REMARK Name = BDB049982 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N ASP A 3 -0.654 1.025 1.077 0.00 0.00 -0.302 N ATOM 2 H ASP A 3 -0.581 1.956 0.675 0.00 0.00 +0.150 HD ATOM 3 C SER A 2 0.390 0.161 0.804 0.00 0.00 +0.236 C ATOM 4 O SER A 2 0.273 -1.062 0.860 0.00 0.00 -0.274 OA ENDROOT BRANCH 3 5 ATOM 5 CA SER A 2 1.714 0.845 0.427 0.00 0.00 +0.184 C BRANCH 5 6 ATOM 6 N SER A 2 2.800 -0.112 0.621 0.00 0.00 -0.301 N ATOM 7 H SER A 2 2.568 -1.107 0.625 0.00 0.00 +0.150 HD ATOM 8 C GLU A 1 4.129 0.201 0.471 0.00 0.00 +0.231 C ATOM 9 O GLU A 1 4.512 1.336 0.205 0.00 0.00 -0.274 OA BRANCH 8 10 ATOM 10 CA GLU A 1 5.067 -1.011 0.698 0.00 0.00 +0.138 C BRANCH 10 11 ATOM 11 N GLU A 1 4.501 -2.176 -0.024 0.00 0.00 -0.320 NA ATOM 12 H1 GLU A 1 5.096 -2.988 0.141 0.00 0.00 +0.119 HD ATOM 13 H2 GLU A 1 4.560 -1.999 -1.029 0.00 0.00 +0.119 HD ENDBRANCH 10 11 BRANCH 10 14 ATOM 14 CB GLU A 1 6.504 -0.749 0.233 0.00 0.00 +0.039 C BRANCH 14 15 ATOM 15 CG GLU A 1 7.266 0.190 1.173 0.00 0.00 +0.122 C BRANCH 15 16 ATOM 16 CD GLU A 1 8.691 0.371 0.724 0.00 0.00 +0.305 C ATOM 17 OE1 GLU A 1 9.238 -0.149 -0.232 0.00 0.00 -0.251 OA BRANCH 16 18 ATOM 18 OE2 GLU A 1 9.370 1.207 1.533 0.00 0.00 -0.481 OA ATOM 19 HE2 GLU A 1 10.264 1.252 1.135 0.00 0.00 +0.295 HD ENDBRANCH 16 18 ENDBRANCH 15 16 ENDBRANCH 14 15 ENDBRANCH 10 14 ENDBRANCH 8 10 ENDBRANCH 5 6 BRANCH 5 20 ATOM 20 CB SER A 2 1.648 1.378 -1.012 0.00 0.00 +0.187 C BRANCH 20 21 ATOM 21 OG SER A 2 2.494 2.520 -1.175 0.00 0.00 -0.393 OA ATOM 22 H SER A 2 3.372 2.279 -0.804 0.00 0.00 +0.209 HD ENDBRANCH 20 21 ENDBRANCH 5 20 ENDBRANCH 3 5 BRANCH 1 23 ATOM 23 CA ASP A 3 -2.023 0.510 1.206 0.00 0.00 +0.169 C BRANCH 23 26 ATOM 24 N VAL A 4 -3.801 -0.127 -0.376 0.00 0.00 -0.301 N ATOM 25 H VAL A 4 -4.269 -0.423 0.480 0.00 0.00 +0.150 HD ATOM 26 C ASP A 3 -2.663 0.628 -0.195 0.00 0.00 +0.235 C ATOM 27 O ASP A 3 -2.213 1.378 -1.060 0.00 0.00 -0.274 OA BRANCH 24 28 ATOM 28 CA VAL A 4 -4.662 0.095 -1.540 0.00 0.00 +0.184 C BRANCH 28 30 ATOM 29 CG1 VAL A 4 -4.476 -2.250 -2.478 0.00 0.00 +0.009 C ATOM 30 CB VAL A 4 -5.434 -1.176 -1.953 0.00 0.00 +0.014 C ATOM 31 CG2 VAL A 4 -6.303 -1.757 -0.833 0.00 0.00 +0.009 C ENDBRANCH 28 30 BRANCH 28 32 ATOM 32 C VAL A 4 -5.619 1.249 -1.220 0.00 0.00 +0.326 C ATOM 33 O VAL A 4 -5.855 1.711 -0.112 0.00 0.00 -0.249 OA BRANCH 32 34 ATOM 34 OXT VAL A 4 -6.242 1.739 -2.311 0.00 0.00 -0.479 OA ATOM 35 HXT VAL A 4 -6.790 2.476 -1.968 0.00 0.00 +0.295 HD ENDBRANCH 32 34 ENDBRANCH 28 32 ENDBRANCH 24 28 ENDBRANCH 23 26 BRANCH 23 36 ATOM 36 CB ASP A 3 -2.820 1.345 2.206 0.00 0.00 +0.152 C BRANCH 36 37 ATOM 37 CG ASP A 3 -3.761 0.503 3.017 0.00 0.00 +0.307 C ATOM 38 OD1 ASP A 3 -3.950 0.600 4.218 0.00 0.00 -0.251 OA BRANCH 37 39 ATOM 39 OD2 ASP A 3 -4.483 -0.374 2.292 0.00 0.00 -0.481 OA ATOM 40 HD2 ASP A 3 -5.078 -0.775 2.966 0.00 0.00 +0.295 HD ENDBRANCH 37 39 ENDBRANCH 36 37 ENDBRANCH 23 36 ENDBRANCH 1 23 TORSDOF 19