USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 784 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 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 39:sc= 0.639 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.0442 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 170:sc= -1.01 USER MOD Single : A 29 MET CE :methyl 145:sc= -0.115 (180deg=-0.766) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 26:sc=-0.000607 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 35:sc= -0.613 USER MOD Single : A 53 LYS NZ :NH3+ -161:sc= -0.0378 (180deg=-0.303) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc=-0.00706 USER MOD Single : A 66 CYS SG : rot 180:sc= -0.439 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 161:sc= 1.15 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc=-0.000289 USER MOD Single : A 83 LYS NZ :NH3+ -125:sc= -0.54 (180deg=-2.04) USER MOD Single : A 88 HIS : no HD1:sc= -7.82! C(o=-7.8!,f=-8.1!) USER MOD Single : A 92 SER OG : rot 24:sc= -0.523 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -121:sc= 0 (180deg=-1.04) USER MOD Single : A 106 SER OG : rot 180:sc= -0.0701 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 10:sc= 0.584! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.693 30.638 -10.783 1.00 0.00 N ATOM 2 CA GLY A 1 23.097 30.285 -10.880 1.00 0.00 C ATOM 3 C GLY A 1 23.496 29.214 -9.884 1.00 0.00 C ATOM 4 O GLY A 1 23.550 28.032 -10.222 1.00 0.00 O ATOM 0 H1 GLY A 1 21.471 31.373 -11.484 1.00 0.00 H new ATOM 0 H2 GLY A 1 21.110 29.797 -10.967 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.491 30.997 -9.828 1.00 0.00 H new ATOM 0 HA2 GLY A 1 23.312 29.936 -11.890 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.704 31.175 -10.715 1.00 0.00 H new ATOM 8 N SER A 2 23.777 29.628 -8.653 1.00 0.00 N ATOM 9 CA SER A 2 24.178 28.696 -7.605 1.00 0.00 C ATOM 10 C SER A 2 23.407 27.385 -7.720 1.00 0.00 C ATOM 11 O SER A 2 22.218 27.322 -7.407 1.00 0.00 O ATOM 12 CB SER A 2 23.949 29.317 -6.226 1.00 0.00 C ATOM 13 OG SER A 2 24.954 30.268 -5.921 1.00 0.00 O ATOM 0 H SER A 2 23.734 30.603 -8.356 1.00 0.00 H new ATOM 0 HA SER A 2 25.240 28.484 -7.728 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.970 29.796 -6.198 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.943 28.534 -5.468 1.00 0.00 H new ATOM 0 HG SER A 2 24.784 30.651 -5.035 1.00 0.00 H new ATOM 19 N SER A 3 24.092 26.340 -8.173 1.00 0.00 N ATOM 20 CA SER A 3 23.472 25.030 -8.334 1.00 0.00 C ATOM 21 C SER A 3 22.644 24.667 -7.105 1.00 0.00 C ATOM 22 O SER A 3 21.473 24.305 -7.216 1.00 0.00 O ATOM 23 CB SER A 3 24.540 23.963 -8.577 1.00 0.00 C ATOM 24 OG SER A 3 25.250 24.216 -9.777 1.00 0.00 O ATOM 0 H SER A 3 25.077 26.375 -8.435 1.00 0.00 H new ATOM 0 HA SER A 3 22.809 25.073 -9.198 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.235 23.942 -7.737 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.072 22.980 -8.628 1.00 0.00 H new ATOM 0 HG SER A 3 25.928 23.521 -9.909 1.00 0.00 H new ATOM 30 N GLY A 4 23.262 24.766 -5.932 1.00 0.00 N ATOM 31 CA GLY A 4 22.569 24.444 -4.698 1.00 0.00 C ATOM 32 C GLY A 4 22.857 23.035 -4.221 1.00 0.00 C ATOM 33 O GLY A 4 22.419 22.062 -4.836 1.00 0.00 O ATOM 0 H GLY A 4 24.231 25.064 -5.814 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.863 25.153 -3.924 1.00 0.00 H new ATOM 0 HA3 GLY A 4 21.496 24.561 -4.847 1.00 0.00 H new ATOM 37 N SER A 5 23.599 22.923 -3.124 1.00 0.00 N ATOM 38 CA SER A 5 23.950 21.622 -2.568 1.00 0.00 C ATOM 39 C SER A 5 22.701 20.787 -2.306 1.00 0.00 C ATOM 40 O SER A 5 22.697 19.573 -2.511 1.00 0.00 O ATOM 41 CB SER A 5 24.742 21.795 -1.270 1.00 0.00 C ATOM 42 OG SER A 5 24.027 22.586 -0.338 1.00 0.00 O ATOM 0 H SER A 5 23.969 23.718 -2.603 1.00 0.00 H new ATOM 0 HA SER A 5 24.569 21.099 -3.297 1.00 0.00 H new ATOM 0 HB2 SER A 5 24.953 20.818 -0.836 1.00 0.00 H new ATOM 0 HB3 SER A 5 25.703 22.262 -1.486 1.00 0.00 H new ATOM 0 HG SER A 5 24.554 22.680 0.483 1.00 0.00 H new ATOM 48 N SER A 6 21.640 21.447 -1.853 1.00 0.00 N ATOM 49 CA SER A 6 20.384 20.767 -1.559 1.00 0.00 C ATOM 50 C SER A 6 19.514 20.668 -2.809 1.00 0.00 C ATOM 51 O SER A 6 18.986 21.669 -3.291 1.00 0.00 O ATOM 52 CB SER A 6 19.626 21.504 -0.453 1.00 0.00 C ATOM 53 OG SER A 6 19.337 22.838 -0.835 1.00 0.00 O ATOM 0 H SER A 6 21.625 22.452 -1.682 1.00 0.00 H new ATOM 0 HA SER A 6 20.617 19.758 -1.219 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.698 20.977 -0.230 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.220 21.505 0.461 1.00 0.00 H new ATOM 0 HG SER A 6 19.096 22.861 -1.785 1.00 0.00 H new ATOM 59 N GLY A 7 19.371 19.453 -3.329 1.00 0.00 N ATOM 60 CA GLY A 7 18.565 19.245 -4.517 1.00 0.00 C ATOM 61 C GLY A 7 17.356 18.370 -4.252 1.00 0.00 C ATOM 62 O GLY A 7 16.776 17.804 -5.180 1.00 0.00 O ATOM 0 H GLY A 7 19.799 18.609 -2.948 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.234 20.210 -4.901 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.178 18.787 -5.293 1.00 0.00 H new ATOM 66 N ILE A 8 16.976 18.256 -2.984 1.00 0.00 N ATOM 67 CA ILE A 8 15.829 17.443 -2.601 1.00 0.00 C ATOM 68 C ILE A 8 14.540 17.991 -3.205 1.00 0.00 C ATOM 69 O ILE A 8 14.346 19.203 -3.286 1.00 0.00 O ATOM 70 CB ILE A 8 15.675 17.373 -1.070 1.00 0.00 C ATOM 71 CG1 ILE A 8 16.999 16.963 -0.421 1.00 0.00 C ATOM 72 CG2 ILE A 8 14.570 16.398 -0.693 1.00 0.00 C ATOM 73 CD1 ILE A 8 17.429 15.554 -0.763 1.00 0.00 C ATOM 0 H ILE A 8 17.446 18.717 -2.205 1.00 0.00 H new ATOM 0 HA ILE A 8 16.011 16.440 -2.987 1.00 0.00 H new ATOM 0 HB ILE A 8 15.402 18.362 -0.701 1.00 0.00 H new ATOM 0 HG12 ILE A 8 17.778 17.658 -0.734 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.907 17.053 0.661 1.00 0.00 H new ATOM 0 HG21 ILE A 8 14.473 16.360 0.392 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.628 16.729 -1.130 1.00 0.00 H new ATOM 0 HG23 ILE A 8 14.816 15.406 -1.071 1.00 0.00 H new ATOM 0 HD11 ILE A 8 18.375 15.332 -0.269 1.00 0.00 H new ATOM 0 HD12 ILE A 8 16.669 14.850 -0.425 1.00 0.00 H new ATOM 0 HD13 ILE A 8 17.554 15.463 -1.842 1.00 0.00 H new ATOM 85 N GLY A 9 13.660 17.088 -3.627 1.00 0.00 N ATOM 86 CA GLY A 9 12.400 17.499 -4.218 1.00 0.00 C ATOM 87 C GLY A 9 11.244 17.400 -3.243 1.00 0.00 C ATOM 88 O GLY A 9 11.404 17.663 -2.051 1.00 0.00 O ATOM 0 H GLY A 9 13.797 16.079 -3.570 1.00 0.00 H new ATOM 0 HA2 GLY A 9 12.486 18.526 -4.572 1.00 0.00 H new ATOM 0 HA3 GLY A 9 12.191 16.878 -5.089 1.00 0.00 H new ATOM 92 N ASP A 10 10.076 17.022 -3.749 1.00 0.00 N ATOM 93 CA ASP A 10 8.887 16.890 -2.915 1.00 0.00 C ATOM 94 C ASP A 10 8.008 15.740 -3.399 1.00 0.00 C ATOM 95 O ASP A 10 7.544 15.739 -4.539 1.00 0.00 O ATOM 96 CB ASP A 10 8.089 18.194 -2.917 1.00 0.00 C ATOM 97 CG ASP A 10 7.123 18.284 -1.751 1.00 0.00 C ATOM 98 OD1 ASP A 10 7.025 17.302 -0.986 1.00 0.00 O ATOM 99 OD2 ASP A 10 6.465 19.335 -1.605 1.00 0.00 O ATOM 0 H ASP A 10 9.927 16.801 -4.734 1.00 0.00 H new ATOM 0 HA ASP A 10 9.210 16.673 -1.897 1.00 0.00 H new ATOM 0 HB2 ASP A 10 8.778 19.038 -2.880 1.00 0.00 H new ATOM 0 HB3 ASP A 10 7.534 18.276 -3.852 1.00 0.00 H new ATOM 104 N ALA A 11 7.786 14.764 -2.526 1.00 0.00 N ATOM 105 CA ALA A 11 6.962 13.609 -2.864 1.00 0.00 C ATOM 106 C ALA A 11 5.595 14.043 -3.382 1.00 0.00 C ATOM 107 O ALA A 11 5.057 13.447 -4.315 1.00 0.00 O ATOM 108 CB ALA A 11 6.806 12.700 -1.654 1.00 0.00 C ATOM 0 H ALA A 11 8.165 14.749 -1.579 1.00 0.00 H new ATOM 0 HA ALA A 11 7.463 13.056 -3.658 1.00 0.00 H new ATOM 0 HB1 ALA A 11 6.189 11.842 -1.921 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.788 12.354 -1.330 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.330 13.252 -0.843 1.00 0.00 H new ATOM 114 N ARG A 12 5.039 15.084 -2.771 1.00 0.00 N ATOM 115 CA ARG A 12 3.733 15.595 -3.169 1.00 0.00 C ATOM 116 C ARG A 12 3.715 15.941 -4.656 1.00 0.00 C ATOM 117 O ARG A 12 2.653 16.015 -5.273 1.00 0.00 O ATOM 118 CB ARG A 12 3.372 16.831 -2.343 1.00 0.00 C ATOM 119 CG ARG A 12 3.962 18.122 -2.888 1.00 0.00 C ATOM 120 CD ARG A 12 3.803 19.267 -1.900 1.00 0.00 C ATOM 121 NE ARG A 12 4.380 20.510 -2.406 1.00 0.00 N ATOM 122 CZ ARG A 12 4.504 21.613 -1.676 1.00 0.00 C ATOM 123 NH1 ARG A 12 4.095 21.627 -0.415 1.00 0.00 N ATOM 124 NH2 ARG A 12 5.039 22.704 -2.207 1.00 0.00 N ATOM 0 H ARG A 12 5.473 15.590 -1.999 1.00 0.00 H new ATOM 0 HA ARG A 12 2.994 14.815 -2.985 1.00 0.00 H new ATOM 0 HB2 ARG A 12 2.287 16.926 -2.302 1.00 0.00 H new ATOM 0 HB3 ARG A 12 3.718 16.687 -1.319 1.00 0.00 H new ATOM 0 HG2 ARG A 12 5.019 17.975 -3.110 1.00 0.00 H new ATOM 0 HG3 ARG A 12 3.472 18.379 -3.827 1.00 0.00 H new ATOM 0 HD2 ARG A 12 2.745 19.419 -1.688 1.00 0.00 H new ATOM 0 HD3 ARG A 12 4.282 19.002 -0.958 1.00 0.00 H new ATOM 0 HE ARG A 12 4.705 20.532 -3.372 1.00 0.00 H new ATOM 0 HH11 ARG A 12 3.684 20.789 -0.003 1.00 0.00 H new ATOM 0 HH12 ARG A 12 4.192 22.475 0.143 1.00 0.00 H new ATOM 0 HH21 ARG A 12 5.356 22.697 -3.177 1.00 0.00 H new ATOM 0 HH22 ARG A 12 5.134 23.550 -1.646 1.00 0.00 H new ATOM 138 N ARG A 13 4.899 16.153 -5.222 1.00 0.00 N ATOM 139 CA ARG A 13 5.019 16.493 -6.635 1.00 0.00 C ATOM 140 C ARG A 13 5.201 15.237 -7.483 1.00 0.00 C ATOM 141 O ARG A 13 4.848 15.216 -8.662 1.00 0.00 O ATOM 142 CB ARG A 13 6.197 17.444 -6.854 1.00 0.00 C ATOM 143 CG ARG A 13 6.050 18.772 -6.130 1.00 0.00 C ATOM 144 CD ARG A 13 5.037 19.673 -6.819 1.00 0.00 C ATOM 145 NE ARG A 13 5.318 21.088 -6.590 1.00 0.00 N ATOM 146 CZ ARG A 13 4.732 22.072 -7.262 1.00 0.00 C ATOM 147 NH1 ARG A 13 3.837 21.797 -8.202 1.00 0.00 N ATOM 148 NH2 ARG A 13 5.040 23.335 -6.996 1.00 0.00 N ATOM 0 H ARG A 13 5.788 16.095 -4.725 1.00 0.00 H new ATOM 0 HA ARG A 13 4.098 16.988 -6.943 1.00 0.00 H new ATOM 0 HB2 ARG A 13 7.113 16.957 -6.520 1.00 0.00 H new ATOM 0 HB3 ARG A 13 6.307 17.632 -7.922 1.00 0.00 H new ATOM 0 HG2 ARG A 13 5.739 18.594 -5.101 1.00 0.00 H new ATOM 0 HG3 ARG A 13 7.017 19.274 -6.089 1.00 0.00 H new ATOM 0 HD2 ARG A 13 5.042 19.471 -7.890 1.00 0.00 H new ATOM 0 HD3 ARG A 13 4.037 19.439 -6.455 1.00 0.00 H new ATOM 0 HE ARG A 13 6.002 21.334 -5.874 1.00 0.00 H new ATOM 0 HH11 ARG A 13 3.597 20.828 -8.410 1.00 0.00 H new ATOM 0 HH12 ARG A 13 3.388 22.555 -8.717 1.00 0.00 H new ATOM 0 HH21 ARG A 13 5.728 23.551 -6.274 1.00 0.00 H new ATOM 0 HH22 ARG A 13 4.589 24.090 -7.513 1.00 0.00 H new ATOM 162 N ALA A 14 5.754 14.193 -6.874 1.00 0.00 N ATOM 163 CA ALA A 14 5.981 12.934 -7.572 1.00 0.00 C ATOM 164 C ALA A 14 4.664 12.219 -7.857 1.00 0.00 C ATOM 165 O ALA A 14 3.788 12.141 -6.996 1.00 0.00 O ATOM 166 CB ALA A 14 6.904 12.039 -6.758 1.00 0.00 C ATOM 0 H ALA A 14 6.053 14.195 -5.899 1.00 0.00 H new ATOM 0 HA ALA A 14 6.457 13.157 -8.527 1.00 0.00 H new ATOM 0 HB1 ALA A 14 7.065 11.102 -7.291 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.860 12.541 -6.610 1.00 0.00 H new ATOM 0 HB3 ALA A 14 6.449 11.832 -5.789 1.00 0.00 H new ATOM 172 N LYS A 15 4.530 11.700 -9.073 1.00 0.00 N ATOM 173 CA LYS A 15 3.321 10.990 -9.473 1.00 0.00 C ATOM 174 C LYS A 15 3.580 9.491 -9.584 1.00 0.00 C ATOM 175 O LYS A 15 4.703 9.064 -9.853 1.00 0.00 O ATOM 176 CB LYS A 15 2.808 11.530 -10.810 1.00 0.00 C ATOM 177 CG LYS A 15 1.927 12.760 -10.672 1.00 0.00 C ATOM 178 CD LYS A 15 1.849 13.539 -11.975 1.00 0.00 C ATOM 179 CE LYS A 15 0.546 14.315 -12.082 1.00 0.00 C ATOM 180 NZ LYS A 15 0.604 15.352 -13.150 1.00 0.00 N ATOM 0 H LYS A 15 5.244 11.758 -9.799 1.00 0.00 H new ATOM 0 HA LYS A 15 2.564 11.153 -8.706 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.660 11.773 -11.445 1.00 0.00 H new ATOM 0 HB3 LYS A 15 2.246 10.746 -11.317 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.925 12.459 -10.367 1.00 0.00 H new ATOM 0 HG3 LYS A 15 2.320 13.404 -9.885 1.00 0.00 H new ATOM 0 HD2 LYS A 15 2.691 14.228 -12.039 1.00 0.00 H new ATOM 0 HD3 LYS A 15 1.935 12.852 -12.817 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -0.272 13.625 -12.290 1.00 0.00 H new ATOM 0 HE3 LYS A 15 0.327 14.790 -11.