REMARK Name = BDB055842 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CB ALA A 10 5.582 -2.447 0.901 0.00 0.00 +0.027 C ATOM 2 CA ALA A 10 5.310 -2.446 -0.704 0.00 0.00 +0.193 C ATOM 3 C ALA A 10 6.691 -2.639 -1.508 0.00 0.00 +0.255 C ATOM 4 O ALA A 10 7.526 -3.501 -1.191 0.00 0.00 -0.272 OA ATOM 5 N TYR A 11 6.795 -1.871 -2.619 0.00 0.00 -0.202 NA ATOM 6 CA TYR A 11 7.451 -0.529 -2.439 0.00 0.00 +0.197 C ATOM 7 C TYR A 11 6.990 0.457 -3.633 0.00 0.00 +0.256 C ATOM 8 O TYR A 11 6.974 0.076 -4.812 0.00 0.00 -0.272 OA ATOM 9 N UNK A 12 6.718 1.720 -3.203 0.00 0.00 -0.202 NA ATOM 10 C UNK A 12 5.576 2.404 -3.905 0.00 0.00 +0.203 C ATOM 11 C UNK A 12 4.745 3.140 -2.862 0.00 0.00 +0.083 C ATOM 12 S UNK A 12 4.020 4.156 -1.690 0.00 0.00 -0.134 S ATOM 13 C UNK A 12 2.546 3.388 -1.284 0.00 0.00 +0.083 C ATOM 14 C UNK A 12 1.253 2.979 -0.759 0.00 0.00 -0.027 A ATOM 15 C UNK A 12 0.619 1.839 -1.258 0.00 0.00 +0.010 A ATOM 16 C UNK A 12 -0.640 1.455 -0.771 0.00 0.00 -0.027 A ATOM 17 C UNK A 12 -1.266 2.202 0.234 0.00 0.00 +0.010 A ATOM 18 C UNK A 12 -0.648 3.349 0.751 0.00 0.00 -0.027 A ATOM 19 C UNK A 2 -1.288 4.043 1.854 0.00 0.00 +0.083 C ATOM 20 S UNK A 2 -1.886 4.544 3.374 0.00 0.00 -0.134 S ATOM 21 C UNK A 2 -3.143 5.631 3.011 0.00 0.00 +0.083 C ATOM 22 C UNK A 2 -4.207 6.699 2.941 0.00 0.00 +0.203 C ATOM 23 C UNK A 2 -5.713 6.252 3.252 0.00 0.00 +0.257 C ATOM 24 N GLY A 3 -5.902 4.915 3.200 0.00 0.00 -0.194 NA ATOM 25 CA GLY A 3 -7.317 4.361 3.230 0.00 0.00 +0.201 C ATOM 26 C GLY A 3 -8.614 3.637 3.165 0.00 0.00 +0.264 C ATOM 27 N GLY A 4 -8.535 2.359 3.597 0.00 0.00 -0.194 NA ATOM 28 CA GLY A 4 -9.579 1.386 3.108 0.00 0.00 +0.201 C ATOM 29 C GLY A 4 -10.533 0.358 2.662 0.00 0.00 +0.264 C ATOM 30 N ARG A 5 -10.235 -0.366 1.575 0.00 0.00 -0.203 NA ATOM 31 CA ARG A 5 -9.095 -1.311 1.676 0.00 0.00 +0.191 C ATOM 32 C ARG A 5 -8.626 -1.693 0.213 0.00 0.00 +0.240 C ATOM 33 N PRO A 6 -7.544 -2.582 0.012 0.00 0.00 -0.277 N ATOM 34 CA PRO A 6 -6.812 -3.368 1.073 0.00 0.00 +0.172 C ATOM 35 C PRO A 6 -5.236 -3.369 1.278 0.00 0.00 +0.254 C ATOM 36 N UNK A 7 -4.574 -2.544 0.462 0.00 0.00 -0.202 NA ATOM 37 C UNK A 7 -3.084 -2.635 0.524 0.00 0.00 +0.202 C ATOM 38 C UNK A 7 -2.581 -1.841 -0.627 0.00 0.00 +0.083 C ATOM 39 S UNK A 7 -2.057 -1.038 -2.023 0.00 0.00 -0.134 S ATOM 40 C UNK A 7 -2.439 -2.153 1.846 0.00 0.00 +0.241 C ATOM 41 O UNK A 7 -3.099 -1.646 2.765 0.00 0.00 -0.273 OA ATOM 42 N PRO A 8 -1.069 -2.315 2.050 0.00 0.00 -0.277 N ATOM 43 CA PRO A 8 0.046 -2.735 1.110 0.00 0.00 +0.171 C ATOM 44 CB PRO A 8 1.145 -2.241 1.978 0.00 0.00 +0.025 C ATOM 45 CG PRO A 8 1.122 -1.608 3.373 0.00 0.00 +0.023 C ATOM 46 C PRO A 8 0.127 -4.271 0.915 0.00 0.00 +0.238 C ATOM 47 O PRO A 8 -0.843 -5.003 1.185 0.00 0.00 -0.273 OA ATOM 48 N PRO A 9 1.255 -4.886 0.376 0.00 0.00 -0.277 N ATOM 49 CA PRO A 9 2.698 -4.434 0.494 0.00 0.00 +0.172 C ATOM 50 CB PRO A 9 