REMARK Name = BDB049472 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA TRP A 1 -0.833 -1.004 -2.432 0.00 0.00 +0.142 C ENDROOT BRANCH 1 2 ATOM 2 C TRP A 1 0.582 -0.460 -2.105 0.00 0.00 +0.231 C ATOM 3 N GLU A 2 0.669 0.307 -0.964 0.00 0.00 -0.301 N ATOM 4 H GLU A 2 -0.013 0.116 -0.235 0.00 0.00 +0.150 HD ATOM 5 O TRP A 1 1.546 -0.649 -2.848 0.00 0.00 -0.274 OA BRANCH 3 6 ATOM 6 CA GLU A 2 1.953 0.864 -0.529 0.00 0.00 +0.182 C BRANCH 6 7 ATOM 7 C GLU A 2 2.713 -0.181 0.290 0.00 0.00 +0.325 C ATOM 8 O GLU A 2 2.235 -1.078 0.967 0.00 0.00 -0.249 OA BRANCH 7 9 ATOM 9 OXT GLU A 2 4.051 -0.001 0.238 0.00 0.00 -0.479 OA ATOM 10 HXT GLU A 2 4.396 -0.675 0.863 0.00 0.00 +0.295 HD ENDBRANCH 7 9 ENDBRANCH 6 7 BRANCH 6 11 ATOM 11 CB GLU A 2 1.703 2.152 0.270 0.00 0.00 +0.045 C BRANCH 11 12 ATOM 12 CG GLU A 2 2.962 2.994 0.505 0.00 0.00 +0.123 C BRANCH 12 13 ATOM 13 CD GLU A 2 3.738 2.587 1.737 0.00 0.00 +0.305 C ATOM 14 OE1 GLU A 2 3.346 1.801 2.584 0.00 0.00 -0.251 OA BRANCH 13 15 ATOM 15 OE2 GLU A 2 4.934 3.211 1.827 0.00 0.00 -0.481 OA ATOM 16 HE2 GLU A 2 5.127 3.812 1.083 0.00 0.00 +0.295 HD ENDBRANCH 13 15 ENDBRANCH 12 13 ENDBRANCH 11 12 ENDBRANCH 6 11 ENDBRANCH 3 6 ENDBRANCH 1 2 BRANCH 1 17 ATOM 17 N TRP A 1 -0.894 -1.317 -3.885 0.00 0.00 -0.320 NA ATOM 18 H1 TRP A 1 -0.633 -0.470 -4.394 0.00 0.00 +0.119 HD ATOM 19 H2 TRP A 1 -0.119 -1.957 -4.086 0.00 0.00 +0.119 HD ENDBRANCH 1 17 BRANCH 1 20 ATOM 20 CB TRP A 1 -1.176 -2.257 -1.610 0.00 0.00 +0.065 C BRANCH 20 21 ATOM 21 CG TRP A 1 -1.476 -1.970 -0.170 0.00 0.00 -0.020 A ATOM 22 CD2 TRP A 1 -2.606 -1.265 0.357 0.00 0.00 +0.003 A ATOM 23 CE2 TRP A 1 -2.444 -1.190 1.741 0.00 0.00 +0.047 A ATOM 24 CZ2 TRP A 1 -3.361 -0.544 2.578 0.00 0.00 +0.026 A ATOM 25 CH2 TRP A 1 -4.483 0.040 1.982 0.00 0.00 +0.002 A ATOM 26 CZ3 TRP A 1 -4.677 -0.023 0.605 0.00 0.00 +0.001 A ATOM 27 NE1 TRP A 1 -1.277 -1.849 2.049 0.00 0.00 -0.360 N ATOM 28 HE1 TRP A 1 -0.901 -1.955 2.982 0.00 0.00 +0.165 HD ATOM 29 CE3 TRP A 1 -3.748 -0.671 -0.218 0.00 0.00 +0.010 A ATOM 30 CD1 TRP A 1 -0.697 -2.334 0.910 0.00 0.00 +0.087 A ENDBRANCH 20 21 ENDBRANCH 1 20 TORSDOF 11