Pocket-Gen / tmp /0lig.pdbqt
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REMARK Flexibility Score: inf
REMARK Active torsions [ 5 ] -> [ 5 ]
ROOT
ATOM 1 N1 LIG L 1 7.084 45.353 64.321 1.00 0.00 -0.227 N
ATOM 2 O1 LIG L 1 6.433 44.999 62.519 1.00 0.00 -0.268 OA
ATOM 3 N2 LIG L 1 5.993 43.501 61.936 1.00 0.00 -0.266 N
ATOM 4 N3 LIG L 1 6.891 45.375 64.391 1.00 0.00 -0.161 NA
ATOM 5 C1 LIG L 1 6.221 44.505 62.692 1.00 0.00 0.270 C
ATOM 6 C2 LIG L 1 6.166 45.299 64.019 1.00 0.00 0.151 A
ATOM 7 C3 LIG L 1 6.224 44.788 63.285 1.00 0.00 0.017 A
ATOM 8 C4 LIG L 1 6.539 44.958 63.519 1.00 0.00 0.133 A
ATOM 9 C5 LIG L 1 5.535 44.340 62.552 1.00 0.00 0.059 C
ATOM 10 C6 LIG L 1 5.763 43.349 62.264 1.00 0.00 0.119 C
ENDROOT
BRANCH 1 11
ATOM 11 C7 LIG L 1 7.850 45.732 65.054 1.00 0.00 0.066 A
ATOM 12 C8 LIG L 1 10.265 45.937 66.329 1.00 0.00 0.120 A
ATOM 13 C9 LIG L 1 9.936 46.962 65.246 1.00 0.00 0.048 A
ATOM 14 C10 LIG L 1 9.422 44.955 66.624 1.00 0.00 0.048 A
ATOM 15 C11 LIG L 1 8.717 46.766 64.723 1.00 0.00 0.031 A
ATOM 16 C12 LIG L 1 8.254 45.034 65.922 1.00 0.00 0.031 A
BRANCH 12 17
ATOM 17 O2 LIG L 1 11.507 45.798 66.483 1.00 0.00 -0.495 OA
ATOM 18 C13 LIG L 1 12.152 44.806 66.928 1.00 0.00 0.277 C
ENDBRANCH 12 17
ENDBRANCH 1 11
BRANCH 6 19
ATOM 19 C14 LIG L 1 5.014 45.806 64.403 1.00 0.00 0.262 C
ATOM 20 O3 LIG L 1 4.216 45.911 63.896 1.00 0.00 -0.269 OA
ATOM 21 N4 LIG L 1 4.910 46.151 65.296 1.00 0.00 -0.324 N
ATOM 22 H1 LIG L 1 4.046 46.529 65.580 1.00 0.00 0.145 HD
ATOM 23 H2 LIG L 1 5.667 46.125 65.925 1.00 0.00 0.145 HD
ENDBRANCH 6 19
BRANCH 3 24
ATOM 24 C15 LIG L 1 6.140 42.642 60.814 1.00 0.00 0.037 A
ATOM 25 C16 LIG L 1 6.279 41.367 61.135 1.00 0.00 0.025 A
ATOM 26 C17 LIG L 1 6.687 43.054 59.503 1.00 0.00 0.025 A
ATOM 27 C18 LIG L 1 6.937 40.523 60.274 1.00 0.00 0.025 A
ATOM 28 C19 LIG L 1 7.442 42.039 58.638 1.00 0.00 0.025 A
ATOM 29 C20 LIG L 1 7.503 40.828 59.121 1.00 0.00 0.036 A
BRANCH 29 30
ATOM 30 N5 LIG L 1 8.197 40.280 58.770 1.00 0.00 -0.271 N
ATOM 31 C21 LIG L 1 7.783 39.930 58.039 1.00 0.00 0.220 C
ATOM 32 C22 LIG L 1 9.234 39.681 58.621 1.00 0.00 0.113 C
ATOM 33 O4 LIG L 1 6.972 40.264 58.042 1.00 0.00 -0.275 OA
ATOM 34 C23 LIG L 1 8.264 39.069 57.247 1.00 0.00 0.096 C
ATOM 35 C24 LIG L 1 9.758 38.896 58.237 1.00 0.00 0.020 C
ATOM 36 C25 LIG L 1 9.407 39.068 57.217 1.00 0.00 0.011 C
ENDBRANCH 29 30
ENDBRANCH 3 24
TORSDOF 5