 0.499916 0.510727 0.632027    -0.138704    0.0669896    -0.131512 
2420 O 0.494872 0.489999 0.610357    -0.131162    0.0670505    -0.123238 
2421 O 0.515321 0.532202 0.655434    -0.145696    0.0645213    -0.141651 
2422 C 0.371007  0.40827 0.505112    -0.114845    0.0631011    -0.108015 
2423 O 0.363113 0.387588 0.482631     -0.10898    0.0606635    -0.102539 
2424 N 0.345459 0.393061 0.485652    -0.111976    0.0638026    -0.105333 
2425 C  0.33362  0.38034 0.464537    -0.101623    0.0595276   -0.0970176 
2426 C 0.330457  0.38981   0.4718    -0.101455    0.0621614   -0.0969862 
2427 C 0.341336 0.412628 0.499553    -0.110755    0.0658714    -0.105917 
2428 C 0.344585 0.405335 0.501231    -0.118806    0.0690261    -0.110651 
2429 C 0.331961  0.35699 0.445104   -0.0979271    0.0644013   -0.0878439 
2430 O 0.311406 0.334179 0.415315   -0.0894729    0.0595911   -0.0815305 
2431 N 0.344544 0.353863 0.453093    -0.104114    0.0741101   -0.0870707 
2432 C 0.378221 0.366971 0.469532   -0.0999204    0.0785639    -0.078452 
2433 C 0.422691 0.396622 0.510989     -0.10664     0.091088   -0.0769615 
2434 C 0.453485 0.434949 0.548515    -0.108095     0.096364   -0.0757834 
2435 C 0.510773 0.475081 0.598301    -0.112309     0.108996   -0.0716509 
2436 O 0.556184 0.501167  0.63265    -0.114019     0.114031   -0.0693315 
2437 O 0.559528 0.529003 0.651539    -0.113611     0.114225   -0.0706277 
2438 C 0.375787 0.354262 0.456548   -0.0966179    0.0743348   -0.0774075 
2439 O 0.367399 0.330368 0.434141   -0.0919041     0.076723    -0.070405 
2440 N 0.379092 0.366541 0.466386   -0.0987452    0.0680753   -0.0845168 
2441 C  0.38946 0.369218 0.466979   -0.0948223    0.0633812   -0.0838743 
2442 C 0.429563 0.414084 0.514299    -0.101371    0.0608872   -0.0936966 
2443 C 0.474123 0.446535 0.547181   -0.0986242    0.0585369   -0.0935864 
2444 C 0.503254 0.481421 0.582626    -0.104519     0.054749    -0.104072 
2445 N 0.516086 0.513784 0.601742     -0.10054    0.0439357    -0.107836 
2446 C 0.522912 0.539808 0.623477    -0.104262    0.0398813    -0.114839 
2447 N 0.542417 0.563155 0.655048    -0.113377    0.0457291    -0.120229 
2448 N 0.507535 0.540237 0.610976   -0.0984713    0.0299537     -0.11636 
2449 C 0.366449 0.355219 0.440367   -0.0852309    0.0541302   -0.0796705 
2450 O 0.348386 0.354301 0.431445   -0.0837675    0.0474366   -0.0829871 
2451 N  0.36102 0.337858 0.421531   -0.0785837    0.0541342   -0.0722011 
2452 C 0.330337 0.313208 0.386296   -0.0701191    0.0463689   -0.0679896 
2453 C 0.336368 0.307264 0.380072   -0.0638709    0.0487225   -0.0590293 
2454 C 0.321366 0.296348 0.359578   -0.0557781    0.0416482     -0.05461 
2455 C 0.308625 0.297905 0.352763   -0.0528743    0.0351598   -0.0550274 
2456 C 0.321215 0.285397 0.348425   -0.0510633    0.0419709   -0.0500241 
2457 C  0.29567 0.287423 0.334476   -0.0460536    0.0295643   -0.0507323 
2458 C 0.312109 0.280486 0.335196   -0.0443572    0.0362705    -0.046108 
2459 C 0.305612 0.287338 0.334349   -0.0422309    0.0302262   -0.0464933 
2460 C 0.329254 0.313331 0.382831   -0.0691084    0.0407999   -0.0719894 
2461 O  0.33142 0.302435 0.376879   -0.0695484     0.043687   -0.0717234 
2462 N 0.310442 0.309769 0.370398   -0.0672834    0.0329804   -0.0756073 
2463 C 0.316886 0.319437 0.375468   -0.0669103    0.0273923   -0.0806822 
2464 C 0.330161 0.339639 0.399295   -0.0750342     0.027581   -0.0905155 
2465 C 0.337037 0.351292 0.405236   -0.0751086    0.0212219   -0.0971078 
2466 O 0.333902 0.345598 0.392399   -0.0684732    0.0168746   -0.0936917 
2467 O 0.344804 0.365501 0.421789   -0.0818205    0.0207045    -0.105783 
2468 C 0.309403 0.323788 0.367586   -0.0599041    0.0187867    -0.078878 
2469 O 0.296942 0.325892 0.364356   -0.0600191    0.0141858   -0.0824244 
2470 N 0.309534 0.317282 0.356872   -0.0537528    0.0169176   -0.0735078 
2471 C 0.314117 0.330167 0.359161   -0.0470536   0.00997677   -0.0706249 
2472 C 0.304564 0.311438 0.338272   -0.0410986    0.0105263    -0.063221 
2473 C 0.330842 0.328455 0.356169    -0.040944     0.011552   -0.0649372 
2474 C 0.307603 0.306705 0.339341    -0.040604    0.0160308   -0.0571683 
2475 C 0.333661 0.325098 0.348953   -0.0343978    0.0114588    -0.058027 
2476 C 0.317044 0.342385 0.363629   -0.0466034   0.00319173   -0.0768683 
2477 O 0.327262  0.35998 0.372279   -0.0411823  -0.00259103   -0.0748818 
2478 N 0.333481 0.357683 0.382212   -0.0520764   0.00391812   -0.0843011 
2479 C 0.336954 0.371084 0.387466   -0.0519594  -0.00302332   -0.0913102 
2480 C 0.355615 0.382236 0.402649   -0.0568336  -0.00134643   -0.0979852 
2481 O 0.349323 0.376226 0.406287   -0.0655541   0.00313939    -0.104112 
2482 C 0.370399 0.379777 0.404403   -0.0543372   0.00347719   -0.0928388 
2483 C 0.325938 0.376712 0.389956   -0.0544973  -0.00704952   -0.0971851 
2484 O 0.308711 0.369943 0.375044   -0.0537337   -0.0137871    -0.103238 
2485 N 0.327491 0.381188 0.400392   -0.0572955  -0.00292321   -0.0957364 
2486 C 0.328699 0.399352  0.41537   -0.0590721  -0.00639735    -0.101119 
2487 C 0.323546 0.395574 0.418644   -0.0618792 -0.000432879    -0.098678 
2488 C 0.326347 0.388943 0.424352   -0.0701388   0.00853383    -0.100442 
2489 C 0.318431 0.383777 0.423394   -0.0712119    0.0135815   -0.0973009 
2490 N 0.319206 0.371539 0.423072   -0.0776432    0.0234482   -0.0961538 
2491 C 0.316194 0.371793 0.430828   -0.0863176    0.0286441    -0.102459 
2492 N 0.314456 0.387107 0.442697   -0.0898108    0.0244295    -0.110999 
2493 N 0.324237 0.365968 0.435959   -0.0914142    0.0383645    -0.100054 
2494 C 0.324684 0.406573 0.410191    -0.050902   -0.0149211   -0.0993658 
2495 O 0.320413 0.396838 0.397129     -0.04442   -0.0157362   -0.0915917 
2496 N 0.343299 0.441115 0.438239   -0.0513193   -0.0210451    -0.106708 
2497 C 0.374619 0.484471 0.470888   -0.0435514   -0.0284936     -0.10525 
2498 C 0.422801 0.551543  0.53136   -0.0446662   -0.0349512    -0.114581 
2499 C 0.481159 0.611892 0.586804   -0.0471554   -0.0394999    -0.122269 
2500 C 0.521439 0.672737 0.641392   -0.0491181   -0.0458859    -0.132503 
2501 N  0.58267   0.7356 0.698853   -0.0514519   -0.0507072    -0.140285 
2502 C 0.637466 0.790018 0.760364   -0.0612253   -0.0475933    -0.148619 
2503 N 0.672201 0.826687 0.808648   -0.0698029   -0.0405006    -0.151507 
