REMARK Name = BDB049987 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N ASP A 3 0.251 0.243 0.544 0.00 0.00 -0.302 N ATOM 2 H ASP A 3 0.288 -0.466 1.277 0.00 0.00 +0.150 HD ATOM 3 C SER A 2 1.288 1.114 0.345 0.00 0.00 +0.236 C ATOM 4 O SER A 2 1.245 2.018 -0.491 0.00 0.00 -0.274 OA ENDROOT BRANCH 3 5 ATOM 5 CA SER A 2 2.530 0.872 1.207 0.00 0.00 +0.184 C BRANCH 5 6 ATOM 6 N SER A 2 3.659 1.406 0.441 0.00 0.00 -0.301 N ATOM 7 H SER A 2 3.391 1.961 -0.366 0.00 0.00 +0.150 HD ATOM 8 C GLU A 1 4.928 0.937 0.613 0.00 0.00 +0.231 C ATOM 9 O GLU A 1 5.255 0.339 1.641 0.00 0.00 -0.274 OA BRANCH 8 10 ATOM 10 CA GLU A 1 5.953 1.183 -0.530 0.00 0.00 +0.138 C BRANCH 10 11 ATOM 11 N GLU A 1 6.847 -0.006 -0.602 0.00 0.00 -0.320 NA ATOM 12 H1 GLU A 1 7.732 0.287 -1.026 0.00 0.00 +0.119 HD ATOM 13 H2 GLU A 1 7.101 -0.232 0.373 0.00 0.00 +0.119 HD ENDBRANCH 10 11 BRANCH 10 14 ATOM 14 CB GLU A 1 5.391 1.453 -1.937 0.00 0.00 +0.039 C BRANCH 14 15 ATOM 15 CG GLU A 1 4.899 0.236 -2.728 0.00 0.00 +0.122 C BRANCH 15 16 ATOM 16 CD GLU A 1 3.954 -0.666 -1.979 0.00 0.00 +0.305 C ATOM 17 OE1 GLU A 1 2.734 -0.636 -2.087 0.00 0.00 -0.251 OA BRANCH 16 18 ATOM 18 OE2 GLU A 1 4.578 -1.514 -1.136 0.00 0.00 -0.481 OA ATOM 19 HE2 GLU A 1 5.545 -1.317 -1.040 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 2.389 1.527 2.581 0.00 0.00 +0.187 C BRANCH 20 21 ATOM 21 OG SER A 2 3.297 0.960 3.527 0.00 0.00 -0.393 OA ATOM 22 H SER A 2 4.134 0.758 3.055 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 -0.974 0.285 -0.255 0.00 0.00 +0.169 C BRANCH 23 26 ATOM 24 N UNK A 4 -3.319 -0.435 -0.021 0.00 0.00 -0.300 N ATOM 25 H UNK A 4 -3.439 -0.051 -0.953 0.00 0.00 +0.150 HD ATOM 26 C ASP A 3 -2.052 -0.511 0.508 0.00 0.00 +0.235 C ATOM 27 O ASP A 3 -1.782 -1.136 1.534 0.00 0.00 -0.274 OA BRANCH 24 28 ATOM 28 C UNK A 4 -4.382 -1.359 0.403 0.00 0.00 +0.187 C BRANCH 28 30 ATOM 29 C UNK A 4 -4.953 0.006 2.459 0.00 0.00 +0.013 C ATOM 30 C UNK A 4 -5.523 -0.634 1.175 0.00 0.00 -0.009 C ATOM 31 C UNK A 4 -6.608 -1.644 1.599 0.00 0.00 +0.013 C ATOM 32 C UNK A 4 -6.185 0.472 0.333 0.00 0.00 +0.013 C ENDBRANCH 28 30 BRANCH 28 33 ATOM 33 C UNK A 4 -4.854 -2.042 -0.886 0.00 0.00 +0.326 C ATOM 34 O UNK A 4 -4.901 -1.514 -1.990 0.00 0.00 -0.249 OA BRANCH 33 35 ATOM 35 O UNK A 4 -5.240 -3.320 -0.715 0.00 0.00 -0.479 OA ATOM 36 H UNK A 4 -5.410 -3.644 -1.624 0.00 0.00 +0.295 HD ENDBRANCH 33 35 ENDBRANCH 28 33 ENDBRANCH 24 28 ENDBRANCH 23 26 BRANCH 23 37 ATOM 37 CB ASP A 3 -0.750 -0.214 -1.682 0.00 0.00 +0.152 C BRANCH 37 38 ATOM 38 CG ASP A 3 -0.622 -1.712 -1.745 0.00 0.00 +0.307 C ATOM 39 OD1 ASP A 3 -1.589 -2.462 -1.714 0.00 0.00 -0.251 OA BRANCH 38 40 ATOM 40 OD2 ASP A 3 0.639 -2.170 -1.831 0.00 0.00 -0.481 OA ATOM 41 HD2 ASP A 3 1.354 -1.485 -1.880 0.00 0.00 +0.295 HD ENDBRANCH 38 40 ENDBRANCH 37 38 ENDBRANCH 23 37 ENDBRANCH 1 23 TORSDOF 19