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -0.303 15.859 -13.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 1.368 16.026 -12.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 0.788 14.896 -14.067 1.00 0.00 H new ATOM 194 N VAL A 16 2.535 8.698 -9.376 1.00 0.00 N ATOM 195 CA VAL A 16 2.649 7.246 -9.455 1.00 0.00 C ATOM 196 C VAL A 16 1.442 6.637 -10.159 1.00 0.00 C ATOM 197 O VAL A 16 0.302 6.825 -9.734 1.00 0.00 O ATOM 198 CB VAL A 16 2.785 6.617 -8.056 1.00 0.00 C ATOM 199 CG1 VAL A 16 4.068 7.081 -7.383 1.00 0.00 C ATOM 200 CG2 VAL A 16 1.573 6.954 -7.200 1.00 0.00 C ATOM 0 H VAL A 16 1.599 9.036 -9.151 1.00 0.00 H new ATOM 0 HA VAL A 16 3.549 7.030 -10.031 1.00 0.00 H new ATOM 0 HB VAL A 16 2.833 5.534 -8.168 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.146 6.626 -6.396 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.924 6.784 -7.988 1.00 0.00 H new ATOM 0 HG13 VAL A 16 4.054 8.166 -7.282 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.686 6.501 -6.215 1.00 0.00 H new ATOM 0 HG22 VAL A 16 1.491 8.036 -7.095 1.00 0.00 H new ATOM 0 HG23 VAL A 16 0.672 6.566 -7.676 1.00 0.00 H new ATOM 210 N TYR A 17 1.700 5.906 -11.238 1.00 0.00 N ATOM 211 CA TYR A 17 0.634 5.270 -12.003 1.00 0.00 C ATOM 212 C TYR A 17 1.035 3.861 -12.427 1.00 0.00 C ATOM 213 O TYR A 17 2.165 3.626 -12.854 1.00 0.00 O ATOM 214 CB TYR A 17 0.293 6.109 -13.236 1.00 0.00 C ATOM 215 CG TYR A 17 1.503 6.720 -13.906 1.00 0.00 C ATOM 216 CD1 TYR A 17 2.334 5.955 -14.715 1.00 0.00 C ATOM 217 CD2 TYR A 17 1.814 8.063 -13.732 1.00 0.00 C ATOM 218 CE1 TYR A 17 3.441 6.509 -15.328 1.00 0.00 C ATOM 219 CE2 TYR A 17 2.917 8.626 -14.343 1.00 0.00 C ATOM 220 CZ TYR A 17 3.728 7.845 -15.139 1.00 0.00 C ATOM 221 OH TYR A 17 4.829 8.401 -15.750 1.00 0.00 O ATOM 0 H TYR A 17 2.638 5.739 -11.602 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.247 5.201 -11.364 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -0.234 5.483 -13.957 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.392 6.906 -12.945 1.00 0.00 H new ATOM 0 HD1 TYR A 17 2.111 4.909 -14.867 1.00 0.00 H new ATOM 0 HD2 TYR A 17 1.182 8.677 -13.108 1.00 0.00 H new ATOM 0 HE1 TYR A 17 4.078 5.900 -15.952 1.00 0.00 H new ATOM 0 HE2 TYR A 17 3.143 9.672 -14.198 1.00 0.00 H new ATOM 0 HH TYR A 17 4.889 9.351 -15.516 1.00 0.00 H new ATOM 231 N GLY A 18 0.098 2.925 -12.308 1.00 0.00 N ATOM 232 CA GLY A 18 0.370 1.550 -12.683 1.00 0.00 C ATOM 233 C GLY A 18 -0.760 0.612 -12.310 1.00 0.00 C ATOM 234 O GLY A 18 -1.848 1.056 -11.941 1.00 0.00 O ATOM 0 H GLY A 18 -0.845 3.095 -11.958 1.00 0.00 H new ATOM 0 HA2 GLY A 18 0.542 1.497 -13.758 1.00 0.00 H new ATOM 0 HA3 GLY A 18 1.288 1.219 -12.197 1.00 0.00 H new ATOM 238 N ARG A 19 -0.505 -0.689 -12.407 1.00 0.00 N ATOM 239 CA ARG A 19 -1.511 -1.692 -12.079 1.00 0.00 C ATOM 240 C ARG A 19 -1.238 -2.308 -10.711 1.00 0.00 C ATOM 241 O ARG A 19 -2.128 -2.890 -10.092 1.00 0.00 O ATOM 242 CB ARG A 19 -1.537 -2.786 -13.148 1.00 0.00 C ATOM 243 CG ARG A 19 -2.336 -4.014 -12.742 1.00 0.00 C ATOM 244 CD ARG A 19 -1.463 -5.037 -12.032 1.00 0.00 C ATOM 245 NE ARG A 19 -1.942 -6.402 -12.237 1.00 0.00 N ATOM 246 CZ ARG A 19 -1.710 -7.103 -13.341 1.00 0.00 C ATOM 247 NH1 ARG A 19 -1.010 -6.571 -14.334 1.00 0.00 N ATOM 248 NH2 ARG A 19 -2.178 -8.339 -13.454 1.00 0.00 N ATOM 0 H ARG A 19 0.390 -1.073 -12.710 1.00 0.00 H new ATOM 0 HA ARG A 19 -2.483 -1.200 -12.049 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -1.958 -2.376 -14.066 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -0.514 -3.087 -13.373 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -3.155 -3.716 -12.087 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -2.783 -4.467 -13.627 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -0.439 -4.954 -12.395 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -1.442 -4.817 -10.965 1.00 0.00 H new ATOM 0 HE ARG A 19 -2.484 -6.840 -11.492 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -0.648 -5.621 -14.251 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.834 -7.112 -15.181 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -2.717 -8.752 -12.693 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -1.999 -8.876 -14.302 1.00 0.00 H new ATOM 262 N GLY A 20 0.000 -2.177 -10.244 1.00 0.00 N ATOM 263 CA GLY A 20 0.368 -2.727 -8.952 1.00 0.00 C ATOM 264 C GLY A 20 0.273 -1.703 -7.838 1.00 0.00 C ATOM 265 O GLY A 20 0.958 -1.816 -6.821 1.00 0.00 O ATOM 0 H GLY A 20 0.755 -1.700 -10.737 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.282 -3.571 -8.722 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.386 -3.112 -9.001 1.00 0.00 H new ATOM 269 N LEU A 21 -0.579 -0.701 -8.029 1.00 0.00 N ATOM 270 CA LEU A 21 -0.761 0.348 -7.032 1.00 0.00 C ATOM 271 C LEU A 21 -2.178 0.323 -6.469 1.00 0.00 C ATOM 272 O LEU A 21 -2.401 0.667 -5.308 1.00 0.00 O ATOM 273 CB LEU A 21 -0.468 1.718 -7.646 1.00 0.00 C ATOM 274 CG LEU A 21 0.958 1.935 -8.154 1.00 0.00 C ATOM 275 CD1 LEU A 21 1.072 3.270 -8.873 1.00 0.00 C ATOM 276 CD2 LEU A 21 1.952 1.860 -7.004 1.00 0.00 C ATOM 0 H LEU A 21 -1.154 -0.593 -8.865 1.00 0.00 H new ATOM 0 HA LEU A 21 -0.062 0.165 -6.216 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -1.156 1.876 -8.476 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -0.687 2.482 -6.900 1.00 0.00 H new ATOM 0 HG LEU A 21 1.194 1.142 -8.864 1.00 0.00 H new ATOM 0 HD11 LEU A 21 2.094 3.406 -9.227 1.00 0.00 H new ATOM 0 HD12 LEU A 21 0.389 3.286 -9.722 1.00 0.00 H new ATOM 0 HD13 LEU A 21 0.815 4.076 -8.186 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.961 2.017 -7.385 1.00 0.00 H new ATOM 0 HD22 LEU A 21 1.717 2.630 -6.270 1.00 0.00 H new ATOM 0 HD23 LEU A 21 1.890 0.879 -6.533 1.00 0.00 H new ATOM 288 N SER A 22 -3.132 -0.088 -7.298 1.00 0.00 N ATOM 289 CA SER A 22 -4.528 -0.156 -6.883 1.00 0.00 C ATOM 290 C SER A 22 -4.949 -1.600 -6.627 1.00 0.00 C ATOM 291 O SER A 22 -5.240 -1.981 -5.493 1.00 0.00 O ATOM 292 CB SER A 22 -5.430 0.468 -7.949 1.00 0.00 C ATOM 293 OG SER A 22 -5.578 1.862 -7.740 1.00 0.00 O ATOM 0 H SER A 22 -2.964 -0.379 -8.261 1.00 0.00 H new ATOM 0 HA SER A 22 -4.633 0.405 -5.954 1.00 0.00 H new ATOM 0 HB2 SER A 22 -5.008 0.288 -8.938 1.00 0.00 H new ATOM 0 HB3 SER A 22 -6.408 -0.012 -7.928 1.00 0.00 H new ATOM 0 HG SER A 22 -6.157 2.237 -8.435 1.00 0.00 H new ATOM 299 N GLU A 23 -4.978 -2.399 -7.689 1.00 0.00 N ATOM 300 CA GLU A 23 -5.364 -3.801 -7.579 1.00 0.00 C ATOM 301 C GLU A 23 -4.180 -4.716 -7.881 1.00 0.00 C ATOM 302 O GLU A 23 -3.069 -4.250 -8.131 1.00 0.00 O ATOM 303 CB GLU A 23 -6.518 -4.111 -8.534 1.00 0.00 C ATOM 304 CG GLU A 23 -6.155 -3.952 -10.001 1.00 0.00 C ATOM 305 CD GLU A 23 -5.578 -5.220 -10.599 1.00 0.00 C ATOM 306 OE1 GLU A 23 -4.345 -5.404 -10.523 1.00 0.00 O ATOM 307 OE2 GLU A 23 -6.359 -6.029 -11.144 1.00 0.00 O ATOM 0 H GLU A 23 -4.739 -2.100 -8.634 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.690 -3.983 -6.555 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.857 -5.132 -8.361 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -7.356 -3.454 -8.303 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -7.043 -3.662 -10.562 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -5.432 -3.143 -10.107 1.00 0.00 H new ATOM 314 N GLY A 24 -4.428 -6.022 -7.855 1.00 0.00 N ATOM 315 CA GLY A 24 -3.374 -6.982 -8.126 1.00 0.00 C ATOM 316 C GLY A 24 -3.867 -8.415 -8.072 1.00 0.00 C ATOM 317 O GLY A 24 -5.008 -8.671 -7.689 1.00 0.00 O ATOM 0 H GLY A 24 -5.339 -6.432 -7.651 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.950 -6.784 -9.111 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.571 -6.850 -7.401 1.00 0.00 H new ATOM 321 N ARG A 25 -3.006 -9.350 -8.459 1.00 0.00 N ATOM 322 CA ARG A 25 -3.361 -10.764 -8.456 1.00 0.00 C ATOM 323 C ARG A 25 -2.157 -11.626 -8.089 1.00 0.00 C ATOM 324 O ARG A 25 -1.009 -11.205 -8.237 1.00 0.00 O ATOM 325 CB ARG A 25 -3.901 -11.179 -9.825 1.00 0.00 C ATOM 326 CG ARG A 25 -5.405 -11.012 -9.963 1.00 0.00 C ATOM 327 CD ARG A 25 -5.952 -11.827 -11.125 1.00 0.00 C ATOM 328 NE ARG A 25 -7.367 -12.145 -10.952 1.00 0.00 N ATOM 329 CZ ARG A 25 -8.353 -11.323 -11.293 1.00 0.00 C ATOM 330 NH1 ARG A 25 -8.079 -10.139 -11.824 1.00 0.00 N ATOM 331 NH2 ARG A 25 -9.615 -11.684 -11.105 1.00 0.00 N ATOM 0 H ARG A 25 -2.057 -9.154 -8.779 1.00 0.00 H new ATOM 0 HA ARG A 25 -4.137 -10.916 -7.706 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -3.406 -10.588 -10.596 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -3.642 -12.222 -10.007 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.893 -11.321 -9.039 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -5.643 -9.959 -10.112 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.816 -11.272 -12.053 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -5.382 -12.751 -11.220 1.00 0.00 H new ATOM 0 HE ARG A 25 -7.612 -13.049 -10.547 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -7.110 -9.858 -11.971 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -8.838 -9.509 -12.085 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -9.830 -12.594 -10.698 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -10.371 -11.051 -11.367 1.00 0.00 H new ATOM 345 N THR A 26 -2.426 -12.837 -7.609 1.00 0.00 N ATOM 346 CA THR A 26 -1.366 -13.758 -7.220 1.00 0.00 C ATOM 347 C THR A 26 -0.633 -14.301 -8.441 1.00 0.00 C ATOM 348 O THR A 26 -1.229 -14.489 -9.502 1.00 0.00 O ATOM 349 CB THR A 26 -1.921 -14.939 -6.401 1.00 0.00 C ATOM 350 OG1 THR A 26 -3.122 -15.431 -7.004 1.00 0.00 O ATOM 351 CG2 THR A 26 -2.202 -14.518 -4.966 1.00 0.00 C ATOM 0 H THR A 26 -3.370 -13.202 -7.481 1.00 0.00 H new ATOM 0 HA THR A 26 -0.668 -13.193 -6.603 1.00 0.00 H new ATOM 0 HB THR A 26 -1.171 -15.730 -6.390 1.00 0.00 H new ATOM 0 HG1 THR A 26 -3.380 -16.275 -6.577 1.00 0.00 H new ATOM 0 HG21 THR A 26 -2.593 -15.368 -4.407 1.00 0.00 H new ATOM 0 HG22 THR A 26 -1.279 -14.172 -4.501 1.00 0.00 H new ATOM 0 HG23 THR A 26 -2.936 -13.712 -4.960 1.00 0.00 H new ATOM 359 N PHE A 27 0.662 -14.552 -8.285 1.00 0.00 N ATOM 360 CA PHE A 27 1.477 -15.073 -9.376 1.00 0.00 C ATOM 361 C PHE A 27 1.392 -14.166 -10.600 1.00 0.00 C ATOM 362 O PHE A 27 1.574 -14.615 -11.731 1.00 0.00 O ATOM 363 CB PHE A 27 1.028 -16.489 -9.744 1.00 0.00 C ATOM 364 CG PHE A 27 1.510 -17.539 -8.785 1.00 0.00 C ATOM 365 CD1 PHE A 27 1.351 -17.373 -7.418 1.00 0.00 C ATOM 366 CD2 PHE A 27 2.121 -18.693 -9.249 1.00 0.00 C ATOM 367 CE1 PHE A 27 1.793 -18.338 -6.532 1.00 0.00 C ATOM 368 CE2 PHE A 27 2.564 -19.661 -8.368 1.00 0.00 C ATOM 369 CZ PHE A 27 2.401 -19.483 -7.008 1.00 0.00 C ATOM 0 H PHE A 27 1.170 -14.403 -7.413 1.00 0.00 H new ATOM 0 HA PHE A 27 2.513 -15.103 -9.040 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -0.061 -16.517 -9.784 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.390 -16.728 -10.744 1.00 0.00 H new ATOM 0 HD1 PHE A 27 0.876 -16.479 -7.041 1.00 0.00 H new ATOM 0 HD2 PHE A 27 2.252 -18.837 -10.311 1.00 0.00 H new ATOM 0 HE1 PHE A 27 1.663 -18.197 -5.469 1.00 0.00 H new ATOM 0 HE2 PHE A 27 3.038 -20.556 -8.743 1.00 0.00 H new ATOM 0 HZ PHE A 27 2.748 -20.238 -6.318 1.00 0.00 H new ATOM 379 N GLU A 28 1.114 -12.888 -10.363 1.00 0.00 N ATOM 380 CA GLU A 28 1.004 -11.918 -11.446 1.00 0.00 C ATOM 381 C GLU A 28 1.952 -10.743 -11.224 1.00 0.00 C ATOM 382 O GLU A 28 1.808 -9.990 -10.261 1.00 0.00 O ATOM 383 CB GLU A 28 -0.435 -11.411 -11.562 1.00 0.00 C ATOM 384 CG GLU A 28 -1.304 -12.250 -12.484 1.00 0.00 C ATOM 385 CD GLU A 28 -1.680 -13.587 -11.875 1.00 0.00 C ATOM 386 OE1 GLU A 28 -0.823 -14.495 -11.865 1.00 0.00 O ATOM 387 OE2 GLU A 