USER MOD reduce.3.24.130724 H: found=0, std=0, add=899, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 899 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 Set 1.1: A 49 LYS NZ :NH3+ -168:sc=-0.00402 (180deg=-0.168) USER MOD Set 1.2: A 50 ASN : amide:sc= 0 X(o=-0.004,f=-0.17) USER MOD Set 2.1: A 18 THR OG1 : rot -88:sc= 1.24 USER MOD Set 2.2: A 21 SER OG : rot 103:sc= 0.92 USER MOD Single : A 1 MET CE :methyl -163:sc= -0.0106 (180deg=-0.484) USER MOD Single : A 1 MET N :NH3+ 178:sc= -0.291 (180deg=-0.298) USER MOD Single : A 6 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0514) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.035 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 158:sc= 0.83 USER MOD Single : A 17 ASN : amide:sc= -0.138 K(o=-0.14,f=-1.1) USER MOD Single : A 20 ASN : amide:sc= -2.64! C(o=-2.6!,f=-8.1!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 88:sc= 1.22 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.138) USER MOD Single : A 40 TYR OH : rot -32:sc= -2.53! USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0.764 K(o=0.76,f=-5.5!) USER MOD Single : A 58 LYS NZ :NH3+ -168:sc=-0.00341 (180deg=-0.149) USER MOD Single : A 62 THR OG1 : rot -109:sc= 0 USER MOD Single : A 64 THR OG1 : rot -67:sc= -0.463! USER MOD Single : A 67 LYS NZ :NH3+ 177:sc= -0.0984 (180deg=-0.136) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -1.04! C(o=-1!,f=-9.1!) USER MOD Single : A 85 LYS NZ :NH3+ -172:sc=-0.000779 (180deg=-0.0872) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -147:sc= 0.0671 (180deg=-0.14) USER MOD Single : A 106 LYS NZ :NH3+ 165:sc= -0.0309 (180deg=-0.253) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.154 -5.730 -22.208 1.00 0.00 N ATOM 2 CA MET A 1 -10.879 -5.636 -20.913 1.00 0.00 C ATOM 3 C MET A 1 -10.898 -6.983 -20.201 1.00 0.00 C ATOM 4 O MET A 1 -11.767 -7.249 -19.370 1.00 0.00 O ATOM 5 CB MET A 1 -12.314 -5.148 -21.139 1.00 0.00 C ATOM 6 CG MET A 1 -12.399 -3.773 -21.787 1.00 0.00 C ATOM 7 SD MET A 1 -11.503 -2.510 -20.862 1.00 0.00 S ATOM 8 CE MET A 1 -12.470 -2.435 -19.356 1.00 0.00 C ATOM 0 H1 MET A 1 -10.184 -4.809 -22.690 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.164 -5.998 -22.033 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.606 -6.449 -22.808 1.00 0.00 H new ATOM 0 HA MET A 1 -10.352 -4.918 -20.284 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.839 -5.868 -21.767 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.834 -5.121 -20.181 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.999 -3.828 -22.800 1.00 0.00 H new ATOM 0 HG3 MET A 1 -13.446 -3.481 -21.873 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.239 -1.514 -18.821 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.531 -2.454 -19.604 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.229 -3.291 -18.726 1.00 0.00 H new ATOM 20 N ALA A 2 -9.934 -7.832 -20.537 1.00 0.00 N ATOM 21 CA ALA A 2 -9.831 -9.152 -19.927 1.00 0.00 C ATOM 22 C ALA A 2 -9.152 -9.064 -18.561 1.00 0.00 C ATOM 23 O ALA A 2 -8.017 -8.596 -18.460 1.00 0.00 O ATOM 24 CB ALA A 2 -9.063 -10.097 -20.840 1.00 0.00 C ATOM 0 H ALA A 2 -9.212 -7.630 -21.229 1.00 0.00 H new ATOM 0 HA ALA A 2 -10.838 -9.544 -19.784 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -8.994 -11.079 -20.372 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -9.584 -10.185 -21.793 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -8.060 -9.704 -21.010 1.00 0.00 H new ATOM 30 N PRO A 3 -9.846 -9.500 -17.490 1.00 0.00 N ATOM 31 CA PRO A 3 -9.302 -9.474 -16.121 1.00 0.00 C ATOM 32 C PRO A 3 -8.025 -10.293 -15.978 1.00 0.00 C ATOM 33 O PRO A 3 -7.891 -11.369 -16.566 1.00 0.00 O ATOM 34 CB PRO A 3 -10.425 -10.086 -15.278 1.00 0.00 C ATOM 35 CG PRO A 3 -11.657 -9.883 -16.087 1.00 0.00 C ATOM 36 CD PRO A 3 -11.222 -10.031 -17.517 1.00 0.00 C ATOM 0 HA PRO A 3 -9.022 -8.464 -15.820 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -10.246 -11.144 -15.088 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -10.503 -9.597 -14.307 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -12.421 -10.617 -15.831 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -12.088 -8.898 -15.907 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -11.249 -11.071 -17.844 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -11.861 -9.467 -18.196 1.00 0.00 H new ATOM 44 N LEU A 4 -7.100 -9.788 -15.174 1.00 0.00 N ATOM 45 CA LEU A 4 -5.825 -10.457 -14.952 1.00 0.00 C ATOM 46 C LEU A 4 -5.850 -11.222 -13.634 1.00 0.00 C ATOM 47 O LEU A 4 -6.583 -10.861 -12.712 1.00 0.00 O ATOM 48 CB LEU A 4 -4.687 -9.434 -14.944 1.00 0.00 C ATOM 49 CG LEU A 4 -4.610 -8.537 -16.183 1.00 0.00 C ATOM 50 CD1 LEU A 4 -3.449 -7.562 -16.066 1.00 0.00 C ATOM 51 CD2 LEU A 4 -4.485 -9.373 -17.448 1.00 0.00 C ATOM 0 H LEU A 4 -7.209 -8.913 -14.662 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.658 -11.165 -15.764 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.794 -8.801 -14.063 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -3.742 -9.966 -14.841 1.00 0.00 H new ATOM 0 HG LEU A 4 -5.534 -7.963 -16.246 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -3.411 -6.933 -16.956 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -3.587 -6.936 -15.185 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -2.516 -8.117 -15.974 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -4.432 -8.715 -18.315 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -3.580 -9.979 -17.396 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.353 -10.025 -17.540 1.00 0.00 H new ATOM 63 N