USER MOD reduce.3.24.130724 H: found=0, std=0, add=658, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 662 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 4 SER OG : rot 180:sc= -0.0449 USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.0706 USER MOD Single : A 31 HIS :FLIP no HE2:sc= 0.444 F(o=-1.4!,f=0.44) USER MOD Single : B 64 SER OG : rot 180:sc= -0.033 USER MOD Single : B 67 THR OG1 : rot 180:sc= -0.0776 USER MOD Single : B 91 HIS :FLIP no HE2:sc= 0.436 F(o=-1.4!,f=0.44) USER MOD ----------------------------------------------------------------- ATOM 25 N ILE A 2 -1.394 -1.010 -30.809 1.00 0.00 N ATOM 26 CA ILE A 2 -1.826 -1.518 -29.509 1.00 0.00 C ATOM 27 C ILE A 2 -2.802 -0.551 -28.833 1.00 0.00 C ATOM 28 O ILE A 2 -2.683 0.665 -28.994 1.00 0.00 O ATOM 29 CB ILE A 2 -0.629 -1.784 -28.561 1.00 0.00 C ATOM 30 CG1 ILE A 2 0.405 -0.649 -28.633 1.00 0.00 C ATOM 31 CG2 ILE A 2 0.024 -3.117 -28.897 1.00 0.00 C ATOM 32 CD1 ILE A 2 0.207 0.421 -27.579 1.00 0.00 C ATOM 0 HA ILE A 2 -2.331 -2.465 -29.701 1.00 0.00 H new ATOM 0 HB ILE A 2 -1.011 -1.824 -27.541 1.00 0.00 H new ATOM 0 HG12 ILE A 2 1.404 -1.072 -28.526 1.00 0.00 H new ATOM 0 HG13 ILE A 2 0.358 -0.188 -29.620 1.00 0.00 H new ATOM 0 HG21 ILE A 2 0.863 -3.291 -28.224 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -0.706 -3.919 -28.782 1.00 0.00 H new ATOM 0 HG23 ILE A 2 0.383 -3.097 -29.926 1.00 0.00 H new ATOM 0 HD11 ILE A 2 0.973 1.188 -27.691 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.778 0.871 -27.698 1.00 0.00 H new ATOM 0 HD13 ILE A 2 0.284 -0.026 -26.588 1.00 0.00 H new ATOM 44 N PRO A 3 -3.784 -1.081 -28.065 1.00 0.00 N ATOM 45 CA PRO A 3 -4.780 -0.254 -27.365 1.00 0.00 C ATOM 46 C PRO A 3 -4.175 0.557 -26.218 1.00 0.00 C ATOM 47 O PRO A 3 -3.297 0.072 -25.500 1.00 0.00 O ATOM 48 CB PRO A 3 -5.782 -1.280 -26.826 1.00 0.00 C ATOM 49 CG PRO A 3 -5.024 -2.558 -26.727 1.00 0.00 C ATOM 50 CD PRO A 3 -4.003 -2.526 -27.830 1.00 0.00 C ATOM 0 HA PRO A 3 -5.223 0.489 -28.028 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -6.170 -0.977 -25.854 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -6.638 -1.381 -27.493 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -4.543 -2.651 -25.753 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -5.689 -3.415 -26.837 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -3.081 -3.028 -27.537 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -4.367 -3.027 -28.727 1.00 0.00 H new ATOM 58 N SER A 4 -4.653 1.790 -26.056 1.00 0.00 N ATOM 59 CA SER A 4 -4.169 2.681 -25.000 1.00 0.00 C ATOM 60 C SER A 4 -4.821 2.361 -23.652 1.00 0.00 C ATOM 61 O SER A 4 -4.430 2.911 -22.618 1.00 0.00 O ATOM 62 CB SER A 4 -4.438 4.139 -25.375 1.00 0.00 C ATOM 63 OG SER A 4 -3.785 4.485 -26.584 1.00 0.00 O ATOM 0 H SER A 4 -5.379 2.197 -26.646 1.00 0.00 H new ATOM 0 HA SER A 4 -3.095 2.525 -24.901 1.00 0.00 H new ATOM 0 HB2 SER A 4 -5.511 4.298 -25.480 1.00 0.00 H new ATOM 0 HB3 SER A 4 -4.095 4.793 -24.573 1.00 0.00 H new ATOM 0 HG SER A 4 -3.975 5.421 -26.802 1.00 0.00 H new ATOM 69 N ILE A 5 -5.812 1.466 -23.671 1.00 0.00 N ATOM 70 CA ILE A 5 -6.524 1.068 -22.455 1.00 0.00 C ATOM 71 C ILE A 5 -5.753 -0.016 -21.695 1.00 0.00 C ATOM 72 O ILE A 5 -5.802 -0.074 -20.466 1.00 0.00 O ATOM 73 CB ILE A 5 -7.953 0.554 -22.769 1.00 0.00 C ATOM 74 CG1 ILE A 5 -8.647 1.457 -23.795 1.00 0.00 C ATOM 75 CG2 ILE A 5 -8.788 0.476 -21.496 1.00 0.00 C ATOM 76 CD1 ILE A 5 -8.554 0.941 -25.217 1.00 0.00 C ATOM 0 H ILE A 5 -6.140 1.002 -24.518 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.603 1.959 -21.832 1.00 0.00 H new ATOM 0 HB ILE A 5 -7.862 -0.446 -23.193 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -9.697 1.562 -23.523 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.205 2.452 -23.749 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -9.787 0.113 -21.738 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.314 -0.208 -20.792 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -8.860 1.467 -21.047 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -9.067 1.630 -25.888 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -7.506 0.863 -25.508 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -9.022 -0.041 -25.279 1.00 0.00 H new ATOM 88 N ALA A 6 -5.044 -0.868 -22.438 1.00 0.00 N ATOM 89 CA ALA A 6 -4.264 -1.952 -21.843 1.00 0.00 C ATOM 90 C ALA A 6 -2.885 -1.469 -21.390 1.00 0.00 C ATOM 91 O ALA A 6 -2.305 -2.022 -20.453 1.00 0.00 O ATOM 92 CB ALA A 6 -4.119 -3.099 -22.832 1.00 0.00 C ATOM 0 H ALA A 6 -4.995 -0.827 -23.456 1.00 0.00 H new ATOM 0 HA ALA A 6 -4.801 -2.303 -20.962 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -3.536 -3.900 -22.377 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -5.106 -3.475 -23.100 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.610 -2.744 -23.728 1.00 0.00 H new ATOM 98 N THR A 7 -2.375 -0.430 -22.054 1.00 0.00 N ATOM 99 CA THR A 7 -1.063 0.136 -21.733 1.00 0.00 C ATOM 100 C THR A 7 -1.043 0.742 -20.325 1.00 0.00 C ATOM 101 O THR A 7 -0.010 0.730 -19.653 1.00 0.00 O ATOM 102 CB THR A 7 -0.655 1.217 -22.756 1.00 0.00 C ATOM 103 OG1 THR A 7 -1.171 0.889 -24.053 1.00 0.00 O ATOM 104 CG2 THR A 7 0.861 1.352 -22.836 1.00 0.00 C ATOM 0 H THR A 7 -2.854 0.039 -22.822 1.00 0.00 H new ATOM 0 HA THR A 7 -0.347 -0.685 -21.775 1.00 0.00 H new ATOM 0 HB THR A 7 -1.074 2.167 -22.424 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.908 1.582 -24.694 1.00 0.00 H new ATOM 0 HG21 THR A 7 1.120 2.121 -23.564 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.253 1.632 -21.858 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.295 0.400 -23.143 1.00 0.00 H new ATOM 112 N GLY A 8 -2.190 1.271 -19.891 1.00 0.00 N ATOM 113 CA GLY A 8 -2.292 1.863 -18.565 1.00 0.00 C ATOM 114 C GLY A 8 -2.517 0.819 -17.486 1.00 0.00 C ATOM 115 O GLY A 8 -1.913 0.882 -16.406 1.00 0.00 O ATOM 0 H GLY A 8 -3.051 1.299 -20.437 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -1.380 2.419 -18.346 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -3.113 2.580 -18.551 1.00 0.00 H new ATOM 119 N LEU A 9 -3.380 -0.153 -17.790 1.00 0.00 N ATOM 120 CA LEU A 9 -3.702 -1.231 -16.858 1.00 0.00 C ATOM 121 C LEU A 9 -2.464 -2.063 -16.527 1.00 0.00 C ATOM 122 O LEU A 9 -2.227 -2.394 -15.370 1.00 0.00 O ATOM 123 CB LEU A 9 -4.790 -2.140 -17.442 1.00 0.00 C ATOM 124 CG LEU A 9 -6.171 -1.491 -17.605 1.00 0.00 C ATOM 125 CD1 LEU A 9 -6.989 -2.234 -18.649 1.00 0.00 C ATOM 126 CD2 LEU A 9 -6.913 -1.462 -16.275 1.00 0.00 C ATOM 0 H LEU A 9 -3.871 -0.214 -18.682 1.00 0.00 H new ATOM 0 HA LEU A 9 -4.070 -0.774 -15.939 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -4.457 -2.497 -18.417 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -4.892 -3.015 -16.800 1.00 0.00 H new ATOM 0 HG LEU A 9 -6.027 -0.464 -17.942 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -7.965 -1.760 -18.751 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -6.469 -2.205 -19.607 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -7.120 -3.271 -18.339 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -7.890 -0.998 -16.413 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -7.044 -2.480 -15.909 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -6.337 -0.887 -15.550 1.00 0.00 H new ATOM 138 N VAL A 10 -1.672 -2.385 -17.550 1.00 0.00 N ATOM 139 CA VAL A 10 -0.461 -3.184 -17.361 1.00 0.00 C ATOM 140 C VAL A 10 0.529 -2.495 -16.420 1.00 0.00 C ATOM 141 O VAL A 10 1.167 -3.143 -15.590 1.00 0.00 O ATOM 142 CB VAL A 10 0.229 -3.514 -18.709 1.00 0.00 C ATOM 143 CG1 VAL A 10 -0.652 -4.435 -19.541 1.00 0.00 C ATOM 144 CG2 VAL A 10 0.568 -2.250 -19.493 1.00 0.00 C ATOM 0 H VAL A 10 -1.846 -2.106 -18.515 1.00 0.00 H new ATOM 0 HA VAL A 10 -0.777 -4.121 -16.902 1.00 0.00 H new ATOM 0 HB VAL A 10 1.166 -4.024 -18.486 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -0.155 -4.659 -20.485 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -0.827 -5.362 -18.995 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.605 -3.945 -19.740 1.00 0.00 H new ATOM 0 HG21 VAL A 10 1.050 -2.522 -20.432 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.347 -1.696 -19.703 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.243 -1.628 -18.906 1.00 0.00 H new ATOM 154 N GLY A 11 0.623 -1.174 -16.541 1.00 0.00 N ATOM 155 CA GLY A 11 1.526 -0.398 -15.703 1.00 0.00 C ATOM 156 C GLY A 11 1.089 -0.357 -14.250 1.00 0.00 C ATOM 157 O GLY A 11 1.887 -0.630 -13.349 1.00 0.00 O ATOM 0 H GLY A 11 0.086 -0.622 -17.210 1.00 0.00 H new ATOM 0 HA2 GLY A 11 2.528 -0.823 -15.765 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.588 0.620 -16.088 1.00 0.00 H new ATOM 161 N ALA A 12 -0.186 -0.036 -14.025 1.00 0.00 N ATOM 162 CA ALA A 12 -0.727 0.056 -12.668 1.00 0.00 C ATOM 163 C ALA A 12 -0.924 -1.311 -12.023 1.00 0.00 C ATOM 164 O ALA A 12 -0.626 -1.490 -10.840 1.00 