28 -2.830 -13.724 -11.409 1.00 0.00 O ATOM 0 H GLU A 28 0.961 -12.501 -9.432 1.00 0.00 H new ATOM 0 HA GLU A 28 1.283 -12.416 -12.375 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.886 -11.392 -10.570 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -0.421 -10.383 -11.925 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -2.212 -11.697 -12.725 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -0.775 -12.418 -13.422 1.00 0.00 H new ATOM 394 N MET A 29 2.921 -10.594 -12.121 1.00 0.00 N ATOM 395 CA MET A 29 3.893 -9.511 -12.023 1.00 0.00 C ATOM 396 C MET A 29 3.200 -8.153 -12.074 1.00 0.00 C ATOM 397 O MET A 29 2.731 -7.725 -13.128 1.00 0.00 O ATOM 398 CB MET A 29 4.921 -9.616 -13.151 1.00 0.00 C ATOM 399 CG MET A 29 6.273 -9.017 -12.799 1.00 0.00 C ATOM 400 SD MET A 29 7.348 -10.185 -11.944 1.00 0.00 S ATOM 401 CE MET A 29 8.271 -9.079 -10.880 1.00 0.00 C ATOM 0 H MET A 29 3.054 -11.209 -12.924 1.00 0.00 H new ATOM 0 HA MET A 29 4.406 -9.601 -11.065 1.00 0.00 H new ATOM 0 HB2 MET A 29 5.055 -10.666 -13.413 1.00 0.00 H new ATOM 0 HB3 MET A 29 4.530 -9.114 -14.036 1.00 0.00 H new ATOM 0 HG2 MET A 29 6.764 -8.677 -13.711 1.00 0.00 H new ATOM 0 HG3 MET A 29 6.125 -8.139 -12.171 1.00 0.00 H new ATOM 0 HE1 MET A 29 8.479 -9.575 -9.932 1.00 0.00 H new ATOM 0 HE2 MET A 29 9.210 -8.809 -11.363 1.00 0.00 H new ATOM 0 HE3 MET A 29 7.686 -8.178 -10.697 1.00 0.00 H new ATOM 411 N SER A 30 3.141 -7.481 -10.929 1.00 0.00 N ATOM 412 CA SER A 30 2.502 -6.173 -10.844 1.00 0.00 C ATOM 413 C SER A 30 3.543 -5.068 -10.695 1.00 0.00 C ATOM 414 O SER A 30 4.169 -4.927 -9.645 1.00 0.00 O ATOM 415 CB SER A 30 1.528 -6.134 -9.664 1.00 0.00 C ATOM 416 OG SER A 30 0.293 -6.741 -10.001 1.00 0.00 O ATOM 0 H SER A 30 3.527 -7.820 -10.048 1.00 0.00 H new ATOM 0 HA SER A 30 1.950 -6.005 -11.768 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.967 -6.647 -8.809 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.358 -5.100 -9.363 1.00 0.00 H new ATOM 0 HG SER A 30 -0.311 -6.705 -9.230 1.00 0.00 H new ATOM 422 N ASP A 31 3.723 -4.287 -11.755 1.00 0.00 N ATOM 423 CA ASP A 31 4.687 -3.193 -11.744 1.00 0.00 C ATOM 424 C ASP A 31 3.996 -1.856 -11.992 1.00 0.00 C ATOM 425 O ASP A 31 2.858 -1.812 -12.458 1.00 0.00 O ATOM 426 CB ASP A 31 5.767 -3.427 -12.801 1.00 0.00 C ATOM 427 CG ASP A 31 6.053 -4.899 -13.022 1.00 0.00 C ATOM 428 OD1 ASP A 31 5.962 -5.674 -12.047 1.00 0.00 O ATOM 429 OD2 ASP A 31 6.367 -5.278 -14.170 1.00 0.00 O ATOM 0 H ASP A 31 3.214 -4.391 -12.633 1.00 0.00 H new ATOM 0 HA ASP A 31 5.153 -3.162 -10.759 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.453 -2.976 -13.742 1.00 0.00 H new ATOM 0 HB3 ASP A 31 6.684 -2.924 -12.496 1.00 0.00 H new ATOM 434 N PHE A 32 4.691 -0.769 -11.675 1.00 0.00 N ATOM 435 CA PHE A 32 4.143 0.570 -11.862 1.00 0.00 C ATOM 436 C PHE A 32 5.258 1.588 -12.083 1.00 0.00 C ATOM 437 O PHE A 32 6.413 1.346 -11.729 1.00 0.00 O ATOM 438 CB PHE A 32 3.302 0.973 -10.649 1.00 0.00 C ATOM 439 CG PHE A 32 4.045 0.880 -9.347 1.00 0.00 C ATOM 440 CD1 PHE A 32 4.046 -0.298 -8.617 1.00 0.00 C ATOM 441 CD2 PHE A 32 4.742 1.971 -8.852 1.00 0.00 C ATOM 442 CE1 PHE A 32 4.728 -0.387 -7.418 1.00 0.00 C ATOM 443 CE2 PHE A 32 5.427 1.887 -7.654 1.00 0.00 C ATOM 444 CZ PHE A 32 5.419 0.708 -6.936 1.00 0.00 C ATOM 0 H PHE A 32 5.634 -0.788 -11.288 1.00 0.00 H new ATOM 0 HA PHE A 32 3.508 0.556 -12.748 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.950 1.995 -10.785 1.00 0.00 H new ATOM 0 HB3 PHE A 32 2.419 0.335 -10.601 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.507 -1.157 -8.989 1.00 0.00 H new ATOM 0 HD2 PHE A 32 4.750 2.897 -9.408 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.721 -1.311 -6.859 1.00 0.00 H new ATOM 0 HE2 PHE A 32 5.968 2.744 -7.280 1.00 0.00 H new ATOM 0 HZ PHE A 32 5.952 0.642 -5.999 1.00 0.00 H new ATOM 454 N ILE A 33 4.904 2.725 -12.670 1.00 0.00 N ATOM 455 CA ILE A 33 5.874 3.780 -12.938 1.00 0.00 C ATOM 456 C ILE A 33 5.819 4.863 -11.865 1.00 0.00 C ATOM 457 O ILE A 33 4.764 5.129 -11.290 1.00 0.00 O ATOM 458 CB ILE A 33 5.637 4.426 -14.316 1.00 0.00 C ATOM 459 CG1 ILE A 33 6.222 3.547 -15.423 1.00 0.00 C ATOM 460 CG2 ILE A 33 6.247 5.819 -14.360 1.00 0.00 C ATOM 461 CD1 ILE A 33 7.707 3.301 -15.278 1.00 0.00 C ATOM 0 H ILE A 33 3.953 2.940 -12.969 1.00 0.00 H new ATOM 0 HA ILE A 33 6.859 3.313 -12.929 1.00 0.00 H new ATOM 0 HB ILE A 33 4.563 4.516 -14.479 1.00 0.00 H new ATOM 0 HG12 ILE A 33 5.702 2.589 -15.428 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.032 4.018 -16.388 1.00 0.00 H new ATOM 0 HG21 ILE A 33 6.071 6.262 -15.340 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.788 6.442 -13.592 1.00 0.00 H new ATOM 0 HG23 ILE A 33 7.320 5.752 -14.179 1.00 0.00 H new ATOM 0 HD11 ILE A 33 8.053 2.671 -16.097 1.00 0.00 H new ATOM 0 HD12 ILE A 33 8.238 4.253 -15.303 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.902 2.802 -14.329 1.00 0.00 H new ATOM 473 N VAL A 34 6.963 5.486 -11.602 1.00 0.00 N ATOM 474 CA VAL A 34 7.046 6.542 -10.601 1.00 0.00 C ATOM 475 C VAL A 34 7.614 7.824 -11.199 1.00 0.00 C ATOM 476 O VAL A 34 8.824 7.950 -11.389 1.00 0.00 O ATOM 477 CB VAL A 34 7.919 6.116 -9.406 1.00 0.00 C ATOM 478 CG1 VAL A 34 8.223 7.309 -8.513 1.00 0.00 C ATOM 479 CG2 VAL A 34 7.237 5.009 -8.616 1.00 0.00 C ATOM 0 H VAL A 34 7.846 5.277 -12.069 1.00 0.00 H new ATOM 0 HA VAL A 34 6.030 6.726 -10.252 1.00 0.00 H new ATOM 0 HB VAL A 34 8.864 5.730 -9.789 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.841 6.988 -7.674 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.756 8.067 -9.087 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.290 7.729 -8.137 1.00 0.00 H new ATOM 0 HG21 VAL A 34 7.868 4.720 -7.775 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.277 5.366 -8.243 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.077 4.146 -9.263 1.00 0.00 H new ATOM 489 N ASP A 35 6.733 8.773 -11.495 1.00 0.00 N ATOM 490 CA ASP A 35 7.147 10.047 -12.071 1.00 0.00 C ATOM 491 C ASP A 35 7.771 10.947 -11.009 1.00 0.00 C ATOM 492 O ASP A 35 7.095 11.390 -10.080 1.00 0.00 O ATOM 493 CB ASP A 35 5.952 10.751 -12.716 1.00 0.00 C ATOM 494 CG ASP A 35 6.107 12.259 -12.730 1.00 0.00 C ATOM 495 OD1 ASP A 35 6.802 12.777 -13.629 1.00 0.00 O ATOM 496 OD2 ASP A 35 5.532 12.922 -11.842 1.00 0.00 O ATOM 0 H ASP A 35 5.728 8.684 -11.346 1.00 0.00 H new ATOM 0 HA ASP A 35 7.897 9.845 -12.836 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.831 10.392 -13.738 1.00 0.00 H new ATOM 0 HB3 ASP A 35 5.043 10.487 -12.175 1.00 0.00 H new ATOM 501 N THR A 36 9.065 11.213 -11.152 1.00 0.00 N ATOM 502 CA THR A 36 9.781 12.058 -10.205 1.00 0.00 C ATOM 503 C THR A 36 10.394 13.268 -10.900 1.00 0.00 C ATOM 504 O THR A 36 11.359 13.854 -10.411 1.00 0.00 O ATOM 505 CB THR A 36 10.896 11.275 -9.485 1.00 0.00 C ATOM 506 OG1 THR A 36 11.646 10.507 -10.433 1.00 0.00 O ATOM 507 CG2 THR A 36 10.312 10.353 -8.426 1.00 0.00 C ATOM 0 H THR A 36 9.639 10.855 -11.915 1.00 0.00 H new ATOM 0 HA THR A 36 9.051 12.396 -9.470 1.00 0.00 H new ATOM 0 HB THR A 36 11.556 11.992 -8.996 1.00 0.00 H new ATOM 0 HG1 THR A 36 11.594 10.933 -11.314 1.00 0.00 H new ATOM 0 HG21 THR A 36 11.118 9.811 -7.931 1.00 0.00 H new ATOM 0 HG22 THR A 36 9.767 10.944 -7.690 1.00 0.00 H new ATOM 0 HG23 THR A 36 9.632 9.643 -8.897 1.00 0.00 H new ATOM 515 N ARG A 37 9.825 13.638 -12.043 1.00 0.00 N ATOM 516 CA ARG A 37 10.316 14.779 -12.806 1.00 0.00 C ATOM 517 C ARG A 37 9.799 16.089 -12.219 1.00 0.00 C ATOM 518 O ARG A 37 10.540 17.066 -12.106 1.00 0.00 O ATOM 519 CB ARG A 37 9.891 14.661 -14.271 1.00 0.00 C ATOM 520 CG ARG A 37 10.203 13.307 -14.889 1.00 0.00 C ATOM 521 CD ARG A 37 9.236 12.972 -16.014 1.00 0.00 C ATOM 522 NE ARG A 37 9.104 11.531 -16.211 1.00 0.00 N ATOM 523 CZ ARG A 37 8.139 10.974 -16.932 1.00 0.00 C ATOM 524 NH1 ARG A 37 7.225 11.732 -17.522 1.00 0.00 N ATOM 525 NH2 ARG A 37 8.085 9.655 -17.065 1.00 0.00 N ATOM 0 H ARG A 37 9.024 13.164 -12.461 1.00 0.00 H new ATOM 0 HA ARG A 37 11.405 14.780 -12.750 1.00 0.00 H new ATOM 0 HB2 ARG A 37 8.820 14.847 -14.346 1.00 0.00 H new ATOM 0 HB3 ARG A 37 10.390 15.439 -14.849 1.00 0.00 H new ATOM 0 HG2 ARG A 37 11.223 13.307 -15.273 1.00 0.00 H new ATOM 0 HG3 ARG A 37 10.151 12.535 -14.121 1.00 0.00 H new ATOM 0 HD2 ARG A 37 8.258 13.398 -15.790 1.00 0.00 H new ATOM 0 HD3 ARG A 37 9.581 13.434 -16.939 1.00 0.00 H new ATOM 0 HE ARG A 37 9.791 10.919 -15.770 1.00 0.00 H new ATOM 0 HH11 ARG A 37 7.262 12.746 -17.422 1.00 0.00 H new ATOM 0 HH12 ARG A 37 6.485 11.301 -18.075 1.00 0.00 H new ATOM 0 HH21 ARG A 37 8.786 9.068 -16.613 1.00 0.00 H new ATOM 0 HH22 ARG A 37 7.343 9.228 -17.619 1.00 0.00 H new ATOM 539 N ASP A 38 8.523 16.102 -11.849 1.00 0.00 N ATOM 540 CA ASP A 38 7.906 17.291 -11.273 1.00 0.00 C ATOM 541 C ASP A 38 8.319 17.465 -9.815 1.00 0.00 C ATOM 542 O ASP A 38 8.006 18.477 -9.188 1.00 0.00 O ATOM 543 CB ASP A 38 6.383 17.203 -11.378 1.00 0.00 C ATOM 544 CG ASP A 38 5.861 17.748 -12.693 1.00 0.00 C ATOM 545 OD1 ASP A 38 6.547 18.599 -13.297 1.00 0.00 O ATOM 546 OD2 ASP A 38 4.767 17.322 -13.118 1.00 0.00 O ATOM 0 H ASP A 38 7.896 15.302 -11.938 1.00 0.00 H new ATOM 0 HA ASP A 38 8.251 18.158 -11.836 1.00 0.00 H new ATOM 0 HB2 ASP A 38 6.074 16.163 -11.271 1.00 0.00 H new ATOM 0 HB3 ASP A 38 5.932 17.756 -10.554 1.00 0.00 H new ATOM 551 N ALA A 39 9.022 16.471 -9.281 1.00 0.00 N ATOM 552 CA ALA A 39 9.477 16.515 -7.897 1.00 0.00 C ATOM 553 C ALA A 39 10.948 16.912 -7.816 1.00 0.00 C ATOM 554 O ALA A 39 11.313 17.831 -7.084 1.00 0.00 O ATOM 555 CB ALA A 39 9.254 15.169 -7.225 1.00 0.00 C ATOM 0 H ALA A 39 9.289 15.626 -9.786 1.00 0.00 H new ATOM 0 HA ALA A 39 8.894 17.271 -7.372 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.598 15.217 -6.192 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.192 14.925 -7.242 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.812 14.399 -7.758 1.00 0.00 H new ATOM 561 N GLY A 40 11.787 16.212 -8.573 1.00 0.00 N ATOM 562 CA GLY A 40 13.209 16.506 -8.570 1.00 0.00 C ATOM 563 C GLY A 40 14.045 15.321 -8.130 1.00 0.00 C ATOM 564 O GLY A 40 14.044 14.276 -8.780 1.00 0.00 O ATOM 0 H GLY A 40 11.508 15.447 -9.188 1.00 0.00 H new ATOM 0 HA2 GLY A 40 13.516 16.812 -9.570 1.00 0.00 H new ATOM 0 HA3 GLY A 40 13.401 17.349 -7.906 1.00 0.00 H new ATOM 568 N TYR A 41 14.762 15.484 -7.023 1.00 0.00 N ATOM 569 CA TYR A 41 15.610 14.421 -6.499 1.00 0.00 C ATOM 570 C TYR A 41 15.135 13.975 -5.119 1.00 0.00 C ATOM 571 O TYR A 41 14.279 14.614 -4.509 1.00 0.00 O ATOM 572 CB TYR A 41 17.064 14.890 -6.422 1.00 0.00 C ATOM 573 CG TYR A 41 18.070 13.771 -6.564 1.00 0.00 C ATOM 574 CD1 TYR A 41 18.005 12.883 -7.631 1.00 0.00 C ATOM 575 CD2 TYR A 41 19.086 13.600 -5.631 1.00 0.00 C ATOM 576 CE1 TYR A 41 18.922 11.858 -7.765 1.00 0.00 C ATOM 577 CE2 TYR A 41 20.007 12.579 -5.758 1.00 0.00 C ATOM 578 CZ TYR A 41 19.921 11.711 -6.826 1.00 0.00 C ATOM 579 OH TYR A 41 20.837 10.691 -6.955 1.00 0.00 O ATOM 0 H TYR A 41 14.772 16.342 -6.472 1.00 0.00 H new ATOM 0 HA TYR A 41 15.544 13.571 -7.179 1.00 0.00 H new ATOM 0 HB2 TYR A 41 17.241 15.628 -7.205 1.00 0.00 H new ATOM 0 HB3 TYR A 41 17.225 15.393 -5.468 1.00 0.00 H new ATOM 0 HD1 TYR A 41 17.224 12.996 -8.368 1.00 0.00 H new ATOM 0 HD2 TYR A 41 19.156 14.277 -4.793 1.00 0.00 H new ATOM 0 HE1 TYR A 41 18.857 11.176 -8.600 1.00 0.00 H new ATOM 0 HE2 TYR A 41 20.791 12.461 -5.024 1.00 0.00 H new ATOM 0 HH TYR A 41 21.475 10.728 -6.212 1.00 0.00 H new ATOM 589 N GLY A 42 15.698 12.873 -4.634 1.00 0.00 N ATOM 590 CA GLY A 42 15.321 12.360 -3.330 1.00 0.00 C ATOM 591 C GLY A 42 15.361 10.846 -3.269 1.00 0.00 C ATOM 592 O GLY A 42 14.873 10.168 -4.172 1.00 0.00 O ATOM 0 H GLY A 42 16.408 12.326 -5.121 1.00 0.00 H new ATOM 0 HA2 GLY A 42 15.992 12.769 -2.574 1.00 0.00 H new ATOM 0 HA3 GLY A 42 14.316 12.704 -3.084 1.00 0.00 H new ATOM 596 N GLY A 43 15.947 10.313 -2.201 1.00 0.00 N ATOM 597 CA GLY A 43 16.040 8.873 -2.047 1.00 0.00 C ATOM 598 C GLY A 43 14.681 8.215 -1.915 1.00 0.00 C ATOM 599 O GLY A 43 13.919 8.528 -1.000 1.00 0.00 O ATOM 0 H GLY A 43 16.359 10.853 -1.440 1.00 0.00 H new ATOM 0 HA2 GLY A 43 16.562 8.452 -2.906 1.00 0.00 H new ATOM 0 HA3 GLY A 43 16.639 8.643 -1.166 1.00 0.00 H new ATOM 603 N ILE A 44 14.376 7.302 -2.831 1.00 0.00 N ATOM 604 CA ILE A 44 13.100 6.599 -2.813 1.00 0.00 C ATOM 605 C ILE A 44 13.155 5.383 -1.894 1.00 0.00 C ATOM 606 O ILE A 44 14.055 4.551 -2.002 1.00 0.00 O ATOM 607 CB ILE A 44 12.687 6.143 -4.225 1.00 0.00 C ATOM 608 CG1 ILE A 44 12.565 7.349 -5.158 1.00 0.00 C ATOM 609 CG2 ILE A 44 11.376 5.373 -4.171 1.00 0.00 C ATOM 610 CD1 ILE A 44 12.470 6.974 -6.621 1.00 0.00 C ATOM 0 H ILE A 44 14.996 7.032 -3.595 1.00 0.00 H new ATOM 0 HA ILE A 44 12.358 7.303 -2.437 1.00 0.00 H new ATOM 0 HB ILE A 44 13.458 5.480 -4.617 1.00 0.00 H new ATOM 0 HG12 ILE A 44 11.682 7.925 -4.881 1.00 0.00 H new ATOM 0 HG13 ILE A 44 13.428 7.999 -5.013 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.098 5.058 -5.177 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.495 4.496 -3.535 1.00 0.00 H new ATOM 0 HG23 ILE A 44 10.594 6.013 -3.762 1.00 0.00 H new ATOM 0 HD11 ILE A 44 12.386 7.878 -7.224 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.364 6.424 -6.914 1.00 0.00 H new ATOM 0 HD13 ILE A 44 11.591 6.349 -6.780 1.00 0.00 H new ATOM 622 N SER A 45 12.184 5.286 -0.991 1.00 0.00 N ATOM 623 CA SER A 45 12.123 4.173 -0.051 1.00 0.00 C ATOM 624 C SER A 45 10.886 3.316 -0.304 1.00 0.00 C ATOM 625 O SER A 45 9.759 3.739 -0.045 1.00 0.00 O ATOM 626 CB SER A 45 12.111 4.692 1.388 1.00 0.00 C ATOM 627 OG SER A 45 13.428 4.813 1.896 1.00 0.00 O ATOM 0 H SER A 45 11.429 5.965 -0.891 1.00 0.00 H new ATOM 0 HA SER A 45 13.009 3.556 -0.200 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.613 5.661 1.425 1.00 0.00 H new ATOM 0 HB3 SER A 45 11.535 4.014 2.018 1.00 0.00 H new ATOM 0 HG SER A 45 13.394 5.148 2.816 1.00 0.00 H new ATOM 633 N LEU A 46 11.105 2.108 -0.813 1.00 0.00 N ATOM 634 CA LEU A 46 10.009 1.190 -1.102 1.00 0.00 C ATOM 635 C LEU A 46 10.004 0.023 -0.120 1.00 0.00 C ATOM 636 O LEU A 46 11.050 -0.548 0.187 1.00 0.00 O ATOM 637 CB LEU A 46 10.122 0.665 -2.535 1.00 0.00 C ATOM 638 CG LEU A 46 10.242 1.725 -3.630 1.00 0.00 C ATOM 639 CD1 LEU A 46 11.042 1.188 -4.807 1.00 0.00 C ATOM 640 CD2 LEU A 46 8.864 2.183 -4.084 1.00 0.00 C ATOM 0 H LEU A 46 12.031 1.742 -1.034 1.00 0.00 H new ATOM 0 HA LEU A 46 9.072 1.736 -0.994 1.00 0.00 H new ATOM 0 HB2 LEU A 46 10.992 0.011 -2.594 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.246 0.051 -2.746 1.00 0.00 H new ATOM 0 HG LEU A 46 10.771 2.585 -3.219 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.117 1.956 -5.577 1.00 0.00 H new ATOM 0 HD12 LEU A 46 12.042 0.911 -4.472 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.541 0.311 -5.217 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.970 2.937 -4.864 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.308 1.331 -4.476 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.325 2.609 -3.238 1.00 0.00 H new ATOM 652 N ALA A 47 8.818 -0.329 0.367 1.00 0.00 N ATOM 653 CA ALA A 47 8.676 -1.431 1.310 1.00 0.00 C ATOM 654 C ALA A 47 7.282 -2.045 1.231 1.00 0.00 C ATOM 655 O ALA A 47 6.296 -1.424 1.629 1.00 0.00 O ATOM 656 CB ALA A 47 8.965 -0.954 2.726 1.00 0.00 C ATOM 0 H ALA A 47 7.942 0.133 0.124 1.00 0.00 H new ATOM 0 HA ALA A 47 9.399 -2.201 1.043 1.00 0.00 H new ATOM 0 HB1 ALA A 47 8.855 -1.787 3.420 1.00 0.00 H new ATOM 0 HB2 ALA A 47 9.983 -0.569 2.779 1.00 0.00 H new ATOM 0 HB3 ALA A 47 8.264 -0.164 2.994 1.00 0.00 H new ATOM 662 N VAL A 48 7.207 -3.267 0.714 1.00 0.00 N ATOM 663 CA VAL A 48 5.934 -3.965 0.583 1.00 0.00 C ATOM 664 C VAL A 48 5.674 -4.864 1.786 1.00 0.00 C ATOM 665 O VAL A 48 6.510 -5.690 2.148 1.00 0.00 O ATOM 666 CB VAL A 48 5.891 -4.818 -0.700 1.00 0.00 C ATOM 667 CG1 VAL A 48 4.649 -5.695 -0.716 1.00 0.00 C ATOM 668 CG2 VAL A 48 5.942 -3.928 -1.932 1.00 0.00 C ATOM 0 H VAL A 48 8.013 -3.794 0.379 1.00 0.00 H new ATOM 0 HA VAL A 48 5.158 -3.201 0.529 1.00 0.00 H new ATOM 0 HB VAL A 48 6.766 -5.469 -0.714 1.00 0.00 H new ATOM 0 HG11 VAL A 48 4.636 -6.290 -1.629 1.00 0.00 H new ATOM 0 HG12 VAL A 48 4.661 -6.358 0.149 1.00 0.00 H new ATOM 0 HG13 VAL A 48 3.759 -5.066 -0.679 1.00 0.00 H new ATOM 0 HG21 VAL A 48 5.911 -4.546 -2.829 1.00 0.00 H new ATOM 0 HG22 VAL A 48 5.087 -3.251 -1.928 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.864 -3.347 -1.923 1.00 0.00 H new ATOM 678 N GLU A 49 4.507 -4.696 2.402 1.00 0.00 N ATOM 679 CA GLU A 49 4.137 -5.492 3.566 1.00 0.00 C ATOM 680 C GLU A 49 2.834 -6.246 3.317 1.00 0.00 C ATOM 681 O GLU A 49 1.749 -5.669 3.380 1.00 0.00 O ATOM 682 CB GLU A 49 3.995 -4.598 4.799 1.00 0.00 C ATOM 683 CG GLU A 49 5.311 -4.329 5.510 1.00 0.00 C ATOM 684 CD GLU A 49 5.672 -5.417 6.502 1.00 0.00 C ATOM 685 OE1 GLU A 49 4.913 -5.611 7.474 1.00 0.00 O ATOM 686 OE2 GLU A 49 6.715 -6.076 6.305 1.00 0.00 O ATOM 0 H GLU A 49 3.803 -4.016 2.114 1.00 0.00 H new ATOM 0 HA GLU A 49 4.929 -6.219 3.744 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.553 -3.648 4.500 1.00 0.00 H new ATOM 0 HB3 GLU A 49 3.302 -5.066 5.499 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.107 -4.238 4.771 1.00 0.00 H new ATOM 0 HG3 GLU A 49 5.249 -3.374 6.031 1.00 0.00 H new ATOM 693 N GLY A 50 2.949 -7.540 3.034 1.00 0.00 N ATOM 694 CA GLY A 50 1.773 -8.351 2.779 1.00 0.00 C ATOM 695 C GLY A 50 1.771 -9.637 3.582 1.00 0.00 C ATOM 696 O GLY A 50 2.514 -9.789 4.552 1.00 0.00 O ATOM 0 H GLY A 50 3.836 -8.041 2.977 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.879 -7.775 3.019 1.00 0.00 H new ATOM 0 HA3 GLY A 50 1.723 -8.589 1.717 1.00 0.00 H new ATOM 700 N PRO A 51 0.918 -10.590 3.178 1.00 0.00 N ATOM 701 CA PRO A 51 0.801 -11.885 3.854 1.00 0.00 C ATOM 702 C PRO A 51 2.031 -12.761 3.646 1.00 0.00 C ATOM 703 O PRO A 51 2.153 -13.829 4.246 1.00 0.00 O ATOM 704 CB PRO A 51 -0.426 -12.520 3.194 1.00 0.00 C ATOM 705 CG PRO A 51 -0.507 -11.880 1.851 1.00 0.00 C ATOM 706 CD PRO A 51 0.003 -10.476 2.030 1.00 0.00 C ATOM 0 HA PRO A 51 0.711 -11.774 4.935 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -0.316 -13.601 3.111 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -1.329 -12.335 3.776 1.00 0.00 H new ATOM 0 HG2 PRO A 51 0.094 -12.424 1.123 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -1.532 -11.879 1.480 1.00 0.00 H new ATOM 0 HD2 PRO A 51 0.519 -10.119 1.139 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -0.808 -9.776 2.230 1.00 0.00 H new ATOM 714 N SER A 52 2.941 -12.302 2.793 1.00 0.00 N ATOM 715 CA SER A 52 4.162 -13.046 2.504 1.00 0.00 C ATOM 716 C SER A 52 5.227 -12.131 1.907 1.00 0.00 C ATOM 717 O SER A 52 4.986 -10.947 1.674 1.00 0.00 O ATOM 718 CB SER A 52 3.866 -14.199 1.542 1.00 0.00 C ATOM 719 OG SER A 52 3.529 -15.379 2.250 1.00 0.00 O ATOM 0 H SER A 52 2.856 -11.419 2.290 1.00 0.00 H new ATOM 0 HA SER A 52 4.541 -13.453 3.442 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.046 -13.922 0.879 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.736 -14.385 0.913 1.00 0.00 H new ATOM 0 HG SER A 52 3.027 -15.144 3.058 1.00 0.00 H new ATOM 725 N LYS A 53 6.407 -12.690 1.662 1.00 0.00 N ATOM 726 CA LYS A 53 7.511 -11.928 1.090 1.00 0.00 C ATOM 727 C LYS A 53 7.371 -11.819 -0.425 1.00 0.00 C ATOM 728 O LYS A 53 7.002 -12.783 -1.095 1.00 0.00 O ATOM 729 CB LYS A 53 8.848 -12.584 1.444 1.00 0.00 C ATOM 730 CG LYS A 53 10.030 -11.633 1.371 1.00 0.00 C ATOM 731 CD LYS A 53 10.595 -11.552 -0.037 1.00 0.00 C ATOM 732 CE LYS A 53 11.429 -12.778 -0.374 1.00 0.00 C ATOM 733 NZ LYS A 53 12.684 -12.832 0.426 1.00 0.00 N ATOM 0 H LYS A 53 6.624 -13.669 1.851 1.00 0.00 H new ATOM 0 HA LYS A 53 7.483 -10.923 1.512 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.786 -12.996 2.451 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.023 -13.421 0.768 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.720 -10.640 1.697 1.00 0.00 H new ATOM 0 HG3 LYS A 53 10.808 -11.965 2.058 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.779 -11.458 -0.753 1.00 0.00 H new ATOM 0 HD3 LYS A 53 11.208 -10.656 -0.133 1.00 0.00 H new ATOM 0 HE2 LYS A 53 10.842 -13.678 -0.190 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.675 -12.769 -1.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.363 -13.471 -0.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 13.095 -11.879 0.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.472 -13.184 1.381 1.00 0.00 H new ATOM 747 N VAL A 54 7.670 -10.639 -0.959 1.00 0.00 N ATOM 748 CA VAL A 54 7.580 -10.406 -2.395 1.00 0.00 C ATOM 749 C VAL A 54 8.816 -9.679 -2.913 1.00 0.00 C ATOM 750 O VAL A 54 9.215 -8.648 -2.372 1.00 0.00 O ATOM 751 CB VAL A 54 6.328 -9.583 -2.753 1.00 0.00 C ATOM 752 CG1 VAL A 54 5.117 -10.491 -2.904 1.00 0.00 C ATOM 753 CG2 VAL A 54 6.075 -8.514 -1.700 1.00 0.00 C ATOM 0 H VAL A 54 7.977 -9.830 -0.419 1.00 0.00 H new ATOM 0 HA VAL A 54 7.511 -11.385 -2.870 1.00 0.00 H new ATOM 0 HB VAL A 54 6.501 -9.087 -3.708 1.00 0.00 H new ATOM 0 HG11 VAL A 54 4.242 -9.892 -3.157 1.00 0.00 H new ATOM 0 HG12 VAL A 54 5.302 -11.216 -3.697 1.00 0.00 H new ATOM 0 HG13 VAL A 54 4.938 -11.017 -1.966 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.187 -7.942 -1.968 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.922 -8.988 -0.730 1.00 0.00 H new ATOM 0 HG23 VAL A 54 6.934 -7.846 -1.646 1.00 0.00 H new ATOM 763 N ASP A 55 9.419 -10.224 -3.964 1.00 0.00 N ATOM 764 CA ASP A 55 10.610 -9.628 -4.556 1.00 0.00 C ATOM 765 C ASP A 55 10.311 -8.230 -5.089 1.00 0.00 C ATOM 766 O ASP A 55 9.174 -7.923 -5.449 1.00 0.00 O ATOM 767 CB ASP A 55 11.143 -10.513 -5.684 1.00 0.00 C ATOM 768 CG ASP A 55 11.679 -11.837 -5.176 1.00 0.00 C ATOM 769 OD1 ASP A 55 12.213 -11.868 -4.047 1.00 0.00 O ATOM 770 OD2 ASP A 55 11.565 -12.843 -5.907 1.00 0.00 O ATOM 0 H ASP A 55 9.102 -11.078 -4.423 1.00 0.00 H new ATOM 0 HA ASP A 55 11.369 -9.547 -3.778 1.00 0.00 H new ATOM 0 HB2 ASP A 55 10.346 -10.699 -6.404 1.00 0.00 H new ATOM 0 HB3 ASP A 55 11.934 -9.983 -6.215 1.00 0.00 H new ATOM 775 N ILE A 56 11.337 -7.387 -5.134 1.00 0.00 N ATOM 776 CA ILE A 56 11.183 -6.022 -5.622 1.00 0.00 C ATOM 777 C ILE A 56 12.327 -5.639 -6.554 1.00 0.00 C ATOM 778 O ILE A 56 13.481 -5.555 -6.133 1.00 0.00 O ATOM 779 CB ILE A 56 11.121 -5.012 -4.461 1.00 0.00 C ATOM 780 CG1 ILE A 56 9.961 -5.351 -3.522 1.00 0.00 C ATOM 781 CG2 ILE A 56 10.979 -3.596 -4.997 1.00 0.00 C ATOM 782 CD1 ILE A 56 9.670 -4.269 -2.506 1.00 0.00 C ATOM 0 H ILE A 56 12.284 -7.625 -4.838 1.00 0.00 H new ATOM 0 HA ILE A 56 10.243 -5.988 -6.172 1.00 0.00 H new ATOM 0 HB ILE A 56 12.051 -5.074 -3.896 1.00 0.00 H new ATOM 0 HG12 ILE A 56 9.065 -5.531 -4.115 1.00 0.00 H new ATOM 0 HG13 ILE A 56 10.188 -6.279 -2.997 1.00 0.00 H new ATOM 0 HG21 ILE A 56 10.937 -2.894 -4.164 1.00 0.00 H new ATOM 0 HG22 ILE A 56 11.835 -3.358 -5.628 1.00 0.00 H new ATOM 0 HG23 ILE A 56 10.063 -3.519 -5.583 1.00 0.00 H new ATOM 0 HD11 ILE A 56 8.837 -4.577 -1.875 1.00 0.00 H new ATOM 0 HD12 ILE A 56 10.552 -4.104 -1.887 1.00 0.00 H new ATOM 0 HD13 ILE A 56 9.411 -3.345 -3.023 1.00 0.00 H new ATOM 794 N GLN A 57 12.000 -5.407 -7.821 1.00 0.00 N ATOM 795 CA GLN A 57 13.001 -5.032 -8.812 1.00 0.00 C ATOM 796 C GLN A 57 12.817 -3.582 -9.250 1.00 0.00 C ATOM 797 O GLN A 57 11.757 -3.203 -9.750 1.00 0.00 O ATOM 798 CB GLN A 57 12.919 -5.958 -10.026 1.00 0.00 C ATOM 799 CG GLN A 57 13.409 -7.370 -9.749 1.00 0.00 C ATOM 800 CD GLN A 57 12.920 -8.371 -10.777 1.00 0.00 C ATOM 801 OE1 GLN A 57 12.190 -9.307 -10.451 1.00 0.00 O ATOM 802 NE2 GLN A 57 13.321 -8.178 -12.028 1.00 0.00 N ATOM 0 H GLN A 57 11.050 -5.472 -8.185 1.00 0.00 H new ATOM 0 HA GLN A 57 13.985 -5.132 -8.354 1.00 0.00 H new ATOM 0 HB2 GLN A 57 11.886 -6.002 -10.370 1.00 0.00 H new ATOM 0 HB3 GLN A 57 13.507 -5.531 -10.838 1.00 0.00 H new ATOM 0 HG2 GLN A 57 14.499 -7.375 -9.733 1.00 0.00 H new ATOM 0 HG3 GLN A 57 13.074 -7.679 -8.759 1.00 0.00 H new ATOM 0 HE21 GLN A 57 13.926 -7.389 -12.254 1.00 0.00 H new ATOM 0 HE22 GLN A 57 13.024 -8.819 -12.763 1.00 0.00 H new ATOM 811 N THR A 58 13.855 -2.775 -9.059 1.00 0.00 N ATOM 812 CA THR A 58 13.808 -1.367 -9.432 1.00 0.00 C ATOM 813 C THR A 58 14.894 -1.030 -10.447 1.00 0.00 C ATOM 814 O THR A 58 15.938 -1.681 -10.491 1.00 0.00 O ATOM 815 CB THR A 58 13.970 -0.454 -8.202 1.00 0.00 C ATOM 816 OG1 THR A 58 15.101 -0.869 -7.429 1.00 0.00 O ATOM 817 CG2 THR A 58 12.719 -0.484 -7.337 1.00 0.00 C ATOM 0 H THR A 58 14.740 -3.073 -8.648 1.00 0.00 H new ATOM 0 HA THR A 58 12.830 -1.192 -9.879 1.00 0.00 H new ATOM 0 HB THR A 58 14.125 0.566 -8.553 1.00 0.00 H new ATOM 0 HG1 THR A 58 15.198 -0.282 -6.650 1.00 0.00 H new ATOM 0 HG21 THR A 58 12.857 0.168 -6.475 1.00 0.00 H new ATOM 0 HG22 THR A 58 11.865 -0.139 -7.920 1.00 0.00 H new ATOM 0 HG23 THR A 58 12.537 -1.503 -6.996 1.00 0.00 H new ATOM 825 N GLU A 59 14.641 -0.010 -11.261 1.00 0.00 N ATOM 826 CA GLU A 59 15.599 0.412 -12.276 1.00 0.00 C ATOM 827 C GLU A 59 15.301 1.832 -12.749 1.00 0.00 C ATOM 828 O GLU A 59 14.159 2.288 -12.698 1.00 0.00 O ATOM 829 CB GLU A 59 15.571 -0.550 -13.466 1.00 0.00 C ATOM 830 CG GLU A 59 16.425 -0.093 -14.637 1.00 0.00 C ATOM 831 CD GLU A 59 16.979 -1.253 -15.442 1.00 0.00 C ATOM 832 OE1 GLU A 59 17.238 -2.320 -14.846 1.00 0.00 O ATOM 833 OE2 GLU A 59 17.154 -1.093 -16.668 1.00 0.00 O ATOM 0 H GLU A 59 13.782 0.539 -11.237 1.00 0.00 H new ATOM 0 HA GLU A 59 16.593 0.398 -11.829 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.914 -1.531 -13.138 1.00 0.00 H new ATOM 0 HB3 GLU A 59 14.541 -0.669 -13.803 1.00 0.00 H new ATOM 0 HG2 GLU A 59 15.829 0.545 -15.289 1.00 0.00 H new ATOM 0 HG3 GLU A 59 17.251 0.514 -14.265 1.00 0.00 H new ATOM 840 N ASP A 60 16.337 2.526 -13.207 1.00 0.00 N ATOM 841 CA ASP A 60 16.188 3.894 -13.689 1.00 0.00 C ATOM 842 C ASP A 60 15.927 3.916 -15.192 1.00 0.00 C ATOM 843 O ASP A 60 16.722 3.398 -15.978 1.00 0.00 O ATOM 844 CB ASP A 60 17.439 4.711 -13.364 1.00 0.00 C ATOM 845 CG ASP A 60 17.664 5.842 -14.349 1.00 0.00 C ATOM 846 OD1 ASP A 60 16.667 6.446 -14.796 1.00 0.00 O ATOM 847 OD2 ASP A 60 18.837 6.123 -14.671 1.00 0.00 O ATOM 0 H ASP A 60 17.289 2.164 -13.255 1.00 0.00 H new ATOM 0 HA ASP A 60 15.331 4.339 -13.183 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.350 5.121 -12.358 1.00 0.00 H new ATOM 0 HB3 ASP A 60 18.309 4.054 -13.365 1.00 0.00 H new ATOM 852 N LEU A 61 14.809 4.516 -15.584 1.00 0.00 N ATOM 853 CA LEU A 61 14.442 4.604 -16.994 1.00 0.00 C ATOM 854 C LEU A 61 14.943 5.908 -17.606 1.00 0.00 C ATOM 855 O LEU A 61 15.426 6.791 -16.899 1.00 0.00 O ATOM 856 CB LEU A 61 12.924 4.502 -17.153 1.00 0.00 C ATOM 857 CG LEU A 61 12.283 3.206 -16.657 1.00 0.00 C ATOM 858 CD1 LEU A 61 10.776 3.243 -16.863 1.00 0.00 C ATOM 859 CD2 LEU A 61 12.890 2.004 -17.366 1.00 0.00 C ATOM 0 H LEU A 61 14.141 4.949 -14.946 1.00 0.00 H new ATOM 0 HA LEU A 61 14.913 3.773 -17.520 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.466 5.337 -16.622 1.00 0.00 H new ATOM 0 HB3 LEU A 61 12.680 4.624 -18.208 1.00 0.00 H new ATOM 0 HG LEU A 61 12.482 3.111 -15.589 1.00 0.00 H new ATOM 0 HD11 LEU A 61 10.337 2.312 -16.504 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.353 4.081 -16.309 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.557 3.362 -17.924 1.00 0.00 H new ATOM 0 HD21 LEU A 61 12.421 1.091 -17.000 1.00 0.00 H new ATOM 0 HD22 LEU A 61 12.723 2.092 -18.440 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.961 1.967 -17.167 1.00 0.00 H new ATOM 871 N GLU A 62 14.822 6.021 -18.925 1.00 0.00 N ATOM 872 CA GLU A 62 15.262 7.218 -19.632 1.00 0.00 C ATOM 873 C GLU A 62 14.368 8.408 -19.295 1.00 0.00 C ATOM 874 O GLU A 62 14.671 9.546 -19.653 1.00 0.00 O ATOM 875 CB GLU A 62 15.258 6.976 -21.143 1.00 0.00 C ATOM 876 CG GLU A 62 13.865 6.872 -21.739 1.00 0.00 C ATOM 877 CD GLU A 62 13.882 6.810 -23.254 1.00 0.00 C ATOM 878 OE1 GLU A 62 14.033 7.874 -23.890 1.00 0.00 O ATOM 879 OE2 GLU A 62 13.745 5.697 -23.804 1.00 0.00 O ATOM 0 H GLU A 62 14.423 5.299 -19.525 1.00 0.00 H new ATOM 0 HA GLU A 62 16.278 7.445 -19.310 1.00 0.00 H new ATOM 0 HB2 GLU A 62 15.794 7.788 -21.634 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.805 6.058 -21.357 1.00 0.00 H new ATOM 0 HG2 GLU A 62 13.372 5.982 -21.348 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.273 7.730 -21.421 1.00 0.00 H new ATOM 886 N ASP A 63 13.266 8.136 -18.604 1.00 0.00 N ATOM 887 CA ASP A 63 12.328 9.183 -18.218 1.00 0.00 C ATOM 888 C ASP A 63 12.603 9.661 -16.796 1.00 0.00 C ATOM 889 O ASP A 63 11.854 10.467 -16.245 1.00 0.00 O ATOM 890 CB ASP A 63 10.890 8.675 -18.329 1.00 0.00 C ATOM 891 CG ASP A 63 10.717 7.664 -19.446 1.00 0.00 C ATOM 892 OD1 ASP A 63 11.285 7.883 -20.537 1.00 0.00 O ATOM 893 OD2 ASP A 63 10.016 6.655 -19.230 1.00 0.00 O ATOM 0 H ASP A 63 13.001 7.199 -18.300 1.00 0.00 H new ATOM 0 HA ASP A 63 12.461 10.025 -18.898 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.594 8.221 -17.383 1.00 0.00 H new ATOM 0 HB3 ASP A 63 10.222 9.519 -18.500 1.00 0.00 H new ATOM 898 N GLY A 64 13.683 9.157 -16.205 1.00 0.00 N ATOM 899 CA GLY A 64 14.037 9.543 -14.852 1.00 0.00 C ATOM 900 C GLY A 64 13.046 9.032 -13.825 1.00 0.00 C ATOM 901 O GLY A 64 12.880 9.627 -12.760 1.00 0.00 O ATOM 0 H GLY A 64 14.319 8.488 -16.640 1.00 0.00 H new ATOM 0 HA2 GLY A 64 15.030 9.160 -14.616 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.092 10.630 -14.790 1.00 0.00 H new ATOM 905 N THR A 65 12.383 7.925 -14.146 1.00 0.00 N ATOM 906 CA THR A 65 11.401 7.335 -13.245 1.00 0.00 C ATOM 907 C THR A 65 11.860 5.968 -12.750 1.00 0.00 C ATOM 908 O THR A 65 12.798 5.384 -13.294 1.00 0.00 O ATOM 909 CB THR A 65 10.029 7.186 -13.929 1.00 0.00 C ATOM 910 OG1 THR A 65 10.121 6.259 -15.016 1.00 0.00 O ATOM 911 CG2 THR A 65 9.531 8.529 -14.441 1.00 0.00 C ATOM 0 H THR A 65 12.508 7.419 -15.023 1.00 0.00 H new ATOM 0 HA THR A 65 11.304 8.012 -12.396 1.00 0.00 H new ATOM 0 HB THR A 65 9.319 6.810 -13.192 1.00 0.00 H new ATOM 0 HG1 THR A 65 9.244 6.169 -15.444 1.00 0.00 H new ATOM 0 HG21 THR A 65 8.561 8.399 -14.920 1.00 0.00 H new ATOM 0 HG22 THR A 65 9.433 9.223 -13.606 1.00 0.00 H new ATOM 0 HG23 THR A 65 10.242 8.929 -15.164 1.00 0.00 H new ATOM 919 N CYS A 66 11.194 5.463 -11.717 1.00 0.00 N ATOM 920 CA CYS A 66 11.535 4.164 -11.149 1.00 0.00 C ATOM 921 C CYS A 66 10.395 3.170 -11.343 1.00 0.00 C ATOM 922 O CYS A 66 9.289 3.369 -10.839 1.00 0.00 O ATOM 923 CB CYS A 66 11.858 4.303 -9.661 1.00 0.00 C ATOM 924 SG CYS A 66 12.564 2.815 -8.916 1.00 0.00 S ATOM 0 H CYS A 66 10.415 5.933 -11.256 1.00 0.00 H new ATOM 0 HA CYS A 66 12.415 3.787 -11.670 1.00 0.00 H new ATOM 0 HB2 CYS A 66 12.556 5.129 -9.528 1.00 0.00 H new ATOM 0 HB3 CYS A 66 10.946 4.567 -9.125 1.00 0.00 H new ATOM 0 HG CYS A 66 12.805 3.032 -7.657 1.00 0.00 H new ATOM 930 N LYS A 67 10.670 2.098 -12.079 1.00 0.00 N ATOM 931 CA LYS A 67 9.668 1.071 -12.341 1.00 0.00 C ATOM 932 C LYS A 67 9.792 -0.077 -11.345 1.00 0.00 C ATOM 933 O LYS A 67 10.654 -0.945 -11.488 1.00 0.00 O ATOM 934 CB LYS A 67 9.814 0.540 -13.769 1.00 0.00 C ATOM 935 CG LYS A 67 8.602 -0.233 -14.257 1.00 0.00 C ATOM 936 CD LYS A 67 8.604 -0.378 -15.770 1.00 0.00 C ATOM 937 CE LYS A 67 9.406 -1.593 -16.212 1.00 0.00 C ATOM 938 NZ LYS A 67 9.157 -1.931 -17.641 1.00 0.00 N ATOM 0 H LYS A 67 11.579 1.918 -12.505 1.00 0.00 H new ATOM 0 HA LYS A 67 8.683 1.522 -12.227 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.995 1.378 -14.442 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.691 -0.106 -13.820 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.590 -1.221 -13.796 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.692 0.278 -13.941 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.579 -0.467 -16.130 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.024 0.521 -16.222 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.469 -1.400 -16.064 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.147 -2.447 -15.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.721 -2.764 -17.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.147 -2.140 -17.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.428 -1.126 -18.241 1.00 0.00 H new ATOM 952 N VAL A 68 8.925 -0.077 -10.338 1.00 0.00 N ATOM 953 CA VAL A 68 8.936 -1.120 -9.320 1.00 0.00 C ATOM 954 C VAL A 68 8.215 -2.372 -9.807 1.00 0.00 C ATOM 955 O VAL A 68 7.128 -2.291 -10.379 1.00 0.00 O ATOM 956 CB VAL A 68 8.277 -0.637 -8.014 1.00 0.00 C ATOM 957 CG1 VAL A 68 8.495 -1.650 -6.899 1.00 0.00 C ATOM 958 CG2 VAL A 68 8.819 0.728 -7.618 1.00 0.00 C ATOM 0 H VAL A 68 8.206 0.634 -10.205 1.00 0.00 H new ATOM 0 HA VAL A 68 9.981 -1.359 -9.124 1.00 0.00 H new ATOM 0 HB VAL A 68 7.204 -0.543 -8.182 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.023 -1.292 -5.984 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.055 -2.606 -7.184 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.564 -1.779 -6.729 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.343 1.054 -6.693 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.897 0.662 -7.468 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.607 1.447 -8.409 1.00 0.00 H new ATOM 968 N SER A 69 8.828 -3.529 -9.578 1.00 0.00 N ATOM 969 CA SER A 69 8.245 -4.798 -9.997 1.00 0.00 C ATOM 970 C SER A 69 8.279 -5.813 -8.858 1.00 0.00 C ATOM 971 O SER A 69 9.299 -5.977 -8.187 1.00 0.00 O ATOM 972 CB SER A 69 8.995 -5.351 -11.210 1.00 0.00 C ATOM 973 OG SER A 69 9.440 -4.304 -12.055 1.00 0.00 O ATOM 0 H SER A 69 9.728 -3.614 -9.105 1.00 0.00 H new ATOM 0 HA SER A 69 7.205 -4.620 -10.271 1.00 0.00 H new ATOM 0 HB2 SER A 69 9.849 -5.941 -10.876 1.00 0.00 H new ATOM 0 HB3 SER A 69 8.343 -6.022 -11.770 1.00 0.00 H new ATOM 0 HG SER A 69 9.918 -4.683 -12.822 1.00 0.00 H new ATOM 979 N TYR A 70 7.157 -6.492 -8.646 1.00 0.00 N ATOM 980 CA TYR A 70 7.056 -7.490 -7.588 1.00 0.00 C ATOM 981 C TYR A 70 6.180 -8.661 -8.024 1.00 0.00 C ATOM 982 O TYR A 70 5.285 -8.505 -8.855 1.00 0.00 O ATOM 983 CB TYR A 70 6.487 -6.859 -6.316 1.00 0.00 C ATOM 984 CG TYR A 70 5.000 -6.592 -6.386 1.00 0.00 C ATOM 985 CD1 TYR A 70 4.080 -7.588 -6.087 1.00 0.00 C ATOM 986 CD2 TYR A 70 4.516 -5.341 -6.751 1.00 0.00 C ATOM 987 CE1 TYR A 70 2.721 -7.348 -6.150 1.00 0.00 C ATOM 988 CE2 TYR A 70 3.159 -5.092 -6.816 1.00 0.00 C ATOM 989 CZ TYR A 70 2.265 -6.098 -6.515 1.00 0.00 C ATOM 990 OH TYR A 70 0.912 -5.855 -6.578 1.00 0.00 O ATOM 0 H TYR A 70 6.305 -6.369 -9.193 1.00 0.00 H new ATOM 0 HA TYR A 70 8.058 -7.867 -7.382 1.00 0.00 H new ATOM 0 HB2 TYR A 70 6.690 -7.517 -5.471 1.00 0.00 H new ATOM 0 HB3 TYR A 70 7.007 -5.921 -6.121 1.00 0.00 H new ATOM 0 HD1 TYR A 70 4.433 -8.568 -5.800 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.213 -4.551 -6.988 1.00 0.00 H new ATOM 0 HE1 TYR A 70 2.019 -8.135 -5.915 1.00 0.00 H new ATOM 0 HE2 TYR A 70 2.800 -4.114 -7.101 1.00 0.00 H new ATOM 0 HH TYR A 70 0.759 -4.926 -6.849 1.00 0.00 H new ATOM 1000 N PHE A 71 6.446 -9.833 -7.457 1.00 0.00 N ATOM 1001 CA PHE A 71 5.683 -11.031 -7.787 1.00 0.00 C ATOM 1002 C PHE A 71 5.042 -11.629 -6.538 1.00 0.00 C ATOM 1003 O PHE A 71 5.683 -12.329 -5.755 1.00 0.00 O ATOM 1004 CB PHE A 71 6.587 -12.069 -8.456 1.00 0.00 C ATOM 1005 CG PHE A 71 5.834 -13.093 -9.256 1.00 0.00 C ATOM 1006 CD1 PHE A 71 5.188 -12.737 -10.429 1.00 0.00 