ARG A 5 -5.054 -12.283 -13.549 1.00 0.00 N ATOM 64 CA ARG A 5 -4.998 -13.092 -12.336 1.00 0.00 C ATOM 65 C ARG A 5 -4.153 -12.403 -11.268 1.00 0.00 C ATOM 66 O ARG A 5 -3.002 -12.043 -11.522 1.00 0.00 O ATOM 67 CB ARG A 5 -4.414 -14.479 -12.633 1.00 0.00 C ATOM 68 CG ARG A 5 -5.054 -15.196 -13.817 1.00 0.00 C ATOM 69 CD ARG A 5 -6.541 -15.434 -13.606 1.00 0.00 C ATOM 70 NE ARG A 5 -7.355 -14.487 -14.364 1.00 0.00 N ATOM 71 CZ ARG A 5 -8.680 -14.416 -14.285 1.00 0.00 C ATOM 72 NH1 ARG A 5 -9.341 -15.211 -13.455 1.00 0.00 N ATOM 73 NH2 ARG A 5 -9.342 -13.540 -15.032 1.00 0.00 N ATOM 0 H ARG A 5 -4.442 -12.602 -14.300 1.00 0.00 H new ATOM 0 HA ARG A 5 -6.017 -13.208 -11.966 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -3.345 -14.376 -12.822 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -4.523 -15.102 -11.745 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -4.907 -14.605 -14.721 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -4.553 -16.151 -13.976 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -6.792 -16.451 -13.906 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -6.776 -15.348 -12.545 1.00 0.00 H new ATOM 0 HE ARG A 5 -6.877 -13.841 -14.992 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -8.833 -15.879 -12.875 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -10.358 -15.155 -13.396 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -8.834 -12.923 -15.665 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -10.359 -13.484 -14.972 1.00 0.00 H new ATOM 87 N LYS A 6 -4.745 -12.228 -10.078 1.00 0.00 N ATOM 88 CA LYS A 6 -4.084 -11.593 -8.921 1.00 0.00 C ATOM 89 C LYS A 6 -3.854 -10.096 -9.113 1.00 0.00 C ATOM 90 O LYS A 6 -4.181 -9.297 -8.234 1.00 0.00 O ATOM 91 CB LYS A 6 -2.759 -12.289 -8.583 1.00 0.00 C ATOM 92 CG LYS A 6 -2.892 -13.781 -8.301 1.00 0.00 C ATOM 93 CD LYS A 6 -3.773 -14.051 -7.089 1.00 0.00 C ATOM 94 CE LYS A 6 -3.761 -15.523 -6.711 1.00 0.00 C ATOM 95 NZ LYS A 6 -4.313 -16.383 -7.795 1.00 0.00 N ATOM 0 H LYS A 6 -5.702 -12.524 -9.887 1.00 0.00 H new ATOM 0 HA LYS A 6 -4.772 -11.711 -8.084 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.065 -12.148 -9.412 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.318 -11.804 -7.712 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -3.312 -14.280 -9.174 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -1.903 -14.209 -8.134 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -3.426 -13.454 -6.245 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -4.795 -13.737 -7.303 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.740 -15.832 -6.488 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -4.343 -15.668 -5.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -4.381 -17.365 -7.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -5.259 -16.042 -8.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -3.685 -16.344 -8.623 1.00 0.00 H new ATOM 109 N THR A 7 -3.296 -9.717 -10.247 1.00 0.00 N ATOM 110 CA THR A 7 -3.025 -8.317 -10.525 1.00 0.00 C ATOM 111 C THR A 7 -4.255 -7.593 -11.055 1.00 0.00 C ATOM 112 O THR A 7 -4.882 -8.020 -12.024 1.00 0.00 O ATOM 113 CB THR A 7 -1.870 -8.143 -11.528 1.00 0.00 C ATOM 114 OG1 THR A 7 -1.894 -9.203 -12.492 1.00 0.00 O ATOM 115 CG2 THR A 7 -0.527 -8.120 -10.815 1.00 0.00 C ATOM 0 H THR A 7 -3.021 -10.358 -10.991 1.00 0.00 H new ATOM 0 HA THR A 7 -2.737 -7.874 -9.571 1.00 0.00 H new ATOM 0 HB THR A 7 -2.002 -7.189 -12.038 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.157 -9.084 -13.127 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.271 -7.996 -11.547 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.504 -7.290 -10.109 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.384 -9.058 -10.278 1.00 0.00 H new ATOM 123 N ALA A 8 -4.580 -6.490 -10.404 1.00 0.00 N ATOM 124 CA ALA A 8 -5.717 -5.664 -10.782 1.00 0.00 C ATOM 125 C ALA A 8 -5.243 -4.405 -11.494 1.00 0.00 C ATOM 126 O ALA A 8 -4.121 -3.945 -11.272 1.00 0.00 O ATOM 127 CB ALA A 8 -6.540 -5.313 -9.557 1.00 0.00 C ATOM 0 H ALA A 8 -4.063 -6.140 -9.597 1.00 0.00 H new ATOM 0 HA ALA A 8 -6.348 -6.227 -11.470 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.388 -4.695 -9.853 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -6.904 -6.228 -9.089 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -5.921 -4.764 -8.848 1.00 0.00 H new ATOM 133 N VAL A 9 -6.094 -3.842 -12.342 1.00 0.00 N ATOM 134 CA VAL A 9 -5.724 -2.652 -13.090 1.00 0.00 C ATOM 135 C VAL A 9 -6.467 -1.430 -12.563 1.00 0.00 C ATOM 136 O VAL A 9 -7.700 -1.400 -12.518 1.00 0.00 O ATOM 137 CB VAL A 9 -6.013 -2.819 -14.598 1.00 0.00 C ATOM 138 CG1 VAL A 9 -5.642 -1.554 -15.372 1.00 0.00 C ATOM 139 CG2 VAL A 9 -5.260 -4.020 -15.155 1.00 0.00 C ATOM 0 H VAL A 9 -7.036 -4.187 -12.527 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.652 -2.508 -12.956 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.083 -2.989 -14.719 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.856 -1.700 -16.431 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.225 -0.713 -14.996 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.580 -1.346 -15.242 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.475 -4.123 -16.219 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.189 -3.875 -15.014 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.576 -4.922 -14.632 1.00 0.00 H new ATOM 149 N LEU A 10 -5.703 -0.424 -12.177 1.00 0.00 N ATOM 150 CA LEU A 10 -6.257 0.814 -11.661 1.00 0.00 C ATOM 151 C LEU A 10 -5.897 1.915 -12.648 1.00 0.00 C ATOM 152 O LEU A 10 -4.721 2.090 -12.978 1.00 