REMARK Name = LIG000350 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -3.344 -0.326 -0.577 0.00 0.00 +0.219 A ATOM 2 N LIG 1 -3.886 0.886 -0.779 0.00 0.00 -0.195 NA ATOM 3 C LIG 1 -2.963 1.843 -0.947 0.00 0.00 +0.167 A ATOM 4 C LIG 1 -1.591 1.686 -0.930 0.00 0.00 +0.148 A ATOM 5 N LIG 1 -0.953 2.896 -1.117 0.00 0.00 -0.231 NA ATOM 6 C LIG 1 -1.929 3.768 -1.264 0.00 0.00 +0.201 A ATOM 7 C LIG 1 -1.109 0.385 -0.719 0.00 0.00 +0.152 A ATOM 8 N LIG 1 -3.164 3.178 -1.171 0.00 0.00 -0.312 N ATOM 9 N LIG 1 -2.026 -0.603 -0.538 0.00 0.00 -0.197 NA ENDROOT BRANCH 8 10 ATOM 10 C LIG 1 -4.454 3.842 -1.286 0.00 0.00 +0.084 C ATOM 11 C LIG 1 -4.643 4.470 -2.667 0.00 0.00 +0.030 C ATOM 12 C LIG 1 -4.659 4.871 -0.174 0.00 0.00 +0.030 C ENDBRANCH 8 10 BRANCH 1 13 ATOM 13 N LIG 1 -4.270 -1.334 -0.408 0.00 0.00 -0.308 N ATOM 14 H LIG 1 -5.167 -0.878 -0.276 0.00 0.00 +0.149 HD BRANCH 13 15 ATOM 15 CA LIG 1 -4.028 -2.472 0.477 0.00 0.00 +0.098 C BRANCH 15 17 ATOM 16 C LIG 1 -3.004 -1.325 2.584 0.00 0.00 +0.006 C ATOM 17 C LIG 1 -4.155 -2.110 1.970 0.00 0.00 +0.021 C ENDBRANCH 15 17 BRANCH 15 18 ATOM 18 C LIG 1 -2.790 -3.317 0.120 0.00 0.00 +0.178 C BRANCH 18 19 ATOM 19 O LIG 1 -2.894 -4.629 0.681 0.00 0.00 -0.393 OA ATOM 20 H LIG 1 -3.536 -5.118 0.138 0.00 0.00 +0.209 HD ENDBRANCH 18 19 ENDBRANCH 15 18 ENDBRANCH 13 15 ENDBRANCH 1 13 BRANCH 7 21 ATOM 21 N LIG 1 0.262 0.111 -0.699 0.00 0.00 -0.323 N ATOM 22 H LIG 1 0.788 0.973 -0.568 0.00 0.00 +0.148 HD BRANCH 21 23 ATOM 23 C LIG 1 0.655 -0.989 0.158 0.00 0.00 +0.138 C BRANCH 23 24 ATOM 24 C LIG 1 2.164 -1.040 0.231 0.00 0.00 -0.030 A ATOM 25 C LIG 1 2.907 -1.528 -0.853 0.00 0.00 +0.006 A ATOM 26 C LIG 1 4.303 -1.563 -0.799 0.00 0.00 +0.010 A ATOM 27 C LIG 1 4.982 -1.108 0.338 0.00 0.00 -0.002 A ATOM 28 C LIG 1 4.241 -0.610 1.418 0.00 0.00 +0.010 A ATOM 29 C LIG 1 2.844 -0.574 1.364 0.00 0.00 +0.006 A BRANCH 27 30 ATOM 30 C LIG 1 6.454 -1.133 0.378 0.00 0.00 +0.050 A ATOM 31 N LIG 1 7.136 -0.447 -0.604 0.00 0.00 -0.360 N ATOM 32 H LIG 1 6.599 0.121 -1.252 0.00 0.00 +0.165 HD ATOM 33 C LIG 1 8.503 -0.396 -0.636 0.00 0.00 +0.087 A ATOM 34 C LIG 1 9.271 -1.031 0.257 0.00 0.00 +0.068 A ATOM 35 C LIG 1 8.587 -1.808 1.324 0.00 0.00 +0.182 A ATOM 36 O LIG 1 9.231 -2.414 2.173 0.00 0.00 -0.288 OA ATOM 37 C LIG 1 7.100 -1.819 1.337 0.00 0.00 +0.077 A ENDBRANCH 27 30 ENDBRANCH 23 24 ENDBRANCH 21 23 ENDBRANCH 7 21 TORSDOF 10