0.00 O ATOM 165 CB ALA A 12 -2.034 0.832 -12.672 1.00 0.00 C ATOM 0 H ALA A 12 -0.862 0.164 -14.763 1.00 0.00 H new ATOM 0 HA ALA A 12 0.009 0.589 -12.066 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.424 0.892 -11.656 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -1.859 1.838 -13.054 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.757 0.323 -13.309 1.00 0.00 H new ATOM 171 N LEU A 13 -1.424 -2.271 -12.796 1.00 0.00 N ATOM 172 CA LEU A 13 -1.655 -3.620 -12.285 1.00 0.00 C ATOM 173 C LEU A 13 -0.332 -4.302 -11.936 1.00 0.00 C ATOM 174 O LEU A 13 -0.222 -4.959 -10.897 1.00 0.00 O ATOM 175 CB LEU A 13 -2.444 -4.447 -13.304 1.00 0.00 C ATOM 176 CG LEU A 13 -3.971 -4.290 -13.234 1.00 0.00 C ATOM 177 CD1 LEU A 13 -4.401 -2.877 -13.619 1.00 0.00 C ATOM 178 CD2 LEU A 13 -4.650 -5.313 -14.130 1.00 0.00 C ATOM 0 H LEU A 13 -1.677 -2.141 -13.776 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.245 -3.547 -11.371 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -2.112 -4.172 -14.305 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.196 -5.499 -13.164 1.00 0.00 H new ATOM 0 HG LEU A 13 -4.279 -4.465 -12.203 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -5.487 -2.798 -13.560 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -3.947 -2.160 -12.935 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -4.077 -2.663 -14.637 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -5.731 -5.189 -14.069 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.325 -5.167 -15.160 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -4.381 -6.318 -13.804 1.00 0.00 H new ATOM 190 N LEU A 14 0.678 -4.128 -12.798 1.00 0.00 N ATOM 191 CA LEU A 14 1.996 -4.714 -12.557 1.00 0.00 C ATOM 192 C LEU A 14 2.701 -4.012 -11.400 1.00 0.00 C ATOM 193 O LEU A 14 3.357 -4.657 -10.580 1.00 0.00 O ATOM 194 CB LEU A 14 2.861 -4.652 -13.819 1.00 0.00 C ATOM 195 CG LEU A 14 2.904 -5.943 -14.647 1.00 0.00 C ATOM 196 CD1 LEU A 14 1.636 -6.099 -15.475 1.00 0.00 C ATOM 197 CD2 LEU A 14 4.132 -5.954 -15.546 1.00 0.00 C ATOM 0 H LEU A 14 0.606 -3.590 -13.661 1.00 0.00 H new ATOM 0 HA LEU A 14 1.850 -5.760 -12.289 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.493 -3.845 -14.453 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.879 -4.391 -13.530 1.00 0.00 H new ATOM 0 HG LEU A 14 2.966 -6.787 -13.961 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.690 -7.021 -16.053 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.771 -6.136 -14.813 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.538 -5.251 -16.153 1.00 0.00 H new ATOM 0 HD21 LEU A 14 4.149 -6.876 -16.127 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.096 -5.099 -16.222 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.032 -5.895 -14.934 1.00 0.00 H new ATOM 209 N LEU A 15 2.544 -2.688 -11.328 1.00 0.00 N ATOM 210 CA LEU A 15 3.163 -1.903 -10.259 1.00 0.00 C ATOM 211 C LEU A 15 2.492 -2.202 -8.921 1.00 0.00 C ATOM 212 O LEU A 15 3.157 -2.269 -7.884 1.00 0.00 O ATOM 213 CB LEU A 15 3.077 -0.405 -10.567 1.00 0.00 C ATOM 214 CG LEU A 15 4.416 0.274 -10.876 1.00 0.00 C ATOM 215 CD1 LEU A 15 4.571 0.491 -12.373 1.00 0.00 C ATOM 216 CD2 LEU A 15 4.531 1.593 -10.127 1.00 0.00 C ATOM 0 H LEU A 15 1.997 -2.141 -11.993 1.00 0.00 H new ATOM 0 HA LEU A 15 4.214 -2.184 -10.196 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.410 -0.263 -11.418 1.00 0.00 H new ATOM 0 HB3 LEU A 15 2.620 0.099 -9.716 1.00 0.00 H new ATOM 0 HG LEU A 15 5.220 -0.381 -10.540 1.00 0.00 H new ATOM 0 HD11 LEU A 15 5.527 0.974 -12.574 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.535 -0.470 -12.886 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.761 1.125 -12.734 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.488 2.061 -10.359 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.720 2.256 -10.430 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.467 1.409 -9.055 1.00 0.00 H new ATOM 228 N LEU A 16 1.172 -2.399 -8.958 1.00 0.00 N ATOM 229 CA LEU A 16 0.399 -2.706 -7.756 1.00 0.00 C ATOM 230 C LEU A 16 0.729 -4.111 -7.248 1.00 0.00 C ATOM 231 O LEU A 16 0.785 -4.342 -6.040 1.00 0.00 O ATOM 232 CB LEU A 16 -1.102 -2.590 -8.044 1.00 0.00 C ATOM 233 CG LEU A 16 -1.985 -2.309 -6.823 1.00 0.00 C ATOM 234 CD1 LEU A 16 -2.099 -0.813 -6.573 1.00 0.00 C ATOM 235 CD2 LEU A 16 -3.364 -2.926 -7.012 1.00 0.00 C ATOM 0 H LEU A 16 0.616 -2.351 -9.812 1.00 0.00 H new ATOM 0 HA LEU A 16 0.666 -1.985 -6.983 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.255 -1.794 -8.773 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.438 -3.517 -8.509 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.518 -2.765 -5.950 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.730 -0.637 -5.702 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -1.107 -0.398 -6.393 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -2.541 -0.331 -7.445 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -3.979 -2.718 -6.136 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.836 -2.499 -7.897 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -3.266 -4.004 -7.138 1.00 0.00 H new ATOM 247 N LEU A 17 0.948 -5.040 -8.183 1.00 0.00 N ATOM 248 CA LEU A 17 1.283 -6.422 -7.838 1.00 0.00 C ATOM 249 C LEU A 17 2.685 -6.519 -7.230 1.00 0.00 C ATOM 250 O LEU A 17 2.899 -7.258 -6.267 1.00 0.00 O ATOM 251 CB LEU A 17 1.187 -7.321 -9.075 1.00 0.00 C ATOM 252 CG LEU A 17 -0.236 -7.657 -9.534 1.00 0.00 C ATOM 253 CD1 LEU A 17 -0.250 -8.002 -11.015 1.00 0.00 C ATOM 254 CD2 LEU A 17 -0.808 -8.808 -8.717 1.00 0.00 C ATOM 0 H LEU A 17 0.899 -4.858 -9.186 1.00 0.00 H new ATOM 0 HA LEU A 17 0.563 -6.761 -7.093 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.711 -6.835 -9.898 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.713 -8.253 -8.868 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.862 -6.779 -9.375 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.268 -8.238 -11.324 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.116 -7.151 -11.590 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.392 -8.864 -11.194 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.819 -9.030 -9.059 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.180 -9.690 -8.842 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -0.835 -8.528 -7.664 1.00 0.00 H new ATOM 266 N VAL A 18 3.634 -5.766 -7.797 1.00 0.00 N ATOM 267 CA VAL A 18 5.017 -5.765 -7.308 1.00 0.00 C ATOM 268 C VAL A 18 5.119 -5.091 -5.933 1.00 0.00 C ATOM 269 O VAL A 18 5.818 -5.586 -5.045 1.00 0.00 O ATOM 270 CB VAL A 18 5.977 -5.059 -8.302 1.00 0.00 C ATOM 271 CG1 VAL A 18 7.401 -5.023 -7.761 1.00 0.00 C ATOM 272 CG2 VAL A 18 5.947 -5.750 -9.659 1.00 0.00 C ATOM 0 H VAL A 18 3.470 -5.150 -8.594 1.00 0.00 H new ATOM 0 HA VAL A 18 5.318 -6.809 -7.217 1.00 0.00 H new ATOM 0 HB VAL A 18 5.633 -4.032 -8.423 1.00 0.00 H new ATOM 0 HG11 VAL A 18 8.051 -4.522 -8.479 1.00 0.00 H new ATOM 0 HG12 VAL A 18 7.418 -4.479 -6.816 1.00 0.00 H new ATOM 0 HG13 VAL A 18 7.755 -6.041 -7.600 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.627 -5.240 -10.342 1.00 0.00 H new ATOM 0 HG22 VAL A 18 6.258 -6.788 -9.545 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.935 -5.716 -10.062 1.00 0.00 H new ATOM 282 N VAL A 19 4.414 -3.968 -5.765 1.00 0.00 N ATOM 283 CA VAL A 19 4.425 -3.233 -4.495 1.00 0.00 C ATOM 284 C VAL A 19 3.673 -4.002 -3.404 1.00 0.00 C ATOM 285 O VAL A 19 4.094 -4.019 -2.247 1.00 0.00 O ATOM 286 CB VAL A 19 3.814 -1.816 -4.650 1.00 0.00 C ATOM 287 CG1 VAL A 19 3.754 -1.092 -3.309 1.00 0.00 C ATOM 288 CG2 VAL A 19 4.611 -0.994 -5.654 1.00 0.00 C ATOM 0 H VAL A 19 3.830 -3.549 -6.489 1.00 0.00 H new ATOM 0 HA VAL A 19 5.469 -3.129 -4.199 1.00 0.00 H new ATOM 0 HB VAL A 19 2.796 -1.933 -5.021 1.00 0.00 H new ATOM 0 HG11 VAL A 19 3.321 -0.101 -3.449 1.00 0.00 H new ATOM 0 HG12 VAL A 19 3.137 -1.663 -2.615 1.00 0.00 H new ATOM 0 HG13 VAL A 19 4.761 -0.994 -2.903 1.00 0.00 H new ATOM 0 HG21 VAL A 19 4.166 -0.003 -5.748 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.641 -0.898 -5.310 1.00 0.00 H new ATOM 0 HG23 VAL A 19 4.598 -1.491 -6.624 1.00 0.00 H new ATOM 298 N ALA A 20 2.564 -4.645 -3.784 1.00 0.00 N ATOM 299 CA ALA A 20 1.758 -5.419 -2.839 1.00 0.00 C ATOM 300 C ALA A 20 2.480 -6.695 -2.409 1.00 0.00 C ATOM 301 O ALA A 20 2.425 -7.083 -1.239 1.00 0.00 O ATOM 302 CB ALA A 20 0.405 -5.756 -3.447 1.00 0.00 C ATOM 0 H ALA A 20 2.206 -4.644 -4.739 1.00 0.00 H new ATOM 0 HA ALA A 20 1.603 -4.806 -1.951 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -0.182 -6.332 -2.732 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -0.123 -4.835 -3.692 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.550 -6.343 -4.354 1.00 0.00 H new ATOM 308 N LEU A 21 3.162 -7.337 -3.361 1.00 0.00 N ATOM 309 CA LEU A 21 3.903 -8.569 -3.088 1.00 0.00 C ATOM 310 C LEU A 21 5.145 -8.284 -2.240 