0.00 O ATOM 153 CB LEU A 10 -5.691 1.097 -10.259 1.00 0.00 C ATOM 154 CG LEU A 10 -6.323 2.263 -9.485 1.00 0.00 C ATOM 155 CD1 LEU A 10 -7.809 2.017 -9.237 1.00 0.00 C ATOM 156 CD2 LEU A 10 -5.599 2.459 -8.165 1.00 0.00 C ATOM 0 H LEU A 10 -4.684 -0.442 -12.212 1.00 0.00 H new ATOM 0 HA LEU A 10 -7.341 0.754 -11.559 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.797 0.193 -9.660 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.623 1.291 -10.356 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.226 3.166 -10.087 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.230 2.859 -8.687 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -8.325 1.912 -10.192 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.934 1.104 -8.655 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -6.052 3.288 -7.621 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -5.675 1.549 -7.570 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -4.549 2.681 -8.355 1.00 0.00 H new ATOM 168 N LYS A 11 -6.886 2.662 -13.126 1.00 0.00 N ATOM 169 CA LYS A 11 -6.611 3.700 -14.111 1.00 0.00 C ATOM 170 C LYS A 11 -6.880 5.087 -13.553 1.00 0.00 C ATOM 171 O LYS A 11 -7.867 5.316 -12.849 1.00 0.00 O ATOM 172 CB LYS A 11 -7.443 3.503 -15.385 1.00 0.00 C ATOM 173 CG LYS A 11 -7.052 2.281 -16.198 1.00 0.00 C ATOM 174 CD LYS A 11 -7.886 2.173 -17.465 1.00 0.00 C ATOM 175 CE LYS A 11 -7.473 0.975 -18.304 1.00 0.00 C ATOM 176 NZ LYS A 11 -8.289 0.854 -19.543 1.00 0.00 N ATOM 0 H LYS A 11 -7.865 2.572 -12.855 1.00 0.00 H new ATOM 0 HA LYS A 11 -5.553 3.616 -14.359 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -8.495 3.422 -15.110 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.344 4.390 -16.011 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -5.995 2.338 -16.459 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.184 1.383 -15.595 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -8.940 2.088 -17.202 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -7.777 3.085 -18.052 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.420 1.065 -18.571 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.575 0.065 -17.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.975 0.024 -20.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.291 0.742 -19.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.172 1.711 -20.121 1.00 0.00 H new ATOM 190 N LEU A 12 -5.983 6.006 -13.872 1.00 0.00 N ATOM 191 CA LEU A 12 -6.112 7.382 -13.439 1.00 0.00 C ATOM 192 C LEU A 12 -6.353 8.272 -14.649 1.00 0.00 C ATOM 193 O LEU A 12 -5.564 8.258 -15.596 1.00 0.00 O ATOM 194 CB LEU A 12 -4.841 7.838 -12.716 1.00 0.00 C ATOM 195 CG LEU A 12 -5.053 8.502 -11.352 1.00 0.00 C ATOM 196 CD1 LEU A 12 -3.721 8.950 -10.771 1.00 0.00 C ATOM 197 CD2 LEU A 12 -6.004 9.684 -11.461 1.00 0.00 C ATOM 0 H LEU A 12 -5.153 5.819 -14.434 1.00 0.00 H new ATOM 0 HA LEU A 12 -6.954 7.457 -12.750 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.192 6.973 -12.581 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.310 8.538 -13.361 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.501 7.767 -10.684 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -3.887 9.420 -9.802 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.068 8.086 -10.648 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.252 9.666 -11.446 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.136 10.136 -10.478 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.590 10.422 -12.147 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.969 9.342 -11.836 1.00 0.00 H new ATOM 209 N TYR A 13 -7.426 9.036 -14.637 1.00 0.00 N ATOM 210 CA TYR A 13 -7.729 9.932 -15.738 1.00 0.00 C ATOM 211 C TYR A 13 -7.278 11.331 -15.351 1.00 0.00 C ATOM 212 O TYR A 13 -7.753 11.884 -14.363 1.00 0.00 O ATOM 213 CB TYR A 13 -9.233 9.919 -16.019 1.00 0.00 C ATOM 214 CG TYR A 13 -9.759 8.570 -16.471 1.00 0.00 C ATOM 215 CD1 TYR A 13 -10.170 7.617 -15.546 1.00 0.00 C ATOM 216 CD2 TYR A 13 -9.852 8.254 -17.819 1.00 0.00 C ATOM 217 CE1 TYR A 13 -10.652 6.387 -15.952 1.00 0.00 C ATOM 218 CE2 TYR A 13 -10.335 7.026 -18.235 1.00 0.00 C ATOM 219 CZ TYR A 13 -10.734 6.097 -17.297 1.00 0.00 C ATOM 220 OH TYR A 13 -11.214 4.873 -17.704 1.00 0.00 O ATOM 0 H TYR A 13 -8.105 9.056 -13.876 1.00 0.00 H new ATOM 0 HA TYR A 13 -7.209 9.611 -16.641 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -9.764 10.222 -15.117 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -9.457 10.661 -16.785 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -10.112 7.842 -14.491 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -9.542 8.979 -18.556 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -10.963 5.657 -15.219 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -10.399 6.796 -19.288 1.00 0.00 H new ATOM 0 HH TYR A 13 -11.538 4.939 -18.627 1.00 0.00 H new ATOM 230 N VAL A 14 -6.367 11.903 -16.120 1.00 0.00 N ATOM 231 CA VAL A 14 -5.844 13.225 -15.810 1.00 0.00 C ATOM 232 C VAL A 14 -5.955 14.167 -16.995 1.00 0.00 C ATOM 233 O VAL A 14 -6.107 13.732 -18.139 1.00 0.00 O ATOM 234 CB VAL A 14 -4.368 13.157 -15.356 1.00 0.00 C ATOM 235 CG1 VAL A 14 -4.252 12.437 -14.017 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.507 12.476 -16.412 1.00 0.00 C ATOM 0 H VAL A 14 -5.975 11.476 -16.960 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.453 13.612 -14.993 1.00 0.00 H new ATOM 0 HB VAL A 14 -4.003 14.176 -15.229 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.206 12.399 -13.714 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.829 12.974 -13.264 