3.300 -5.803 0.391 0.00 0.00 +0.025 C ATOM 51 CG PRO A 9 2.618 -7.147 0.131 0.00 0.00 +0.023 C ATOM 52 C PRO A 9 3.153 -3.447 -0.606 0.00 0.00 +0.254 C ATOM 53 O PRO A 9 2.387 -2.580 -1.019 0.00 0.00 -0.272 OA ATOM 54 CD PRO A 9 1.397 -6.229 0.164 0.00 0.00 +0.094 C ATOM 55 CD PRO A 8 -0.368 -1.824 3.111 0.00 0.00 +0.094 C ATOM 56 O PRO A 6 -4.748 -4.159 2.098 0.00 0.00 -0.272 OA ATOM 57 CB PRO A 6 -7.090 -4.729 0.474 0.00 0.00 +0.025 C ATOM 58 CG PRO A 6 -7.474 -5.010 -0.982 0.00 0.00 +0.023 C ATOM 59 CD PRO A 6 -7.588 -3.485 -1.019 0.00 0.00 +0.094 C ATOM 60 O ARG A 5 -9.286 -1.357 -0.791 0.00 0.00 -0.273 OA ATOM 61 O GLY A 4 -11.611 0.279 3.258 0.00 0.00 -0.271 OA ATOM 62 O GLY A 3 -9.600 4.268 2.772 0.00 0.00 -0.271 OA ATOM 63 O UNK A 2 -6.578 7.117 3.455 0.00 0.00 -0.272 OA ATOM 64 C UNK A 12 -1.300 0.298 -1.307 0.00 0.00 +0.083 C ATOM 65 C UNK A 12 0.612 3.734 0.250 0.00 0.00 +0.010 A ATOM 66 N ALA A 10 4.435 -3.633 -0.955 0.00 0.00 -0.203 NA ENDROOT BRANCH 10 67 ATOM 67 C UNK A 12 5.853 3.371 -5.157 0.00 0.00 +0.257 C ATOM 68 N GLY A 13 6.697 4.413 -4.930 0.00 0.00 -0.192 NA ATOM 69 O UNK A 12 5.207 3.175 -6.201 0.00 0.00 -0.272 OA BRANCH 68 70 ATOM 70 CA GLY A 13 6.881 5.410 -6.086 0.00 0.00 +0.228 C BRANCH 70 71 ATOM 71 C GLY A 13 7.120 6.459 -7.252 0.00 0.00 +0.387 C ATOM 72 OXT GLY A 13 8.310 6.615 -7.704 0.00 0.00 -0.244 OA ATOM 73 O GLY A 13 6.122 7.127 -7.687 0.00 0.00 -0.244 OA ENDBRANCH 70 71 ENDBRANCH 68 70 ENDBRANCH 10 67 BRANCH 22 74 ATOM 74 N UNK A 2 -3.847 7.742 3.948 0.00 0.00 -0.202 NA ATOM 75 C GLY A 1 -3.116 8.759 3.518 0.00 0.00 +0.261 C ATOM 76 O GLY A 1 -2.929 9.217 2.401 0.00 0.00 -0.272 OA BRANCH 75 77 ATOM 77 CA GLY A 1 -2.465 9.440 4.624 0.00 0.00 +0.196 C ATOM 78 N GLY A 1 -1.814 10.131 5.735 0.00 0.00 -0.121 NA ENDBRANCH 75 77 ENDBRANCH 22 74 BRANCH 6 79 ATOM 79 CB TYR A 11 8.954 -0.699 -2.434 0.00 0.00 +0.050 C BRANCH 79 80 ATOM 80 CG TYR A 11 10.388 -0.883 -2.344 0.00 0.00 -0.037 A ATOM 81 CD2 TYR A 11 11.281 0.081 -2.800 0.00 0.00 +0.008 A ATOM 82 CE2 TYR A 11 12.687 -0.108 -2.690 0.00 0.00 +0.051 A ATOM 83 CZ TYR A 11 13.290 -1.255 -2.109 0.00 0.00 +0.179 A ATOM 84 OH TYR A 11 14.562 -1.423 -2.014 0.00 0.00 -0.288 OA ATOM 85 CE1 TYR A 11 12.339 -2.202 -1.661 0.00 0.00 +0.051 A ATOM 86 CD1 TYR A 11 10.930 -2.031 -1.778 0.00 0.00 +0.008 A ENDBRANCH 79 80 ENDBRANCH 6 79 BRANCH 31 87 ATOM 87 CB ARG A 5 -9.629 -2.548 2.298 0.00 0.00 +0.027 C BRANCH 87 88 ATOM 88 CG ARG A 5 -10.135 -3.915 2.808 0.00 0.00 +0.028 C BRANCH 88 89 ATOM 89 CD ARG A 5 -10.559 -5.352 3.187 0.00 0.00 +0.129 C BRANCH 89 90 ATOM 90 NE ARG A 5 -10.868 -6.643 3.406 0.00 0.00 -0.234 NA ATOM 91 CZ ARG A 5 -10.343 -7.511 2.606 0.00 0.00 +0.284 C ATOM 92 NH2 ARG A 5 -9.464 -7.206 1.479 0.00 0.00 -0.104 NA ATOM 93 NH1 ARG A 5 -10.698 -8.919 2.833 0.00 0.00 -0.104 NA ENDBRANCH 89 90 ENDBRANCH 88 89 ENDBRANCH 87 88 ENDBRANCH 31 87 TORSDOF 11