|
a |
|
b/tests/data/pdb/5ar7_HIS.pdb |
|
|
1 |
HEADER 5AR7_PROTEIN |
|
|
2 |
COMPND 5AR7_PROTEIN |
|
|
3 |
REMARK GENERATED BY X-TOOL on Sun Nov 13 13:35:46 2016 |
|
|
4 |
ATOM 1 N GLY B 245 92.419 -71.652 49.383 1.00 80.34 N |
|
|
5 |
ATOM 2 H GLY B 245 92.822 -70.833 48.884 1.00 0.00 H |
|
|
6 |
ATOM 3 CA GLY B 245 90.966 -71.709 49.534 1.00 80.23 C |
|
|
7 |
ATOM 4 C GLY B 245 90.309 -70.422 49.973 1.00 84.60 C |
|
|
8 |
ATOM 5 O GLY B 245 89.144 -70.434 50.371 1.00 83.85 O |
|
|
9 |
ATOM 6 CB HIS B 246 91.826 -66.911 50.094 0.50 86.09 C |
|
|
10 |
ATOM 7 CG HIS B 246 92.785 -66.634 51.216 0.50 91.47 C |
|
|
11 |
ATOM 8 ND1 HIS B 246 93.351 -65.368 51.359 0.50 94.19 N |
|
|
12 |
ATOM 9 CD2 HIS B 246 93.383 -67.477 52.098 0.50 94.41 C |
|
|
13 |
ATOM 10 CE1 HIS B 246 94.268 -65.487 52.304 0.50 94.04 C |
|
|
14 |
ATOM 11 NE2 HIS B 246 94.294 -66.727 52.814 0.50 94.26 N |
|
|
15 |
ATOM 12 N ARG B 247 88.759 -66.647 49.505 1.00 75.54 N |
|
|
16 |
ATOM 13 HN1 ARG B 247 88.875 -67.638 49.211 1.00 0.00 H |
|
|
17 |
ATOM 14 HN2 ARG B 247 89.689 -66.183 49.539 1.00 0.00 H |
|
|
18 |
ATOM 15 HN3 ARG B 247 88.319 -66.613 50.447 1.00 0.00 H |
|
|
19 |
ATOM 16 CA ARG B 247 87.908 -65.955 48.549 1.00 71.41 C |
|
|
20 |
ATOM 17 C ARG B 247 87.757 -64.515 49.003 1.00 74.18 C |
|
|
21 |
ATOM 18 O ARG B 247 88.214 -64.230 50.113 1.00 73.94 O |
|
|
22 |
ATOM 19 CB ARG B 247 86.550 -66.654 48.518 1.00 63.20 C |
|
|
23 |
ATOM 20 CG ARG B 247 86.570 -68.130 48.148 1.00 54.94 C |
|
|
24 |
ATOM 21 CD ARG B 247 86.850 -68.321 46.690 1.00 50.18 C |
|
|
25 |
ATOM 22 NE ARG B 247 86.877 -69.724 46.286 1.00 40.79 N |
|
|
26 |
ATOM 23 HE ARG B 247 85.977 -70.180 46.033 1.00 0.00 H |
|
|
27 |
ATOM 24 CZ ARG B 247 87.990 -70.453 46.223 1.00 59.01 C |
|
|
28 |
ATOM 25 NH1 ARG B 247 89.157 -69.933 46.606 1.00 35.74 N |
|
|
29 |
ATOM 26 1HH1 ARG B 247 89.201 -68.954 46.956 1.00 0.00 H |
|
|
30 |
ATOM 27 2HH1 ARG B 247 90.023 -70.506 46.555 1.00 0.00 H |
|
|
31 |
ATOM 28 NH2 ARG B 247 87.944 -71.715 45.796 1.00 39.63 N |
|
|
32 |
ATOM 29 1HH2 ARG B 247 87.036 -72.135 45.510 1.00 0.00 H |
|
|
33 |
ATOM 30 2HH2 ARG B 247 88.816 -72.280 45.749 1.00 0.00 H |
|
|
34 |
END |