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.639 11.423 -14.115 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.473 12.440 -16.070 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.870 11.462 -16.579 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.562 13.038 -17.344 1.00 0.00 H new ATOM 246 N ALA A 15 -5.870 15.460 -16.717 1.00 0.00 N ATOM 247 CA ALA A 15 -5.959 16.463 -17.759 1.00 0.00 C ATOM 248 C ALA A 15 -4.660 17.251 -17.842 1.00 0.00 C ATOM 249 O ALA A 15 -4.390 18.117 -17.003 1.00 0.00 O ATOM 250 CB ALA A 15 -7.138 17.395 -17.517 1.00 0.00 C ATOM 0 H ALA A 15 -5.740 15.835 -15.778 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.121 15.957 -18.711 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.183 18.139 -18.313 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.062 16.817 -17.507 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.014 17.897 -16.558 1.00 0.00 H new ATOM 256 N GLY A 16 -3.861 16.945 -18.865 1.00 0.00 N ATOM 257 CA GLY A 16 -2.592 17.624 -19.061 1.00 0.00 C ATOM 258 C GLY A 16 -1.640 17.434 -17.898 1.00 0.00 C ATOM 259 O GLY A 16 -1.438 16.315 -17.427 1.00 0.00 O ATOM 0 H GLY A 16 -4.074 16.234 -19.565 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.124 17.253 -19.973 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -2.773 18.689 -19.206 1.00 0.00 H new ATOM 263 N ASN A 17 -1.058 18.531 -17.432 1.00 0.00 N ATOM 264 CA ASN A 17 -0.123 18.481 -16.315 1.00 0.00 C ATOM 265 C ASN A 17 -0.508 19.508 -15.264 1.00 0.00 C ATOM 266 O ASN A 17 0.322 20.290 -14.797 1.00 0.00 O ATOM 267 CB ASN A 17 1.309 18.728 -16.802 1.00 0.00 C ATOM 268 CG ASN A 17 2.344 18.010 -15.959 1.00 0.00 C ATOM 269 OD1 ASN A 17 2.153 16.860 -15.570 1.00 0.00 O ATOM 270 ND2 ASN A 17 3.450 18.687 -15.673 1.00 0.00 N ATOM 0 H ASN A 17 -1.216 19.465 -17.809 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.168 17.488 -15.868 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.398 18.400 -17.838 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.514 19.798 -16.788 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.182 18.254 -15.110 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.568 19.640 -16.017 1.00 0.00 H new ATOM 277 N THR A 18 -1.786 19.510 -14.916 1.00 0.00 N ATOM 278 CA THR A 18 -2.309 20.413 -13.907 1.00 0.00 C ATOM 279 C THR A 18 -1.828 19.979 -12.531 1.00 0.00 C ATOM 280 O THR A 18 -1.542 18.802 -12.319 1.00 0.00 O ATOM 281 CB THR A 18 -3.851 20.443 -13.950 1.00 0.00 C ATOM 282 OG1 THR A 18 -4.361 19.123 -14.185 1.00 0.00 O ATOM 283 CG2 THR A 18 -4.345 21.385 -15.037 1.00 0.00 C ATOM 0 H THR A 18 -2.485 18.889 -15.324 1.00 0.00 H new ATOM 0 HA THR A 18 -1.943 21.419 -14.113 1.00 0.00 H new ATOM 0 HB THR A 18 -4.212 20.805 -12.987 1.00 0.00 H new ATOM 0 HG1 THR A 18 -4.420 18.962 -15.150 1.00 0.00 H new ATOM 0 HG21 THR A 18 -5.435 21.389 -15.047 1.00 0.00 H new ATOM 0 HG22 THR A 18 -3.980 22.393 -14.838 1.00 0.00 H new ATOM 0 HG23 THR A 18 -3.974 21.049 -16.005 1.00 0.00 H new ATOM 291 N PRO A 19 -1.730 20.917 -11.573 1.00 0.00 N ATOM 292 CA PRO A 19 -1.257 20.610 -10.216 1.00 0.00 C ATOM 293 C PRO A 19 -2.096 19.544 -9.530 1.00 0.00 C ATOM 294 O PRO A 19 -1.582 18.764 -8.735 1.00 0.00 O ATOM 295 CB PRO A 19 -1.378 21.949 -9.480 1.00 0.00 C ATOM 296 CG PRO A 19 -2.281 22.785 -10.330 1.00 0.00 C ATOM 297 CD PRO A 19 -2.036 22.344 -11.738 1.00 0.00 C ATOM 0 HA PRO A 19 -0.245 20.205 -10.225 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -1.792 21.813 -8.481 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.403 22.421 -9.359 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -3.325 22.641 -10.051 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -2.062 23.846 -10.208 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.909 22.502 -12.371 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.209 22.887 -12.196 1.00 0.00 H new ATOM 305 N ASN A 20 -3.381 19.511 -9.847 1.00 0.00 N ATOM 306 CA ASN A 20 -4.271 18.509 -9.284 1.00 0.00 C ATOM 307 C ASN A 20 -3.930 17.135 -9.862 1.00 0.00 C ATOM 308 O ASN A 20 -3.889 16.141 -9.139 1.00 0.00 O ATOM 309 CB ASN A 20 -5.744 18.868 -9.551 1.00 0.00 C ATOM 310 CG ASN A 20 -5.997 19.363 -10.966 1.00 0.00 C ATOM 311 OD1 ASN A 20 -5.437 20.373 -11.390 1.00 0.00 O ATOM 312 ND2 ASN A 20 -6.853 18.663 -11.699 1.00 0.00 N ATOM 0 H ASN A 20 -3.829 20.164 -10.489 1.00 0.00 H new ATOM 0 HA ASN A 20 -4.131 18.481 -8.203 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -6.364 17.991 -9.364 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.057 19.636 -8.844 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -7.068 18.957 -12.652 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -7.296 17.831 -11.310 1.00 0.00 H new ATOM 319 N SER A 21 -3.684 17.094 -11.177 1.00 0.00 N ATOM 320 CA SER A 21 -3.313 15.860 -11.862 1.00 0.00 C ATOM 321 C SER A 21 -1.920 15.410 -11.443 1.00 0.00 C ATOM 322 O SER A 21 -1.694 14.224 -11.215 1.00 0.00 O ATOM 323 CB SER A 21 -3.357 16.061 -13.378 1.00 0.00 C ATOM 324 OG SER A 21 -4.677 16.333 -13.821 1.00 0.00 O ATOM 0 H SER A 21 -3.737 17.910 -11.787 1.00 0.00 H new ATOM 0 HA SER A 21 -4.029 15.087 -11.583 1.00 0.00 H new ATOM 0 HB2 SER A 21 -2.700 16.884 -13.658 1.00 0.00 H new ATOM 0 HB3 SER A 21 -2.980 15.168 -13.877 1.00 0.00 H new ATOM 0 HG SER A 21 -4.769 17.291 -14.005 1.00 0.00 H new ATOM 330 N VAL A 22 -0.992 16.355 -11.340 1.00 0.00 N ATOM 331 CA VAL A 22 0.373 16.039 -10.931 1.00 0.00 C ATOM 332 C VAL A 22 0.395 15.516 -9.499 1.00 0.00 C ATOM 333 O VAL A 22 1.041 14.511 -9.205 1.00 0.00 O ATOM 334 CB VAL A 22 1.307 17.263 -11.054 