REMARK Name = BDB050385 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N GLN A 2 1.115 1.564 -0.828 0.00 0.00 -0.301 N ATOM 2 H GLN A 2 1.105 0.683 -1.343 0.00 0.00 +0.150 HD ATOM 3 C TRP A 1 -0.033 2.314 -0.898 0.00 0.00 +0.231 C ATOM 4 O TRP A 1 -0.210 3.341 -0.251 0.00 0.00 -0.274 OA ENDROOT BRANCH 1 5 ATOM 5 CA GLN A 2 2.252 1.868 0.032 0.00 0.00 +0.182 C BRANCH 5 6 ATOM 6 C GLN A 2 3.485 1.164 -0.531 0.00 0.00 +0.325 C ATOM 7 O GLN A 2 3.488 0.315 -1.412 0.00 0.00 -0.249 OA BRANCH 6 8 ATOM 8 OXT GLN A 2 4.635 1.567 0.044 0.00 0.00 -0.479 OA ATOM 9 HXT GLN A 2 5.301 0.932 -0.291 0.00 0.00 +0.295 HD ENDBRANCH 6 8 ENDBRANCH 5 6 BRANCH 5 10 ATOM 10 CB GLN A 2 1.994 1.525 1.508 0.00 0.00 +0.043 C BRANCH 10 11 ATOM 11 CG GLN A 2 1.391 0.141 1.755 0.00 0.00 +0.098 C BRANCH 11 15 ATOM 12 NE2 GLN A 2 1.731 -2.193 1.235 0.00 0.00 -0.329 N ATOM 13 HE21 GLN A 2 0.769 -2.222 0.914 0.00 0.00 +0.145 HD ATOM 14 HE22 GLN A 2 2.332 -2.959 0.961 0.00 0.00 +0.145 HD ATOM 15 CD GLN A 2 2.343 -1.005 1.508 0.00 0.00 +0.211 C ATOM 16 OE1 GLN A 2 3.562 -0.920 1.588 0.00 0.00 -0.276 OA ENDBRANCH 11 15 ENDBRANCH 10 11 ENDBRANCH 5 10 ENDBRANCH 1 5 BRANCH 3 17 ATOM 17 CA TRP A 1 -1.073 1.760 -1.897 0.00 0.00 +0.142 C BRANCH 17 18 ATOM 18 N TRP A 1 -0.496 0.648 -2.707 0.00 0.00 -0.320 NA ATOM 19 H1 TRP A 1 0.256 1.035 -3.283 0.00 0.00 +0.119 HD ATOM 20 H2 TRP A 1 -1.206 0.331 -3.367 0.00 0.00 +0.119 HD ENDBRANCH 17 18 BRANCH 17 21 ATOM 21 CB TRP A 1 -2.396 1.396 -1.205 0.00 0.00 +0.065 C BRANCH 21 22 ATOM 22 CG TRP A 1 -2.305 0.496 -0.006 0.00 0.00 -0.020 A ATOM 23 CD2 TRP A 1 -2.136 -0.928 0.027 0.00 0.00 +0.003 A ATOM 24 CE2 TRP A 1 -2.149 -1.321 1.368 0.00 0.00 +0.047 A ATOM 25 CZ2 TRP A 1 -2.003 -2.653 1.773 0.00 0.00 +0.026 A ATOM 26 CH2 TRP A 1 -1.839 -3.620 0.778 0.00 0.00 +0.002 A ATOM 27 CZ3 TRP A 1 -1.824 -3.264 -0.568 0.00 0.00 +0.001 A ATOM 28 NE1 TRP A 1 -2.328 -0.185 2.121 0.00 0.00 -0.360 N ATOM 29 HE1 TRP A 1 -2.385 -0.167 3.130 0.00 0.00 +0.165 HD ATOM 30 CE3 TRP A 1 -1.975 -1.927 -0.954 0.00 0.00 +0.010 A ATOM 31 CD1 TRP A 1 -2.413 0.911 1.309 0.00 0.00 +0.087 A ENDBRANCH 21 22 ENDBRANCH 17 21 ENDBRANCH 3 17 TORSDOF 10