C ATOM 1007 CD2 PHE A 71 5.773 -14.412 -8.835 1.00 0.00 C ATOM 1008 CE1 PHE A 71 4.494 -13.678 -11.166 1.00 0.00 C ATOM 1009 CE2 PHE A 71 5.080 -15.357 -9.569 1.00 0.00 C ATOM 1010 CZ PHE A 71 4.441 -14.989 -10.737 1.00 0.00 C ATOM 0 H PHE A 71 7.183 -9.979 -6.767 1.00 0.00 H new ATOM 0 HA PHE A 71 4.891 -10.747 -8.480 1.00 0.00 H new ATOM 0 HB2 PHE A 71 7.293 -11.557 -9.109 1.00 0.00 H new ATOM 0 HB3 PHE A 71 7.172 -12.577 -7.690 1.00 0.00 H new ATOM 0 HD1 PHE A 71 5.227 -11.713 -10.771 1.00 0.00 H new ATOM 0 HD2 PHE A 71 6.272 -14.705 -7.923 1.00 0.00 H new ATOM 0 HE1 PHE A 71 3.993 -13.388 -12.078 1.00 0.00 H new ATOM 0 HE2 PHE A 71 5.038 -16.381 -9.230 1.00 0.00 H new ATOM 0 HZ PHE A 71 3.901 -15.726 -11.313 1.00 0.00 H new ATOM 1020 N PRO A 72 3.745 -11.345 -6.346 1.00 0.00 N ATOM 1021 CA PRO A 72 2.988 -11.844 -5.194 1.00 0.00 C ATOM 1022 C PRO A 72 2.749 -13.348 -5.264 1.00 0.00 C ATOM 1023 O PRO A 72 2.542 -13.906 -6.343 1.00 0.00 O ATOM 1024 CB PRO A 72 1.660 -11.087 -5.288 1.00 0.00 C ATOM 1025 CG PRO A 72 1.521 -10.744 -6.730 1.00 0.00 C ATOM 1026 CD PRO A 72 2.918 -10.516 -7.239 1.00 0.00 C ATOM 0 HA PRO A 72 3.521 -11.685 -4.257 1.00 0.00 H new ATOM 0 HB2 PRO A 72 0.828 -11.703 -4.946 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.670 -10.191 -4.667 1.00 0.00 H new ATOM 0 HG2 PRO A 72 1.033 -11.550 -7.278 1.00 0.00 H new ATOM 0 HG3 PRO A 72 0.908 -9.853 -6.862 1.00 0.00 H new ATOM 0 HD2 PRO A 72 3.021 -10.821 -8.280 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.199 -9.464 -7.185 1.00 0.00 H new ATOM 1034 N THR A 73 2.779 -14.003 -4.107 1.00 0.00 N ATOM 1035 CA THR A 73 2.567 -15.443 -4.038 1.00 0.00 C ATOM 1036 C THR A 73 1.365 -15.780 -3.163 1.00 0.00 C ATOM 1037 O THR A 73 0.690 -16.787 -3.379 1.00 0.00 O ATOM 1038 CB THR A 73 3.809 -16.168 -3.486 1.00 0.00 C ATOM 1039 OG1 THR A 73 4.191 -15.597 -2.229 1.00 0.00 O ATOM 1040 CG2 THR A 73 4.970 -16.074 -4.464 1.00 0.00 C ATOM 0 H THR A 73 2.948 -13.558 -3.205 1.00 0.00 H new ATOM 0 HA THR A 73 2.379 -15.784 -5.056 1.00 0.00 H new ATOM 0 HB THR A 73 3.556 -17.219 -3.346 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.980 -16.064 -1.884 1.00 0.00 H new ATOM 0 HG21 THR A 73 5.835 -16.593 -4.052 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.687 -16.535 -5.410 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.221 -15.027 -4.631 1.00 0.00 H new ATOM 1048 N VAL A 74 1.102 -14.931 -2.174 1.00 0.00 N ATOM 1049 CA VAL A 74 -0.021 -15.139 -1.268 1.00 0.00 C ATOM 1050 C VAL A 74 -1.001 -13.974 -1.332 1.00 0.00 C ATOM 1051 O VAL A 74 -0.625 -12.806 -1.229 1.00 0.00 O ATOM 1052 CB VAL A 74 0.457 -15.314 0.186 1.00 0.00 C ATOM 1053 CG1 VAL A 74 -0.709 -15.677 1.092 1.00 0.00 C ATOM 1054 CG2 VAL A 74 1.552 -16.368 0.264 1.00 0.00 C ATOM 0 H VAL A 74 1.651 -14.094 -1.980 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.524 -16.051 -1.590 1.00 0.00 H new ATOM 0 HB VAL A 74 0.871 -14.366 0.530 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.352 -15.796 2.115 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.456 -14.884 1.059 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.156 -16.611 0.753 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.878 -16.478 1.298 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.166 -17.321 -0.099 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.397 -16.061 -0.352 1.00 0.00 H new ATOM 1064 N PRO A 75 -2.292 -14.295 -1.506 1.00 0.00 N ATOM 1065 CA PRO A 75 -3.355 -13.289 -1.587 1.00 0.00 C ATOM 1066 C PRO A 75 -3.605 -12.602 -0.249 1.00 0.00 C ATOM 1067 O PRO A 75 -3.546 -13.233 0.805 1.00 0.00 O ATOM 1068 CB PRO A 75 -4.582 -14.102 -2.008 1.00 0.00 C ATOM 1069 CG PRO A 75 -4.302 -15.485 -1.530 1.00 0.00 C ATOM 1070 CD PRO A 75 -2.813 -15.667 -1.636 1.00 0.00 C ATOM 0 HA PRO A 75 -3.103 -12.484 -2.277 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -5.493 -13.705 -1.560 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -4.722 -14.077 -3.089 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.639 -15.618 -0.502 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.829 -16.222 -2.136 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -2.431 -16.318 -0.850 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -2.530 -16.116 -2.588 1.00 0.00 H new ATOM 1078 N GLY A 76 -3.886 -11.303 -0.299 1.00 0.00 N ATOM 1079 CA GLY A 76 -4.141 -10.551 0.916 1.00 0.00 C ATOM 1080 C GLY A 76 -4.048 -9.054 0.701 1.00 0.00 C ATOM 1081 O GLY A 76 -4.582 -8.524 -0.273 1.00 0.00 O ATOM 0 H GLY A 76 -3.942 -10.758 -1.159 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.133 -10.800 1.292 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -3.425 -10.850 1.682 1.00 0.00 H new ATOM 1085 N VAL A 77 -3.368 -8.368 1.615 1.00 0.00 N ATOM 1086 CA VAL A 77 -3.207 -6.922 1.522 1.00 0.00 C ATOM 1087 C VAL A 77 -1.736 -6.528 1.581 1.00 0.00 C ATOM 1088 O VAL A 77 -1.096 -6.630 2.628 1.00 0.00 O ATOM 1089 CB VAL A 77 -3.966 -6.199 2.650 1.00 0.00 C ATOM 1090 CG1 VAL A 77 -3.778 -4.693 2.542 1.00 0.00 C ATOM 1091 CG2 VAL A 77 -5.443 -6.564 2.617 1.00 0.00 C ATOM 0 H VAL A 77 -2.920 -8.791 2.428 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.623 -6.619 0.561 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.556 -6.524 3.606 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.322 -4.200 3.348 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.718 -4.452 2.619 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.160 -4.347 1.582 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.964 -6.044 3.421 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -5.869 -6.269 1.658 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.555 -7.640 2.748 1.00 0.00 H new ATOM 1101 N TYR A 78 -1.204 -6.076 0.450 1.00 0.00 N ATOM 1102 CA TYR A 78 0.193 -5.668 0.372 1.00 0.00 C ATOM 1103 C TYR A 78 0.327 -4.153 0.501 1.00 0.00 C ATOM 1104 O TYR A 78 -0.144 -3.403 -0.355 1.00 0.00 O ATOM 1105 CB TYR A 78 0.810 -6.135 -0.947 1.00 0.00 C ATOM 1106 CG TYR A 78 1.105 -7.618 -0.986 1.00 0.00 C ATOM 1107 CD1 TYR A 78 2.328 -8.115 -0.554 1.00 0.00 C ATOM 1108 CD2 TYR A 78 0.159 -8.522 -1.454 1.00 0.00 C ATOM 1109 CE1 TYR A 78 2.602 -9.469 -0.589 1.00 0.00 C ATOM 1110 CE2 TYR A 78 0.423 -9.877 -1.491 1.00 0.00 C ATOM 1111 CZ TYR A 78 1.646 -10.346 -1.058 1.00 0.00 C ATOM 1112 OH TYR A 78 1.914 -11.695 -1.092 1.00 0.00 O ATOM 0 H TYR A 78 -1.720 -5.983 -0.425 1.00 0.00 H new ATOM 0 HA TYR A 78 0.727 -6.134 1.200 1.00 0.00 H new ATOM 0 HB2 TYR A 78 0.132 -5.886 -1.764 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.734 -5.584 -1.121 1.00 0.00 H new ATOM 0 HD1 TYR A 78 3.078 -7.431 -0.184 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.799 -8.159 -1.795 1.00 0.00 H new ATOM 0 HE1 TYR A 78 3.559 -9.838 -0.251 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.324 -10.566 -1.857 1.00 0.00 H new ATOM 0 HH TYR A 78 1.073 -12.194 -1.150 1.00 0.00 H new ATOM 1122 N ILE A 79 0.972 -3.712 1.575 1.00 0.00 N ATOM 1123 CA ILE A 79 1.169 -2.288 1.815 1.00 0.00 C ATOM 1124 C ILE A 79 2.453 -1.792 1.157 1.00 0.00 C ATOM 1125 O ILE A 79 3.550 -2.008 1.671 1.00 0.00 O ATOM 1126 CB ILE A 79 1.224 -1.973 3.322 1.00 0.00 C ATOM 1127 CG1 ILE A 79 -0.057 -2.449 4.011 1.00 0.00 C ATOM 1128 CG2 ILE A 79 1.428 -0.482 3.545 1.00 0.00 C ATOM 1129 CD1 ILE A 79 -1.292 -1.686 3.585 1.00 0.00 C ATOM 0 H ILE A 79 1.367 -4.320 2.293 1.00 0.00 H new ATOM 0 HA ILE A 79 0.315 -1.773 1.375 1.00 0.00 H new ATOM 0 HB ILE A 79 2.069 -2.505 3.759 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.203 -3.508 3.798 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.064 -2.355 5.090 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.465 -0.276 4.615 1.00 0.00 H new ATOM 0 HG22 ILE A 79 2.365 -0.170 3.083 1.00 0.00 H new ATOM 0 HG23 ILE A 79 0.601 0.069 3.097 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.162 -2.077 4.113 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.167 -0.630 3.823 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.438 -1.801 2.511 1.00 0.00 H new ATOM 1141 N VAL A 80 2.307 -1.124 0.017 1.00 0.00 N ATOM 1142 CA VAL A 80 3.454 -0.594 -0.711 1.00 0.00 C ATOM 1143 C VAL A 80 3.838 0.789 -0.199 1.00 0.00 C ATOM 1144 O VAL A 80 3.260 1.796 -0.608 1.00 0.00 O ATOM 1145 CB VAL A 80 3.169 -0.510 -2.222 1.00 0.00 C ATOM 1146 CG1 VAL A 80 4.356 0.096 -2.956 1.00 0.00 C ATOM 1147 CG2 VAL A 80 2.834 -1.886 -2.778 1.00 0.00 C ATOM 0 H VAL A 80 1.406 -0.937 -0.422 1.00 0.00 H new ATOM 0 HA VAL A 80 4.282 -1.283 -0.543 1.00 0.00 H new ATOM 0 HB VAL A 80 2.307 0.139 -2.376 1.00 0.00 H new ATOM 0 HG11 VAL A 80 4.137 0.147 -4.022 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.545 1.100 -2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.238 -0.525 -2.797 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.635 -1.808 -3.847 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.675 -2.560 -2.613 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.951 -2.278 -2.273 1.00 0.00 H new ATOM 1157 N SER A 81 4.817 0.831 0.699 1.00 0.00 N ATOM 1158 CA SER A 81 5.277 2.092 1.270 1.00 0.00 C ATOM 1159 C SER A 81 6.170 2.840 0.286 1.00 0.00 C ATOM 1160 O SER A 81 7.364 2.558 0.174 1.00 0.00 O ATOM 1161 CB SER A 81 6.035 1.839 2.574 1.00 0.00 C ATOM 1162 OG SER A 81 5.145 1.754 3.674 1.00 0.00 O ATOM 0 H SER A 81 5.307 0.007 1.047 1.00 0.00 H new ATOM 0 HA SER A 81 4.403 2.708 1.480 1.00 0.00 H new ATOM 0 HB2 SER A 81 6.606 0.914 2.492 1.00 0.00 H new ATOM 0 HB3 SER A 81 6.752 2.643 2.743 1.00 0.00 H new ATOM 0 HG SER A 81 5.654 1.590 4.495 1.00 0.00 H new ATOM 1168 N THR A 82 5.584 3.797 -0.427 1.00 0.00 N ATOM 1169 CA THR A 82 6.325 4.586 -1.403 1.00 0.00 C ATOM 1170 C THR A 82 6.720 5.941 -0.828 1.00 0.00 C ATOM 1171 O THR A 82 5.868 6.793 -0.575 1.00 0.00 O ATOM 1172 CB THR A 82 5.503 4.806 -2.688 1.00 0.00 C ATOM 1173 OG1 THR A 82 4.793 3.609 -3.026 1.00 0.00 O ATOM 1174 CG2 THR A 82 6.405 5.211 -3.844 1.00 0.00 C ATOM 0 H THR A 82 4.598 4.044 -0.347 1.00 0.00 H new ATOM 0 HA THR A 82 7.225 4.022 -1.648 1.00 0.00 H new ATOM 0 HB THR A 82 4.791 5.611 -2.505 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.272 3.757 -3.843 1.00 0.00 H new ATOM 0 HG21 THR A 82 5.803 5.361 -4.740 1.00 0.00 H new ATOM 0 HG22 THR A 82 6.922 6.138 -3.595 1.00 0.00 H new ATOM 0 HG23 THR A 82 7.138 4.425 -4.026 1.00 0.00 H new ATOM 1182 N LYS A 83 8.019 6.136 -0.625 1.00 0.00 N ATOM 1183 CA LYS A 83 8.529 7.389 -0.082 1.00 0.00 C ATOM 1184 C LYS A 83 9.537 8.025 -1.034 1.00 0.00 C ATOM 1185 O LYS A 83 10.221 7.329 -1.785 1.00 0.00 O ATOM 1186 CB LYS A 83 9.181 7.150 1.282 1.00 0.00 C ATOM 1187 CG LYS A 83 8.203 7.207 2.443 1.00 0.00 C ATOM 1188 CD LYS A 83 8.914 7.468 3.760 1.00 0.00 C ATOM 1189 CE LYS A 83 9.328 6.170 4.436 1.00 0.00 C ATOM 1190 NZ LYS A 83 10.673 5.715 3.986 1.00 0.00 N ATOM 0 H LYS A 83 8.738 5.442 -0.829 1.00 0.00 H new ATOM 0 HA LYS A 83 7.688 8.072 0.038 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.668 6.175 1.276 1.00 0.00 H new ATOM 0 HB3 LYS A 83 9.961 7.895 1.438 1.00 0.00 H new ATOM 0 HG2 LYS A 83 7.469 7.992 2.263 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.655 6.267 2.505 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.795 8.085 3.583 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.258 8.032 4.423 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.335 6.310 5.517 1.00 0.00 H new ATOM 0 HE3 LYS A 83 8.591 5.396 4.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 10.607 4.742 3.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.018 6.343 3.