1.00 0.00 C ATOM 335 CG1 VAL A 22 2.651 16.996 -10.392 1.00 0.00 C ATOM 336 CG2 VAL A 22 1.491 17.653 -12.511 1.00 0.00 C ATOM 0 H VAL A 22 -1.158 17.343 -11.533 1.00 0.00 H new ATOM 0 HA VAL A 22 0.740 15.265 -11.605 1.00 0.00 H new ATOM 0 HB VAL A 22 0.838 18.098 -10.533 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.288 17.875 -10.494 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.499 16.779 -9.335 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.130 16.143 -10.872 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.152 18.517 -12.576 1.00 0.00 H new ATOM 0 HG22 VAL A 22 1.930 16.819 -13.058 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.523 17.903 -12.946 1.00 0.00 H new ATOM 346 N ARG A 23 -0.339 16.195 -8.625 1.00 0.00 N ATOM 347 CA ARG A 23 -0.414 15.818 -7.222 1.00 0.00 C ATOM 348 C ARG A 23 -0.998 14.422 -7.081 1.00 0.00 C ATOM 349 O ARG A 23 -0.465 13.579 -6.360 1.00 0.00 O ATOM 350 CB ARG A 23 -1.319 16.799 -6.486 1.00 0.00 C ATOM 351 CG ARG A 23 -0.976 17.000 -5.025 1.00 0.00 C ATOM 352 CD ARG A 23 -0.149 18.258 -4.831 1.00 0.00 C ATOM 353 NE ARG A 23 0.151 18.507 -3.424 1.00 0.00 N ATOM 354 CZ ARG A 23 0.901 19.519 -2.996 1.00 0.00 C ATOM 355 NH1 ARG A 23 1.424 20.374 -3.866 1.00 0.00 N ATOM 356 NH2 ARG A 23 1.129 19.675 -1.698 1.00 0.00 N ATOM 0 H ARG A 23 -0.894 17.016 -8.868 1.00 0.00 H new ATOM 0 HA ARG A 23 0.591 15.835 -6.800 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -1.275 17.763 -6.992 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -2.348 16.448 -6.559 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -1.892 17.068 -4.438 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.424 16.136 -4.655 1.00 0.00 H new ATOM 0 HD2 ARG A 23 0.783 18.168 -5.389 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -0.687 19.112 -5.243 1.00 0.00 H new ATOM 0 HE ARG A 23 -0.237 17.868 -2.729 1.00 0.00 H new ATOM 0 HH11 ARG A 23 1.251 20.256 -4.864 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.999 21.149 -3.536 1.00 0.00 H new ATOM 0 HH21 ARG A 23 0.729 19.019 -1.027 1.00 0.00 H new ATOM 0 HH22 ARG A 23 1.704 20.451 -1.371 1.00 0.00 H new ATOM 370 N ALA A 24 -2.103 14.197 -7.785 1.00 0.00 N ATOM 371 CA ALA A 24 -2.780 12.909 -7.749 1.00 0.00 C ATOM 372 C ALA A 24 -1.895 11.802 -8.316 1.00 0.00 C ATOM 373 O ALA A 24 -1.824 10.704 -7.765 1.00 0.00 O ATOM 374 CB ALA A 24 -4.090 12.975 -8.517 1.00 0.00 C ATOM 0 H ALA A 24 -2.547 14.891 -8.387 1.00 0.00 H new ATOM 0 HA ALA A 24 -2.992 12.674 -6.706 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -4.583 12.004 -8.480 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -4.738 13.728 -8.068 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.890 13.241 -9.555 1.00 0.00 H new ATOM 380 N LEU A 25 -1.223 12.111 -9.425 1.00 0.00 N ATOM 381 CA LEU A 25 -0.331 11.162 -10.088 1.00 0.00 C ATOM 382 C LEU A 25 0.822 10.755 -9.174 1.00 0.00 C ATOM 383 O LEU A 25 1.132 9.569 -9.055 1.00 0.00 O ATOM 384 CB LEU A 25 0.208 11.770 -11.389 1.00 0.00 C ATOM 385 CG LEU A 25 1.177 10.888 -12.181 1.00 0.00 C ATOM 386 CD1 LEU A 25 0.501 9.592 -12.608 1.00 0.00 C ATOM 387 CD2 LEU A 25 1.706 11.640 -13.393 1.00 0.00 C ATOM 0 H LEU A 25 -1.281 13.019 -9.886 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.903 10.264 -10.323 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.638 12.017 -12.031 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.711 12.707 -11.150 1.00 0.00 H new ATOM 0 HG LEU A 25 2.018 10.635 -11.535 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.208 8.981 -13.169 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.171 9.046 -11.725 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.360 9.821 -13.236 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.394 11.000 -13.946 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.874 11.922 -14.038 1.00 0.00 H new ATOM 0 HD23 LEU A 25 2.230 12.537 -13.064 1.00 0.00 H new ATOM 399 N LYS A 26 1.449 11.736 -8.528 1.00 0.00 N ATOM 400 CA LYS A 26 2.562 11.459 -7.621 1.00 0.00 C ATOM 401 C LYS A 26 2.088 10.632 -6.430 1.00 0.00 C ATOM 402 O LYS A 26 2.773 9.707 -5.992 1.00 0.00 O ATOM 403 CB LYS A 26 3.190 12.765 -7.123 1.00 0.00 C ATOM 404 CG LYS A 26 3.825 13.606 -8.221 1.00 0.00 C ATOM 405 CD LYS A 26 5.003 12.901 -8.873 1.00 0.00 C ATOM 406 CE LYS A 26 5.640 13.775 -9.940 1.00 0.00 C ATOM 407 NZ LYS A 26 6.791 13.100 -10.600 1.00 0.00 N ATOM 0 H LYS A 26 1.208 12.723 -8.614 1.00 0.00 H new ATOM 0 HA LYS A 26 3.313 10.892 -8.172 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.423 13.357 -6.624 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.948 12.530 -6.376 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.076 13.837 -8.979 1.00 0.00 H new ATOM 0 HG3 LYS A 26 4.158 14.556 -7.803 1.00 0.00 H new ATOM 0 HD2 LYS A 26 5.744 12.648 -8.115 1.00 0.00 H new ATOM 0 HD3 LYS A 26 4.669 11.964 -9.318 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.893 14.034 -10.690 1.00 0.00 H new ATOM 0 HE3 LYS A 26 5.977 14.709 -9.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 7.196 13.731 -11.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 7.516 12.876 -9.