REMARK Name = BDB049984 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C SER A 2 0.710 1.359 1.462 0.00 0.00 +0.236 C ATOM 2 N ASP A 3 -0.489 0.802 1.095 0.00 0.00 -0.302 N ATOM 3 H ASP A 3 -0.977 0.154 1.713 0.00 0.00 +0.150 HD ATOM 4 O SER A 2 1.247 2.272 0.838 0.00 0.00 -0.274 OA ENDROOT BRANCH 2 5 ATOM 5 CA ASP A 3 -1.179 1.149 -0.148 0.00 0.00 +0.169 C BRANCH 5 6 ATOM 6 C ASP A 3 -2.655 0.723 0.028 0.00 0.00 +0.235 C ATOM 7 N VAL A 4 -3.475 0.930 -1.057 0.00 0.00 -0.301 N ATOM 8 H VAL A 4 -3.045 0.982 -1.972 0.00 0.00 +0.150 HD ATOM 9 O ASP A 3 -3.065 0.294 1.108 0.00 0.00 -0.274 OA BRANCH 7 10 ATOM 10 CA VAL A 4 -4.896 0.543 -1.056 0.00 0.00 +0.184 C BRANCH 10 11 ATOM 11 CB VAL A 4 -5.112 -0.974 -1.295 0.00 0.00 +0.014 C ATOM 12 CG2 VAL A 4 -4.785 -1.886 -0.112 0.00 0.00 +0.009 C ATOM 13 CG1 VAL A 4 -6.522 -1.278 -1.819 0.00 0.00 +0.009 C ENDBRANCH 10 11 BRANCH 10 14 ATOM 14 C VAL A 4 -5.646 1.241 0.097 0.00 0.00 +0.326 C ATOM 15 O VAL A 4 -5.413 2.368 0.517 0.00 0.00 -0.249 OA BRANCH 14 16 ATOM 16 OXT VAL A 4 -6.687 0.560 0.604 0.00 0.00 -0.479 OA ATOM 17 HXT VAL A 4 -7.009 1.141 1.325 0.00 0.00 +0.295 HD ENDBRANCH 14 16 ENDBRANCH 10 14 ENDBRANCH 7 10 ENDBRANCH 5 6 BRANCH 5 18 ATOM 18 CB ASP A 3 -0.461 0.533 -1.345 0.00 0.00 +0.152 C BRANCH 18 19 ATOM 19 CG ASP A 3 -0.872 -0.888 -1.595 0.00 0.00 +0.307 C ATOM 20 OD1 ASP A 3 -1.760 -1.177 -2.387 0.00 0.00 -0.251 OA BRANCH 19 21 ATOM 21 OD2 ASP A 3 -0.214 -1.813 -0.875 0.00 0.00 -0.481 OA ATOM 22 HD2 ASP A 3 0.511 -1.490 -0.282 0.00 0.00 +0.295 HD ENDBRANCH 19 21 ENDBRANCH 18 19 ENDBRANCH 5 18 ENDBRANCH 2 5 BRANCH 1 23 ATOM 23 CA SER A 2 1.403 0.639 2.622 0.00 0.00 +0.184 C BRANCH 23 25 ATOM 24 C GLU A 1 2.801 -0.737 1.145 0.00 0.00 +0.231 C ATOM 25 N SER A 2 2.729 0.227 2.136 0.00 0.00 -0.301 N ATOM 26 H SER A 2 3.425 0.963 2.099 0.00 0.00 +0.150 HD ATOM 27 O GLU A 1 1.796 -1.336 0.750 0.00 0.00 -0.274 OA BRANCH 24 28 ATOM 28 CA GLU A 1 4.225 -1.021 0.587 0.00 0.00 +0.141 C BRANCH 28 30 ATOM 29 C ACE A 0 5.370 -2.855 -0.545 0.00 0.00 +0.101 C ATOM 30 N GLU A 1 4.130 -2.102 -0.418 0.00 0.00 -0.309 NA ATOM 31 H GLU A 1 3.380 -2.742 -0.139 0.00 0.00 +0.122 HD ENDBRANCH 28 30 BRANCH 28 32 ATOM 32 CB GLU A 1 4.875 0.234 -0.018 0.00 0.00 +0.039 C BRANCH 32 33 ATOM 33 CG GLU A 1 4.131 0.793 -1.236 0.00 0.00 +0.122 C BRANCH 33 34 ATOM 34 CD GLU A 1 4.758 2.073 -1.716 0.00 0.00 +0.305 C ATOM 35 OE1 GLU A 1 5.677 2.682 -1.197 0.00 0.00 -0.251 OA BRANCH 34 36 ATOM 36 OE2 GLU A 1 4.171 2.533 -2.837 0.00 0.00 -0.481 OA ATOM 37 HE2 GLU A 1 4.652 3.364 -3.038 0.00 0.00 +0.295 HD ENDBRANCH 34 36 ENDBRANCH 33 34 ENDBRANCH 32 33 ENDBRANCH 28 32 ENDBRANCH 24 28 ENDBRANCH 23 25 BRANCH 23 38 ATOM 38 CB SER A 2 1.514 1.579 3.821 0.00 0.00 +0.187 C BRANCH 38 39 ATOM 39 OG SER A 2 2.051 0.889 4.950 0.00 0.00 -0.393 OA ATOM 40 H SER A 2 2.837 0.399 4.647 0.00 0.00 +0.209 HD ENDBRANCH 38 39 ENDBRANCH 23 38 ENDBRANCH 1 23 TORSDOF 19