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.335 5.742 4.788 1.00 0.00 H new ATOM 1204 N PHE A 84 9.625 9.350 -0.996 1.00 0.00 N ATOM 1205 CA PHE A 84 10.550 10.080 -1.856 1.00 0.00 C ATOM 1206 C PHE A 84 11.081 11.325 -1.151 1.00 0.00 C ATOM 1207 O PHE A 84 10.328 12.250 -0.852 1.00 0.00 O ATOM 1208 CB PHE A 84 9.861 10.475 -3.163 1.00 0.00 C ATOM 1209 CG PHE A 84 10.659 11.440 -3.994 1.00 0.00 C ATOM 1210 CD1 PHE A 84 10.525 12.807 -3.810 1.00 0.00 C ATOM 1211 CD2 PHE A 84 11.542 10.980 -4.957 1.00 0.00 C ATOM 1212 CE1 PHE A 84 11.258 13.696 -4.574 1.00 0.00 C ATOM 1213 CE2 PHE A 84 12.277 11.865 -5.723 1.00 0.00 C ATOM 1214 CZ PHE A 84 12.135 13.225 -5.530 1.00 0.00 C ATOM 0 H PHE A 84 9.067 9.941 -0.379 1.00 0.00 H new ATOM 0 HA PHE A 84 11.391 9.425 -2.081 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.668 9.576 -3.749 1.00 0.00 H new ATOM 0 HB3 PHE A 84 8.893 10.920 -2.934 1.00 0.00 H new ATOM 0 HD1 PHE A 84 9.841 13.181 -3.063 1.00 0.00 H new ATOM 0 HD2 PHE A 84 11.657 9.917 -5.111 1.00 0.00 H new ATOM 0 HE1 PHE A 84 11.144 14.759 -4.423 1.00 0.00 H new ATOM 0 HE2 PHE A 84 12.961 11.494 -6.471 1.00 0.00 H new ATOM 0 HZ PHE A 84 12.709 13.919 -6.126 1.00 0.00 H new ATOM 1224 N ALA A 85 12.384 11.338 -0.888 1.00 0.00 N ATOM 1225 CA ALA A 85 13.017 12.469 -0.220 1.00 0.00 C ATOM 1226 C ALA A 85 12.488 12.633 1.200 1.00 0.00 C ATOM 1227 O ALA A 85 12.259 13.751 1.662 1.00 0.00 O ATOM 1228 CB ALA A 85 12.795 13.745 -1.019 1.00 0.00 C ATOM 0 H ALA A 85 13.021 10.578 -1.127 1.00 0.00 H new ATOM 0 HA ALA A 85 14.087 12.272 -0.161 1.00 0.00 H new ATOM 0 HB1 ALA A 85 13.273 14.581 -0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 85 13.227 13.632 -2.013 1.00 0.00 H new ATOM 0 HB3 ALA A 85 11.726 13.937 -1.108 1.00 0.00 H new ATOM 1234 N ASP A 86 12.295 11.513 1.888 1.00 0.00 N ATOM 1235 CA ASP A 86 11.793 11.533 3.257 1.00 0.00 C ATOM 1236 C ASP A 86 10.360 12.055 3.303 1.00 0.00 C ATOM 1237 O ASP A 86 9.989 12.795 4.213 1.00 0.00 O ATOM 1238 CB ASP A 86 12.693 12.398 4.140 1.00 0.00 C ATOM 1239 CG ASP A 86 14.164 12.079 3.958 1.00 0.00 C ATOM 1240 OD1 ASP A 86 14.693 12.333 2.856 1.00 0.00 O ATOM 1241 OD2 ASP A 86 14.785 11.574 4.916 1.00 0.00 O ATOM 0 H ASP A 86 12.479 10.580 1.520 1.00 0.00 H new ATOM 0 HA ASP A 86 11.800 10.511 3.636 1.00 0.00 H new ATOM 0 HB2 ASP A 86 12.521 13.449 3.909 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.419 12.252 5.185 1.00 0.00 H new ATOM 1246 N GLU A 87 9.562 11.665 2.314 1.00 0.00 N ATOM 1247 CA GLU A 87 8.171 12.096 2.242 1.00 0.00 C ATOM 1248 C GLU A 87 7.325 11.080 1.479 1.00 0.00 C ATOM 1249 O GLU A 87 7.648 10.710 0.350 1.00 0.00 O ATOM 1250 CB GLU A 87 8.072 13.466 1.568 1.00 0.00 C ATOM 1251 CG GLU A 87 8.321 14.629 2.514 1.00 0.00 C ATOM 1252 CD GLU A 87 7.899 15.961 1.924 1.00 0.00 C ATOM 1253 OE1 GLU A 87 6.686 16.154 1.701 1.00 0.00 O ATOM 1254 OE2 GLU A 87 8.784 16.810 1.687 1.00 0.00 O ATOM 0 H GLU A 87 9.854 11.052 1.553 1.00 0.00 H new ATOM 0 HA GLU A 87 7.788 12.171 3.260 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.792 13.513 0.751 1.00 0.00 H new ATOM 0 HB3 GLU A 87 7.081 13.574 1.126 1.00 0.00 H new ATOM 0 HG2 GLU A 87 7.778 14.459 3.444 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.381 14.667 2.766 1.00 0.00 H new ATOM 1261 N HIS A 88 6.241 10.632 2.105 1.00 0.00 N ATOM 1262 CA HIS A 88 5.348 9.659 1.486 1.00 0.00 C ATOM 1263 C HIS A 88 4.495 10.315 0.405 1.00 0.00 C ATOM 1264 O HIS A 88 3.911 11.377 0.620 1.00 0.00 O ATOM 1265 CB HIS A 88 4.449 9.016 2.542 1.00 0.00 C ATOM 1266 CG HIS A 88 5.045 7.797 3.174 1.00 0.00 C ATOM 1267 ND1 HIS A 88 4.770 6.515 2.745 1.00 0.00 N ATOM 1268 CD2 HIS A 88 5.908 7.668 4.209 1.00 0.00 C ATOM 1269 CE1 HIS A 88 5.436 5.651 3.489 1.00 0.00 C ATOM 1270 NE2 HIS A 88 6.135 6.325 4.385 1.00 0.00 N ATOM 0 H HIS A 88 5.960 10.927 3.040 1.00 0.00 H new ATOM 0 HA HIS A 88 5.960 8.886 1.021 1.00 0.00 H new ATOM 0 HB2 HIS A 88 4.233 9.749 3.319 1.00 0.00 H new ATOM 0 HB3 HIS A 88 3.497 8.749 2.083 1.00 0.00 H new ATOM 0 HD2 HIS A 88 6.338 8.472 4.788 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.413 4.576 3.383 1.00 0.00 H new ATOM 0 HE2 HIS A 88 6.744 5.915 5.093 1.00 0.00 H new ATOM 1279 N VAL A 89 4.428 9.676 -0.759 1.00 0.00 N ATOM 1280 CA VAL A 89 3.646 10.197 -1.874 1.00 0.00 C ATOM 1281 C VAL A 89 2.253 10.618 -1.418 1.00 0.00 C ATOM 1282 O VAL A 89 1.740 10.156 -0.399 1.00 0.00 O ATOM 1283 CB VAL A 89 3.512 9.156 -3.001 1.00 0.00 C ATOM 1284 CG1 VAL A 89 4.747 9.170 -3.890 1.00 0.00 C ATOM 1285 CG2 VAL A 89 3.279 7.770 -2.420 1.00 0.00 C ATOM 0 H VAL A 89 4.906 8.796 -0.954 1.00 0.00 H new ATOM 0 HA VAL A 89 4.180 11.067 -2.256 1.00 0.00 H new ATOM 0 HB VAL A 89 2.649 9.418 -3.614 1.00 0.00 H new ATOM 0 HG11 VAL A 89 4.635 8.428 -4.681 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.865 10.159 -4.334 1.00 0.00 H new ATOM 0 HG13 VAL A 89 5.628 8.933 -3.293 1.00 0.00 H new ATOM 0 HG21 VAL A 89 3.187 7.047 -3.230 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.120 7.496 -1.783 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.363 7.772 -1.829 1.00 0.00 H new ATOM 1295 N PRO A 90 1.624 11.517 -2.191 1.00 0.00 N ATOM 1296 CA PRO A 90 0.281 12.020 -1.887 1.00 0.00 C ATOM 1297 C PRO A 90 -0.794 10.956 -2.081 1.00 0.00 C ATOM 1298 O PRO A 90 -1.473 10.926 -3.106 1.00 0.00 O ATOM 1299 CB PRO A 90 0.094 13.159 -2.892 1.00 0.00 C ATOM 1300 CG PRO A 90 0.995 12.815 -4.028 1.00 0.00 C ATOM 1301 CD PRO A 90 2.177 12.111 -3.420 1.00 0.00 C ATOM 0 HA PRO A 90 0.188 12.331 -0.847 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -0.943 13.233 -3.218 1.00 0.00 H new ATOM 0 HB3 PRO A 90 0.359 14.121 -2.454 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.487 12.174 -4.749 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.308 13.711 -4.564 1.00 0.00 H new ATOM 0 HD2 PRO A 90 2.579 11.350 -4.089 1.00 0.00 H new ATOM 0 HD3 PRO A 90 2.989 12.804 -3.201 1.00 0.00 H new ATOM 1309 N GLY A 91 -0.942 10.084 -1.089 1.00 0.00 N ATOM 1310 CA GLY A 91 -1.937 9.030 -1.170 1.00 0.00 C ATOM 1311 C GLY A 91 -1.492 7.757 -0.477 1.00 0.00 C ATOM 1312 O GLY A 91 -2.271 6.815 -0.334 1.00 0.00 O ATOM 0 H GLY A 91 -0.391 10.088 -0.231 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -2.867 9.378 -0.721 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.149 8.815 -2.217 1.00 0.00 H new ATOM 1316 N SER A 92 -0.234 7.728 -0.047 1.00 0.00 N ATOM 1317 CA SER A 92 0.316 6.560 0.629 1.00 0.00 C ATOM 1318 C SER A 92 -0.196 6.472 2.064 1.00 0.00 C ATOM 1319 O SER A 92 -0.683 7.447 2.637 1.00 0.00 O ATOM 1320 CB SER A 92 1.844 6.613 0.624 1.00 0.00 C ATOM 1321 OG SER A 92 2.375 5.922 -0.494 1.00 0.00 O ATOM 0 H SER A 92 0.423 8.501 -0.155 1.00 0.00 H new ATOM 0 HA SER A 92 -0.011 5.671 0.089 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.175 7.651 0.604 1.00 0.00 H new ATOM 0 HB3 SER A 92 2.229 6.173 1.544 1.00 0.00 H new ATOM 0 HG SER A 92 1.701 5.881 -1.204 1.00 0.00 H new ATOM 1327 N PRO A 93 -0.085 5.275 2.659 1.00 0.00 N ATOM 1328 CA PRO A 93 0.492 4.107 1.986 1.00 0.00 C ATOM 1329 C PRO A 93 -0.405 3.579 0.871 1.00 0.00 C ATOM 1330 O PRO A 93 -1.557 3.992 0.740 1.00 0.00 O ATOM 1331 CB PRO A 93 0.613 3.074 3.109 1.00 0.00 C ATOM 1332 CG PRO A 93 -0.426 3.469 4.101 1.00 0.00 C ATOM 1333 CD PRO A 93 -0.514 4.969 4.034 1.00 0.00 C ATOM 0 HA PRO A 93 1.439 4.343 1.501 1.00 0.00 H new ATOM 0 HB2 PRO A 93 0.442 2.064 2.738 1.00 0.00 H new ATOM 0 HB3 PRO A 93 1.609 3.086 3.552 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -1.386 3.011 3.864 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.154 3.138 5.103 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -1.527 5.321 4.226 1.00 0.00 H new ATOM 0 HD3 PRO A 93 0.133 5.443 4.772 1.00 0.00 H new ATOM 1341 N PHE A 94 0.131 2.664 0.071 1.00 0.00 N ATOM 1342 CA PHE A 94 -0.621 2.080 -1.034 1.00 0.00 C ATOM 1343 C PHE A 94 -1.132 0.689 -0.668 1.00 0.00 C ATOM 1344 O PHE A 94 -0.360 -0.266 -0.577 1.00 0.00 O ATOM 1345 CB PHE A 94 0.253 2.000 -2.288 1.00 0.00 C ATOM 1346 CG PHE A 94 0.249 3.263 -3.102 1.00 0.00 C ATOM 1347 CD1 PHE A 94 0.513 4.486 -2.508 1.00 0.00 C ATOM 1348 CD2 PHE A 94 -0.020 3.226 -4.461 1.00 0.00 C ATOM 1349 CE1 PHE A 94 0.510 5.650 -3.254 1.00 0.00 C ATOM 1350 CE2 PHE A 94 -0.024 4.386 -5.212 1.00 0.00 C ATOM 1351 CZ PHE A 94 0.241 5.599 -4.608 1.00 0.00 C ATOM 0 H PHE A 94 1.083 2.311 0.167 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.478 2.722 -1.237 1.00 0.00 H new ATOM 0 HB2 PHE A 94 1.277 1.770 -1.994 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -0.093 1.175 -2.910 1.00 0.00 H new ATOM 0 HD1 PHE A 94 0.724 4.531 -1.450 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.229 2.280 -4.938 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.718 6.597 -2.779 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.234 4.344 -6.271 1.00 0.00 H new ATOM 0 HZ PHE A 94 0.238 6.507 -5.193 1.00 0.00 H new ATOM 1361 N THR A 95 -2.441 0.583 -0.458 1.00 0.00 N ATOM 1362 CA THR A 95 -3.056 -0.689 -0.100 1.00 0.00 C ATOM 1363 C THR A 95 -3.517 -1.445 -1.341 1.00 0.00 C ATOM 1364 O THR A 95 -4.536 -1.108 -1.944 1.00 0.00 O ATOM 1365 CB THR A 95 -4.260 -0.485 0.839 1.00 0.00 C ATOM 1366 OG1 THR A 95 -3.892 0.366 1.929 1.00 0.00 O ATOM 1367 CG2 THR A 95 -4.759 -1.818 1.376 1.00 0.00 C ATOM 0 H THR A 95 -3.095 1.363 -0.530 1.00 0.00 H new ATOM 0 HA THR A 95 -2.295 -1.274 0.417 1.00 0.00 H new ATOM 0 HB THR A 95 -5.063 -0.018 0.269 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.663 0.492 2.520 1.00 0.00 H new ATOM 0 HG21 THR A 95 -5.609 -1.649 2.037 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.066 -2.453 0.545 1.00 0.00 H new ATOM 0 HG23 THR A 95 -3.960 -2.309 1.932 1.00 0.00 H new ATOM 1375 N VAL A 96 -2.759 -2.470 -1.719 1.00 0.00 N ATOM 1376 CA VAL A 96 -3.091 -3.276 -2.888 1.00 0.00 C ATOM 1377 C VAL A 96 -3.768 -4.580 -2.482 1.00 0.00 C ATOM 1378 O VAL A 96 -3.156 -5.440 -1.847 1.00 0.00 O ATOM 1379 CB VAL A 96 -1.836 -3.599 -3.721 1.00 0.00 C ATOM 1380 CG1 VAL A 96 -2.223 -4.270 -5.030 1.00 0.00 C ATOM 1381 CG2 VAL A 96 -1.028 -2.336 -3.977 1.00 0.00 C ATOM 0 H VAL A 96 -1.911 -2.762 -1.233 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.779 -2.687 -3.494 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.213 -4.292 -3.156 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -1.324 -4.491 -5.605 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.756 -5.197 -4.820 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.867 -3.603 -5.604 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -0.145 -2.582 -4.567 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.640 -1.617 -4.522 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.720 -1.902 -3.026 1.00 0.00 H new ATOM 1391 N LYS A 97 -5.036 -4.723 -2.853 1.00 0.00 N ATOM 1392 CA LYS A 97 -5.798 -5.923 -2.530 1.00 0.00 C ATOM 1393 C LYS A 97 -5.643 -6.976 -3.622 1.00 0.00 C ATOM 1394 O LYS A 97 -6.135 -6.804 -4.738 1.00 0.00 O ATOM 1395 CB LYS A 97 -7.277 -5.579 -2.345 1.00 0.00 C ATOM 1396 CG LYS A 97 -7.641 -5.206 -0.919 1.00 0.00 C ATOM 1397 CD LYS A 97 -8.019 -6.430 -0.101 1.00 0.00 C ATOM 1398 CE LYS A 97 -8.904 -6.061 1.080 1.00 0.00 C ATOM 1399 NZ LYS A 97 -9.212 -7.242 1.932 1.00 0.00 N ATOM 0 H LYS A 97 -5.558 -4.022 -3.378 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.407 -6.331 -1.598 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.534 -4.751 -3.005 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.881 -6.432 -2.654 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -6.799 -4.699 -0.448 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.473 -4.502 -0.927 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -8.539 -7.147 -0.736 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -7.115 -6.921 0.260 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -8.408 -5.299 1.681 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.834 -5.624 0.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.817 -6.949 2.