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 6.466 12.222 -11.052 1.00 0.00 H new ATOM 421 N THR A 27 0.909 10.971 -5.917 1.00 0.00 N ATOM 422 CA THR A 27 0.318 10.271 -4.782 1.00 0.00 C ATOM 423 C THR A 27 -0.017 8.820 -5.138 1.00 0.00 C ATOM 424 O THR A 27 0.292 7.900 -4.379 1.00 0.00 O ATOM 425 CB THR A 27 -0.956 11.008 -4.317 1.00 0.00 C ATOM 426 OG1 THR A 27 -0.627 12.351 -3.944 1.00 0.00 O ATOM 427 CG2 THR A 27 -1.604 10.314 -3.136 1.00 0.00 C ATOM 0 H THR A 27 0.338 11.737 -6.275 1.00 0.00 H new ATOM 0 HA THR A 27 1.047 10.260 -3.972 1.00 0.00 H new ATOM 0 HB THR A 27 -1.662 11.005 -5.148 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.679 12.931 -4.732 1.00 0.00 H new ATOM 0 HG21 THR A 27 -2.498 10.862 -2.837 1.00 0.00 H new ATOM 0 HG22 THR A 27 -1.879 9.297 -3.417 1.00 0.00 H new ATOM 0 HG23 THR A 27 -0.902 10.283 -2.303 1.00 0.00 H new ATOM 435 N LEU A 28 -0.625 8.621 -6.305 1.00 0.00 N ATOM 436 CA LEU A 28 -1.011 7.284 -6.755 1.00 0.00 C ATOM 437 C LEU A 28 0.198 6.418 -7.092 1.00 0.00 C ATOM 438 O LEU A 28 0.305 5.286 -6.618 1.00 0.00 O ATOM 439 CB LEU A 28 -1.911 7.377 -7.993 1.00 0.00 C ATOM 440 CG LEU A 28 -3.397 7.073 -7.770 1.00 0.00 C ATOM 441 CD1 LEU A 28 -3.578 5.702 -7.135 1.00 0.00 C ATOM 442 CD2 LEU A 28 -4.042 8.153 -6.919 1.00 0.00 C ATOM 0 H LEU A 28 -0.862 9.369 -6.957 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.549 6.818 -5.930 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.824 8.382 -8.406 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.529 6.689 -8.747 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.893 7.063 -8.740 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.640 5.507 -6.986 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.158 4.939 -7.790 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.066 5.676 -6.173 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.096 7.919 -6.772 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.543 8.200 -5.951 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.951 9.116 -7.422 1.00 0.00 H new ATOM 454 N ALA A 29 1.110 6.954 -7.905 1.00 0.00 N ATOM 455 CA ALA A 29 2.289 6.206 -8.330 1.00 0.00 C ATOM 456 C ALA A 29 3.187 5.809 -7.164 1.00 0.00 C ATOM 457 O ALA A 29 3.626 4.671 -7.095 1.00 0.00 O ATOM 458 CB ALA A 29 3.080 7.009 -9.351 1.00 0.00 C ATOM 0 H ALA A 29 1.053 7.901 -8.280 1.00 0.00 H new ATOM 0 HA ALA A 29 1.932 5.282 -8.786 1.00 0.00 H new ATOM 0 HB1 ALA A 29 3.957 6.441 -9.660 1.00 0.00 H new ATOM 0 HB2 ALA A 29 2.453 7.211 -10.220 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.397 7.952 -8.906 1.00 0.00 H new ATOM 464 N ASN A 30 3.430 6.731 -6.237 1.00 0.00 N ATOM 465 CA ASN A 30 4.291 6.445 -5.089 1.00 0.00 C ATOM 466 C ASN A 30 3.705 5.329 -4.228 1.00 0.00 C ATOM 467 O ASN A 30 4.415 4.407 -3.822 1.00 0.00 O ATOM 468 CB ASN A 30 4.493 7.708 -4.246 1.00 0.00 C ATOM 469 CG ASN A 30 5.463 7.498 -3.099 1.00 0.00 C ATOM 470 OD1 ASN A 30 6.616 7.126 -3.308 1.00 0.00 O ATOM 471 ND2 ASN A 30 5.004 7.742 -1.879 1.00 0.00 N ATOM 0 H ASN A 30 3.047 7.676 -6.255 1.00 0.00 H new ATOM 0 HA ASN A 30 5.257 6.113 -5.468 1.00 0.00 H new ATOM 0 HB2 ASN A 30 4.861 8.511 -4.885 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.531 8.032 -3.848 1.00 0.00 H new ATOM 0 HD21 ASN A 30 5.615 7.622 -1.071 1.00 0.00 H new ATOM 0 HD22 ASN A 30 4.040 8.049 -1.749 1.00 0.00 H new ATOM 478 N ILE A 31 2.410 5.418 -3.961 1.00 0.00 N ATOM 479 CA ILE A 31 1.729 4.411 -3.162 1.00 0.00 C ATOM 480 C ILE A 31 1.732 3.046 -3.847 1.00 0.00 C ATOM 481 O ILE A 31 2.019 2.029 -3.228 1.00 0.00 O ATOM 482 CB ILE A 31 0.306 4.863 -2.791 1.00 0.00 C ATOM 483 CG1 ILE A 31 0.411 5.963 -1.738 1.00 0.00 C ATOM 484 CG2 ILE A 31 -0.553 3.711 -2.297 1.00 0.00 C ATOM 485 CD1 ILE A 31 -0.882 6.682 -1.479 1.00 0.00 C ATOM 0 H ILE A 31 1.811 6.177 -4.286 1.00 0.00 H new ATOM 0 HA ILE A 31 2.288 4.298 -2.233 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.188 5.245 -3.684 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.766 5.526 -0.805 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.161 6.687 -2.057 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.548 4.080 -2.048 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.632 2.955 -3.078 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -0.096 3.271 -1.410 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.726 7.448 -0.720 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.229 7.150 -2.400 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.630 5.971 -1.129 1.00 0.00 H new ATOM 497 N LEU A 32 1.419 3.027 -5.132 1.00 0.00 N ATOM 498 CA LEU A 32 1.400 1.782 -5.886 1.00 0.00 C ATOM 499 C LEU A 32 2.805 1.189 -6.071 1.00 0.00 C ATOM 500 O LEU A 32 2.965 -0.026 -6.094 1.00 0.00 O ATOM 501 CB LEU A 32 0.688 1.988 -7.220 1.00 0.00 C ATOM 502 CG LEU A 32 -0.829 2.181 -7.093 1.00 0.00 C ATOM 503 CD1 LEU A 32 -1.427 2.664 -8.404 1.00 0.00 C ATOM 504 CD2 LEU A 32 -1.485 0.881 -6.662 1.00 0.00 C ATOM 0 H LEU A 32 1.175 3.856 -5.674 1.00 0.00 H new ATOM 0 HA LEU A 32 0.840 1.048 -5.307 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.115 2.859 -7.717 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.882 1.128 -7.861 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.016 2.942 -6.335 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.503 2.793 -8.287 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.975 3.617 -8.681 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.232 1.929 -9.185 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.561 1.028 -6.575 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.283 0.108 -7.404 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.082 0.572 -5.698 1.00 0.00 H new ATOM 516 N GLU A 33 3.811 2.047 -6.228 1.00 0.00 N ATOM 517 CA GLU A 33 5.198 1.595 -6.408 1.00 0.00 C ATOM 518 C GLU A 33 5.781 0.934 -5.158 1.00 0.00 C ATOM 519 O GLU A 33 6.610 0.037 -5.267 1.00 0.00 O ATOM 520 CB GLU A 33 6.112 2.749 -6.836 1.00 0.00 C ATOM 521 CG GLU A 33 5.848 3.246 -8.246 1.00 0.00 C