REMARK Name = BDB043571 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA LEU A 3 0.075 -1.494 -1.052 0.00 0.00 +0.159 C ENDROOT BRANCH 1 3 ATOM 2 C ALA A 2 1.589 -0.405 0.550 0.00 0.00 +0.234 C ATOM 3 N LEU A 3 0.960 -1.547 0.105 0.00 0.00 -0.302 N ATOM 4 H LEU A 3 0.769 -2.271 0.788 0.00 0.00 +0.150 HD ATOM 5 O ALA A 2 1.544 0.667 -0.057 0.00 0.00 -0.274 OA BRANCH 2 6 ATOM 6 CA ALA A 2 2.351 -0.560 1.877 0.00 0.00 +0.156 C ATOM 7 CB ALA A 2 1.387 -0.603 3.054 0.00 0.00 +0.038 C BRANCH 6 9 ATOM 8 C PHE A 1 4.484 0.453 2.601 0.00 0.00 +0.234 C ATOM 9 N ALA A 2 3.262 0.573 1.982 0.00 0.00 -0.303 N ATOM 10 H ALA A 2 3.091 1.341 1.340 0.00 0.00 +0.149 HD ATOM 11 O PHE A 1 4.782 -0.528 3.283 0.00 0.00 -0.274 OA BRANCH 8 12 ATOM 12 CA PHE A 1 5.441 1.648 2.408 0.00 0.00 +0.163 C BRANCH 12 15 ATOM 13 C UNK A 0 8.592 2.002 4.510 0.00 0.00 +0.109 C ATOM 14 C UNK A 0 7.433 2.433 3.654 0.00 0.00 +0.211 C ATOM 15 N PHE A 1 6.630 1.410 3.223 0.00 0.00 -0.304 N ATOM 16 H PHE A 1 6.764 0.461 3.562 0.00 0.00 +0.149 HD ATOM 17 O UNK A 0 7.237 3.607 3.358 0.00 0.00 -0.276 OA ENDBRANCH 12 15 BRANCH 12 18 ATOM 18 CB PHE A 1 5.774 1.921 0.927 0.00 0.00 +0.067 C BRANCH 18 19 ATOM 19 CG PHE A 1 6.224 0.714 0.130 0.00 0.00 -0.045 A ATOM 20 CD2 PHE A 1 5.359 0.108 -0.795 0.00 0.00 +0.004 A ATOM 21 CE2 PHE A 1 5.774 -1.003 -1.530 0.00 0.00 +0.000 A ATOM 22 CZ PHE A 1 7.056 -1.518 -1.353 0.00 0.00 +0.000 A ATOM 23 CE1 PHE A 1 7.925 -0.923 -0.441 0.00 0.00 +0.000 A ATOM 24 CD1 PHE A 1 7.512 0.188 0.296 0.00 0.00 +0.004 A ENDBRANCH 18 19 ENDBRANCH 12 18 ENDBRANCH 8 12 ENDBRANCH 6 9 ENDBRANCH 2 6 ENDBRANCH 1 3 BRANCH 1 25 ATOM 25 C LEU A 3 -1.328 -1.069 -0.566 0.00 0.00 +0.234 C ATOM 26 N UNK A 4 -2.172 -0.636 -1.564 0.00 0.00 -0.302 N ATOM 27 H UNK A 4 -1.903 -0.756 -2.539 0.00 0.00 +0.150 HD ATOM 28 O LEU A 3 -1.674 -1.109 0.616 0.00 0.00 -0.274 OA BRANCH 26 29 ATOM 29 C UNK A 4 -3.563 -0.285 -1.311 0.00 0.00 +0.159 C BRANCH 29 30 ATOM 30 C UNK A 4 -4.389 -0.810 -2.508 0.00 0.00 +0.234 C ATOM 31 N UNK A 5 -5.755 -0.738 -2.342 0.00 0.00 -0.301 N ATOM 32 H UNK A 5 -6.059 -0.733 -1.373 0.00 0.00 +0.150 HD ATOM 33 O UNK A 4 -3.849 -1.230 -3.530 0.00 0.00 -0.274 OA BRANCH 31 34 ATOM 34 C UNK A 5 -6.711 -1.477 -3.193 0.00 0.00 +0.184 C BRANCH 34 35 ATOM 35 C UNK A 5 -6.849 -2.877 -2.561 0.00 0.00 +0.233 C ATOM 36 O UNK A 5 -6.773 -3.033 -1.340 0.00 0.00 -0.274 OA ATOM 37 N UNK A 5 -7.141 -3.924 -3.379 0.00 0.00 -0.328 N ATOM 38 H UNK A 5 -7.105 -4.840 -2.945 0.00 0.00 +0.145 HD ATOM 39 H UNK A 5 -6.775 -3.893 -4.332 0.00 0.00 +0.145 HD ENDBRANCH 34 35 BRANCH 34 40 ATOM 40 C UNK A 5 -6.464 -1.439 -4.708 0.00 0.00 +0.187 C BRANCH 40 41 ATOM 41 O UNK A 5 -5.488 -2.387 -5.138 0.00 0.00 -0.393 OA ATOM 42 H UNK A 5 -4.630 -2.066 -4.778 0.00 0.00 +0.209 HD ENDBRANCH 40 41 ENDBRANCH 34 40 ENDBRANCH 31 34 ENDBRANCH 29 30 BRANCH 29 43 ATOM 43 C UNK A 4 -3.766 1.231 -1.125 0.00 0.00 +0.032 C BRANCH 43 44 ATOM 44 C UNK A 4 -2.761 1.876 -0.161 0.00 0.00 +0.000 C BRANCH 44 45 ATOM 45 C UNK A 4 -3.093 3.316 0.226 0.00 0.00 -0.018 C BRANCH 45 46 ATOM 46 C UNK A 4 -4.332 3.558 1.096 0.00 0.00 -0.076 C BRANCH 46 47 ATOM 47 N UNK A 4 -4.245 3.128 2.575 0.00 0.00 +0.374 N ATOM 48 C UNK A 4 -4.419 1.624 2.767 0.00 0.00 -0.093 C ATOM 49 C UNK A 4 -5.405 3.818 3.314 0.00 0.00 -0.093 C ATOM 50 C UNK A 4 -2.943 3.573 3.232 0.00 0.00 -0.093 C ENDBRANCH 46 47 ENDBRANCH 45 46 ENDBRANCH 44 45 ENDBRANCH 43 44 ENDBRANCH 29 43 ENDBRANCH 26 29 ENDBRANCH 1 25 BRANCH 1 51 ATOM 51 CB LEU A 3 -0.001 -2.853 -1.762 0.00 0.00 +0.034 C BRANCH 51 52 ATOM 52 CG LEU A 3 1.353 -3.386 -2.277 0.00 0.00 -0.015 C ATOM 53 CD2 LEU A 3 1.155 -4.760 -2.921 0.00 0.00 +0.007 C ATOM 54 CD1 LEU A 3 2.014 -2.437 -3.279 0.00 0.00 +0.007 C ENDBRANCH 51 52 ENDBRANCH 1 51 TORSDOF 21