1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56
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; HyperChem file created by BALL
;
forcefield AMBER
sys 0
mol 1 "Protein"
res 1 ALA 1 - -
atom 1 N N ** - 0 -1.45 0 0 4 2 s 5 s 7 s 9 s
vel 1 0 0 0
atom 2 CA C ** - 0 0 0 0 4 1 s 3 s 12 s 11 s
vel 2 0 0 0
atom 3 C C ** - 0 0.494864 0 1.43719 3 2 s 13 s 4 d
vel 3 0 0 0
atom 4 O O ** - 0 1.23478 -0.910695 1.83814 1 3 d
vel 4 0 0 0
atom 5 1H H ** - 0 -1.78794 0.918428 0.249791 1 1 s
vel 5 0 0 0
atom 6 1HB H ** - 0 1.64175 1.12351 -0.864007 1 11 s
vel 6 0 0 0
atom 7 2H H ** - 0 -1.80122 -0.259809 -0.91062 1 1 s
vel 7 0 0 0
atom 8 2HB H ** - 0 0.154357 1.136 -1.8271 1 11 s
vel 8 0 0 0
atom 9 3H H ** - 0 -1.74918 -0.665137 0.704076 1 1 s
vel 9 0 0 0
atom 10 3HB H ** - 0 0.258031 2.11837 -0.35129 1 11 s
vel 10 0 0 0
atom 11 CB C ** - 0 0.553667 1.17545 -0.813004 4 2 s 6 s 8 s 10 s
vel 11 0 0 0
atom 12 HA H ** - 0 0.340871 -0.928171 -0.460441 1 2 s
vel 12 0 0 0
endres 1
res 2 ALA 2 - -
atom 13 N N ** - 0 0.132896 0.980466 2.26779 3 14 s 3 s 16 s
vel 13 0 0 0
atom 14 CA C ** - 0 0.60497 0.980466 3.63879 4 13 s 15 s 21 s 20 s
vel 14 0 0 0
atom 15 C C ** - 0 0.414376 -0.407752 4.22779 3 14 s 22 d 23 s
vel 15 0 0 0
atom 16 H H ** - 0 -0.475743 1.72959 1.93797 1 13 s
vel 16 0 0 0
atom 17 1HB H ** - 0 0.324808 2.10582 5.4716 1 20 s
vel 17 0 0 0
atom 18 2HB H ** - 0 0.0648391 3.03932 3.98802 1 20 s
vel 18 0 0 0
atom 19 3HB H ** - 0 -1.15977 1.86806 4.51934 1 20 s
vel 19 0 0 0
atom 20 CB C ** - 0 -0.0893519 2.07 4.46343 4 14 s 17 s 18 s 19 s
vel 20 0 0 0
atom 21 HA H ** - 0 1.67632 1.18499 3.6304 1 14 s
vel 21 0 0 0
atom 22 O O ** - 0 0.531224 -1.35797 3.42112 1 15 d
vel 22 0 0 0
atom 23 OXT O ** - 0 0.462066 -0.511803 5.47313 1 15 s
vel 23 0 0 0
endres 2
endmol 1
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