ATOM 522 CD GLU A 33 6.762 4.385 -8.653 1.00 0.00 C ATOM 523 OE1 GLU A 33 7.519 4.878 -7.790 1.00 0.00 O ATOM 524 OE2 GLU A 33 6.722 4.785 -9.834 1.00 0.00 O ATOM 0 H GLU A 33 3.696 3.061 -6.235 1.00 0.00 H new ATOM 0 HA GLU A 33 5.158 0.844 -7.197 1.00 0.00 H new ATOM 0 HB2 GLU A 33 5.987 3.578 -6.139 1.00 0.00 H new ATOM 0 HB3 GLU A 33 7.150 2.425 -6.763 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.972 2.420 -8.946 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.811 3.574 -8.322 1.00 0.00 H new ATOM 531 N LYS A 34 5.395 1.399 -3.972 1.00 0.00 N ATOM 532 CA LYS A 34 5.942 0.832 -2.740 1.00 0.00 C ATOM 533 C LYS A 34 4.900 0.053 -1.935 1.00 0.00 C ATOM 534 O LYS A 34 5.098 -1.122 -1.625 1.00 0.00 O ATOM 535 CB LYS A 34 6.537 1.945 -1.870 1.00 0.00 C ATOM 536 CG LYS A 34 7.934 2.379 -2.292 1.00 0.00 C ATOM 537 CD LYS A 34 8.971 1.288 -2.052 1.00 0.00 C ATOM 538 CE LYS A 34 9.222 1.066 -0.568 1.00 0.00 C ATOM 539 NZ LYS A 34 10.305 0.075 -0.329 1.00 0.00 N ATOM 0 H LYS A 34 4.720 2.151 -3.837 1.00 0.00 H new ATOM 0 HA LYS A 34 6.720 0.127 -3.033 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.874 2.810 -1.900 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.570 1.605 -0.835 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.927 2.645 -3.349 1.00 0.00 H new ATOM 0 HG3 LYS A 34 8.217 3.275 -1.740 1.00 0.00 H new ATOM 0 HD2 LYS A 34 8.632 0.357 -2.507 1.00 0.00 H new ATOM 0 HD3 LYS A 34 9.906 1.560 -2.542 1.00 0.00 H new ATOM 0 HE2 LYS A 34 9.488 2.014 -0.099 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.304 0.722 -0.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.444 -0.047 0.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 10.041 -0.837 -0.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 11.188 0.415 -0.760 1.00 0.00 H new ATOM 553 N GLU A 35 3.797 0.714 -1.603 1.00 0.00 N ATOM 554 CA GLU A 35 2.728 0.105 -0.809 1.00 0.00 C ATOM 555 C GLU A 35 2.056 -1.076 -1.519 1.00 0.00 C ATOM 556 O GLU A 35 1.752 -2.085 -0.887 1.00 0.00 O ATOM 557 CB GLU A 35 1.676 1.164 -0.437 1.00 0.00 C ATOM 558 CG GLU A 35 2.098 2.110 0.689 1.00 0.00 C ATOM 559 CD GLU A 35 3.243 3.036 0.321 1.00 0.00 C ATOM 560 OE1 GLU A 35 3.312 3.468 -0.846 1.00 0.00 O ATOM 561 OE2 GLU A 35 4.071 3.331 1.208 1.00 0.00 O ATOM 0 H GLU A 35 3.616 1.681 -1.873 1.00 0.00 H new ATOM 0 HA GLU A 35 3.192 -0.290 0.095 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.445 1.755 -1.323 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.757 0.657 -0.143 1.00 0.00 H new ATOM 0 HG2 GLU A 35 1.239 2.712 0.985 1.00 0.00 H new ATOM 0 HG3 GLU A 35 2.388 1.518 1.557 1.00 0.00 H new ATOM 568 N PHE A 36 1.820 -0.957 -2.825 1.00 0.00 N ATOM 569 CA PHE A 36 1.157 -2.035 -3.567 1.00 0.00 C ATOM 570 C PHE A 36 1.989 -2.562 -4.733 1.00 0.00 C ATOM 571 O PHE A 36 1.431 -3.030 -5.733 1.00 0.00 O ATOM 572 CB PHE A 36 -0.209 -1.574 -4.074 1.00 0.00 C ATOM 573 CG PHE A 36 -1.165 -1.237 -2.970 1.00 0.00 C ATOM 574 CD1 PHE A 36 -1.277 0.063 -2.511 1.00 0.00 C ATOM 575 CD2 PHE A 36 -1.942 -2.222 -2.386 1.00 0.00 C ATOM 576 CE1 PHE A 36 -2.146 0.375 -1.486 1.00 0.00 C ATOM 577 CE2 PHE A 36 -2.815 -1.916 -1.364 1.00 0.00 C ATOM 578 CZ PHE A 36 -2.916 -0.615 -0.913 1.00 0.00 C ATOM 0 H PHE A 36 2.071 -0.142 -3.385 1.00 0.00 H new ATOM 0 HA PHE A 36 1.034 -2.859 -2.864 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -0.077 -0.700 -4.711 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -0.643 -2.358 -4.695 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.678 0.842 -2.960 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -1.864 -3.241 -2.735 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.223 1.393 -1.133 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.419 -2.692 -0.917 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.598 -0.373 -0.111 1.00 0.00 H new ATOM 588 N LYS A 37 3.311 -2.484 -4.615 1.00 0.00 N ATOM 589 CA LYS A 37 4.199 -2.960 -5.673 1.00 0.00 C ATOM 590 C LYS A 37 3.972 -4.441 -5.973 1.00 0.00 C ATOM 591 O LYS A 37 4.041 -5.288 -5.082 1.00 0.00 O ATOM 592 CB LYS A 37 5.659 -2.745 -5.271 1.00 0.00 C ATOM 593 CG LYS A 37 6.656 -3.127 -6.354 1.00 0.00 C ATOM 594 CD LYS A 37 8.085 -2.849 -5.918 1.00 0.00 C ATOM 595 CE LYS A 37 9.074 -3.172 -7.024 1.00 0.00 C ATOM 596 NZ LYS A 37 9.058 -4.617 -7.381 1.00 0.00 N ATOM 0 H LYS A 37 3.790 -2.098 -3.802 1.00 0.00 H new ATOM 0 HA LYS A 37 3.973 -2.388 -6.573 1.00 0.00 H new ATOM 0 HB2 LYS A 37 5.804 -1.697 -5.010 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.869 -3.328 -4.375 1.00 0.00 H new ATOM 0 HG2 LYS A 37 6.547 -4.185 -6.594 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.437 -2.569 -7.265 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.183 -1.801 -5.634 1.00 0.00 H new ATOM 0 HD3 LYS A 37 8.319 -3.442 -5.034 1.00 0.00 H new ATOM 0 HE2 LYS A 37 8.838 -2.578 -7.907 1.00 0.00 H new ATOM 0 HE3 LYS A 37 10.078 -2.888 -6.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 9.867 -4.831 -7.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.123 -5.189 -6.