1.00 0.00 C ATOM 311 O LEU A 21 5.437 -9.013 -1.289 1.00 0.00 O ATOM 312 CB LEU A 21 4.306 -9.247 -4.402 1.00 0.00 C ATOM 313 CG LEU A 21 4.433 -10.772 -4.339 1.00 0.00 C ATOM 314 CD1 LEU A 21 3.101 -11.437 -4.657 1.00 0.00 C ATOM 315 CD2 LEU A 21 5.513 -11.256 -5.295 1.00 0.00 C ATOM 0 H LEU A 21 3.216 -7.022 -4.330 1.00 0.00 H new ATOM 0 HA LEU A 21 3.252 -9.240 -2.527 1.00 0.00 H new ATOM 0 HB2 LEU A 21 3.570 -8.991 -5.164 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.260 -8.833 -4.728 1.00 0.00 H new ATOM 0 HG LEU A 21 4.719 -11.050 -3.325 1.00 0.00 H new ATOM 0 HD11 LEU A 21 3.214 -12.520 -4.607 1.00 0.00 H new ATOM 0 HD12 LEU A 21 2.352 -11.116 -3.933 1.00 0.00 H new ATOM 0 HD13 LEU A 21 2.782 -11.152 -5.659 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.590 -12.342 -5.237 1.00 0.00 H new ATOM 0 HD22 LEU A 21 5.255 -10.964 -6.313 1.00 0.00 H new ATOM 0 HD23 LEU A 21 6.469 -10.810 -5.020 1.00 0.00 H new ATOM 327 N GLY A 22 5.865 -7.212 -2.588 1.00 0.00 N ATOM 328 CA GLY A 22 7.064 -6.838 -1.854 1.00 0.00 C ATOM 329 C GLY A 22 6.756 -6.341 -0.452 1.00 0.00 C ATOM 330 O GLY A 22 7.243 -6.901 0.533 1.00 0.00 O ATOM 0 H GLY A 22 5.635 -6.596 -3.368 1.00 0.00 H new ATOM 0 HA2 GLY A 22 7.732 -7.697 -1.793 1.00 0.00 H new ATOM 0 HA3 GLY A 22 7.595 -6.060 -2.403 1.00 0.00 H new ATOM 334 N ILE A 23 5.935 -5.292 -0.365 1.00 0.00 N ATOM 335 CA ILE A 23 5.549 -4.716 0.924 1.00 0.00 C ATOM 336 C ILE A 23 4.708 -5.712 1.729 1.00 0.00 C ATOM 337 O ILE A 23 4.793 -5.757 2.957 1.00 0.00 O ATOM 338 CB ILE A 23 4.759 -3.389 0.750 1.00 0.00 C ATOM 339 CG1 ILE A 23 5.518 -2.402 -0.161 1.00 0.00 C ATOM 340 CG2 ILE A 23 4.463 -2.747 2.105 1.00 0.00 C ATOM 341 CD1 ILE A 23 6.921 -2.048 0.308 1.00 0.00 C ATOM 0 H ILE A 23 5.525 -4.824 -1.173 1.00 0.00 H new ATOM 0 HA ILE A 23 6.469 -4.496 1.466 1.00 0.00 H new ATOM 0 HB ILE A 23 3.811 -3.631 0.270 1.00 0.00 H new ATOM 0 HG12 ILE A 23 5.582 -2.829 -1.162 1.00 0.00 H new ATOM 0 HG13 ILE A 23 4.936 -1.484 -0.243 1.00 0.00 H new ATOM 0 HG21 ILE A 23 3.909 -1.820 1.955 1.00 0.00 H new ATOM 0 HG22 ILE A 23 3.868 -3.431 2.710 1.00 0.00 H new ATOM 0 HG23 ILE A 23 5.400 -2.531 2.618 1.00 0.00 H new ATOM 0 HD11 ILE A 23 7.374 -1.350 -0.395 1.00 0.00 H new ATOM 0 HD12 ILE A 23 6.869 -1.587 1.294 1.00 0.00 H new ATOM 0 HD13 ILE A 23 7.526 -2.953 0.362 1.00 0.00 H new ATOM 353 N GLY A 24 3.906 -6.515 1.022 1.00 0.00 N ATOM 354 CA GLY A 24 3.071 -7.509 1.678 1.00 0.00 C ATOM 355 C GLY A 24 3.890 -8.593 2.357 1.00 0.00 C ATOM 356 O GLY A 24 3.645 -8.927 3.518 1.00 0.00 O ATOM 0 H GLY A 24 3.822 -6.492 0.006 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.438 -7.018 2.417 1.00 0.00 H new ATOM 0 HA3 GLY A 24 2.407 -7.965 0.943 1.00 0.00 H new ATOM 360 N LEU A 25 4.873 -9.133 1.629 1.00 0.00 N ATOM 361 CA LEU A 25 5.744 -10.182 2.162 1.00 0.00 C ATOM 362 C LEU A 25 6.758 -9.607 3.152 1.00 0.00 C ATOM 363 O LEU A 25 7.265 -10.324 4.017 1.00 0.00 O ATOM 364 CB LEU A 25 6.478 -10.898 1.022 1.00 0.00 C ATOM 365 CG LEU A 25 5.606 -11.799 0.142 1.00 0.00 C ATOM 366 CD1 LEU A 25 6.241 -11.976 -1.229 1.00 0.00 C ATOM 367 CD2 LEU A 25 5.391 -13.154 0.804 1.00 0.00 C ATOM 0 H LEU A 25 5.084 -8.860 0.669 1.00 0.00 H new ATOM 0 HA LEU A 25 5.117 -10.900 2.690 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.950 -10.147 0.388 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.278 -11.502 1.450 1.00 0.00 H new ATOM 0 HG LEU A 25 4.635 -11.319 0.018 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.609 -12.619 -1.842 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.345 -11.003 -1.710 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.224 -12.433 -1.118 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.769 -13.778 0.162 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.354 -13.640 0.959 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.896 -13.015 1.765 1.00 0.00 H new ATOM 379 N PHE A 26 7.049 -8.309 3.016 1.00 0.00 N ATOM 380 CA PHE A 26 7.997 -7.631 3.899 1.00 0.00 C ATOM 381 C PHE A 26 7.378 -7.359 5.274 1.00 0.00 C ATOM 382 O PHE A 26 8.045 -7.496 6.300 1.00 0.00 O ATOM 383 CB PHE A 26 8.464 -6.317 3.266 1.00 0.00 C ATOM 384 CG PHE A 26 9.831 -5.878 3.717 1.00 0.00 C ATOM 385 CD1 PHE A 26 10.965 -6.285 3.031 1.00 0.00 C ATOM 386 CD2 PHE A 26 9.979 -5.059 4.824 1.00 0.00 C ATOM 387 CE1 PHE A 26 12.220 -5.882 3.443 1.00 0.00 C ATOM 388 CE2 PHE A 26 11.234 -4.654 5.240 1.00 0.00 C ATOM 389 CZ PHE A 26 12.355 -5.066 4.549 1.00 0.00 C ATOM 0 H PHE A 26 6.639 -7.708 2.301 1.00 0.00 H new ATOM 0 HA PHE A 26 8.856 -8.288 4.037 1.00 0.00 H new ATOM 0 HB2 PHE A 26 8.468 -6.428 2.182 1.00 0.00 H new ATOM 0 HB3 PHE A 26 7.744 -5.534 3.504 1.00 0.00 H new ATOM 0 HD1 PHE A 26 10.866 -6.924 2.166 1.00 0.00 H new ATOM 0 HD2 PHE A 26 9.105 -4.733 5.368 1.00 0.00 H new ATOM 0 HE1 PHE A 26 13.096 -6.205 2.900 1.00 0.00 H new ATOM 0 HE2 PHE A 26 11.337 -4.016 6.105 1.00 0.00 H new ATOM 0 HZ PHE A 26 13.336 -4.751 4.872 1.00 0.00 H new ATOM 399 N ILE A 27 6.099 -6.971 5.282 1.00 0.00 N ATOM 400 CA ILE A 27 5.385 -6.682 6.528 1.00 0.00 C ATOM 401 C ILE A 27 4.835 -7.965 7.162 1.00 0.00 C ATOM 402 O ILE A 27 4.754 -8.071 8.387 1.00 0.00 O ATOM 403 CB ILE A 27 4.221 -5.678 6.303 1.00 0.00 C ATOM 404 CG1 ILE A 27 4.717 -4.394 5.605 1.00 0.00 C ATOM 405 CG2 ILE A 27 3.528 -5.336 7.622 1.00 0.00 C ATOM 406 CD1 ILE A 27 5.829 -3.657 6.336 1.00 0.00 C ATOM 0 H ILE A 27 5.537 -6.850 4.439 1.00 0.00 H new ATOM 0 HA ILE A 27 6.108 -6.230 7.206 1.00 0.00 H new ATOM 0 HB ILE A 27 3.494 -6.160 5.649 1.00 0.00 H new ATOM 0 HG12 ILE A 27 5.068 -4.653 4.606 1.00 0.00 H new ATOM 0 HG13 ILE A 27 3.873 -3.716 5.480 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.717 -4.632 7.435 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.123 -6.245 8.067 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.248 -4.887 8.306 1.00 0.00 H new ATOM 0 HD11 ILE A 27 6.111 -2.769 5.770 1.00 0.00 H new ATOM 0 HD12 ILE A 27 5.480 -3.361 7.325 1.00 0.00 H new ATOM 0 HD13 ILE A 27 6.694 -4.312 6.438 1.00 0.00 H new ATOM 418 N ARG A 28 4.464 -8.936 6.322 1.00 0.00 N ATOM 419 CA ARG A 28 3.923 -10.213 6.798 1.00 0.00 C ATOM 420 C ARG A 28 4.974 -11.007 7.581 1.00 0.00 C ATOM 421 O ARG A 28 4.633 -11.826 8.437 1.00 0.00 O ATOM 422 CB ARG A 28 3.412 -11.047 5.620 1.00 0.00 C ATOM 423 CG ARG A 28 2.213 -11.918 5.962 1.00 0.00 C ATOM 424 CD ARG A 28 1.748 -12.721 4.758 1.00 0.00 C ATOM 425 NE ARG A 28 0.594 -13.564 5.073 1.00 0.00 N ATOM 426 CZ ARG A 28 -0.013 -14.361 4.192 1.00 0.00 C ATOM 427 NH1 ARG A 28 0.415 -14.431 2.936 1.00 0.00 N ATOM 428 NH2 ARG A 28 -1.055 -15.091 4.570 1.00 0.00 N ATOM 0 H ARG A 28 4.529 -8.862 5.307 1.00 0.00 H new ATOM 0 HA ARG A 28 3.093 -9.992 7.469 1.00 0.00 H new ATOM 0 HB2 ARG A 28 3.143 -10.378 4.803 1.00 0.00 H new ATOM 0 HB3 ARG A 28 4.220 -11.683 5.259 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.474 -12.596 6.774 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.396 -11.291 6.320 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.489 -12.041 3.947 1.00 0.00 H new ATOM 0 HD3 ARG A 28 2.567 -13.346 4.401 1.00 0.00 H new ATOM 0 HE ARG A 28 0.231 -13.541 6.026 1.00 0.00 H new ATOM 0 HH11 ARG A 28 1.215 -13.872 2.638 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.056 -15.043 2.270 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.390 -15.042 5.532 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -1.521 -15.701 3.898 1.00 0.00 H new ATOM 442 N ARG A 29 6.249 -10.758 7.277 1.00 0.00 N ATOM 443 CA ARG A 29 7.357 -11.443 7.945 1.00 0.00 C ATOM 444 C ARG A 29 7.682 -10.796 9.294 1.00 0.00 C ATOM 445 O ARG A 29 8.335 -11.408 10.140 1.00 0.00 O ATOM 446 CB ARG A 29 8.603 -11.436 7.054 1.00 0.00 C ATOM 447 CG ARG A 29 8.530 -12.412 5.886 1.00 0.00 C ATOM 448 CD ARG A 29 9.033 -13.793 6.276 1.00 0.00 C ATOM 449 NE ARG A 29 8.964 -14.737 5.160 1.00 0.00 N ATOM 450 CZ ARG A 29 9.336 -16.017 5.237 1.00 0.00 C ATOM 451 NH1 ARG A 29 9.805 -16.515 6.376 1.00 0.00 N ATOM 452 NH2 ARG A 29 9.237 -16.798 4.171 1.00 0.00 N ATOM 0 H ARG A 29 6.541 -10.084 6.569 1.00 0.00 H new ATOM 0 HA ARG A 29 7.048 -12.473 8.125 1.00 0.00 H new ATOM 0 HB2 ARG A 29 8.754 -10.429 6.665 1.00 0.00 H new ATOM 0 HB3 ARG A 29 9.475 -11.677 7.663 1.00 0.00 H new ATOM 0 HG2 ARG A 29 7.500 -12.485 5.536 1.00 0.00 H new ATOM 0 HG3 ARG A 29 9.123 -12.030 5.055 1.00 0.00 H new ATOM 0 HD2 ARG A 29 10.063 -13.719 6.625 1.00 0.00 H new ATOM 0 HD3 ARG A 29 8.441 -14.173 7.109 1.00 0.00 H new ATOM 0 HE ARG A 29 8.609 -14.396 4.267 1.00 0.00 H new ATOM 0 HH11 ARG A 29 9.883 -15.918 7.200 1.00 0.00 H new ATOM 0 HH12 ARG A 29 10.087 -17.494 6.427 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.877 -16.421 3.294 1.00 0.00 H new ATOM 0 HH22 ARG A 29 9.521 -17.776 4.227 1.00 0.00 H new ATOM 466 N ARG A 30 7.218 -9.559 9.483 1.00 0.00 N ATOM 467 CA ARG