2504 N 0.657562 0.806889  0.77281    -0.062571   -0.0512646    -0.154248 
2505 C 0.350351 0.460497 0.450665   -0.0413433   -0.0249123   -0.0991576 
2506 O 0.352885 0.464513 0.462704   -0.0470715   -0.0191052    -0.100914 
2507 N 0.324655  0.43227 0.417308   -0.0333964   -0.0276008   -0.0918883 
2508 C  0.31045 0.418117 0.406594     -0.03131   -0.0244547    -0.086785 
2509 C 0.304248 0.408597  0.39001    -0.022478   -0.0290577   -0.0800903 
2510 C 0.305993 0.403351 0.380157   -0.0210303   -0.0316989   -0.0795273 
2511 C 0.315435 0.418863 0.395234   -0.0265541   -0.0330035   -0.0883003 
2512 C 0.315331 0.438863 0.426974   -0.0327296   -0.0253983   -0.0923321 
2513 O 0.317912 0.454985 0.435399   -0.0301711    -0.032106   -0.0976641 
2514 N 0.325707 0.448249 0.444242   -0.0367529   -0.0185693   -0.0914522 
2515 C 0.323061  0.46119 0.456743   -0.0377746   -0.0187531    -0.096486 
2516 C 0.345491 0.485307 0.489781   -0.0477593   -0.0113966    -0.101839 
2517 C 0.301328 0.438135 0.433763   -0.0321397    -0.017371   -0.0903778 
2518 O 0.269018 0.391967 0.390318   -0.0301435   -0.0145503   -0.0830984 
2519 N 0.301876 0.453348 0.445458   -0.0289632   -0.0198089   -0.0934676 
2520 C  0.29598 0.445749 0.438287   -0.0234994   -0.0182849   -0.0882731 
2521 C 0.305335 0.473864 0.459601   -0.0184601   -0.0239994   -0.0934026 
2522 C 0.314389 0.496263 0.481104   -0.0247543    -0.025159    -0.102427 
2523 C 0.313189 0.483889 0.470735   -0.0297828   -0.0247583    -0.102334 
2524 C 0.268192 0.411214 0.412638   -0.0288855  -0.00871037   -0.0862066 
2525 O 0.240406 0.393279 0.396695   -0.0309765  -0.00523214   -0.0897894 
2526 N 0.248142   0.3745 0.380896   -0.0312172  -0.00428553    -0.080654 
2527 C 0.241384 0.359058 0.372759   -0.0351176   0.00438088   -0.0775744 
2528 C 0.247269 0.347684  0.36547   -0.0373657   0.00754194   -0.0724464 
2529 C 0.249793 0.342449  0.35592   -0.0308277   0.00263822    -0.066477 
2530 N 0.255247 0.343558 0.356201   -0.0259168   0.00278904   -0.0612233 
2531 C 0.254867 0.336696 0.345999   -0.0216778  -0.00157426   -0.0570257 
2532 N 0.253503 0.335369 0.342792    -0.023128  -0.00435055   -0.0591156 
2533 C 0.258459 0.346874 0.356987   -0.0289397  -0.00191343   -0.0652694 
2534 C 0.235824 0.353422 0.365854   -0.0294508   0.00497616   -0.0736297 
2535 O 0.228472   0.3511 0.357923   -0.0224466  -0.00110954   -0.0727787 
2536 N 0.229671 0.340359 0.358095   -0.0323339    0.0125603   -0.0711498 
2537 C 0.226885 0.337283 0.354349   -0.0278894    0.0142514   -0.0683249 
2538 C 0.231243 0.348588 0.369385   -0.0326826    0.0216603    -0.072183 
2539 C 0.232872 0.369206 0.387706   -0.0337347    0.0195447   -0.0798312 
2540 C 0.241056 0.382977 0.406676   -0.0410608    0.0283217   -0.0839764 
2541 C 0.233102 0.379043 0.391849   -0.0253363    0.0142801   -0.0802535 
2542 C  0.22775 0.322507 0.341059   -0.0257192    0.0163078   -0.0611153 
2543 O 0.228793 0.321309 0.340448   -0.0237121    0.0195267   -0.0591468 
2544 N 0.225868 0.310654  0.32925   -0.0258355    0.0141678   -0.0575772 
2545 C 0.227888 0.298992 0.318774    -0.024368    0.0159429    -0.051263 
2546 C 0.232546 0.295636 0.315666    -0.025459    0.0141163   -0.0488927 
2547 C 0.222317 0.292507 0.309079   -0.0179361    0.0121921   -0.0482484 
2548 O 0.225506 0.287464  0.30493   -0.0167308    0.0145869   -0.0444106 
2549 N 0.211646 0.290525 0.303353   -0.0137595   0.00642423   -0.0504576 
2550 C 0.221431 0.299595 0.310102  -0.00742188   0.00282568   -0.0482767 
2551 C 0.222347 0.301796 0.308287  -0.00329139  -0.00426742   -0.0475263 
2552 C  0.22338 0.293001 0.299504  -0.00450761  -0.00538943   -0.0434707 
2553 C 0.225066 0.283849 0.292191  -0.00402951  -0.00390019   -0.0384986 
2554 C 0.228478 0.300302 0.304525  -0.00585253  -0.00810265   -0.0449466 
2555 C 0.220154  0.27147 0.279502   -0.0048798  -0.00484107   -0.0350118 
2556 C 0.232004 0.295201 0.299155  -0.00646741  -0.00878176   -0.0412861 
2557 C 0.222659 0.276151 0.282056  -0.00593186  -0.00705069   -0.0363004 
2558 C  0.22478 0.312621 0.322527  -0.00481978   0.00377545    -0.051809 
2559 O  0.22796 0.316405 0.324505   0.00111448  0.000428137   -0.0509261 
2560 N 0.225811 0.321154 0.332871  -0.00923089   0.00865448   -0.0559475 
2561 C 0.214654 0.320153 0.331301  -0.00700351    0.0105715   -0.0595433 
2562 C  0.21419 0.334004  0.34095  -0.00350393   0.00458164   -0.0641019 
2563 O 0.209841 0.332954 0.338021  -0.00526967  0.000767763   -0.0657514 
2564 N 0.211851 0.340305 0.345362   0.00178069   0.00374566   -0.0663708 
2565 C 0.219931  0.36482 0.365345    0.0052888  -0.00128639   -0.0716371 
2566 C 0.227665 0.385719  0.38707  -0.00186591   0.00212945   -0.0779618 
2567 C  0.23804 0.413976 0.409765  0.000475541  -0.00422581   -0.0840888 
2568 C 0.243261 0.419095 0.410691   0.00176889   -0.0114738   -0.0841413 
2569 C 0.248866 0.442562  0.43673   0.00133568  -0.00285934   -0.0901651 
2570 C  0.24096 0.433823 0.419082   0.00425352   -0.0179426   -0.0901685 
2571 C 0.241146  0.45297 0.441086   0.00375683  -0.00939198   -0.0963357 
2572 C 0.244509 0.455676 0.439148    0.0052141   -0.0171312   -0.0963529 
2573 C 0.207558 0.358193 0.357134    0.0128162  -0.00189142   -0.0725701 
2574 O 0.198433 0.343715 0.345782    0.0126848   0.00382371   -0.0711546 
2575 N 0.210557  0.37202 0.365737    0.0196245  -0.00878101   -0.0751374 
2576 C 0.220682   0.3883  0.38028    0.0279766  -0.00990895   -0.0763368 
2577 C 0.227988 0.378419 0.372375    0.0338663   -0.0113504   -0.0700357 
2578 O 0.215015 0.353052 0.347513    0.0332279   -0.0141659   -0.0654479 
2579 N 0.228112 0.377651 0.373107    0.0391987  -0.00889321   -0.0701028 
2580 C 0.245007 0.380405 0.377512    0.0461799   -0.0114352   -0.0653973 
2581 C 0.252623 0.390205 0.388668    0.0523122  -0.00841243   -0.0672022 
2582 C 0.246779 0.363189 0.364619    0.0414517  -0.00933993   -0.0597599 
2583 O 0.260401 0.364935  0.36724    0.0450434   -0.0131298   -0.0554638 
2584 N 0.240071 0.353815 0.357817    0.0335094  -0.00319897   -0.0597928 
2585 C 0.237742 0.335251 0.342638    0.0294082  -0.00105572    -0.054987 
2586 C 0.234574  0.32878 0.338674    0.0254509   0.00656553   -0.0555515 
2587 C 0.234131 0.327435 0.338217    0.0313348   0.00851005   -0.0568587 
2588 N 0.235942 0.315195 0.328441    0.0347026   0.00739426   -0.0536963 