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.708 -7.959 1.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.327 -7.644 2.301 1.00 0.00 H new ATOM 1413 N ILE A 98 -4.958 -8.067 -3.294 1.00 0.00 N ATOM 1414 CA ILE A 98 -4.741 -9.148 -4.247 1.00 0.00 C ATOM 1415 C ILE A 98 -5.869 -10.173 -4.181 1.00 0.00 C ATOM 1416 O ILE A 98 -6.193 -10.687 -3.111 1.00 0.00 O ATOM 1417 CB ILE A 98 -3.400 -9.861 -3.994 1.00 0.00 C ATOM 1418 CG1 ILE A 98 -2.251 -8.851 -4.003 1.00 0.00 C ATOM 1419 CG2 ILE A 98 -3.170 -10.943 -5.038 1.00 0.00 C ATOM 1420 CD1 ILE A 98 -2.137 -8.077 -5.298 1.00 0.00 C ATOM 0 H ILE A 98 -4.544 -8.225 -2.375 1.00 0.00 H new ATOM 0 HA ILE A 98 -4.721 -8.696 -5.238 1.00 0.00 H new ATOM 0 HB ILE A 98 -3.436 -10.333 -3.012 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.389 -8.149 -3.181 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -1.314 -9.377 -3.820 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -2.218 -11.438 -4.846 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -3.976 -11.675 -4.987 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -3.151 -10.493 -6.030 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -1.302 -7.380 -5.233 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -1.968 -8.770 -6.122 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -3.059 -7.523 -5.473 1.00 0.00 H new ATOM 1432 N SER A 99 -6.463 -10.466 -5.334 1.00 0.00 N ATOM 1433 CA SER A 99 -7.556 -11.428 -5.408 1.00 0.00 C ATOM 1434 C SER A 99 -7.080 -12.822 -5.010 1.00 0.00 C ATOM 1435 O SER A 99 -7.514 -13.373 -3.999 1.00 0.00 O ATOM 1436 CB SER A 99 -8.141 -11.460 -6.821 1.00 0.00 C ATOM 1437 OG SER A 99 -9.005 -10.358 -7.041 1.00 0.00 O ATOM 0 H SER A 99 -6.205 -10.051 -6.229 1.00 0.00 H new ATOM 0 HA SER A 99 -8.331 -11.114 -4.709 1.00 0.00 H new ATOM 0 HB2 SER A 99 -7.333 -11.444 -7.553 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.688 -12.391 -6.970 1.00 0.00 H new ATOM 0 HG SER A 99 -9.364 -10.401 -7.952 1.00 0.00 H new ATOM 1443 N GLY A 100 -6.185 -13.387 -5.815 1.00 0.00 N ATOM 1444 CA GLY A 100 -5.665 -14.712 -5.531 1.00 0.00 C ATOM 1445 C GLY A 100 -6.027 -15.719 -6.605 1.00 0.00 C ATOM 1446 O GLY A 100 -5.927 -15.427 -7.796 1.00 0.00 O ATOM 0 H GLY A 100 -5.811 -12.951 -6.658 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -4.580 -14.661 -5.436 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -6.053 -15.053 -4.571 1.00 0.00 H new ATOM 1450 N GLU A 101 -6.447 -16.907 -6.182 1.00 0.00 N ATOM 1451 CA GLU A 101 -6.822 -17.961 -7.117 1.00 0.00 C ATOM 1452 C GLU A 101 -8.028 -17.542 -7.954 1.00 0.00 C ATOM 1453 O GLU A 101 -8.991 -16.978 -7.436 1.00 0.00 O ATOM 1454 CB GLU A 101 -7.136 -19.255 -6.363 1.00 0.00 C ATOM 1455 CG GLU A 101 -8.466 -19.224 -5.629 1.00 0.00 C ATOM 1456 CD GLU A 101 -8.488 -20.143 -4.423 1.00 0.00 C ATOM 1457 OE1 GLU A 101 -7.861 -19.794 -3.400 1.00 0.00 O ATOM 1458 OE2 GLU A 101 -9.130 -21.211 -4.502 1.00 0.00 O ATOM 0 H GLU A 101 -6.536 -17.163 -5.199 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.979 -18.134 -7.786 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -7.140 -20.085 -7.069 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -6.339 -19.450 -5.645 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.676 -18.204 -5.308 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -9.262 -19.512 -6.315 1.00 0.00 H new ATOM 1465 N GLY A 102 -7.966 -17.822 -9.253 1.00 0.00 N ATOM 1466 CA GLY A 102 -9.057 -17.466 -10.141 1.00 0.00 C ATOM 1467 C GLY A 102 -8.636 -16.479 -11.211 1.00 0.00 C ATOM 1468 O GLY A 102 -8.021 -15.455 -10.912 1.00 0.00 O ATOM 0 H GLY A 102 -7.180 -18.289 -9.705 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -9.444 -18.368 -10.615 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -9.872 -17.038 -9.557 1.00 0.00 H new ATOM 1472 N ARG A 103 -8.965 -16.787 -12.461 1.00 0.00 N ATOM 1473 CA ARG A 103 -8.615 -15.920 -13.579 1.00 0.00 C ATOM 1474 C ARG A 103 -9.719 -15.918 -14.633 1.00 0.00 C ATOM 1475 O ARG A 103 -10.501 -16.863 -14.729 1.00 0.00 O ATOM 1476 CB ARG A 103 -7.296 -16.373 -14.209 1.00 0.00 C ATOM 1477 CG ARG A 103 -7.329 -17.798 -14.736 1.00 0.00 C ATOM 1478 CD ARG A 103 -6.125 -18.095 -15.615 1.00 0.00 C ATOM 1479 NE ARG A 103 -5.843 -19.526 -15.692 1.00 0.00 N ATOM 1480 CZ ARG A 103 -5.436 -20.252 -14.656 1.00 0.00 C ATOM 1481 NH1 ARG A 103 -5.265 -19.683 -13.470 1.00 0.00 N ATOM 1482 NH2 ARG A 103 -5.200 -21.549 -14.805 1.00 0.00 N ATOM 0 H ARG A 103 -9.474 -17.631 -12.725 1.00 0.00 H new ATOM 0 HA ARG A 103 -8.499 -14.906 -13.197 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -7.043 -15.698 -15.027 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -6.501 -16.287 -13.468 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -7.351 -18.496 -13.899 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -8.245 -17.955 -15.306 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -6.303 -17.706 -16.618 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -5.252 -17.574 -15.222 1.00 0.00 H new ATOM 0 HE ARG A 103 -5.965 -19.994 -16.590 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -5.446 -18.686 -13.352 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -4.953 -20.242 -12.676 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -5.331 -21.990 -15.715 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -4.888 -22.105 -14.009 1.00 0.00 H new ATOM 1496 N VAL A 104 -9.776 -14.849 -15.420 1.00 0.00 N ATOM 1497 CA VAL A 104 -10.783 -14.723 -16.467 1.00 0.00 C ATOM 1498 C VAL A 104 -10.195 -15.042 -17.837 1.00 0.00 C ATOM 1499 O VAL A 104 -9.047 -14.704 -18.126 1.00 0.00 O ATOM 1500 CB VAL A 104 -11.387 -13.307 -16.497 1.00 0.00 C ATOM 1501 CG1 VAL A 104 -10.327 -12.281 -16.868 1.00 0.00 C ATOM 1502 CG2 VAL A 104 -12.559 -13.249 -17.465 1.00 0.00 C ATOM 0 H VAL A 104 -9.137 -14.057 -15.353 1.00 0.00 H new ATOM 0 HA VAL A 104 -11.570 -15.441 -16.237 1.00 0.00 H new ATOM 0 HB VAL A 104 -11.756 -13.067 -15.500 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -10.773 -11.287 -16.884 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -9.523 -12.306 -16.132 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -9.924 -12.514 -17.854 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -12.974 -12.241 -17.474 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -12.217 -13.509 -18.467 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -13.327 -13.955 -17.149 1.00 0.00 H new ATOM 1512 N LYS A 105 -10.989 -15.695 -18.678 1.00 0.00 N ATOM 1513 CA LYS A 105 -10.550 -16.059 -20.020 1.00 0.00 C ATOM 1514 C LYS A 105 -11.483 -15.475 -21.076 1.00 0.00 C ATOM 1515 O LYS A 105 -12.574 -15.000 -20.759 1.00 0.00 O ATOM 1516 CB LYS A 105 -10.489 -17.582 -20.163 1.00 0.00 C ATOM 1517 CG LYS A 105 -9.530 -18.053 -21.243 1.00 0.00 C ATOM 1518 CD LYS A 105 -9.224 -19.535 -21.109 1.00 0.00 C ATOM 1519 CE LYS A 105 -8.492 -20.066 -22.331 1.00 0.00 C ATOM 1520 NZ LYS A 105 -9.424 -20.344 -23.459 1.00 0.00 N ATOM 0 H LYS A 105 -11.941 -15.983 -18.454 1.00 0.00 H new ATOM 0 HA LYS A 105 -9.553 -15.645 -20.174 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -10.191 -18.017 -19.209 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -11.487 -17.958 -20.386 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -9.961 -17.857 -22.225 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -8.603 -17.482 -21.182 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -8.618 -19.703 -20.219 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -10.153 -20.088 -20.971 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -7.743 -19.341 -22.649 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -7.959 -20.979 -22.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -9.356 -21.347 -23.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -10.398 -20.129 -23.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -9.169 -19.750 -24.274 1.00 0.00 H new ATOM 1534 N SER A 106 -11.048 -15.516 -22.331 1.00 0.00 N ATOM 1535 CA SER A 106 -11.845 -14.989 -23.433 1.00 0.00 C ATOM 1536 C SER A 106 -13.231 -15.625 -23.454 1.00 0.00 C ATOM 1537 O SER A 106 -14.244 -14.935 -23.344 1.00 0.00 O ATOM 1538 CB SER A 106 -11.137 -15.238 -24.766 1.00 0.00 C ATOM 1539 OG SER A 106 -10.806 -16.607 -24.920 1.00 0.00 O ATOM 0 H SER A 106 -10.149 -15.908 -22.610 1.00 0.00 H new ATOM 0 HA SER A 106 -11.960 -13.915 -23.285 1.00 0.00 H new ATOM 0 HB2 SER A 106 -11.780 -14.922 -25.587 1.00 0.00 H new ATOM 0 HB3 SER A 106 -10.231 -14.634 -24.819 1.00 0.00 H new ATOM 0 HG SER A 106 -10.356 -16.740 -25.780 1.00 0.00 H new ATOM 1545 N GLY A 107 -13.268 -16.946 -23.596 1.00 0.00 N ATOM 1546 CA GLY A 107 -14.534 -17.654 -23.630 1.00 0.00 C ATOM 1547 C GLY A 107 -14.380 -19.098 -24.065 1.00 0.00 C ATOM 1548 O GLY A 107 -14.768 -19.480 -25.169 1.00 0.00 O ATOM 0 H GLY A 107 -12.443 -17.539 -23.688 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.991 -17.623 -22.641 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -15.214 -17.143 -24.312 1.00 0.00 H new ATOM 1552 N PRO A 108 -13.799 -19.927 -23.185 1.00 0.00 N ATOM 1553 CA PRO A 108 -13.580 -21.349 -23.463 1.00 0.00 C ATOM 1554 C PRO A 108 -14.883 -22.141 -23.497 1.00 0.00 C ATOM 1555 O PRO A 108 -15.343 -22.643 -22.472 1.00 0.00 O ATOM 1556 CB PRO A 108 -12.707 -21.809 -22.293 1.00 0.00 C ATOM 1557 CG PRO A 108 -13.020 -20.858 -21.190 1.00 0.00 C ATOM 1558 CD PRO A 108 -13.313 -19.539 -21.850 1.00 0.00 C ATOM 0 HA PRO A 108 -13.125 -21.507 -24.441 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -12.936 -22.836 -22.008 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -11.649 -21.779 -22.553 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -13.876 -21.202 -20.609 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -12.181 -20.771 -20.500 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -14.063 -18.971 -21.299 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -12.422 -18.914 -21.912 1.00 0.00 H new ATOM 1566 N SER A 109 -15.475 -22.247 -24.683 1.00 0.00 N ATOM 1567 CA SER A 109 -16.727 -22.975 -24.850 1.00 0.00 C ATOM 1568 C SER A 109 -16.698 -23.822 -26.118 1.00 0.00 C ATOM 1569 O SER A 109 -15.968 -23.522 -27.062 1.00 0.00 O ATOM 1570 CB SER A 109 -17.905 -22.000 -24.901 1.00 0.00 C ATOM 1571 OG SER A 109 -18.382 -21.707 -23.599 1.00 0.00 O ATOM 0 H SER A 109 -15.107 -21.838 -25.542 1.00 0.00 H new ATOM 0 HA SER A 109 -16.850 -23.638 -23.994 1.00 0.00 H new ATOM 0 HB2 SER A 109 -17.597 -21.078 -25.395 1.00 0.00 H new ATOM 0 HB3 SER A 109 -18.710 -22.428 -25.499 1.00 0.00 H new ATOM 0 HG SER A 109 -19.133 -21.081 -23.659 1.00 0.00 H new ATOM 1577 N SER A 110 -17.498 -24.883 -26.132 1.00 0.00 N ATOM 1578 CA SER A 110 -17.563 -25.778 -27.282 1.00 0.00 C ATOM 1579 C SER A 110 -17.948 -25.013 -28.544 1.00 0.00 C ATOM 1580 O SER A 110 -18.999 -24.375 -28.600 1.00 0.00 O ATOM 1581 CB SER A 110 -18.569 -26.901 -27.025 1.00 0.00 C ATOM 1582 OG SER A 110 -19.900 -26.440 -27.186 1.00 0.00 O ATOM 0 H SER A 110 -18.111 -25.144 -25.360 1.00 0.00 H new ATOM 0 HA SER A 110 -16.574 -26.213 -27.429 1.00 0.00 H new ATOM 0 HB2 SER A 110 -18.381 -27.726 -27.712 1.00 0.00 H new ATOM 0 HB3 SER A 110 -18.435 -27.290 -26.016 1.00 0.00 H new ATOM 0 HG SER A 110 -19.890 -25.545 -27.586 1.00 0.00 H new ATOM 1588 N GLY A 111 -17.089 -25.082 -29.556 1.00 0.00 N ATOM 1589 CA GLY A 111 -17.356 -24.392 -30.804 1.00 0.00 C ATOM 1590 C GLY A 111 -16.558 -24.958 -31.962 1.00 0.00 C ATOM 1591 O GLY A 111 -16.013 -24.210 -32.774 1.00 0.00 O ATOM 0 H GLY A 111 -16.213 -25.604 -29.534 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -18.420 -24.459 -31.032 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -17.121 -23.334 -30.688 1.00 0.00 H new TER 1595 GLY A 111