A 30 7.456 -8.820 10.725 1.00 0.00 C ATOM 468 C ARG A 30 6.469 -9.226 11.820 1.00 0.00 C ATOM 469 O ARG A 30 6.737 -9.030 13.007 1.00 0.00 O ATOM 470 CB ARG A 30 7.357 -7.313 10.471 1.00 0.00 C ATOM 471 CG ARG A 30 8.566 -6.733 9.754 1.00 0.00 C ATOM 472 CD ARG A 30 8.426 -5.233 9.551 1.00 0.00 C ATOM 473 NE ARG A 30 9.609 -4.652 8.917 1.00 0.00 N ATOM 474 CZ ARG A 30 9.746 -3.355 8.634 1.00 0.00 C ATOM 475 NH1 ARG A 30 8.778 -2.494 8.927 1.00 0.00 N ATOM 476 NH2 ARG A 30 10.858 -2.920 8.058 1.00 0.00 N ATOM 0 H ARG A 30 6.673 -9.046 8.789 1.00 0.00 H new ATOM 0 HA ARG A 30 8.461 -9.066 11.068 1.00 0.00 H new ATOM 0 HB2 ARG A 30 6.464 -7.111 9.880 1.00 0.00 H new ATOM 0 HB3 ARG A 30 7.231 -6.800 11.425 1.00 0.00 H new ATOM 0 HG2 ARG A 30 9.467 -6.941 10.331 1.00 0.00 H new ATOM 0 HG3 ARG A 30 8.687 -7.222 8.788 1.00 0.00 H new ATOM 0 HD2 ARG A 30 7.549 -5.031 8.936 1.00 0.00 H new ATOM 0 HD3 ARG A 30 8.258 -4.751 10.514 1.00 0.00 H new ATOM 0 HE ARG A 30 10.378 -5.278 8.676 1.00 0.00 H new ATOM 0 HH11 ARG A 30 7.921 -2.822 9.372 1.00 0.00 H new ATOM 0 HH12 ARG A 30 8.892 -1.505 8.707 1.00 0.00 H new ATOM 0 HH21 ARG A 30 11.606 -3.576 7.832 1.00 0.00 H new ATOM 0 HH22 ARG A 30 10.966 -1.929 7.840 1.00 0.00 H new ATOM 490 N HIS A 31 5.328 -9.793 11.414 1.00 0.00 N ATOM 491 CA HIS A 31 4.296 -10.225 12.359 1.00 0.00 C ATOM 492 C HIS A 31 4.741 -11.453 13.159 1.00 0.00 C ATOM 493 O HIS A 31 4.295 -11.659 14.289 1.00 0.00 O ATOM 494 CB HIS A 31 2.995 -10.536 11.616 1.00 0.00 C ATOM 495 CG HIS A 31 2.233 -9.313 11.208 1.00 0.00 C ATOM 496 ND1 HIS A 31 2.371 -8.500 10.134 1.00 0.00 N flip ATOM 497 CD2 HIS A 31 1.185 -8.801 11.941 1.00 0.00 C flip ATOM 498 CE1 HIS A 31 1.413 -7.522 10.238 1.00 0.00 C flip ATOM 499 NE2 HIS A 31 0.710 -7.726 11.336 1.00 0.00 N flip ATOM 0 H HIS A 31 5.097 -9.963 10.435 1.00 0.00 H new ATOM 0 HA HIS A 31 4.129 -9.407 13.060 1.00 0.00 H new ATOM 0 HB2 HIS A 31 3.225 -11.124 10.728 1.00 0.00 H new ATOM 0 HB3 HIS A 31 2.361 -11.154 12.252 1.00 0.00 H new ATOM 0 HD1 HIS A 31 3.059 -8.596 9.387 1.00 0.00 H new ATOM 0 HD2 HIS A 31 0.810 -9.214 12.866 1.00 0.00 H new ATOM 0 HE1 HIS A 31 1.260 -6.716 9.535 1.00 0.00 H new ATOM 508 N ILE A 32 5.618 -12.263 12.563 1.00 0.00 N ATOM 509 CA ILE A 32 6.127 -13.471 13.219 1.00 0.00 C ATOM 510 C ILE A 32 7.294 -13.141 14.156 1.00 0.00 C ATOM 511 O ILE A 32 7.694 -13.971 14.976 1.00 0.00 O ATOM 512 CB ILE A 32 6.587 -14.536 12.190 1.00 0.00 C ATOM 513 CG1 ILE A 32 5.645 -14.565 10.980 1.00 0.00 C ATOM 514 CG2 ILE A 32 6.654 -15.914 12.842 1.00 0.00 C ATOM 515 CD1 ILE A 32 6.340 -14.894 9.674 1.00 0.00 C ATOM 0 H ILE A 32 5.991 -12.105 11.627 1.00 0.00 H new ATOM 0 HA ILE A 32 5.301 -13.881 13.800 1.00 0.00 H new ATOM 0 HB ILE A 32 7.584 -14.265 11.843 1.00 0.00 H new ATOM 0 HG12 ILE A 32 4.861 -15.300 11.159 1.00 0.00 H new ATOM 0 HG13 ILE A 32 5.157 -13.595 10.887 1.00 0.00 H new ATOM 0 HG21 ILE A 32 6.978 -16.649 12.106 1.00 0.00 H new ATOM 0 HG22 ILE A 32 7.364 -15.891 13.669 1.00 0.00 H new ATOM 0 HG23 ILE A 32 5.668 -16.187 13.217 1.00 0.00 H new ATOM 0 HD11 ILE A 32 5.610 -14.896 8.864 1.00 0.00 H new ATOM 0 HD12 ILE A 32 7.106 -14.145 9.471 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.804 -15.877 9.747 1.00 0.00 H new ATOM 627 N LEU A 38 1.052 -7.709 23.061 1.00 0.00 N ATOM 628 CA LEU A 38 0.347 -6.478 22.706 1.00 0.00 C ATOM 629 C LEU A 38 -1.092 -6.792 22.313 1.00 0.00 C ATOM 630 O LEU A 38 -1.919 -5.898 22.157 1.00 0.00 O ATOM 631 CB LEU A 38 1.068 -5.750 21.566 1.00 0.00 C ATOM 632 CG LEU A 38 2.412 -5.117 21.945 1.00 0.00 C ATOM 633 CD1 LEU A 38 3.276 -4.925 20.709 1.00 0.00 C ATOM 634 CD2 LEU A 38 2.201 -3.788 22.661 1.00 0.00 C ATOM 0 HA LEU A 38 0.337 -5.821 23.576 1.00 0.00 H new ATOM 0 HB2 LEU A 38 1.233 -6.456 20.752 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.412 -4.969 21.182 1.00 0.00 H new ATOM 0 HG LEU A 38 2.928 -5.793 22.627 1.00 0.00 H new ATOM 0 HD11 LEU A 38 4.226 -4.475 20.996 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.459 -5.891 20.240 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.763 -4.271 20.004 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.168 -3.357 22.920 1.00 0.00 H new ATOM 0 HD22 LEU A 38 1.662 -3.103 22.006 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.621 -3.952 23.569 1.00 0.00 H new ATOM 646 N ARG A 39 -1.349 -8.084 22.153 1.00 0.00 N ATOM 647 CA ARG A 39 -2.657 -8.616 21.805 1.00 0.00 C ATOM 648 C ARG A 39 -3.317 -9.072 23.088 1.00 0.00 C ATOM 649 O ARG A 39 -4.535 -8.999 23.248 1.00 0.00 O ATOM 650 CB ARG A 39 -2.529 -9.785 20.823 1.00 0.00 C ATOM 651 CG ARG A 39 -2.157 -9.360 19.411 1.00 0.00 C ATOM 652 CD ARG A 39 -2.043 -10.557 18.479 1.00 0.00 C ATOM 653 NE ARG A 39 -1.688 -10.161 17.118 1.00 0.00 N ATOM 654 CZ ARG A 39 -1.519 -11.017 16.109 1.00 0.00 C ATOM 655 NH1 ARG A 39 -1.669 -12.324 16.300 1.00 0.00 N ATOM 656 NH2 ARG A 39 -1.198 -10.565 14.905 1.00 0.00 N ATOM 0 H ARG A 39 -0.637 -8.806 22.264 1.00 0.00 H new ATOM 0 HA ARG A 39 -3.257 -7.849 21.315 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -1.775 -10.479 21.194 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -3.474 -10.327 20.793 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -2.909 -8.670 19.028 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -1.210 -8.821 19.430 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.291 -11.245 18.864 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -2.990 -11.096 18.464 1.00 0.00 H new ATOM 0 HE ARG A 39 -1.561 -9.167 16.927 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -1.915 -12.679 17.224 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -1.538 -12.971 15.523 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -1.080 -9.564 14.751 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -1.068 -11.219 14.133 1.00 0.00 H new ATOM 670 N ARG A 40 -2.466 -9.552 24.004 1.00 0.00 N ATOM 671 CA ARG A 40 -2.908 -9.990 25.321 1.00 0.00 C ATOM 672 C ARG A 40 -3.154 -8.754 26.169 1.00 0.00 C ATOM 673 O ARG A 40 -3.917 -8.777 27.134 1.00 0.00 O ATOM 674 CB ARG A 40 -1.861 -10.892 25.979 1.00 0.00 C ATOM 675 CG ARG A 40 -1.765 -12.277 25.357 1.00 0.00 C ATOM 676 CD ARG A 40 -0.711 -13.130 26.046 1.00 0.00 C ATOM 677 NE ARG A 40 -1.157 -13.607 27.356 1.00 0.00 N ATOM 678 CZ ARG A 40 -0.421 -14.370 28.166 1.00 0.00 C ATOM 679 NH1 ARG A 40 0.801 -14.750 27.809 1.00 0.00 N ATOM 680 NH2 ARG A 40 -0.911 -14.754 29.336 1.00 0.00 N ATOM 0 H ARG A 40 -1.462 -9.645 23.849 1.00 0.00 H new ATOM 0 HA ARG A 40 -3.824 -10.573 25.228 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -0.887 -10.407 25.916 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -2.098 -10.995 27.038 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -2.734 -12.773 25.421 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -1.524 -12.185 24.298 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -0.467 -13.984 25.414 1.00 0.00 H new ATOM 0 HD3 ARG A 40 0.204 -12.549 26.165 1.00 0.00 H new ATOM 0 HE ARG A 40 -2.090 -13.339 27.670 1.00 0.00 H new ATOM 0 HH11 ARG A 40 1.183 -14.458 26.909 1.00 0.00 H new ATOM 0 HH12 ARG A 40 1.357 -15.333 28.434 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -1.849 -14.466 29.615 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -0.350 -15.337 29.957 1.00 0.00 H new ATOM 694 N LEU A 41 -2.472 -7.674 25.777 1.00 0.00 N ATOM 695 CA LEU A 41 -2.605 -6.382 26.423 1.00 0.00 C ATOM 696 C LEU A 41 -3.525 -5.497 25.591 1.00 0.00 C ATOM 697 O LEU A 41 -4.082 -4.520 26.096 1.00 0.00 O ATOM 698 CB LEU A 41 -1.239 -5.704 26.587 1.00 0.00 C ATOM 699 CG LEU A 41 -0.417 -6.161 27.798 1.00 0.00 C ATOM 700 CD1 LEU A 41 1.060 -5.863 27.585 1.00 0.00 C ATOM 701 CD2 LEU A 41 -0.911 -5.488 29.073 1.00 0.00 C ATOM 0 H LEU A 41 -1.812 -7.680 24.999 1.00 0.00 H new ATOM 0 HA LEU A 41 -3.030 -6.530 27.416 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.654 -5.882 25.685 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.393 -4.627 26.660 1.00 0.00 H new ATOM 0 HG LEU A 41 -0.544 -7.238 27.905 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.627 -6.194 28.455 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.413 -6.390 26.699 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.199 -4.791 27.448 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -0.313 -5.827 29.919 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -0.818 -4.407 28.973 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -1.956 -5.748 29.240 1.00 0.00 H new ATOM 713 N LEU A 42 -3.681 -5.850 24.303 1.00 0.00 N ATOM 714 CA LEU A 42 -4.552 -5.089 23.397 1.00 0.00 C ATOM 715 C LEU A 42 -6.003 -5.143 23.875 1.00 0.00 C ATOM 716 O LEU A 42 -6.675 -4.115 23.963 1.00 0.00 O ATOM 717 CB LEU A 42 -4.461 -5.629 21.965 1.00 0.00 C ATOM 718 CG LEU A 42 -5.013 -4.705 20.875 1.00 0.00 C ATOM 719 CD1 LEU A 42 -3.896 -3.883 