2589 C 0.237184  0.31847 0.332219    0.0395783   0.00996249   -0.0561902 
2590 N 0.242135 0.338797 0.350255    0.0395943    0.0128203   -0.0606204 
2591 C 0.237455 0.341812 0.351599    0.0338751    0.0119687   -0.0611825 
2592 C  0.23503  0.32887 0.335851    0.0235878  -0.00262356   -0.0527525 
2593 O 0.229924 0.311939 0.321215    0.0200312 -0.000883256   -0.0490116 
2594 N 0.236596 0.340644 0.344326    0.0231173  -0.00625324   -0.0552375 
2595 C 0.242722  0.34306 0.346135    0.0183329  -0.00795229   -0.0534651 
2596 C 0.252427 0.364618  0.36291    0.0196665   -0.0132711   -0.0568973 
2597 C 0.272979 0.381763 0.379765    0.0138532   -0.0137914   -0.0560302 
2598 C 0.290335 0.410527 0.403272    0.0142054   -0.0190799   -0.0601104 
2599 O 0.304583 0.424731 0.412997    0.0197236   -0.0251531   -0.0588901 
2600 N 0.293911  0.42349 0.416681   0.00808524   -0.0166692     -0.06515 
2601 C 0.239911 0.325385 0.329642    0.0197243   -0.0103754   -0.0476333 
2602 O 0.250638 0.331588 0.335414     0.025788   -0.0139521   -0.0455452 
2603 N 0.243906 0.321824 0.327778    0.0140631  -0.00818221   -0.0450753 
2604 C 0.245125 0.309877 0.317332    0.0142023  -0.00928865   -0.0398614 
2605 C 0.247038 0.308176 0.315961   0.00838934  -0.00772728   -0.0383344 
2606 S  0.25108 0.298339 0.307673   0.00785271  -0.00843377   -0.0324465 
2607 C 0.244609 0.305848 0.311508    0.0198176   -0.0148369    -0.037457 
2608 O 0.239213  0.30574 0.307649    0.0212653   -0.0186605   -0.0383702 
2609 N 0.247087 0.298859 0.307125    0.0230671   -0.0152204    -0.034493 
2610 C   0.2639  0.31029 0.317667    0.0280843   -0.0196171   -0.0316407 
2611 C 0.288293 0.326217 0.337611    0.0324163   -0.0191929   -0.0302216 
2612 C 0.310771 0.343023 0.353992    0.0389399   -0.0233592    -0.027562 
2613 C 0.287312 0.314609 0.330344    0.0280999    -0.016011   -0.0277939 
2614 C 0.333002  0.35424 0.370937    0.0428342   -0.0222036   -0.0262314 
2615 C 0.264709 0.303752 0.310802     0.024854   -0.0204062   -0.0277281 
2616 O 0.270947 0.306809 0.311843     0.028036   -0.0237473   -0.0253824 
2617 N 0.256413 0.292855  0.30149    0.0189341   -0.0171308   -0.0269515 
2618 C  0.25124 0.281564 0.289962    0.0158932   -0.0172855   -0.0234751 
2619 C 0.249463 0.285212  0.29044    0.0125951   -0.0173172   -0.0246694 
2620 O 0.254963 0.286104 0.291286   0.00976599   -0.0165432   -0.0221049 
2621 N  0.24625 0.291939 0.294538    0.0131123   -0.0183086   -0.0288312 
2622 C 0.242895 0.293247 0.293978    0.0091054   -0.0176494   -0.0309231 
2623 C 0.263905 0.326146 0.325199   0.00891249    -0.018036   -0.0365032 
2624 C 0.272761 0.342431 0.336828    0.0147197   -0.0233059   -0.0385921 
2625 C 0.320738 0.404112 0.396993    0.0131105   -0.0231378   -0.0449394 
2626 O 0.357216 0.447734 0.437392    0.0110315   -0.0250721   -0.0485364 
2627 N  0.33531  0.42277 0.418082    0.0134387   -0.0204317   -0.0468351 
2628 C 0.248056 0.295781 0.292959   0.00996359   -0.0206201    -0.028902 
2629 O 0.239702 0.285854 0.282964   0.00621969   -0.0190274   -0.0286818 
2630 N  0.24058 0.286485  0.28085    0.0150839   -0.0244293   -0.0270221 
2631 C  0.26779 0.310499 0.300972    0.0158813   -0.0265378   -0.0248242 
2632 C 0.297202 0.340209 0.326096    0.0225328   -0.0312126   -0.0238811 
2633 C 0.335366 0.390507 0.371982    0.0256352   -0.0349178    -0.029187 
2634 C 0.366912 0.430447 0.408554    0.0215378   -0.0354458   -0.0339155 
2635 O 0.340279 0.411725 0.391839    0.0177414   -0.0336164   -0.0385445 
2636 N 0.394271 0.455014 0.428793    0.0215196   -0.0370397   -0.0327937 
2637 C 0.264494 0.297494 0.290822    0.0130925   -0.0236264   -0.0201562 
2638 O  0.25139 0.283026 0.274121    0.0113252   -0.0232733   -0.0192978 
2639 N 0.256796 0.283552 0.281514    0.0128316   -0.0216625   -0.0175127 
2640 C 0.258096 0.277802 0.278459   0.00961565   -0.0189339   -0.0139626 
2641 C 0.266059 0.279478 0.284797   0.00996633   -0.0178612   -0.0119284 
2642 C 0.269624 0.277248  0.28517   0.00643462   -0.0154723  -0.00890995 
2643 C 0.280209 0.284442 0.290541   0.00648054    -0.015662  -0.00573919 
2644 C 0.274989 0.276617 0.289248   0.00633238   -0.0147692  -0.00789978 
2645 C 0.243772 0.265571 0.267146   0.00499703   -0.0159596   -0.0152715 
2646 O 0.241815 0.261035 0.261959   0.00302171   -0.0146698   -0.0133132 
2647 N 0.244121 0.270191 0.273341    0.0035945   -0.0145034   -0.0184311 
2648 C 0.239673 0.266821 0.271119 -0.000343999   -0.0113283   -0.0197326 
2649 C 0.235269 0.267003  0.27309  -0.00146307  -0.00938025   -0.0232194 
2650 C 0.230649 0.259775 0.261443  -0.00151966   -0.0118104   -0.0208983 
2651 O  0.21885 0.244489 0.246681   -0.0035868  -0.00975884   -0.0193184 
2652 N 0.230141 0.264695 0.263034  0.000385865   -0.0148899   -0.0236474 
2653 C 0.241744 0.278448 0.273855 -0.000800495   -0.0156842   -0.0257386 
2654 C 0.251257 0.295957 0.287142   0.00153795   -0.0197416   -0.0298153 
2655 C 0.256162 0.308511 0.301696 -0.000686084   -0.0186993   -0.0347289 
2656 C 0.261022   0.3235  0.31166   0.00225249   -0.0234952   -0.0392068 
2657 N 0.261292 0.332551 0.322319   -0.0014952    -0.022065   -0.0450659 
2658 C 0.261543 0.341009 0.331264 -0.000494758   -0.0222785   -0.0480452 
2659 N 0.277658 0.357532 0.346655   0.00485782   -0.0243508   -0.0459414 
2660 N 0.246103 0.333625 0.325691  -0.00493669   -0.0201792   -0.0535308 
2661 C 0.242885 0.273922 0.267047  0.000183294   -0.0159963   -0.0220117 
2662 O 0.234273 0.263214 0.256364  -0.00198503   -0.0140865   -0.0221183 
2663 N  0.24398 0.272015 0.263581   0.00350514    -0.017905   -0.0186609 
2664 C 0.254344 0.277076 0.266748    0.0042352   -0.0174316   -0.0148083 
2665 C 0.270706 0.289681   0.2787   0.00772941    -0.019185   -0.0114723 
2666 C 0.292228 0.314573 0.298366    0.0121554    -0.023423   -0.0132199 
2667 C 0.294084 0.307121 0.295835   0.00729259   -0.0172283  -0.00707963 
2668 C  0.31078 0.329745 0.314358    0.0158902   -0.0249899   -0.0109135 
2669 C 0.251028 0.269909 0.262928   0.00114864   -0.0136414   -0.0124577 
2670 O 0.237033  0.25428  0.24566  0.000420423   -0.0122357    -0.011501 
2671 N 0.237011 0.254818 0.251987 -0.000201387   -0.0121437    -0.011792 
2672 C 0.240305 0.255309 0.254715  -0.00243595  -0.00924174  -0.00968063 
2673 C 0.243088 0.257044 0.259888  -0.00334571  -0.00837146   -0.0093142 
2674 C 0.259586 0.270623 0.274877  -0.00228444  -0.00958955  -0.00716729 
