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
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REMARK GENERATED USING QUANTA FOR NACCESS
REMARK AUTHOR SIMON HUBBARD
ATOM 1 N ALA S 1 0.000 0.000 0.000 1.00 0.00 N
ATOM 2 CA ALA S 1 1.376 0.000 -0.516 1.00 0.00 C
ATOM 3 C ALA S 1 1.899 1.409 -0.712 1.00 0.00 C
ATOM 4 O ALA S 1 1.235 2.291 -1.242 1.00 0.00 O
ATOM 5 CB ALA S 1 1.389 -0.742 -1.854 1.00 0.00 C
ATOM 6 HT1 ALA S 1 -0.325 -0.981 0.122 1.00 0.00 H
ATOM 7 HT2 ALA S 1 -0.026 0.490 0.917 1.00 0.00 H
ATOM 8 HT3 ALA S 1 -0.623 0.490 -0.673 1.00 0.00 H
ATOM 9 N VAL S 2 3.139 1.594 -0.255 1.00 0.00 N
ATOM 10 CA VAL S 2 3.723 2.924 -0.403 1.00 0.00 C
ATOM 11 C VAL S 2 5.186 2.883 -0.795 1.00 0.00 C
ATOM 12 O VAL S 2 5.992 2.131 -0.259 1.00 0.00 O
ATOM 13 CB VAL S 2 3.573 3.651 0.935 1.00 0.00 C
ATOM 14 CG1 VAL S 2 4.154 5.066 0.900 1.00 0.00 C
ATOM 15 CG2 VAL S 2 2.111 3.797 1.361 1.00 0.00 C
ATOM 16 H VAL S 2 3.656 0.853 0.173 1.00 0.00 H
ATOM 17 N ALA S 3 5.509 3.736 -1.769 1.00 0.00 N
ATOM 18 CA ALA S 3 6.901 3.764 -2.210 1.00 0.00 C
ATOM 19 C ALA S 3 7.401 5.167 -2.487 1.00 0.00 C
ATOM 20 O ALA S 3 7.534 5.522 -3.657 1.00 0.00 O
ATOM 21 CB ALA S 3 7.002 2.922 -3.483 1.00 0.00 C
ATOM 22 OXT ALA S 3 7.656 5.898 -1.532 1.00 0.00 O1-
ATOM 23 H ALA S 3 4.828 4.338 -2.186 1.00 0.00 H
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