20.253 1.00 0.00 C ATOM 720 CD2 LEU A 42 -5.740 -5.513 19.812 1.00 0.00 C ATOM 0 H LEU A 42 -3.219 -6.650 23.871 1.00 0.00 H new ATOM 0 HA LEU A 42 -4.212 -4.053 23.402 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.416 -5.842 21.741 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -4.996 -6.577 21.918 1.00 0.00 H new ATOM 0 HG LEU A 42 -5.726 -4.019 21.333 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.309 -3.233 19.481 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.420 -3.275 21.022 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.157 -4.550 19.809 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.126 -4.841 19.045 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -5.048 -6.223 19.358 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.568 -6.055 20.270 1.00 0.00 H new ATOM 1049 N ILE B 62 0.367 9.034 -29.503 1.00 0.00 N ATOM 1050 CA ILE B 62 0.845 9.187 -28.130 1.00 0.00 C ATOM 1051 C ILE B 62 1.840 8.082 -27.763 1.00 0.00 C ATOM 1052 O ILE B 62 1.710 6.949 -28.232 1.00 0.00 O ATOM 1053 CB ILE B 62 -0.318 9.191 -27.107 1.00 0.00 C ATOM 1054 CG1 ILE B 62 -1.359 8.108 -27.438 1.00 0.00 C ATOM 1055 CG2 ILE B 62 -0.977 10.561 -27.061 1.00 0.00 C ATOM 1056 CD1 ILE B 62 -1.131 6.802 -26.709 1.00 0.00 C ATOM 0 HA ILE B 62 1.347 10.153 -28.084 1.00 0.00 H new ATOM 0 HB ILE B 62 0.099 8.966 -26.125 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -2.352 8.483 -27.191 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -1.347 7.921 -28.512 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -1.792 10.548 -26.338 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -0.241 11.309 -26.765 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -1.370 10.809 -28.047 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -1.904 6.087 -26.993 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -0.152 6.403 -26.975 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -1.173 6.974 -25.633 1.00 0.00 H new ATOM 1068 N PRO B 63 2.848 8.397 -26.917 1.00 0.00 N ATOM 1069 CA PRO B 63 3.864 7.418 -26.492 1.00 0.00 C ATOM 1070 C PRO B 63 3.293 6.335 -25.576 1.00 0.00 C ATOM 1071 O PRO B 63 2.443 6.611 -24.727 1.00 0.00 O ATOM 1072 CB PRO B 63 4.888 8.273 -25.737 1.00 0.00 C ATOM 1073 CG PRO B 63 4.139 9.479 -25.282 1.00 0.00 C ATOM 1074 CD PRO B 63 3.081 9.731 -26.321 1.00 0.00 C ATOM 0 HA PRO B 63 4.281 6.875 -27.340 1.00 0.00 H new ATOM 0 HB2 PRO B 63 5.307 7.728 -24.891 1.00 0.00 H new ATOM 0 HB3 PRO B 63 5.722 8.549 -26.383 1.00 0.00 H new ATOM 0 HG2 PRO B 63 3.691 9.313 -24.302 1.00 0.00 H new ATOM 0 HG3 PRO B 63 4.804 10.338 -25.187 1.00 0.00 H new ATOM 0 HD2 PRO B 63 2.172 10.135 -25.876 1.00 0.00 H new ATOM 0 HD3 PRO B 63 3.417 10.450 -27.068 1.00 0.00 H new ATOM 1082 N SER B 64 3.773 5.103 -25.759 1.00 0.00 N ATOM 1083 CA SER B 64 3.318 3.966 -24.956 1.00 0.00 C ATOM 1084 C SER B 64 4.016 3.926 -23.594 1.00 0.00 C ATOM 1085 O SER B 64 3.659 3.123 -22.729 1.00 0.00 O ATOM 1086 CB SER B 64 3.570 2.658 -25.709 1.00 0.00 C ATOM 1087 OG SER B 64 2.874 2.637 -26.943 1.00 0.00 O ATOM 0 H SER B 64 4.478 4.867 -26.457 1.00 0.00 H new ATOM 0 HA SER B 64 2.249 4.086 -24.783 1.00 0.00 H new ATOM 0 HB2 SER B 64 4.638 2.538 -25.889 1.00 0.00 H new ATOM 0 HB3 SER B 64 3.254 1.815 -25.095 1.00 0.00 H new ATOM 0 HG SER B 64 3.053 1.792 -27.405 1.00 0.00 H new ATOM 1093 N ILE B 65 5.010 4.797 -23.413 1.00 0.00 N ATOM 1094 CA ILE B 65 5.765 4.868 -22.158 1.00 0.00 C ATOM 1095 C ILE B 65 5.026 5.712 -21.117 1.00 0.00 C ATOM 1096 O ILE B 65 5.116 5.447 -19.917 1.00 0.00 O ATOM 1097 CB ILE B 65 7.185 5.452 -22.374 1.00 0.00 C ATOM 1098 CG1 ILE B 65 7.840 4.852 -23.624 1.00 0.00 C ATOM 1099 CG2 ILE B 65 8.064 5.198 -21.154 1.00 0.00 C ATOM 1100 CD1 ILE B 65 7.702 5.721 -24.857 1.00 0.00 C ATOM 0 H ILE B 65 5.313 5.466 -24.121 1.00 0.00 H new ATOM 0 HA ILE B 65 5.860 3.846 -21.792 1.00 0.00 H new ATOM 0 HB ILE B 65 7.084 6.528 -22.517 1.00 0.00 H new ATOM 0 HG12 ILE B 65 8.898 4.684 -23.424 1.00 0.00 H new ATOM 0 HG13 ILE B 65 7.395 3.877 -23.825 1.00 0.00 H new ATOM 0 HG21 ILE B 65 9.056 5.616 -21.327 1.00 0.00 H new ATOM 0 HG22 ILE B 65 7.618 5.672 -20.279 1.00 0.00 H new ATOM 0 HG23 ILE B 65 8.147 4.125 -20.983 1.00 0.00 H new ATOM 0 HD11 ILE B 65 8.189 5.234 -25.702 1.00 0.00 H new ATOM 0 HD12 ILE B 65 6.646 5.868 -25.082 1.00 0.00 H new ATOM 0 HD13 ILE B 65 8.172 6.687 -24.675 1.00 0.00 H new ATOM 1112 N ALA B 66 4.296 6.725 -21.587 1.00 0.00 N ATOM 1113 CA ALA B 66 3.539 7.614 -20.703 1.00 0.00 C ATOM 1114 C ALA B 66 2.176 7.023 -20.346 1.00 0.00 C ATOM 1115 O ALA B 66 1.629 7.308 -19.279 1.00 0.00 O ATOM 1116 CB ALA B 66 3.368 8.978 -21.353 1.00 0.00 C ATOM 0 H ALA B 66 4.213 6.951 -22.578 1.00 0.00 H new ATOM 0 HA ALA B 66 4.105 7.726 -19.778 1.00 0.00 H new ATOM 0 HB1 ALA B 66 2.804 9.630 -20.687 1.00 0.00 H new ATOM 0 HB2 ALA B 66 4.348 9.415 -21.545 1.00 0.00 H new ATOM 0 HB3 ALA B 66 2.830 8.868 -22.294 1.00 0.00 H new ATOM 1122 N THR B 67 1.639 6.190 -21.242 1.00 0.00 N ATOM 1123 CA THR B 67 0.336 5.554 -21.036 1.00 0.00 C ATOM 1124 C THR B 67 0.359 4.601 -19.836 1.00 0.00 C ATOM 1125 O THR B 67 -0.651 4.432 -19.149 1.00 0.00 O ATOM 1126 CB THR B 67 -0.111 4.776 -22.293 1.00 0.00 C ATOM 1127 OG1 THR B 67 0.363 5.435 -23.474 1.00 0.00 O ATOM 1128 CG2 THR B 67 -1.629 4.660 -22.355 1.00 0.00 C ATOM 0 H THR B 67 2.090 5.940 -22.122 1.00 0.00 H new ATOM 0 HA THR B 67 -0.377 6.355 -20.837 1.00 0.00 H new ATOM 0 HB THR B 67 0.314 3.774 -22.236 1.00 0.00 H new ATOM 0 HG1 THR B 67 0.076 4.934 -24.266 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.915 4.108 -23.250 1.00 0.00 H new ATOM 0 HG22 THR B 67 -1.990 4.133 -21.472 1.00 0.00 H new ATOM 0 HG23 THR B 67 -2.069 5.657 -22.387 1.00 0.00 H new ATOM 1136 N GLY B 68 1.518 3.981 -19.594 1.00 0.00 N ATOM 1137 CA GLY B 68 1.661 3.064 -18.472 1.00 0.00 C ATOM 1138 C GLY B 68 1.927 3.792 -17.166 1.00 0.00 C ATOM 1139 O GLY B 68 1.360 3.446 -16.120 1.00 0.00 O ATOM 0 H GLY B 68 2.360 4.099 -20.157 1.00 0.00 H new ATOM 0 HA2 GLY B 68 0.754 2.467 -18.375 1.00 0.00 H new ATOM 0 HA3 GLY B 68 2.478 2.371 -18.673 1.00 0.00 H new ATOM 1143 N LEU B 69 2.784 4.813 -17.235 1.00 0.00 N ATOM 1144 CA LEU B 69 3.140 5.612 -16.064 1.00 0.00 C ATOM 1145 C LEU B 69 1.921 6.322 -15.486 1.00 0.00 C ATOM 1146 O LEU B 69 1.724 6.339 -14.275 1.00 0.00 O ATOM 1147 CB LEU B 69 4.214 6.645 -16.426 1.00 0.00 C ATOM 1148 CG LEU B 69 5.586 6.067 -16.799 1.00 0.00 C ATOM 1149 CD1 LEU B 69 6.372 7.061 -17.639 1.00 0.00 C ATOM 1150 CD2 LEU B 69 6.372 5.696 -15.548 1.00 0.00 C ATOM 0 H LEU B 69 3.246 5.106 -18.096 1.00 0.00 H new ATOM 0 HA LEU B 69 3.533 4.932 -15.309 1.00 0.00 H new ATOM 0 HB2 LEU B 69 3.851 7.243 -17.262 1.00 0.00 H new ATOM 0 HB3 LEU B 69 4.342 7.322 -15.581 1.00 0.00 H new ATOM 0 HG LEU B 69 5.426 5.163 -17.387 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.342 6.635 -17.894 1.00 0.00 H new ATOM 0 HD12 LEU B 69 5.820 7.281 -18.553 1.00 0.00 H new ATOM 0 HD13 LEU B 69 6.518 7.981 -17.073 1.00 0.00 H new ATOM 0 HD21 LEU B 69 7.341 5.288 -15.835 1.00 0.00 H new ATOM 0 HD22 LEU B 69 6.519 6.585 -14.934 1.00 0.00 H new ATOM 0 HD23 LEU B 69 5.818 4.949 -14.979 1.00 0.00 H new ATOM 1162 N VAL B 70 1.095 6.897 -16.362 1.00 0.00 N ATOM 1163 CA VAL B 70 -0.106 7.614 -15.931 1.00 0.00 C ATOM 1164 C VAL B 70 -1.066 6.698 -15.169 1.00 0.00 C ATOM 1165 O VAL B 70 -1.673 7.105 -14.178 1.00 0.00 O ATOM 1166 CB VAL B 70 -0.839 8.282 -17.121 1.00 0.00 C ATOM 1167 CG1 VAL B 70 0.017 9.391 -17.712 1.00 0.00 C ATOM 1168 CG2 VAL B 70 -1.209 7.264 -18.197 1.00 0.00 C ATOM 0 H VAL B 70 1.235 6.880 -17.372 1.00 0.00 H new ATOM 0 HA VAL B 70 0.229 8.401 -15.255 1.00 0.00 H new ATOM 0 HB VAL B 70 -1.766 8.712 -16.741 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.510 9.852 -18.547 1.00 0.00 H new ATOM 0 HG12 VAL B 70 0.215 10.143 -16.949 1.00 0.00 H new ATOM 0 HG13 VAL B 70 0.960 8.974 -18.064 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -1.721 7.770 -19.015 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -0.304 6.788 -18.574 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -1.866 6.506 -17.770 1.00 0.00 H new ATOM 1178 N GLY B 71 -1.169 5.454 -15.628 1.00 0.00 N ATOM 1179 CA GLY B 71 -2.049 4.482 -14.993 1.00 0.00 C ATOM 1180 C GLY B 71 -1.563 4.064 -13.617 1.00 0.00 C ATOM 1181 O GLY B 71 -2.329 4.088 -12.650 1.00 0.00 O ATOM 0 H GLY B 71 -0.656 5.098 -16.434 1.00 0.00 H new ATOM 0 HA2 GLY B 71 -3.050 4.905 -14.907 1.00 0.00 H new ATOM 0 HA3 GLY B 71 -2.129 3.600 -15.629 1.00 0.00 H new ATOM 1185 N ALA B 72 -0.282 3.700 -13.526 1.00 0.00 N ATOM 1186 CA ALA B 72 0.303 3.260 -12.259 1.00 0.00 C ATOM 1187 C ALA B 72 0.527 4.412 -11.286 1.00 0.00 C ATOM 1188 O ALA B 72 0.269 4.274 -10.090 1.00 0.00 O ATOM 1189 CB ALA B 72 1.606 2.519 -12.509 1.00 0.00 C ATOM 0 H ALA B 72 0.368 3.701 -14.312 1.00 0.00 H new ATOM 0 HA