2675 C 0.264155 0.273523 0.280672  -0.00359962   -0.0085945  -0.00695706 
2676 O 0.286157 0.295346 0.302383  -0.00524171  -0.00704638  -0.00606042 
2677 O 0.261215 0.269303 0.278419    -0.002556    -0.009526  -0.00772875 
2678 C 0.225882 0.241609 0.241024  -0.00423261  -0.00714001   -0.0115035 
2679 O 0.226205 0.239909 0.238689  -0.00459384  -0.00546188  -0.00976058 
2680 N 0.211848 0.230284 0.230889  -0.00540482  -0.00685533   -0.0151419 
2681 C 0.220387  0.23794 0.240001  -0.00763716  -0.00424187   -0.0171272 
2682 C 0.217148 0.237857 0.242309  -0.00969025  -0.00331653   -0.0211034 
2683 C 0.225125  0.24516 0.252403   -0.0102046  -0.00150269   -0.0201878 
2684 C 0.237427 0.261189  0.27076   -0.0125459  0.000302782   -0.0243209 
2685 C 0.232481 0.246888  0.25578   -0.0107286   0.00150042   -0.0170459 
2686 C  0.22609 0.243187 0.242438  -0.00726233  -0.00479362   -0.0180986 
2687 O 0.221483  0.23504  0.23544  -0.00813513  -0.00219057   -0.0176695 
2688 N 0.229469 0.249518 0.244649  -0.00533921   -0.0081789   -0.0191659 
2689 C 0.241666 0.261076 0.252424  -0.00460993  -0.00887259   -0.0202514 
2690 C 0.247514 0.270775 0.256646  -0.00194804   -0.0132132   -0.0218033 
2691 C 0.259902 0.289712 0.275463  -0.00264224   -0.0157047   -0.0267632 
2692 C 0.266988 0.301207 0.281787   0.00130311   -0.0204745   -0.0272917 
2693 O 0.274991 0.306029 0.283264   0.00467473   -0.0218085   -0.0235241 
2694 N 0.270696 0.312373 0.292348   0.00114637   -0.0228983   -0.0318944 
2695 C 0.240413 0.255499 0.245744  -0.00345562  -0.00692869   -0.0160768 
2696 O 0.247073 0.259701 0.249618  -0.00385499  -0.00494518   -0.0166713 
2697 N  0.23456  0.24887 0.238674  -0.00204426  -0.00738552   -0.0121788 
2698 C 0.239318 0.251064 0.240005   -0.0013978  -0.00533241  -0.00830097 
2699 C 0.246698  0.25771 0.246689 -0.000523529  -0.00624822  -0.00481803 
2700 C 0.263516 0.274179 0.258971   0.00198888   -0.0088205  -0.00471777 
2701 C  0.24837 0.258146 0.247352  -0.00097358  -0.00366134  -0.00121478 
2702 C 0.272457 0.280704 0.266385   0.00296698  -0.00946305  -0.00167583 
2703 C 0.233506  0.24387 0.236074  -0.00275773  -0.00224367  -0.00755763 
2704 O 0.237296 0.246309 0.237283  -0.00207445 -0.000151391  -0.00655721 
2705 N 0.228459  0.23902 0.234908  -0.00415528  -0.00190092  -0.00818652 
2706 C 0.233298 0.242087 0.240416  -0.00467724  0.000668214  -0.00703773 
2707 C 0.238604 0.247477 0.248717  -0.00579488  0.000703467  -0.00720928 
2708 C 0.256376 0.262322 0.265668   -0.0059791   0.00348259  -0.00683979 
2709 C 0.234431 0.244674 0.245419  -0.00546074 -0.000822978   -0.0047563 
2710 C 0.251975 0.257913 0.257138  -0.00483981   0.00296661  -0.00891966 
2711 O 0.247865   0.2521  0.25075  -0.00345193   0.00492004  -0.00715593 
2712 N 0.244064  0.24979 0.250314  -0.00642996   0.00268321   -0.0127249 
2713 C 0.266394 0.268006 0.270884  -0.00738413   0.00532137   -0.0150444 
2714 C 0.264766  0.26694 0.272735   -0.0104745   0.00540103   -0.0196274 
2715 C 0.264601 0.266246  0.27603   -0.0122082    0.0071661   -0.0193522 
2716 C 0.268854 0.265414 0.277834   -0.0116024    0.0103348   -0.0165158 
2717 C 0.263024 0.269542 0.279675   -0.0138303   0.00560847   -0.0218324 
2718 C 0.269054 0.264515 0.279736   -0.0128893     0.012205   -0.0161348 
2719 C 0.267931  0.27387 0.287246   -0.0152721   0.00781838   -0.0215809 
2720 C 0.265853 0.265822  0.28164   -0.0149356    0.0112398   -0.0187209 
2721 C 0.254878  0.25539 0.254911  -0.00574747   0.00533027   -0.0154101 
2722 O 0.293301 0.289397 0.290272  -0.00485038   0.00814199    -0.015043 
2723 N 0.252261 0.256228 0.251068  -0.00483107   0.00237585   -0.0160029 
2724 C 0.261534 0.264207 0.254923  -0.00302243   0.00264497   -0.0163177 
2725 C 0.270517  0.27663 0.261605    -0.001744 -0.000926466   -0.0168833 
2726 C 0.287658 0.292095 0.271802  0.000139477 -0.000699659   -0.0180382 
2727 C 0.286792 0.289894 0.266933   0.00250475   0.00188593   -0.0137266 
2728 O  0.27559 0.280471 0.257693   0.00288467   0.00196735  -0.00964555 
2729 O 0.271739  0.27213 0.247003   0.00382829   0.00403085   -0.0147183 
2730 C 0.249409 0.250733 0.240634   -0.0008088   0.00526507   -0.0121095 
2731 O 0.265546 0.263668  0.25334  0.000449848   0.00773873   -0.0125564 
2732 N 0.239671 0.243654 0.233435 -0.000393839   0.00485721  -0.00839694 
2733 C 0.244577 0.249483 0.237746   0.00140529   0.00695763  -0.00483926 
2734 C 0.243321 0.251653  0.23907   0.00094821   0.00568643  -0.00179718 
2735 O 0.241149 0.249712 0.234446  0.000874743   0.00345509  -0.00211649 
2736 C  0.23996 0.250927 0.236402   0.00220437   0.00805254   0.00148198 
2737 C 0.246922 0.249733 0.241146   0.00229278   0.00954816  -0.00425144 
2738 O 0.256546 0.258612 0.248699   0.00462544    0.0119918  -0.00330738 
2739 N  0.24421 0.245725 0.240988  0.000894845   0.00919283  -0.00481862 
2740 C 0.247351 0.245661 0.243788   0.00216591    0.0115064  -0.00395254 
2741 C 0.248756 0.245173 0.247003  0.000111524     0.011168  -0.00478688 
2742 C  0.25245  0.24382 0.248585   0.00162089    0.0138118  -0.00369134 
2743 C 0.255131 0.250126 0.251886   0.00479243    0.0133413 -0.000207417 
2744 C 0.237067  0.22557 0.233966 -0.000875607    0.0143723  -0.00488836 
2745 C 0.262612 0.255092 0.254774   0.00358436    0.0143921  -0.00566169 
2746 O 0.271476  0.26285 0.261986   0.00679593    0.0164975  -0.00384728 
2747 N  0.25804 0.247056  0.24866   0.00130175    0.0144105  -0.00948518 
2748 C 0.274367 0.256284 0.260652    0.0019013    0.0173488   -0.0118946 
2749 C 0.276541 0.255284 0.263441  -0.00217329    0.0171695   -0.0165643 
2750 C 0.276096 0.251873 0.265394  -0.00422151     0.018698    -0.016151 
2751 C 0.291235 0.259265 0.277241  -0.00260611    0.0225197   -0.0144244 
2752 C  0.28888 0.269056  0.28302  -0.00736796    0.0166477   -0.0174987 
2753 C 0.289819 0.254351 0.276635  -0.00422015      0.02436   -0.0136055 
2754 C 0.283899 0.261267 0.279691  -0.00916887    0.0186833   -0.0170439 
2755 C 0.293557 0.262915 0.285309  -0.00770895    0.0226038   -0.0149815 
2756 C 0.278016 0.260215 0.260378   0.00448394    0.0180387   -0.0121807 
2757 O 0.284368 0.260426  0.26254   0.00626112    0.0209726   -0.0133903 
2758 N   0.2659 0.254415 0.248928    0.0049169    0.0157993   -0.0109183 
2759 C 0.264803 0.254199 0.243846   0.00769179    0.0171101   -0.0103126 
