REMARK Name = BDB050387 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N ARG A 2 0.422 0.764 -0.284 0.00 0.00 -0.301 N ATOM 2 H ARG A 2 -0.004 1.162 -1.122 0.00 0.00 +0.150 HD ATOM 3 C TRP A 1 -0.480 0.675 0.758 0.00 0.00 +0.231 C ATOM 4 O TRP A 1 -0.153 0.564 1.935 0.00 0.00 -0.274 OA ENDROOT BRANCH 1 5 ATOM 5 CA ARG A 2 1.832 1.052 -0.033 0.00 0.00 +0.182 C BRANCH 5 6 ATOM 6 C ARG A 2 1.971 2.569 0.118 0.00 0.00 +0.325 C ATOM 7 O ARG A 2 1.288 3.420 -0.435 0.00 0.00 -0.249 OA BRANCH 6 8 ATOM 8 OXT ARG A 2 2.979 2.932 0.936 0.00 0.00 -0.479 OA ATOM 9 HXT ARG A 2 2.943 3.911 0.945 0.00 0.00 +0.295 HD ENDBRANCH 6 8 ENDBRANCH 5 6 BRANCH 5 10 ATOM 10 CB ARG A 2 2.677 0.531 -1.199 0.00 0.00 +0.035 C BRANCH 10 11 ATOM 11 CG ARG A 2 4.177 0.539 -0.898 0.00 0.00 +0.026 C BRANCH 11 12 ATOM 12 CD ARG A 2 4.974 -0.093 -2.038 0.00 0.00 +0.145 C BRANCH 12 14 ATOM 13 CZ ARG A 2 6.984 -0.972 -1.138 0.00 0.00 +0.188 C ATOM 14 NE ARG A 2 6.400 -0.007 -1.743 0.00 0.00 -0.253 NA BRANCH 13 15 ATOM 15 NH1 ARG A 2 6.474 -2.127 -0.668 0.00 0.00 -0.370 N ATOM 16 HH11 ARG A 2 7.026 -2.673 -0.025 0.00 0.00 +0.159 HD ATOM 17 HH12 ARG A 2 5.474 -2.204 -0.559 0.00 0.00 +0.159 HD ENDBRANCH 13 15 BRANCH 13 18 ATOM 18 NH2 ARG A 2 8.314 -0.895 -0.920 0.00 0.00 -0.370 N ATOM 19 HH21 ARG A 2 8.593 -1.090 0.031 0.00 0.00 +0.159 HD ATOM 20 HH22 ARG A 2 8.649 0.021 -1.205 0.00 0.00 +0.159 HD ENDBRANCH 13 18 ENDBRANCH 12 14 ENDBRANCH 11 12 ENDBRANCH 10 11 ENDBRANCH 5 10 ENDBRANCH 1 5 BRANCH 3 21 ATOM 21 CA TRP A 1 -1.946 0.680 0.293 0.00 0.00 +0.142 C BRANCH 21 22 ATOM 22 N TRP A 1 -2.065 1.527 -0.931 0.00 0.00 -0.320 NA ATOM 23 H1 TRP A 1 -3.041 1.485 -1.235 0.00 0.00 +0.119 HD ATOM 24 H2 TRP A 1 -1.910 2.500 -0.656 0.00 0.00 +0.119 HD ENDBRANCH 21 22 BRANCH 21 25 ATOM 25 CB TRP A 1 -2.385 -0.770 0.040 0.00 0.00 +0.065 C BRANCH 25 26 ATOM 26 CG TRP A 1 -3.862 -0.908 -0.183 0.00 0.00 -0.020 A ATOM 27 CD2 TRP A 1 -4.886 -0.870 0.818 0.00 0.00 +0.003 A ATOM 28 CE2 TRP A 1 -6.110 -1.033 0.169 0.00 0.00 +0.047 A ATOM 29 CZ2 TRP A 1 -7.333 -1.040 0.850 0.00 0.00 +0.026 A ATOM 30 CH2 TRP A 1 -7.303 -0.876 2.238 0.00 0.00 +0.002 A ATOM 31 CZ3 TRP A 1 -6.097 -0.714 2.915 0.00 0.00 +0.001 A ATOM 32 NE1 TRP A 1 -5.842 -1.176 -1.172 0.00 0.00 -0.360 N ATOM 33 HE1 TRP A 1 -6.545 -1.319 -1.883 0.00 0.00 +0.165 HD ATOM 34 CE3 TRP A 1 -4.883 -0.710 2.219 0.00 0.00 +0.010 A ATOM 35 CD1 TRP A 1 -4.494 -1.101 -1.396 0.00 0.00 +0.087 A ENDBRANCH 25 26 ENDBRANCH 21 25 ENDBRANCH 3 21 TORSDOF 13