ALA B 72 -0.415 2.585 -11.793 1.00 0.00 H new ATOM 0 HB1 ALA B 72 2.030 2.198 -11.558 1.00 0.00 H new ATOM 0 HB2 ALA B 72 1.414 1.647 -13.134 1.00 0.00 H new ATOM 0 HB3 ALA B 72 2.309 3.180 -13.015 1.00 0.00 H new ATOM 1195 N LEU B 73 1.006 5.544 -11.798 1.00 0.00 N ATOM 1196 CA LEU B 73 1.259 6.712 -10.960 1.00 0.00 C ATOM 1197 C LEU B 73 -0.049 7.273 -10.401 1.00 0.00 C ATOM 1198 O LEU B 73 -0.121 7.635 -9.223 1.00 0.00 O ATOM 1199 CB LEU B 73 2.019 7.782 -11.753 1.00 0.00 C ATOM 1200 CG LEU B 73 3.546 7.617 -11.777 1.00 0.00 C ATOM 1201 CD1 LEU B 73 3.956 6.356 -12.533 1.00 0.00 C ATOM 1202 CD2 LEU B 73 4.199 8.843 -12.397 1.00 0.00 C ATOM 0 H LEU B 73 1.226 5.676 -12.785 1.00 0.00 H new ATOM 0 HA LEU B 73 1.878 6.405 -10.117 1.00 0.00 H new ATOM 0 HB2 LEU B 73 1.653 7.779 -12.780 1.00 0.00 H new ATOM 0 HB3 LEU B 73 1.782 8.760 -11.333 1.00 0.00 H new ATOM 0 HG LEU B 73 3.890 7.516 -10.748 1.00 0.00 H new ATOM 0 HD11 LEU B 73 5.042 6.268 -12.532 1.00 0.00 H new ATOM 0 HD12 LEU B 73 3.521 5.483 -12.047 1.00 0.00 H new ATOM 0 HD13 LEU B 73 3.598 6.415 -13.561 1.00 0.00 H new ATOM 0 HD21 LEU B 73 5.281 8.713 -12.408 1.00 0.00 H new ATOM 0 HD22 LEU B 73 3.839 8.970 -13.418 1.00 0.00 H new ATOM 0 HD23 LEU B 73 3.946 9.726 -11.810 1.00 0.00 H new ATOM 1214 N LEU B 74 -1.087 7.326 -11.244 1.00 0.00 N ATOM 1215 CA LEU B 74 -2.393 7.824 -10.813 1.00 0.00 C ATOM 1216 C LEU B 74 -3.062 6.840 -9.859 1.00 0.00 C ATOM 1217 O LEU B 74 -3.688 7.246 -8.876 1.00 0.00 O ATOM 1218 CB LEU B 74 -3.301 8.091 -12.019 1.00 0.00 C ATOM 1219 CG LEU B 74 -3.365 9.552 -12.478 1.00 0.00 C ATOM 1220 CD1 LEU B 74 -2.125 9.924 -13.279 1.00 0.00 C ATOM 1221 CD2 LEU B 74 -4.623 9.791 -13.302 1.00 0.00 C ATOM 0 H LEU B 74 -1.047 7.032 -12.220 1.00 0.00 H new ATOM 0 HA LEU B 74 -2.233 8.764 -10.285 1.00 0.00 H new ATOM 0 HB2 LEU B 74 -2.958 7.480 -12.854 1.00 0.00 H new ATOM 0 HB3 LEU B 74 -4.310 7.759 -11.774 1.00 0.00 H new ATOM 0 HG LEU B 74 -3.400 10.188 -11.593 1.00 0.00 H new ATOM 0 HD11 LEU B 74 -2.194 10.965 -13.594 1.00 0.00 H new ATOM 0 HD12 LEU B 74 -1.238 9.790 -12.660 1.00 0.00 H new ATOM 0 HD13 LEU B 74 -2.054 9.283 -14.158 1.00 0.00 H new ATOM 0 HD21 LEU B 74 -4.656 10.833 -13.622 1.00 0.00 H new ATOM 0 HD22 LEU B 74 -4.613 9.143 -14.178 1.00 0.00 H new ATOM 0 HD23 LEU B 74 -5.502 9.569 -12.697 1.00 0.00 H new ATOM 1233 N LEU B 75 -2.909 5.545 -10.140 1.00 0.00 N ATOM 1234 CA LEU B 75 -3.495 4.505 -9.294 1.00 0.00 C ATOM 1235 C LEU B 75 -2.780 4.447 -7.946 1.00 0.00 C ATOM 1236 O LEU B 75 -3.408 4.237 -6.907 1.00 0.00 O ATOM 1237 CB LEU B 75 -3.428 3.139 -9.984 1.00 0.00 C ATOM 1238 CG LEU B 75 -4.778 2.560 -10.416 1.00 0.00 C ATOM 1239 CD1 LEU B 75 -4.984 2.739 -11.911 1.00 0.00 C ATOM 1240 CD2 LEU B 75 -4.874 1.090 -10.034 1.00 0.00 C ATOM 0 H LEU B 75 -2.387 5.193 -10.943 1.00 0.00 H new ATOM 0 HA LEU B 75 -4.542 4.756 -9.127 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -2.789 3.225 -10.863 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -2.947 2.432 -9.308 1.00 0.00 H new ATOM 0 HG LEU B 75 -5.567 3.103 -9.896 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -5.949 2.321 -12.198 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -4.961 3.801 -12.157 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -4.190 2.224 -12.452 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -5.840 0.695 -10.349 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -4.076 0.533 -10.526 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -4.775 0.988 -8.953 1.00 0.00 H new ATOM 1252 N LEU B 76 -1.460 4.651 -7.974 1.00 0.00 N ATOM 1253 CA LEU B 76 -0.646 4.637 -6.761 1.00 0.00 C ATOM 1254 C LEU B 76 -0.952 5.859 -5.893 1.00 0.00 C ATOM 1255 O LEU B 76 -0.966 5.767 -4.665 1.00 0.00 O ATOM 1256 CB LEU B 76 0.844 4.607 -7.119 1.00 0.00 C ATOM 1257 CG LEU B 76 1.766 4.021 -6.044 1.00 0.00 C ATOM 1258 CD1 LEU B 76 1.881 2.511 -6.198 1.00 0.00 C ATOM 1259 CD2 LEU B 76 3.140 4.671 -6.112 1.00 0.00 C ATOM 0 H LEU B 76 -0.933 4.828 -8.829 1.00 0.00 H new ATOM 0 HA LEU B 76 -0.891 3.738 -6.195 1.00 0.00 H new ATOM 0 HB2 LEU B 76 0.969 4.029 -8.035 1.00 0.00 H new ATOM 0 HB3 LEU B 76 1.169 5.624 -7.337 1.00 0.00 H new ATOM 0 HG LEU B 76 1.331 4.231 -5.067 1.00 0.00 H new ATOM 0 HD11 LEU B 76 2.540 2.116 -5.425 1.00 0.00 H new ATOM 0 HD12 LEU B 76 0.894 2.059 -6.100 1.00 0.00 H new ATOM 0 HD13 LEU B 76 2.291 2.276 -7.180 1.00 0.00 H new ATOM 0 HD21 LEU B 76 3.783 4.244 -5.342 1.00 0.00 H new ATOM 0 HD22 LEU B 76 3.580 4.491 -7.093 1.00 0.00 H new ATOM 0 HD23 LEU B 76 3.043 5.744 -5.949 1.00 0.00 H new ATOM 1271 N LEU B 77 -1.199 7.000 -6.546 1.00 0.00 N ATOM 1272 CA LEU B 77 -1.516 8.242 -5.840 1.00 0.00 C ATOM 1273 C LEU B 77 -2.896 8.171 -5.181 1.00 0.00 C ATOM 1274 O LEU B 77 -3.075 8.631 -4.051 1.00 0.00 O ATOM 1275 CB LEU B 77 -1.457 9.434 -6.801 1.00 0.00 C ATOM 1276 CG LEU B 77 -0.049 9.884 -7.204 1.00 0.00 C ATOM 1277 CD1 LEU B 77 -0.084 10.604 -8.543 1.00 0.00 C ATOM 1278 CD2 LEU B 77 0.556 10.784 -6.134 1.00 0.00 C ATOM 0 H LEU B 77 -1.185 7.087 -7.562 1.00 0.00 H new ATOM 0 HA LEU B 77 -0.770 8.377 -5.056 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -2.011 9.178 -7.704 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -1.971 10.277 -6.339 1.00 0.00 H new ATOM 0 HG LEU B 77 0.578 8.998 -7.302 1.00 0.00 H new ATOM 0 HD11 LEU B 77 0.924 10.917 -8.814 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -0.473 9.932 -9.308 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -0.728 11.480 -8.468 1.00 0.00 H new ATOM 0 HD21 LEU B 77 1.556 11.092 -6.440 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.071 11.666 -6.003 1.00 0.00 H new ATOM 0 HD23 LEU B 77 0.617 10.239 -5.192 1.00 0.00 H new ATOM 1290 N VAL B 78 -3.867 7.587 -5.892 1.00 0.00 N ATOM 1291 CA VAL B 78 -5.232 7.452 -5.374 1.00 0.00 C ATOM 1292 C VAL B 78 -5.290 6.443 -4.222 1.00 0.00 C ATOM 1293 O VAL B 78 -5.958 6.685 -3.213 1.00 0.00 O ATOM 1294 CB VAL B 78 -6.227 7.027 -6.487 1.00 0.00 C ATOM 1295 CG1 VAL B 78 -7.634 6.844 -5.926 1.00 0.00 C ATOM 1296 CG2 VAL B 78 -6.241 8.048 -7.616 1.00 0.00 C ATOM 0 H VAL B 78 -3.733 7.201 -6.826 1.00 0.00 H new ATOM 0 HA VAL B 78 -5.526 8.433 -5.002 1.00 0.00 H new ATOM 0 HB VAL B 78 -5.890 6.070 -6.885 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -8.310 6.546 -6.728 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -7.621 6.072 -5.157 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -7.978 7.783 -5.492 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -6.945 7.730 -8.385 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -6.545 9.019 -7.225 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -5.243 8.127 -8.048 1.00 0.00 H new ATOM 1306 N VAL B 79 -4.587 5.317 -4.376 1.00 0.00 N ATOM 1307 CA VAL B 79 -4.558 4.275 -3.344 1.00 0.00 C ATOM 1308 C VAL B 79 -3.766 4.737 -2.116 1.00 0.00 C ATOM 1309 O VAL B 79 -4.147 4.447 -0.981 1.00 0.00 O ATOM 1310 CB VAL B 79 -3.959 2.951 -3.883 1.00 0.00 C ATOM 1311 CG1 VAL B 79 -3.857 1.903 -2.780 1.00 0.00 C ATOM 1312 CG2 VAL B 79 -4.794 2.417 -5.040 1.00 0.00 C ATOM 0 H VAL B 79 -4.031 5.103 -5.204 1.00 0.00 H new ATOM 0 HA VAL B 79 -5.592 4.091 -3.051 1.00 0.00 H new ATOM 0 HB VAL B 79 -2.953 3.164 -4.244 1.00 0.00 H new ATOM 0 HG11 VAL B 79 -3.433 0.985 -3.188 1.00 0.00 H new ATOM 0 HG12 VAL B 79 -3.215 2.276 -1.982 1.00 0.00 H new ATOM 0 HG13 VAL B 79 -4.850 1.698 -2.380 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -4.358 1.487 -5.405 1.00 0.00 H new ATOM 0 HG22 VAL B 79 -5.812 2.230 -4.698 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -4.810 3.151 -5.846 1.00 0.00 H new ATOM 1322 N ALA B 80 -2.669 5.461 -2.351 1.00 0.00 N ATOM 1323 CA ALA B 80 -1.827 5.965 -1.263 1.00 0.00 C ATOM 1324 C ALA B 80 -2.530 7.081 -0.491 1.00 0.00 C ATOM 1325 O ALA B 80 -2.434 7.150 0.737 1.00 0.00 O ATOM 1326 CB ALA B 80 -0.494 6.456 -1.808 1.00 0.00 C ATOM 0 H ALA B 80 -2.343 5.711 -3.285 1.00 0.00 H new ATOM 0 HA ALA B 80 -1.643 5.142 -0.572 1.00 0.00 H new ATOM 0 HB1 ALA B 80 0.120 6.827 -0.987 1.00 0.00 H new ATOM 0 HB2 ALA B 80 0.022 5.633 -2.304 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -0.667 7.260 -2.524 1.00 0.00 H new ATOM 1332 N LEU B 81 -3.240 7.947 -1.218 1.00 0.00 N ATOM 1333 CA LEU B 81 -3.965 9.061 -0.608 1.00 0.00 C ATOM 1334 C LEU B 81 -5.180 8.559 0.176 1.00 0.00 C ATOM 1335 O LEU B 81 -5.437 9.013 1.294 1.00 0.00 O ATOM 1336 CB LEU B 81 -4.409 10.057 -1.686 1.00 0.00 C ATOM 1337 CG LEU B 81 -4.527 11.512 -1.221 1.00 0.00 C ATOM 1338 CD1 LEU B 81 -3.204 12.242 -1.400 1.00 0.00 C ATOM 1339 CD2 LEU B 81 -5.638 12.224 -1.981 1.00 0.00 C ATOM 0 H LEU B 81 -3.328 7.897 -2.233 1.00 0.00 H new ATOM 0 HA LEU B 81 -3.293 9.564 0.087 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -3.700 10.013 -2.513 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -5.375 9.738 -2.077 1.00 0.00 H new