2760 C 0.265913 0.259925 0.243799      0.00698    0.0144061   -0.0101964 
2761 C 0.268609 0.264494 0.242629   0.00973645    0.0162756  -0.00825705 
2762 C 0.273481 0.271237 0.243708   0.00926569    0.0137718  -0.00859098 
2763 N 0.264789 0.265896 0.239086   0.00730637    0.0106476  -0.00687337 
2764 C 0.257983 0.262502 0.235865    0.0070524    0.0111371  -0.00279515 
2765 N 0.258321  0.26496 0.237399   0.00837214    0.0144391 -2.57583e-06 
2766 N 0.258913 0.264984  0.23974   0.00535203   0.00833335  -0.00184973 
2767 C 0.275109  0.26714 0.255764    0.0111046    0.0195004   -0.0063478 
2768 O 0.271892 0.261686 0.249205    0.0142488    0.0224273   -0.0064448 
2769 N 0.266864 0.263874 0.252872    0.0106228    0.0181926  -0.00331495 
2770 C 0.262181 0.264821 0.251361    0.0132589    0.0194616  6.59986e-05 
2771 C  0.25479 0.264049 0.249159    0.0109971    0.0170575   0.00228577 
2772 C  0.25018 0.261401 0.243013   0.00943554    0.0165132    0.0025547 
2773 C 0.248085  0.26519 0.245812   0.00759877    0.0155131   0.00526794 
2774 N 0.261348 0.284611 0.263656   0.00921452    0.0176156   0.00736671 
2775 C 0.260651 0.289996 0.269203   0.00753771    0.0167648   0.00910833 
2776 N 0.261156 0.290322 0.271132   0.00411458     0.014591    0.0095552 
2777 N 0.259671 0.295576 0.273281    0.0094984    0.0180363    0.0101237 
2778 C 0.264843 0.266043 0.254862    0.0166155    0.0211599   0.00130044 
2779 O 0.266046 0.271903 0.257999    0.0199751    0.0227515    0.0032143 
2780 N 0.256239 0.250946 0.244495    0.0160551    0.0211409  0.000216729 
2781 C 0.253367 0.245025  0.24057    0.0199904    0.0228509   0.00181307 
2782 C 0.249893 0.240902 0.238613    0.0186429    0.0210843   0.00290167 
2783 C 0.247191 0.247884 0.241905     0.017159    0.0177555   0.00471257 
2784 C 0.239897 0.239277 0.234725    0.0165792    0.0162871   0.00553127 
2785 C 0.246978 0.256203  0.24554    0.0204499     0.017767   0.00675842 
2786 C 0.261836 0.242833 0.242635    0.0214605     0.026129 -0.000450884 
2787 O 0.262337 0.235671 0.240585    0.0189403    0.0267225  -0.00226773 
2788 N 0.265115 0.245064 0.243195    0.0251963    0.0287005 -0.000767876 
2789 C 0.281119 0.249959 0.252518    0.0260194    0.0318366  -0.00370514 
2790 C 0.284409 0.255526 0.254095    0.0307532    0.0342542  -0.00343192 
2791 C 0.284817 0.268012 0.261322    0.0337482    0.0329974  0.000641239 
2792 C 0.267322  0.25652  0.24882    0.0285785    0.0291017   0.00138136 
2793 C 0.283392 0.242566 0.251306    0.0282361    0.0340319  -0.00277894 
2794 O   0.2813 0.242851 0.250218    0.0329458    0.0342077   0.00063431 
2795 N 0.281969 0.230523 0.245737    0.0248278    0.0357072  -0.00591755 
2796 C 0.294733 0.231388 0.253733    0.0261861    0.0388394   -0.0051854 
2797 C  0.28915 0.227739 0.250509    0.0251836    0.0373104  -0.00222766 
2798 O 0.306368 0.236515 0.263124    0.0282626    0.0397865  4.07782e-05 
2799 N 0.277336 0.225989 0.244827    0.0211809     0.033462  -0.00227775 
2800 C 0.281333 0.231566 0.250729    0.0194911    0.0320292  -0.00032486 
2801 C 0.277661 0.237806 0.253565    0.0144427    0.0280755  -0.00171981 
2802 C 0.290484 0.253967 0.268824     0.013041    0.0261941  0.000116037 
2803 C 0.293338 0.262385 0.272304    0.0178505    0.0244977   0.00391932 
2804 C 0.287622 0.259031 0.271687   0.00839751    0.0227944  -0.00163918 
2805 C 0.287644 0.225027 0.252125    0.0171595    0.0357929   -0.0013434 
2806 O 0.297785 0.229316 0.261472    0.0127181    0.0376718    -0.005288 
2807 N 0.297633 0.230556 0.258553    0.0200971    0.0370328   0.00211956 
2808 C 0.308412 0.227555 0.263188    0.0187077    0.0416733   0.00221538 
2809 C 0.327848 0.233186 0.274811    0.0225813    0.0464575   0.00228201 
2810 C 0.329923 0.236819 0.273629      0.03189    0.0457814   0.00622418 
2811 C 0.350484 0.244976 0.287209    0.0362698    0.0501676    0.0057052 
2812 N 0.363827 0.262234 0.298819    0.0456984    0.0490685   0.00954326 
2813 C 0.361048 0.266816 0.298985    0.0495747    0.0479495   0.00888039 
2814 N  0.35519 0.259424 0.289591    0.0586126    0.0490268    0.0116405 
2815 N 0.348135 0.264741 0.293139    0.0448638    0.0453452   0.00584015 
2816 C 0.311656 0.231106 0.263844    0.0217286     0.041056   0.00645552 
2817 O 0.298506 0.227595 0.252878      0.02593    0.0372002   0.00908389 
2818 N 0.327946 0.236831 0.275354    0.0192802    0.0450391   0.00683005 
2819 C 0.334018 0.241235 0.276904    0.0221913     0.045105    0.0107666 
2820 C 0.361108 0.255926 0.299569    0.0172851    0.0508407    0.0100749 
2821 C 0.369865 0.270995 0.316496   0.00883745    0.0503471   0.00584546 
2822 C 0.382536 0.270951 0.325724   0.00346145    0.0572251   0.00449627 
2823 C 0.367957 0.280892 0.318854   0.00878971    0.0458581   0.00689524 
2824 C 0.345032 0.248041 0.280413    0.0314609    0.0452108    0.0153061 
2825 O 0.366613 0.260422 0.297032    0.0350657    0.0483075      0.01571 
2826 N 0.339002 0.249355 0.273749    0.0355058    0.0414865    0.0183619 
2827 C 0.352295 0.260209 0.279764    0.0447889    0.0407357    0.0227618 
2828 C 0.333449 0.259034 0.268151    0.0485208    0.0339056    0.0232535 
2829 C 0.372816 0.270878 0.290325    0.0466813    0.0432101    0.0260704 
2830 O 0.391186 0.285512  0.30054    0.0549381    0.0427133    0.0300761 
2831 N  0.37824 0.271838 0.296116    0.0392497    0.0462226    0.0243102 
2832 C 0.399945 0.283099 0.308238    0.0396519    0.0499573    0.0270823 
2833 C 0.400407 0.295523 0.311202    0.0396414    0.0448502    0.0274433 
2834 C 0.423413 0.309036 0.323238    0.0408604    0.0482394    0.0304808 
2835 C 0.422812 0.320959 0.323755    0.0429051    0.0419632    0.0308297 
2836 C 0.444149 0.332437 0.332317    0.0452669    0.0452844    0.0340613 
2837 N 0.441356 0.341466 0.329368     0.048286    0.0385776    0.0341013 
2838 C 0.411735 0.285922 0.321543    0.0307308    0.0561364    0.0240243 
2839 O 0.379989 0.263812 0.300471    0.0238311    0.0542101    0.0196866 
2840 N  0.44039 0.296491 0.340095     0.030495    0.0636494    0.0259777 
2841 C 0.449967  0.29858 0.352785    0.0211772    0.0697683    0.0223071 
2842 C 0.473414 0.300115 0.362757    0.0232308    0.0781084    0.0257143 
2843 C 0.487761 0.309908 0.366054     0.035034    0.0759356    0.0314769 
2844 C 0.467958 0.310129 0.353009    0.0391322    0.0666447    0.0316483 
