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test_new.pdb
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test_new.pdb
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MODEL 0
ATOM 1 H1 ACE A 0 2.000 1.000 -0.000 1.00 0.00 H
ATOM 2 CH3 ACE A 0 2.000 2.090 0.000 1.00 0.00 C
ATOM 3 H2 ACE A 0 1.486 2.454 0.890 1.00 0.00 H
ATOM 4 H3 ACE A 0 1.486 2.454 -0.890 1.00 0.00 H
ATOM 5 C ACE A 0 3.427 2.641 -0.000 1.00 0.00 C
ATOM 6 O ACE A 0 4.391 1.877 -0.000 1.00 0.00 O
ATOM 7 N VAL A 1 3.555 3.970 -0.000 1.00 0.00 N
ATOM 8 H VAL A 1 2.733 4.556 -0.000 1.00 0.00 H
ATOM 9 CA VAL A 1 4.853 4.614 -0.000 1.00 0.00 C
ATOM 10 HA VAL A 1 5.408 4.316 0.890 1.00 0.00 H
ATOM 11 CB VAL A 1 5.661 4.221 -1.232 1.00 0.00 C
ATOM 12 C VAL A 1 4.713 6.129 0.000 1.00 0.00 C
ATOM 13 O VAL A 1 3.601 6.653 0.000 1.00 0.00 O
ATOM 14 HB VAL A 1 5.809 3.141 -1.241 1.00 0.00 H
ATOM 15 CG1 VAL A 1 6.912 5.042 -1.297 1.00 0.00 C
ATOM 16 HG11 VAL A 1 7.736 4.356 -1.492 1.00 0.00 H
ATOM 17 HG12 VAL A 1 7.102 5.689 -0.440 1.00 0.00 H
ATOM 18 HG13 VAL A 1 6.906 5.574 -2.248 1.00 0.00 H
ATOM 19 CG2 VAL A 1 4.809 4.419 -2.481 1.00 0.00 C
ATOM 20 HG21 VAL A 1 5.306 4.142 -3.411 1.00 0.00 H
ATOM 21 HG22 VAL A 1 4.052 3.634 -2.489 1.00 0.00 H
ATOM 22 HG23 VAL A 1 4.312 5.384 -2.573 1.00 0.00 H
ATOM 23 N NME A 2 5.846 6.835 0.000 1.00 0.00 N
ATOM 24 H NME A 2 6.737 6.359 -0.000 1.00 0.00 H
ATOM 25 C NME A 2 5.846 8.284 0.000 1.00 0.00 C
ATOM 26 H1 NME A 2 4.819 8.648 0.000 1.00 0.00 H
ATOM 27 H2 NME A 2 6.360 8.648 0.890 1.00 0.00 H
ATOM 28 H3 NME A 2 6.360 8.648 -0.890 1.00 0.00 H
TER 29 NME A 2
ENDMDL
CONECT 1 2
CONECT 2 3 4 1 5
CONECT 3 2
CONECT 4 2
CONECT 5 6 7 2
CONECT 6 5
CONECT 7 5
CONECT 12 23
CONECT 23 24 12 25
CONECT 24 23
CONECT 25 26 27 28 23
CONECT 26 25
CONECT 27 25
CONECT 28 25
END