ATOM 0 HG LEU B 81 -4.777 11.515 -0.160 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -3.309 13.274 -1.064 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -2.432 11.746 -0.812 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -2.922 12.230 -2.453 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -5.709 13.257 -1.639 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -5.416 12.210 -3.048 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.585 11.716 -1.801 1.00 0.00 H new ATOM 1351 N GLY B 82 -5.915 7.612 -0.416 1.00 0.00 N ATOM 1352 CA GLY B 82 -7.092 7.053 0.236 1.00 0.00 C ATOM 1353 C GLY B 82 -6.739 6.209 1.447 1.00 0.00 C ATOM 1354 O GLY B 82 -7.190 6.491 2.559 1.00 0.00 O ATOM 0 H GLY B 82 -5.714 7.223 -1.337 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -7.753 7.864 0.542 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -7.645 6.444 -0.479 1.00 0.00 H new ATOM 1358 N ILE B 83 -5.920 5.176 1.229 1.00 0.00 N ATOM 1359 CA ILE B 83 -5.493 4.286 2.310 1.00 0.00 C ATOM 1360 C ILE B 83 -4.622 5.041 3.318 1.00 0.00 C ATOM 1361 O ILE B 83 -4.666 4.762 4.517 1.00 0.00 O ATOM 1362 CB ILE B 83 -4.716 3.054 1.770 1.00 0.00 C ATOM 1363 CG1 ILE B 83 -5.510 2.336 0.657 1.00 0.00 C ATOM 1364 CG2 ILE B 83 -4.377 2.082 2.899 1.00 0.00 C ATOM 1365 CD1 ILE B 83 -6.897 1.865 1.064 1.00 0.00 C ATOM 0 H ILE B 83 -5.540 4.936 0.313 1.00 0.00 H new ATOM 0 HA ILE B 83 -6.395 3.929 2.806 1.00 0.00 H new ATOM 0 HB ILE B 83 -3.783 3.417 1.339 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -5.606 3.010 -0.194 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -4.934 1.475 0.318 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -3.833 1.229 2.494 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -3.758 2.587 3.641 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -5.297 1.736 3.369 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -7.377 1.373 0.218 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -6.814 1.162 1.893 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -7.496 2.722 1.373 1.00 0.00 H new ATOM 1377 N GLY B 84 -3.841 6.004 2.819 1.00 0.00 N ATOM 1378 CA GLY B 84 -2.980 6.796 3.684 1.00 0.00 C ATOM 1379 C GLY B 84 -3.770 7.662 4.649 1.00 0.00 C ATOM 1380 O GLY B 84 -3.486 7.681 5.848 1.00 0.00 O ATOM 0 H GLY B 84 -3.791 6.248 1.830 1.00 0.00 H new ATOM 0 HA2 GLY B 84 -2.326 6.131 4.248 1.00 0.00 H new ATOM 0 HA3 GLY B 84 -2.339 7.430 3.072 1.00 0.00 H new ATOM 1384 N LEU B 85 -4.774 8.369 4.122 1.00 0.00 N ATOM 1385 CA LEU B 85 -5.622 9.238 4.938 1.00 0.00 C ATOM 1386 C LEU B 85 -6.607 8.420 5.777 1.00 0.00 C ATOM 1387 O LEU B 85 -7.080 8.883 6.816 1.00 0.00 O ATOM 1388 CB LEU B 85 -6.392 10.223 4.051 1.00 0.00 C ATOM 1389 CG LEU B 85 -5.546 11.327 3.408 1.00 0.00 C ATOM 1390 CD1 LEU B 85 -6.225 11.852 2.153 1.00 0.00 C ATOM 1391 CD2 LEU B 85 -5.303 12.463 4.394 1.00 0.00 C ATOM 0 H LEU B 85 -5.018 8.355 3.132 1.00 0.00 H new ATOM 0 HA LEU B 85 -4.973 9.795 5.613 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -6.889 9.662 3.260 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -7.174 10.690 4.650 1.00 0.00 H new ATOM 0 HG LEU B 85 -4.582 10.901 3.131 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -5.612 12.636 1.708 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -6.348 11.038 1.439 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -7.202 12.259 2.411 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -4.700 13.236 3.917 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -6.258 12.887 4.703 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -4.776 12.080 5.268 1.00 0.00 H new ATOM 1403 N PHE B 86 -6.907 7.201 5.317 1.00 0.00 N ATOM 1404 CA PHE B 86 -7.829 6.310 6.024 1.00 0.00 C ATOM 1405 C PHE B 86 -7.164 5.692 7.257 1.00 0.00 C ATOM 1406 O PHE B 86 -7.796 5.554 8.306 1.00 0.00 O ATOM 1407 CB PHE B 86 -8.323 5.206 5.084 1.00 0.00 C ATOM 1408 CG PHE B 86 -9.674 4.658 5.451 1.00 0.00 C ATOM 1409 CD1 PHE B 86 -10.829 5.224 4.934 1.00 0.00 C ATOM 1410 CD2 PHE B 86 -9.790 3.577 6.310 1.00 0.00 C ATOM 1411 CE1 PHE B 86 -12.073 4.724 5.267 1.00 0.00 C ATOM 1412 CE2 PHE B 86 -11.031 3.072 6.647 1.00 0.00 C ATOM 1413 CZ PHE B 86 -12.174 3.647 6.125 1.00 0.00 C ATOM 0 H PHE B 86 -6.523 6.810 4.457 1.00 0.00 H new ATOM 0 HA PHE B 86 -8.681 6.902 6.358 1.00 0.00 H new ATOM 0 HB2 PHE B 86 -8.364 5.598 4.068 1.00 0.00 H new ATOM 0 HB3 PHE B 86 -7.599 4.391 5.083 1.00 0.00 H new ATOM 0 HD1 PHE B 86 -10.755 6.067 4.262 1.00 0.00 H new ATOM 0 HD2 PHE B 86 -8.900 3.124 6.721 1.00 0.00 H new ATOM 0 HE1 PHE B 86 -12.965 5.175 4.857 1.00 0.00 H new ATOM 0 HE2 PHE B 86 -11.108 2.229 7.318 1.00 0.00 H new ATOM 0 HZ PHE B 86 -13.145 3.254 6.388 1.00 0.00 H new ATOM 1423 N ILE B 87 -5.888 5.321 7.121 1.00 0.00 N ATOM 1424 CA ILE B 87 -5.134 4.719 8.224 1.00 0.00 C ATOM 1425 C ILE B 87 -4.558 5.795 9.152 1.00 0.00 C ATOM 1426 O ILE B 87 -4.435 5.576 10.359 1.00 0.00 O ATOM 1427 CB ILE B 87 -3.983 3.814 7.705 1.00 0.00 C ATOM 1428 CG1 ILE B 87 -4.508 2.755 6.713 1.00 0.00 C ATOM 1429 CG2 ILE B 87 -3.248 3.143 8.866 1.00 0.00 C ATOM 1430 CD1 ILE B 87 -5.597 1.848 7.264 1.00 0.00 C ATOM 0 H ILE B 87 -5.355 5.427 6.258 1.00 0.00 H new ATOM 0 HA ILE B 87 -5.835 4.101 8.785 1.00 0.00 H new ATOM 0 HB ILE B 87 -3.276 4.452 7.175 1.00 0.00 H new ATOM 0 HG12 ILE B 87 -4.892 3.265 5.829 1.00 0.00 H new ATOM 0 HG13 ILE B 87 -3.671 2.137 6.386 1.00 0.00 H new ATOM 0 HG21 ILE B 87 -2.447 2.515 8.475 1.00 0.00 H new ATOM 0 HG22 ILE B 87 -2.825 3.907 9.519 1.00 0.00 H new ATOM 0 HG23 ILE B 87 -3.947 2.528 9.433 1.00 0.00 H new ATOM 0 HD11 ILE B 87 -5.902 1.138 6.496 1.00 0.00 H new ATOM 0 HD12 ILE B 87 -5.215 1.305 8.129 1.00 0.00 H new ATOM 0 HD13 ILE B 87 -6.455 2.450 7.563 1.00 0.00 H new ATOM 1442 N ARG B 88 -4.210 6.954 8.582 1.00 0.00 N ATOM 1443 CA ARG B 88 -3.649 8.064 9.359 1.00 0.00 C ATOM 1444 C ARG B 88 -4.669 8.621 10.356 1.00 0.00 C ATOM 1445 O ARG B 88 -4.296 9.190 11.383 1.00 0.00 O ATOM 1446 CB ARG B 88 -3.173 9.178 8.423 1.00 0.00 C ATOM 1447 CG ARG B 88 -1.959 9.936 8.940 1.00 0.00 C ATOM 1448 CD ARG B 88 -1.530 11.027 7.973 1.00 0.00 C ATOM 1449 NE ARG B 88 -0.364 11.764 8.459 1.00 0.00 N ATOM 1450 CZ ARG B 88 0.218 12.767 7.798 1.00 0.00 C ATOM 1451 NH1 ARG B 88 -0.253 13.160 6.619 1.00 0.00 N ATOM 1452 NH2 ARG B 88 1.273 13.377 8.318 1.00 0.00 N ATOM 0 H ARG B 88 -4.307 7.147 7.585 1.00 0.00 H new ATOM 0 HA ARG B 88 -2.800 7.679 9.923 1.00 0.00 H new ATOM 0 HB2 ARG B 88 -2.934 8.746 7.451 1.00 0.00 H new ATOM 0 HB3 ARG B 88 -3.990 9.882 8.266 1.00 0.00 H new ATOM 0 HG2 ARG B 88 -2.190 10.378 9.909 1.00 0.00 H new ATOM 0 HG3 ARG B 88 -1.134 9.241 9.095 1.00 0.00 H new ATOM 0 HD2 ARG B 88 -1.300 10.583 7.005 1.00 0.00 H new ATOM 0 HD3 ARG B 88 -2.357 11.719 7.818 1.00 0.00 H new ATOM 0 HE ARG B 88 0.030 11.494 9.361 1.00 0.00 H new ATOM 0 HH11 ARG B 88 -1.065 12.694 6.213 1.00 0.00 H new ATOM 0 HH12 ARG B 88 0.197 13.927 6.120 1.00 0.00 H new ATOM 0 HH21 ARG B 88 1.639 13.080 9.222 1.00 0.00 H new ATOM 0 HH22 ARG B 88 1.719 14.144 7.814 1.00 0.00 H new ATOM 1466 N ARG B 89 -5.956 8.454 10.040 1.00 0.00 N ATOM 1467 CA ARG B 89 -7.037 8.935 10.902 1.00 0.00 C ATOM 1468 C ARG B 89 -7.319 7.957 12.045 1.00 0.00 C ATOM 1469 O ARG B 89 -7.941 8.324 13.042 1.00 0.00 O ATOM 1470 CB ARG B 89 -8.312 9.156 10.081 1.00 0.00 C ATOM 1471 CG ARG B 89 -8.273 10.403 9.206 1.00 0.00 C ATOM 1472 CD ARG B 89 -8.757 11.633 9.961 1.00 0.00 C ATOM 1473 NE ARG B 89 -8.722 12.836 9.129 1.00 0.00 N ATOM 1474 CZ ARG B 89 -9.085 14.048 9.551 1.00 0.00 C ATOM 1475 NH1 ARG B 89 -9.512 14.231 10.796 1.00 0.00 N ATOM 1476 NH2 ARG B 89 -9.018 15.083 8.723 1.00 0.00 N ATOM 0 H ARG B 89 -6.275 7.988 9.191 1.00 0.00 H new ATOM 0 HA ARG B 89 -6.717 9.882 11.337 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -8.481 8.285 9.448 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -9.162 9.226 10.760 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -7.255 10.569 8.853 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -8.895 10.249 8.324 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -9.775 11.465 10.313 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -8.136 11.784 10.844 1.00 0.00 H new ATOM 0 HE ARG B 89 -8.400 12.742 8.166 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -9.564 13.441 11.439 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -9.787 15.162 11.109 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -8.690 14.950 7.766 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -9.295 16.011 9.043 1.00 0.00 H new ATOM 1490 N ARG B 90 -6.854 6.715 11.888 1.00 0.00 N ATOM 1491 CA ARG B 90 -7.055 5.677 12.899 1.00 0.00 C ATOM 1492 C ARG B 90 -6.029 5.786 14.030 1.00 0.00 C ATOM 1493 O ARG B 90 -6.258 5.285 15.132 1.00 0.00 O ATOM 1494 CB ARG B 90 -6.970 4.289 12.259 1.00 0.00 C ATOM 1495 CG ARG B 90 -8.204 3.911 