2845 C 0.432409 0.288631 0.341159    0.0144774    0.0697966    0.0201852 
2846 O 0.425468 0.284805 0.330026     0.017511    0.0681335     0.023007 
2847 N 0.430458  0.28999 0.348942   0.00568898    0.0715348     0.014872 
2848 C 0.437723 0.304752 0.363228 -0.000897677    0.0721363    0.0121436 
2849 C 0.453956 0.321141 0.388822   -0.0100917    0.0754354   0.00612107 
2850 C 0.465435 0.338897 0.407236   -0.0167399    0.0776057   0.00335425 
2851 C 0.459821 0.338221 0.403969   -0.0108247    0.0692326   0.00219069 
2852 C 0.443959 0.301488 0.359681   1.9689e-05    0.0776232    0.0159339 
2853 O 0.430609 0.296604 0.347937  0.000114411    0.0752158    0.0162918 
2854 N 0.471435 0.310452 0.376056  0.000987621    0.0852453    0.0188643 
2855 C 0.504989 0.332827 0.399618  0.000694175     0.092178    0.0223056 
2856 C 0.572685  0.37847 0.457752  -0.00149018     0.102395     0.023976 
2857 C 0.634185 0.426484 0.508157   0.00627441     0.102905    0.0278829 
2858 C 0.664268 0.457937 0.545284   0.00498336     0.100549    0.0239512 
2859 O 0.657117 0.466278  0.55243 -0.000223548    0.0955371    0.0183068 
2860 O 0.743024 0.521151 0.613878   0.00995986     0.103902    0.0267939 
2861 C  0.49245 0.321541 0.376567   0.00969629    0.0884061     0.027729 
2862 O 0.489634 0.313587 0.366145   0.00985498    0.0924557    0.0302333 
2863 N 0.466872 0.304682 0.351558     0.016808    0.0802898    0.0289634 
2864 C 0.460837  0.30404 0.338412    0.0247308    0.0749218    0.0327114 
2865 C 0.475696 0.316851 0.346896    0.0343236    0.0708579    0.0361778 
2866 C 0.512338 0.332388   0.3702    0.0382204    0.0781858    0.0402266 
2867 C 0.534354 0.352989 0.385229     0.049224    0.0739796    0.0439789 
2868 O 0.545747 0.376246 0.396089    0.0556778    0.0665923    0.0454522 
2869 O   0.5789 0.384397  0.42478    0.0515074    0.0782323    0.0452361 
2870 C 0.429796 0.292602 0.318198    0.0230142    0.0671417    0.0295288 
2871 O 0.417977 0.286102 0.301313    0.0285298    0.0625006    0.0317034 
2872 N 0.411303 0.284323 0.313992    0.0156464    0.0656093    0.0242863 
2873 C 0.417058 0.307336 0.329958     0.014208    0.0583819    0.0213158 
2874 C 0.404736 0.304196 0.332004   0.00785632    0.0563869    0.0161743 
2875 C 0.412546 0.313334 0.342674     0.010249    0.0534483    0.0158772 
2876 C 0.403354 0.312644 0.346069   0.00402836    0.0516537    0.0107445 
2877 C 0.420344 0.329087 0.348955    0.0174009    0.0465954    0.0183266 
2878 C 0.415091  0.30714 0.326569    0.0116805    0.0602374    0.0208081 
2879 O 0.421116 0.304502 0.329965   0.00739991    0.0677282    0.0206041 
2880 N 0.411903 0.315299 0.325596    0.0139905    0.0536997    0.0202402 
2881 C 0.428006 0.334662 0.341486    0.0116733    0.0546871    0.0189326 
2882 C 0.474089 0.387111 0.382117    0.0174759    0.0481347    0.0202802 
2883 C 0.551814 0.455068 0.443282    0.0252494    0.0490217    0.0253896 
2884 C 0.595925 0.508548 0.484371    0.0305028    0.0408968    0.0253954 
2885 N 0.638219 0.556728  0.52909    0.0272774    0.0399713    0.0223334 
2886 C 0.640067  0.57121 0.539651     0.025905    0.0331527    0.0188097 
2887 N 0.633242 0.573451 0.539761    0.0274926    0.0263649    0.0180484 
2888 N 0.617014 0.551282 0.518218    0.0228778    0.0336125     0.015967 
2889 C 0.380738 0.298109 0.308926   0.00478583     0.053422    0.0137027 
2890 O  0.34003 0.268831 0.276388   0.00488604    0.0466165    0.0115681 
2891 N 0.356876 0.270684  0.28818 -0.000971496    0.0601078    0.0116851 
2892 C 0.339755 0.264142 0.284438  -0.00669721    0.0590692    0.0066977 
2893 C 0.344263 0.264253 0.294396   -0.0132528    0.0661918   0.00418216 
2894 C 0.355044 0.272198 0.308363   -0.0145221      0.06567   0.00342435 
2895 C  0.38124 0.285594 0.324205   -0.0112907    0.0686475   0.00723567 
2896 C 0.347412 0.274436 0.313231   -0.0182748    0.0619745  -0.00111217 
2897 C  0.37371 0.274799  0.31915   -0.0123018    0.0685163   0.00616318 
2898 C 0.352346 0.276531 0.320097    -0.019242    0.0614803  -0.00214093 
2899 C 0.356363  0.26749 0.314109   -0.0164464    0.0649462   0.00133364 
2900 C 0.329745 0.260397 0.274787  -0.00637933    0.0577779    0.0054794 
2901 O 0.341527 0.266409 0.275649  -0.00311249    0.0599494   0.00818453 
2902 N 0.311158 0.253243 0.268075   -0.0093026    0.0540961   0.00134802 
2903 C 0.311683 0.260402 0.269998  -0.00852596    0.0517425 -0.000331174 
2904 C 0.287922 0.248276 0.257309  -0.00922111    0.0445901  -0.00350301 
2905 C 0.284611 0.247196 0.252412  -0.00568551    0.0376868  -0.00169783 
2906 C  0.26527 0.237365 0.243397  -0.00691924    0.0318796  -0.00433401 
2907 N 0.266639 0.244252 0.248468  -0.00730274    0.0300329  -0.00686518 
2908 C 0.276849 0.257958 0.257956  -0.00518443    0.0247389  -0.00700866 
2909 N 0.288416 0.269277 0.265589  -0.00265303    0.0207544  -0.00482461 
2910 N 0.277988 0.263107 0.262928  -0.00568554    0.0235128  -0.00967014 
2911 C 0.326688  0.27468 0.286827   -0.0120766    0.0587278  -0.00234284 
2912 O 0.318846 0.275703 0.288788   -0.0144271    0.0576439  -0.00615669 
2913 N 0.356644 0.293888 0.306677   -0.0119297    0.0660813   0.00043993 
2914 C 0.398497 0.334297 0.348935   -0.0151764    0.0738892   -0.0010012 
2915 C 0.446987 0.367991 0.384919    -0.015256    0.0827003   0.00305705 
2916 C 0.505485 0.417515 0.426548  -0.00827504     0.080792   0.00820687 
2917 N 0.579296 0.490521 0.490615  -0.00433223    0.0805821   0.00930095 
2918 C 0.581519 0.485269 0.478949   0.00192302    0.0778275    0.0137325 
2919 N 0.587453 0.487001 0.485414   0.00242694    0.0766984    0.0157156 
2920 C 0.550322 0.454513 0.462806  -0.00422377    0.0787669    0.0121698 
2921 C 0.384552 0.325132 0.332218   -0.0123172    0.0717822  -0.00201898 
2922 O 0.391081 0.335321 0.343391   -0.0148827    0.0763705  -0.00471701 
2923 N 0.364269 0.305303 0.304914  -0.00704714    0.0647097 -0.000263309 
2924 C 0.358295 0.301739  0.29349  -0.00377581    0.0621897  -0.00109557 
2925 C 0.363355 0.300369 0.283633   0.00214806    0.0586123   0.00278284 
2926 C 0.364658 0.302393 0.285241    0.0044966    0.0522215   0.00483269 
2927 O 0.339261 0.281659 0.271253   0.00138053    0.0505018   0.00347726 
2928 O 0.358383 0.291933 0.267515   0.00966497    0.0493172   0.00783134 
2929 C 0.337053 0.291648 0.282725  -0.00397587    0.0550867  -0.00501696 
