pyuul_kmeans / peptide /aaacmin-nowat.pdb
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ATOM 1 N ALA 1 11.892 17.126 8.757 1.00 0.00 N
ATOM 2 H1 ALA 1 12.684 16.691 8.290 1.00 0.00 H
ATOM 3 H2 ALA 1 11.616 17.947 8.233 1.00 0.00 H
ATOM 4 H3 ALA 1 11.128 16.467 8.744 1.00 0.00 H
ATOM 5 CA ALA 1 12.233 17.461 10.153 1.00 0.00 C
ATOM 6 HA ALA 1 13.073 18.159 10.161 1.00 0.00 H
ATOM 7 CB ALA 1 11.046 18.121 10.867 1.00 0.00 C
ATOM 8 HB1 ALA 1 10.185 17.450 10.870 1.00 0.00 H
ATOM 9 HB2 ALA 1 11.316 18.350 11.900 1.00 0.00 H
ATOM 10 HB3 ALA 1 10.777 19.050 10.361 1.00 0.00 H
ATOM 11 C ALA 1 12.666 16.184 10.870 1.00 0.00 C
ATOM 12 O ALA 1 12.178 15.114 10.513 1.00 0.00 O
ATOM 13 N ALA 2 13.559 16.271 11.858 1.00 0.00 N
ATOM 14 H ALA 2 13.910 17.190 12.120 1.00 0.00 H
ATOM 15 CA ALA 2 14.079 15.109 12.590 1.00 0.00 C
ATOM 16 HA ALA 2 13.264 14.393 12.728 1.00 0.00 H
ATOM 17 CB ALA 2 15.170 14.439 11.740 1.00 0.00 C
ATOM 18 HB1 ALA 2 15.962 15.156 11.519 1.00 0.00 H
ATOM 19 HB2 ALA 2 15.595 13.592 12.279 1.00 0.00 H
ATOM 20 HB3 ALA 2 14.744 14.076 10.803 1.00 0.00 H
ATOM 21 C ALA 2 14.625 15.473 13.984 1.00 0.00 C
ATOM 22 O ALA 2 15.178 16.557 14.179 1.00 0.00 O
ATOM 23 N ALA 3 14.522 14.529 14.920 1.00 0.00 N
ATOM 24 H ALA 3 14.113 13.643 14.659 1.00 0.00 H
ATOM 25 CA ALA 3 15.053 14.576 16.285 1.00 0.00 C
ATOM 26 HA ALA 3 16.017 15.091 16.284 1.00 0.00 H
ATOM 27 CB ALA 3 14.071 15.362 17.167 1.00 0.00 C
ATOM 28 HB1 ALA 3 13.106 14.854 17.199 1.00 0.00 H
ATOM 29 HB2 ALA 3 14.463 15.448 18.181 1.00 0.00 H
ATOM 30 HB3 ALA 3 13.933 16.368 16.768 1.00 0.00 H
ATOM 31 C ALA 3 15.274 13.133 16.800 1.00 0.00 C
ATOM 32 O ALA 3 14.955 12.177 16.088 1.00 0.00 O
ATOM 33 N CYS 4 15.811 12.976 18.016 1.00 0.00 N
ATOM 34 H CYS 4 15.971 13.796 18.583 1.00 0.00 H
ATOM 35 CA CYS 4 16.050 11.679 18.670 1.00 0.00 C
ATOM 36 HA CYS 4 15.299 10.973 18.323 1.00 0.00 H
ATOM 37 CB CYS 4 17.442 11.176 18.231 1.00 0.00 C
ATOM 38 HB2 CYS 4 17.682 11.561 17.238 1.00 0.00 H
ATOM 39 HB3 CYS 4 18.194 11.528 18.945 1.00 0.00 H
ATOM 40 SG CYS 4 17.464 9.362 18.155 1.00 0.00 S
ATOM 41 HG CYS 4 18.783 9.223 17.962 1.00 0.00 H
ATOM 42 C CYS 4 15.863 11.789 20.201 1.00 0.00 C
ATOM 43 O CYS 4 15.107 12.696 20.625 1.00 0.00 O
ATOM 44 OXT CYS 4 16.469 10.997 20.960 1.00 0.00 O
END