11.456 1.00 0.00 C ATOM 1496 CD ARG B 90 -8.078 2.516 10.864 1.00 0.00 C ATOM 1497 NE ARG B 90 -9.285 2.118 10.137 1.00 0.00 N ATOM 1498 CZ ARG B 90 -9.437 0.938 9.532 1.00 0.00 C ATOM 1499 NH1 ARG B 90 -8.464 0.034 9.557 1.00 0.00 N ATOM 1500 NH2 ARG B 90 -10.571 0.663 8.900 1.00 0.00 N ATOM 0 H ARG B 90 -6.334 6.404 11.067 1.00 0.00 H new ATOM 0 HA ARG B 90 -8.048 5.822 13.325 1.00 0.00 H new ATOM 0 HB2 ARG B 90 -6.097 4.252 11.607 1.00 0.00 H new ATOM 0 HB3 ARG B 90 -6.815 3.546 13.042 1.00 0.00 H new ATOM 0 HG2 ARG B 90 -9.085 3.957 12.097 1.00 0.00 H new ATOM 0 HG3 ARG B 90 -8.354 4.635 10.655 1.00 0.00 H new ATOM 0 HD2 ARG B 90 -7.222 2.484 10.190 1.00 0.00 H new ATOM 0 HD3 ARG B 90 -7.883 1.800 11.662 1.00 0.00 H new ATOM 0 HE ARG B 90 -10.057 2.783 10.090 1.00 0.00 H new ATOM 0 HH11 ARG B 90 -7.590 0.238 10.042 1.00 0.00 H new ATOM 0 HH12 ARG B 90 -8.591 -0.865 9.091 1.00 0.00 H new ATOM 0 HH21 ARG B 90 -11.323 1.352 8.878 1.00 0.00 H new ATOM 0 HH22 ARG B 90 -10.691 -0.238 8.436 1.00 0.00 H new ATOM 1514 N HIS B 91 -4.901 6.445 13.749 1.00 0.00 N ATOM 1515 CA HIS B 91 -3.836 6.620 14.739 1.00 0.00 C ATOM 1516 C HIS B 91 -4.248 7.594 15.845 1.00 0.00 C ATOM 1517 O HIS B 91 -3.764 7.498 16.975 1.00 0.00 O ATOM 1518 CB HIS B 91 -2.559 7.119 14.060 1.00 0.00 C ATOM 1519 CG HIS B 91 -1.816 6.049 13.321 1.00 0.00 C ATOM 1520 ND1 HIS B 91 -1.992 5.545 12.076 1.00 0.00 N flip ATOM 1521 CD2 HIS B 91 -0.746 5.368 13.859 1.00 0.00 C flip ATOM 1522 CE1 HIS B 91 -1.037 4.578 11.890 1.00 0.00 C flip ATOM 1523 NE2 HIS B 91 -0.297 4.490 12.978 1.00 0.00 N flip ATOM 0 H HIS B 91 -4.702 6.867 12.842 1.00 0.00 H new ATOM 0 HA HIS B 91 -3.650 5.648 15.196 1.00 0.00 H new ATOM 0 HB2 HIS B 91 -2.816 7.918 13.365 1.00 0.00 H new ATOM 0 HB3 HIS B 91 -1.902 7.552 14.814 1.00 0.00 H new ATOM 0 HD1 HIS B 91 -2.702 5.831 11.402 1.00 0.00 H new ATOM 0 HD2 HIS B 91 -0.338 5.527 14.846 1.00 0.00 H new ATOM 0 HE1 HIS B 91 -0.911 3.984 10.997 1.00 0.00 H new ATOM 1532 N ILE B 92 -5.142 8.528 15.512 1.00 0.00 N ATOM 1533 CA ILE B 92 -5.622 9.520 16.478 1.00 0.00 C ATOM 1534 C ILE B 92 -6.757 8.951 17.335 1.00 0.00 C ATOM 1535 O ILE B 92 -7.128 9.536 18.355 1.00 0.00 O ATOM 1536 CB ILE B 92 -6.112 10.815 15.780 1.00 0.00 C ATOM 1537 CG1 ILE B 92 -5.210 11.164 14.587 1.00 0.00 C ATOM 1538 CG2 ILE B 92 -6.149 11.974 16.771 1.00 0.00 C ATOM 1539 CD1 ILE B 92 -5.947 11.820 13.436 1.00 0.00 C ATOM 0 H ILE B 92 -5.548 8.618 14.581 1.00 0.00 H new ATOM 0 HA ILE B 92 -4.774 9.768 17.117 1.00 0.00 H new ATOM 0 HB ILE B 92 -7.122 10.640 15.409 1.00 0.00 H new ATOM 0 HG12 ILE B 92 -4.417 11.830 14.926 1.00 0.00 H new ATOM 0 HG13 ILE B 92 -4.730 10.254 14.228 1.00 0.00 H new ATOM 0 HG21 ILE B 92 -6.495 12.875 16.264 1.00 0.00 H new ATOM 0 HG22 ILE B 92 -6.829 11.733 17.588 1.00 0.00 H new ATOM 0 HG23 ILE B 92 -5.149 12.144 17.170 1.00 0.00 H new ATOM 0 HD11 ILE B 92 -5.245 12.037 12.631 1.00 0.00 H new ATOM 0 HD12 ILE B 92 -6.722 11.147 13.070 1.00 0.00 H new ATOM 0 HD13 ILE B 92 -6.404 12.748 13.779 1.00 0.00 H new ATOM 1651 N LEU B 98 -0.246 1.410 24.296 1.00 0.00 N ATOM 1652 CA LEU B 98 0.442 0.316 23.608 1.00 0.00 C ATOM 1653 C LEU B 98 1.867 0.728 23.263 1.00 0.00 C ATOM 1654 O LEU B 98 2.684 -0.091 22.851 1.00 0.00 O ATOM 1655 CB LEU B 98 -0.321 -0.091 22.343 1.00 0.00 C ATOM 1656 CG LEU B 98 -1.654 -0.806 22.588 1.00 0.00 C ATOM 1657 CD1 LEU B 98 -2.561 -0.674 21.374 1.00 0.00 C ATOM 1658 CD2 LEU B 98 -1.425 -2.277 22.923 1.00 0.00 C ATOM 0 HA LEU B 98 0.479 -0.545 24.275 1.00 0.00 H new ATOM 0 HB2 LEU B 98 -0.510 0.803 21.748 1.00 0.00 H new ATOM 0 HB3 LEU B 98 0.318 -0.742 21.746 1.00 0.00 H new ATOM 0 HG LEU B 98 -2.143 -0.332 23.440 1.00 0.00 H new ATOM 0 HD11 LEU B 98 -3.503 -1.188 21.566 1.00 0.00 H new ATOM 0 HD12 LEU B 98 -2.756 0.380 21.178 1.00 0.00 H new ATOM 0 HD13 LEU B 98 -2.075 -1.120 20.506 1.00 0.00 H new ATOM 0 HD21 LEU B 98 -2.385 -2.765 23.093 1.00 0.00 H new ATOM 0 HD22 LEU B 98 -0.912 -2.764 22.093 1.00 0.00 H new ATOM 0 HD23 LEU B 98 -0.814 -2.355 23.822 1.00 0.00 H new ATOM 1670 N ARG B 99 2.125 2.019 23.437 1.00 0.00 N ATOM 1671 CA ARG B 99 3.423 2.629 23.197 1.00 0.00 C ATOM 1672 C ARG B 99 4.127 2.737 24.532 1.00 0.00 C ATOM 1673 O ARG B 99 5.351 2.629 24.627 1.00 0.00 O ATOM 1674 CB ARG B 99 3.266 4.014 22.559 1.00 0.00 C ATOM 1675 CG ARG B 99 2.846 3.970 21.098 1.00 0.00 C ATOM 1676 CD ARG B 99 2.707 5.369 20.518 1.00 0.00 C ATOM 1677 NE ARG B 99 2.306 5.341 19.112 1.00 0.00 N ATOM 1678 CZ ARG B 99 2.106 6.430 18.369 1.00 0.00 C ATOM 1679 NH1 ARG B 99 2.267 7.643 18.890 1.00 0.00 N ATOM 1680 NH2 ARG B 99 1.742 6.307 17.100 1.00 0.00 N ATOM 0 H ARG B 99 1.420 2.684 23.756 1.00 0.00 H new ATOM 0 HA ARG B 99 4.004 2.020 22.505 1.00 0.00 H new ATOM 0 HB2 ARG B 99 2.527 4.583 23.123 1.00 0.00 H new ATOM 0 HB3 ARG B 99 4.211 4.551 22.640 1.00 0.00 H new ATOM 0 HG2 ARG B 99 3.582 3.408 20.523 1.00 0.00 H new ATOM 0 HG3 ARG B 99 1.898 3.441 21.006 1.00 0.00 H new ATOM 0 HD2 ARG B 99 1.970 5.929 21.094 1.00 0.00 H new ATOM 0 HD3 ARG B 99 3.656 5.897 20.614 1.00 0.00 H new ATOM 0 HE ARG B 99 2.171 4.431 18.672 1.00 0.00 H new ATOM 0 HH11 ARG B 99 2.546 7.746 19.866 1.00 0.00 H new ATOM 0 HH12 ARG B 99 2.112 8.470 18.314 1.00 0.00 H new ATOM 0 HH21 ARG B 99 1.615 5.380 16.693 1.00 0.00 H new ATOM 0 HH22 ARG B 99 1.589 7.139 16.530 1.00 0.00 H new ATOM 1694 N ARG B 100 3.309 2.955 25.570 1.00 0.00 N ATOM 1695 CA ARG B 100 3.797 3.038 26.940 1.00 0.00 C ATOM 1696 C ARG B 100 4.065 1.623 27.427 1.00 0.00 C ATOM 1697 O ARG B 100 4.860 1.397 28.339 1.00 0.00 O ATOM 1698 CB ARG B 100 2.776 3.731 27.847 1.00 0.00 C ATOM 1699 CG ARG B 100 2.665 5.230 27.611 1.00 0.00 C ATOM 1700 CD ARG B 100 1.639 5.868 28.533 1.00 0.00 C ATOM 1701 NE ARG B 100 2.132 5.988 29.907 1.00 0.00 N ATOM 1702 CZ ARG B 100 1.426 6.509 30.912 1.00 0.00 C ATOM 1703 NH1 ARG B 100 0.193 6.965 30.709 1.00 0.00 N ATOM 1704 NH2 ARG B 100 1.956 6.576 32.126 1.00 0.00 N ATOM 0 H ARG B 100 2.300 3.077 25.479 1.00 0.00 H new ATOM 0 HA ARG B 100 4.711 3.631 26.971 1.00 0.00 H new ATOM 0 HB2 ARG B 100 1.798 3.275 27.693 1.00 0.00 H new ATOM 0 HB3 ARG B 100 3.050 3.555 28.887 1.00 0.00 H new ATOM 0 HG2 ARG B 100 3.637 5.697 27.770 1.00 0.00 H new ATOM 0 HG3 ARG B 100 2.388 5.416 26.573 1.00 0.00 H new ATOM 0 HD2 ARG B 100 1.377 6.856 28.155 1.00 0.00 H new ATOM 0 HD3 ARG B 100 0.726 5.272 28.527 1.00 0.00 H new ATOM 0 HE ARG B 100 3.074 5.652 30.108 1.00 0.00 H new ATOM 0 HH11 ARG B 100 -0.221 6.918 29.778 1.00 0.00 H new ATOM 0 HH12 ARG B 100 -0.338 7.361 31.484 1.00 0.00 H new ATOM 0 HH21 ARG B 100 2.901 6.230 32.290 1.00 0.00 H new ATOM 0 HH22 ARG B 100 1.418 6.974 32.896 1.00 0.00 H new ATOM 1718 N LEU B 101 3.367 0.681 26.790 1.00 0.00 N ATOM 1719 CA LEU B 101 3.515 -0.734 27.070 1.00 0.00 C ATOM 1720 C LEU B 101 4.403 -1.368 26.005 1.00 0.00 C ATOM 1721 O LEU B 101 4.972 -2.441 26.218 1.00 0.00 O ATOM 1722 CB LEU B 101 2.152 -1.438 27.097 1.00 0.00 C ATOM 1723 CG LEU B 101 1.372 -1.316 28.412 1.00 0.00 C ATOM 1724 CD1 LEU B 101 -0.112 -1.555 28.177 1.00 0.00 C ATOM 1725 CD2 LEU B 101 1.908 -2.298 29.450 1.00 0.00 C ATOM 0 H LEU B 101 2.682 0.887 26.063 1.00 0.00 H new ATOM 0 HA LEU B 101 3.974 -0.848 28.052 1.00 0.00 H new ATOM 0 HB2 LEU B 101 1.538 -1.034 26.292 1.00 0.00 H new ATOM 0 HB3 LEU B 101 2.305 -2.496 26.882 1.00 0.00 H new ATOM 0 HG LEU B 101 1.505 -0.304 28.794 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -0.649 -1.464 29.121 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -0.492 -0.817 27.471 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -0.259 -2.555 27.770 1.00 0.00 H new ATOM 0 HD21 LEU B 101 1.341 -2.195 30.375 1.00 0.00 H new ATOM 0 HD22 LEU B 101 1.807 -3.316 29.074 1.00 0.00 H new ATOM 0 HD23 LEU B 101 2.959 -2.085 29.643 1.00 0.00 H new ATOM 1737 N LEU B 102 4.517 -0.690 24.849 1.00 0.00 N ATOM 1738 CA LEU B 102 5.355 -1.184 23.749 1.00 0.00 C ATOM 1739 C LEU B 102 6.820 -1.251 24.175 1.00 0.00 C ATOM 1740 O LEU B 102 7.490 -2.262 23.968 1.00 0.00 O ATOM 1741 CB LEU B 102 5.216 -0.289 22.511 1.00 0.00 C ATOM 1742 CG LEU B 102 5.729 -0.894 21.200 1.00 0.00 C ATOM 1743 CD1 LEU B 102 4.587 -1.529 20.421 1.00 0.00 C ATOM 1744 CD2 LEU B 102 6.424 0.167 20.360 1.00 0.00 C ATOM 0 H LEU B 102 4.043 0.193 24.656 1.00 0.00 H new ATOM 0 HA LEU B 102 5.014 -2.188 23.496 1.00 0.00 H new ATOM 0 HB2 LEU B 102 4.164 -0.033 22.386 1.00 0.00 H new ATOM 0 HB3 LEU B 102 5.751 0.642 22.695 1.00 0.00 H new ATOM 0 HG LEU B 102 6.454 -1.672 21.441 1.00 0.00 H new ATOM 0 HD11 LEU B 102 4.971 -1.953 19.493 1.00 0.00 H new ATOM 0 HD12 LEU B 102 4.133 -2.318 21.020 1.00 0.00 H new ATOM 0 HD13 LEU B 102 3.838 -0.771 20.191 1.00 0.00 H new ATOM 0 HD21 LEU B 102 6.782 -0.280 19.433 1.00 0.00 H new ATOM 0 HD22 LEU B 102 5.720 0.967 20.129 1.00 0.00 H new ATOM 0 HD23 LEU B 102 7.268 0.575 20.915 1.00 0.00 H new