2930 O 0.336889 0.293325 0.278525  -0.00138608     0.052256  -0.00628332 
2931 N 0.314524  0.27566 0.272877   -0.0069983    0.0525291  -0.00702027 
2932 C 0.300599 0.270874 0.268209  -0.00690227    0.0457834   -0.0100093 
2933 C 0.294195 0.266753 0.264865  -0.00621921     0.039169  -0.00879512 
2934 C 0.301568 0.268532 0.261736  -0.00274411    0.0369679  -0.00510186 
2935 S  0.32029 0.287461 0.271581   0.00135285    0.0322994  -0.00526758 
2936 C 0.301338 0.277318 0.262861  0.000540297    0.0242649  -0.00780927 
2937 C 0.292059 0.269407 0.272407   -0.0105512    0.0483783   -0.0138367 
2938 O 0.278981 0.255447 0.263327    -0.014063    0.0540923   -0.0143276 
2939 N 0.284188 0.268502 0.270882  -0.00960101    0.0440956    -0.016723 
2940 C 0.282428 0.274905 0.281532   -0.0118196    0.0453099   -0.0205424 
2941 C 0.280626  0.27882 0.284281  -0.00934668    0.0403268   -0.0231426 
2942 C 0.271815 0.279278 0.288689   -0.0107958    0.0408906   -0.0268948 
2943 C 0.294684 0.289715  0.29067  -0.00657764    0.0419568    -0.023811 
2944 C  0.27173 0.267454 0.278874   -0.0146724    0.0438907   -0.0209098 
2945 O 0.252019 0.251165 0.266655   -0.0181279     0.048169   -0.0231105 
2946 N 0.258426 0.253752 0.264475   -0.0133285    0.0377705   -0.0192254 
2947 C 0.261765 0.259496 0.273833   -0.0154703    0.0360399   -0.0195608 
2948 C 0.259211 0.261308 0.274577    -0.013518    0.0285873   -0.0196861 
2949 C 0.259262 0.268996 0.282948   -0.0129238     0.026772   -0.0231294 
2950 C 0.267123 0.283701 0.300459   -0.0150964    0.0279784   -0.0264044 
2951 C 0.263614 0.273634 0.285407   -0.0100053    0.0239689   -0.0234063 
2952 C 0.264738 0.289017 0.305709    -0.013552    0.0260524   -0.0295537 
2953 C 0.257166 0.273242 0.285899  -0.00861371    0.0226586   -0.0264027 
2954 C 0.248187 0.271678 0.286455  -0.00998169    0.0235208    -0.029281 
2955 C 0.264637 0.254331 0.269637   -0.0162601     0.038676   -0.0163894 
2956 O 0.268566 0.252571 0.264249   -0.0134797    0.0374004   -0.0131151 
2957 N 0.260366  0.24959 0.269858   -0.0200078    0.0427413   -0.0177466 
2958 C 0.266023 0.246447 0.269235   -0.0209887     0.046123   -0.0151486 
2959 C 0.268433 0.248787 0.278106   -0.0264051    0.0522206   -0.0180715 
2960 C 0.274711 0.243422 0.276959   -0.0279932    0.0578369   -0.0155539 
2961 C 0.290694 0.249084 0.281135   -0.0260279    0.0627406   -0.0115755 
2962 C 0.275966  0.24319  0.28232    -0.031358    0.0586377   -0.0173413 
2963 C 0.299173 0.245341  0.28187   -0.0270549    0.0684777  -0.00895072 
2964 C 0.287836 0.242812 0.286889   -0.0327349    0.0642482    -0.015135 
2965 C 0.298405 0.242447 0.285509   -0.0304556     0.069353   -0.0106987 
2966 O 0.307524 0.238054 0.286522   -0.0313692    0.0753214  -0.00819519 
2967 C 0.266882  0.24689 0.268906   -0.0190912    0.0406499   -0.0135053 
2968 O 0.260183 0.247305  0.26784   -0.0182254    0.0349133   -0.0149107 
2969 N 0.272609 0.243671 0.266843   -0.0182263    0.0430221   -0.0104019 
2970 C 0.280318 0.250105 0.271827   -0.0155447    0.0387062  -0.00825823 
2971 C 0.295097 0.254985 0.275063   -0.0121021    0.0409901  -0.00384427 
2972 O 0.303038  0.25493 0.276842   -0.0127102    0.0470233  -0.00249582 
2973 N 0.290133 0.250742 0.267314  -0.00831805    0.0363296  -0.00159386 
2974 C 0.299022 0.251882 0.265845  -0.00385914    0.0372968   0.00252762 
2975 C 0.307262 0.255963 0.273491  -0.00302524    0.0378054    0.0034532 
2976 C 0.324172 0.265127 0.291018  -0.00741574    0.0443929   0.00184433 
2977 C 0.296119 0.253799 0.270239  -0.00324243    0.0322343   0.00172799 
2978 C 0.289908 0.247925 0.253874  0.000387453    0.0316015   0.00409375 
2979 O 0.273635 0.240338 0.244307 -4.30574e-05    0.0263785   0.00247283 
2980 N 0.308723 0.261025 0.262311   0.00447382    0.0326579   0.00716169 
2981 C 0.308154 0.265717  0.25881   0.00839551    0.0269827   0.00806785 
2982 C 0.323592 0.274744 0.262192    0.0119594    0.0290352    0.0103611 
2983 C 0.313578 0.264165 0.251229   0.00936059    0.0318758   0.00842309 
2984 N 0.311279 0.269595 0.252938   0.00859156    0.0274781   0.00567642 
2985 C 0.305831 0.261237 0.245018   0.00686208    0.0319195   0.00446598 
2986 N 0.323412 0.270071 0.257793   0.00596796    0.0391142   0.00632733 
2987 C 0.325163 0.267996 0.258134   0.00748114    0.0391387   0.00883245 
2988 C 0.318405  0.27909 0.269562    0.0120861    0.0227666   0.00981402 
2989 O 0.333663 0.301586  0.28598    0.0143446    0.0171831   0.00969381 
2990 N 0.309426 0.264752 0.259963    0.0125514    0.0256982    0.0111091 
2991 C 0.334657 0.291677 0.284652    0.0168473    0.0229595    0.0130325 
2992 C 0.386078 0.336115 0.324092     0.023339    0.0238811    0.0168839 
2993 C  0.42899 0.380608 0.365305    0.0292889    0.0212753     0.019196 
2994 C  0.48905 0.430661 0.412128    0.0363303    0.0235284     0.023408 
2995 O 0.511696 0.440712 0.426194    0.0356939    0.0296315    0.0250303 
2996 O 0.474391 0.421185 0.395685    0.0426988    0.0191353    0.0250976 
2997 C 0.323985 0.276738 0.277246    0.0147368    0.0262967    0.0124093 
2998 O 0.315039  0.25928 0.266052    0.0118287    0.0318715    0.0119437 
2999 N 0.307412 0.265886 0.265659    0.0161301     0.023194    0.0122184 
3000 C 0.299403 0.253155 0.259109    0.0150798    0.0261747    0.0115799 
3001 C  0.30644 0.265442 0.275321    0.0089886     0.025585    0.0076757 
3002 C 0.306857 0.260239 0.276636   0.00693892    0.0289285   0.00599436 
3003 C 0.330853 0.271864 0.294604   0.00539049    0.0352171   0.00621329 
3004 C  0.30313   0.2633 0.281327   0.00203195    0.0270809   0.00217222 
3005 C 0.290504  0.24681 0.249951    0.0202143    0.0240542    0.0133256 
3006 O 0.277667 0.242433 0.244294    0.0192441    0.0210299    0.0118917 
3007 N 0.294509 0.243533 0.245345     0.026255     0.025809    0.0166238 
3008 C 0.292728 0.244128 0.243343    0.0319768    0.0242807     0.018244 
3009 C  0.30567 0.248199 0.245102    0.0389121    0.0260231    0.0221257 
3010 C 0.312635  0.25218 0.247147    0.0371524    0.0265719    0.0226649 
3011 C 0.313939 0.252253 0.254242    0.0285956    0.0293465    0.0192221 
3012 C 0.300156 0.246963 0.252813    0.0303679     0.027407    0.0166885 
3013 O 0.313832 0.248536 0.261659    0.0283631    0.0325767    0.0163005 
3014 N 0.278791 0.235138 0.238287    0.0311202     0.024476    0.0156625 
3015 C 0.277578 0.230929 0.238814    0.0299731    0.0268549    0.0138445 
3016 C 0.273479 0.233875 0.242813    0.0231817     0.025171     0.010234 
3017 C 0.272382 0.228787 0.241906     0.017259     0.026608   0.00825266 
3018 C 0.265964 0.240382  0.24259    0.0231054    0.0201742    0.0103441 
3019 C 0.281938 0.239845 0.243758    0.0364819    0.0257231    0.0154375 
3020 O 0.273119 0.240988 0.237821    0.0401445     0.021901    0.0170118 
3021 N 0.282715 0.233558  0.24213    0.0377447     0.029187    0.0145636 
3022 C 0.273131  0.22881 0.234187    0.0433074    0.0287999    0.0152856 
3023 C 0.293445 0.239523 0.246075    0.0514281    0.0315173    0.0182215 
3024 O 0.288029 0.240875 0.243737    0.0568783    0.0309808    0.0185492 
3025 C 0.301002 0.229036 0.245107    0.0504142    0.0372647    0.0175796 
3026 C 0.269172 0.223985 0.232932     0.039217    0.0305449    0.0118998 
3027 O 0.269435 0.219446  0.23317    0.0329136    0.0317287   0.00920984 
3028 N 0.263617 0.224228 0.229967    0.0430065    0.0304838    0.0118786 
3029 C 0.266379 0.226424 0.233977    0.0402266    0.0320828   0.00882416 
3030 C 0.256659 0.227541 0.231548    0.0340894    0.0287888   0.00707943 
3031 C 0.249539 0.234866 0.231622    0.0357106    0.0256132   0.00888578 
3032 C 0.254317 0.248029 0.240587     0.036987     0.025767   0.00873413 
3033 N 0.248512 0.254843 0.241992    0.0370919    0.0227509    0.0103158 
3034 C 0.245349 0.251434 0.238732    0.0363164    0.0201526    0.0113455 
3035 C 0.241035 0.257163 0.239937    0.0361477    0.0164611      0.01251 
3036 C 0.245833 0.258338 0.241843    0.0354377    0.0145542    0.0130803 
3037 C 0.248434 0.247936 0.236739    0.0350236    0.0168192    0.0129197 
3038 C 0.257384 0.247201 0.241202     0.034733    0.0206583    0.0116736 
3039 C 0.248117 0.241024 0.234078    0.0357643    0.0221343    0.0107784 
3040 C 0.275691 0.237141 0.242339    0.0473353    0.0339145   0.00977576 
3041 O 0.279265 0.242148 0.244775    0.0540935    0.0337025    0.0126385 
3042 N 0.280665 0.240425 0.246637    0.0464649    0.0360484   0.00717042 
3043 C 0.285701 0.246039 0.250346    0.0532921    0.0385267   0.00765452 
3044 C 0.291828 0.248696 0.254267    0.0509682    0.0409337   0.00404707 
3045 C 0.306266 0.246944 0.260963    0.0478772    0.0437522   0.00101093 
3046 N 0.322768 0.259883 0.275413    0.0429109    0.0445022  -0.00345348 
3047 C 0.310464 0.233039 0.256941    0.0408174    0.0471592  -0.00574383 
3048 N 0.329062 0.245073 0.272947    0.0440702    0.0485127  -0.00255554 
3049 C 0.301595 0.229222 0.250312     0.048856    0.0460131   0.00167066 
3050 C 0.285598 0.262378 0.258377    0.0569814    0.0360916   0.00988244 
3051 O 0.269738 0.257564 0.249423    0.0522961    0.0331979   0.00968546 
3052 N 0.287673 0.265651 0.259651    0.0653448    0.0375434    0.0117426 
3053 C 0.283689 0.278326 0.264411    0.0693481    0.0352333    0.0135847 
3054 C 0.294731 0.288251 0.272932    0.0797858    0.0363836    0.0158176 
3055 C 0.297842 0.310497 0.286479     0.083912    0.0335699    0.0171616 
3056 N 0.292189  0.31536 0.286759    0.0818773    0.0285331    0.0183137 
3057 C 0.289012 0.329313 0.293407     0.085938    0.0270012    0.0186567 
3058 N 0.285605 0.327045 0.290731    0.0905889    0.0310433    0.0180513 
3059 C 0.301244 0.324443 0.295648    0.0896509     0.035239    0.0170962 
3060 C 0.283324 0.287457  0.26968    0.0676034    0.0367618    0.0119594 
3061 O 0.297711 0.294173 0.278901    0.0686033    0.0406128    0.0100639 
3062 N 0.272698 0.292622 0.268944    0.0647728    0.0340613    0.0125655 
3063 C 0.279175 0.308672 0.280885    0.0634862    0.0361711    0.0116717 
3064 C 0.288476 0.328308 0.297767    0.0558782    0.0333113    0.0117578 
3065 C 0.287524 0.333676 0.299963    0.0533316    0.0362653    0.0110512 
3066 N 0.311879 0.371761 0.332762    0.0562656    0.0381905    0.0117704 
3067 C 0.300864  0.36179 0.321162    0.0528474    0.0413927    0.0111628 
3068 N 0.308262 0.357287  0.32007    0.0484713    0.0409025    0.0100138 
3069 C 0.286412 0.326651 0.294023     0.048545    0.0377465   0.00972649 
3070 C 0.281771 0.320982 0.288497    0.0716356    0.0380932    0.0126407 
3071 O 0.261856 0.315519 0.277945    0.0732815    0.0355696    0.0138487 
3072 N 0.293343  0.32447 0.293779    0.0771045    0.0425102    0.0117502 
3073 C 0.293356 0.332425 0.297695     0.086007    0.0448867     0.012471 
3074 C 0.305248 0.329622 0.299204     0.091948    0.0497904    0.0111992 
3075 C 0.320431 0.326749 0.303738    0.0941338    0.0494157    0.0116217 
3076 N 0.342682 0.347696 0.324733     0.102221    0.0481872    0.0140774 
3077 C 0.344393 0.330317 0.315339     0.101706    0.0490889    0.0141049 
3078 N 0.334843 0.311517  0.30134    0.0933596    0.0504239    0.0113185 
3079 C 0.329274 0.318605 0.302944    0.0891767     0.050434   0.00982828 
3080 C 0.290297 0.347397 0.305822    0.0843945    0.0464733    0.0121835 
3081 O 0.282472 0.352323  0.30582    0.0908086    0.0471716    0.0128894 
3082 O 0.268359  0.32669 0.284607    0.0772161    0.0474693    0.0112628 
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_omega_angle 
1 1 A  92 GLU A 92  ? A  93 PRO A 93  ? . 0.0899545958  
2 1 A 134 GLY A 134 ? A 135 PRO A 135 ? . -0.0260223497 
# 
_struct_conn.id                        1     
_struct_conn.conn_type_id              covale 
_struct_conn.ptnr1_label_asym_id       B     
_struct_conn.ptnr1_label_comp_id       HEM   
_struct_conn.ptnr1_label_seq_id            . 
_struct_conn.ptnr1_label_atom_id       FE    
_struct_conn.pdbx_ptnr1_label_alt_id   ?     
_struct_conn.ptnr1_auth_asym_id        A     
_struct_conn.ptnr1_auth_seq_id         1408  
_struct_conn.pdbx_ptnr1_PDB_ins_code   ?     
_struct_conn.ptnr1_symmetry            1_555 
_struct_conn.ptnr2_label_asym_id       A     
_struct_conn.ptnr2_label_comp_id       CYS   
_struct_conn.ptnr2_label_seq_id          348 
_struct_conn.ptnr2_label_atom_id       SG    
_struct_conn.pdbx_ptnr2_label_alt_id   ?     
_struct_conn.ptnr2_auth_asym_id        A     
_struct_conn.ptnr2_auth_seq_id         348   
_struct_conn.pdbx_ptnr2_PDB_ins_code   ?     
_struct_conn.ptnr2_symmetry            1_555 
_struct_conn.details                   ?     
_struct_conn.pdbx_dist_value           2.4167 
_struct_conn.ptnr1_auth_comp_id        HEM   
_struct_conn.ptnr2_auth_comp_id        CYS   
#