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 8.173 -4.842 -7.879 1.00 0.00 H new ATOM 610 N GLY A 38 3.699 -4.742 -7.241 1.00 0.00 N ATOM 611 CA GLY A 38 3.488 -6.117 -7.653 1.00 0.00 C ATOM 612 C GLY A 38 2.047 -6.580 -7.528 1.00 0.00 C ATOM 613 O GLY A 38 1.713 -7.676 -7.974 1.00 0.00 O ATOM 0 H GLY A 38 3.620 -4.055 -7.991 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.807 -6.229 -8.689 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.123 -6.768 -7.052 1.00 0.00 H new ATOM 617 N VAL A 39 1.187 -5.760 -6.928 1.00 0.00 N ATOM 618 CA VAL A 39 -0.213 -6.145 -6.765 1.00 0.00 C ATOM 619 C VAL A 39 -1.129 -5.360 -7.702 1.00 0.00 C ATOM 620 O VAL A 39 -2.014 -5.937 -8.339 1.00 0.00 O ATOM 621 CB VAL A 39 -0.692 -5.975 -5.304 1.00 0.00 C ATOM 622 CG1 VAL A 39 -2.149 -6.404 -5.152 1.00 0.00 C ATOM 623 CG2 VAL A 39 0.201 -6.760 -4.351 1.00 0.00 C ATOM 0 H VAL A 39 1.428 -4.842 -6.553 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.271 -7.202 -7.026 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.623 -4.918 -5.048 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.460 -6.274 -4.115 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.778 -5.792 -5.799 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.251 -7.452 -5.433 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.153 -6.627 -3.329 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.170 -7.818 -4.611 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.226 -6.397 -4.430 1.00 0.00 H new ATOM 633 N TYR A 40 -0.922 -4.052 -7.801 1.00 0.00 N ATOM 634 CA TYR A 40 -1.772 -3.241 -8.664 1.00 0.00 C ATOM 635 C TYR A 40 -0.996 -2.666 -9.842 1.00 0.00 C ATOM 636 O TYR A 40 0.162 -2.274 -9.706 1.00 0.00 O ATOM 637 CB TYR A 40 -2.410 -2.092 -7.882 1.00 0.00 C ATOM 638 CG TYR A 40 -3.875 -2.245 -7.559 1.00 0.00 C ATOM 639 CD1 TYR A 40 -4.295 -2.558 -6.274 1.00 0.00 C ATOM 640 CD2 TYR A 40 -4.840 -2.037 -8.535 1.00 0.00 C ATOM 641 CE1 TYR A 40 -5.637 -2.661 -5.970 1.00 0.00 C ATOM 642 CE2 TYR A 40 -6.184 -2.142 -8.240 1.00 0.00 C ATOM 643 CZ TYR A 40 -6.577 -2.452 -6.957 1.00 0.00 C ATOM 644 OH TYR A 40 -7.913 -2.551 -6.661 1.00 0.00 O ATOM 0 H TYR A 40 -0.191 -3.540 -7.307 1.00 0.00 H new ATOM 0 HA TYR A 40 -2.551 -3.901 -9.045 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -1.863 -1.967 -6.947 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -2.278 -1.173 -8.453 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -3.560 -2.724 -5.500 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -4.534 -1.789 -9.541 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -5.949 -2.904 -4.965 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -6.923 -1.982 -9.011 1.00 0.00 H new ATOM 0 HH TYR A 40 -8.044 -3.221 -5.958 1.00 0.00 H new ATOM 654 N ALA A 41 -1.650 -2.621 -10.995 1.00 0.00 N ATOM 655 CA ALA A 41 -1.052 -2.049 -12.189 1.00 0.00 C ATOM 656 C ALA A 41 -1.645 -0.662 -12.416 1.00 0.00 C ATOM 657 O ALA A 41 -2.867 -0.515 -12.496 1.00 0.00 O ATOM 658 CB ALA A 41 -1.290 -2.945 -13.395 1.00 0.00 C ATOM 0 H ALA A 41 -2.597 -2.975 -11.127 1.00 0.00 H new ATOM 0 HA ALA A 41 0.026 -1.966 -12.054 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -0.833 -2.496 -14.277 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -0.846 -3.924 -13.214 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -2.362 -3.058 -13.559 1.00 0.00 H new ATOM 664 N LEU A 42 -0.792 0.351 -12.513 1.00 0.00 N ATOM 665 CA LEU A 42 -1.269 1.719 -12.695 1.00 0.00 C ATOM 666 C LEU A 42 -1.274 2.136 -14.158 1.00 0.00 C ATOM 667 O LEU A 42 -0.262 2.051 -14.854 1.00 0.00 O ATOM 668 CB LEU A 42 -0.423 2.704 -11.881 1.00 0.00 C ATOM 669 CG LEU A 42 -0.778 4.187 -12.068 1.00 0.00 C ATOM 670 CD1 LEU A 42 -2.203 4.470 -11.616 1.00 0.00 C ATOM 671 CD2 LEU A 42 0.206 5.072 -11.319 1.00 0.00 C ATOM 0 H LEU A 42 0.223 0.255 -12.469 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.298 1.743 -12.336 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.521 2.455 -10.824 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.625 2.562 -12.146 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.710 4.417 -13.131 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.427 5.527 -11.760 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.897 3.869 -12.203 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.307 4.217 -10.561 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.063 6.118 -11.464 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.174 4.833 -10.256 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.213 4.900 -11.699 1.00 0.00 H new ATOM 683 N LYS A 43 -2.435 2.589 -14.607 1.00 0.00 N ATOM 684 CA LYS A 43 -2.612 3.068 -15.965 1.00 0.00 C ATOM 685 C LYS A 43 -3.130 4.499 -15.923 1.00 0.00 C ATOM 686 O LYS A 43 -3.979 4.833 -15.103 1.00 0.00 O ATOM 687 CB LYS A 43 -3.586 2.180 -16.740 1.00 0.00 C ATOM 688 CG LYS A 43 -2.923 1.272 -17.760 1.00 0.00 C ATOM 689 CD LYS A 43 -2.589 -0.090 -17.172 1.00 0.00 C ATOM 690 CE LYS A 43 -2.430 -1.133 -18.264 1.00 0.00 C ATOM 691 NZ LYS A 43 -1.196 -0.913 -19.068 1.00 0.00 N ATOM 0 H LYS A 43 -3.280 2.634 -14.038 1.00 0.00 H new ATOM 0 HA LYS A 43 -1.651 3.035 -16.478 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -4.143 1.567 -16.032 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.310 2.814 -17.251 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -3.584 1.145 -18.618 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -2.011 1.743 -18.127 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -1.669 -0.023 -16.592 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -3.378 -0.396 -16.485 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.399 -2.126 -17.816 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -3.300 -1.107 -18.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -1.125 -1.646 -19.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -1.237 0.024 -19.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -0.363 -0.963 -18.447 1.00 0.00 H new ATOM 705 N VAL A 44 -2.608 5.344 -16.795 1.00 0.00 N ATOM 706 CA VAL A 44 -3.014 6.743 -16.854 1.00 0.00 C ATOM 707 C VAL A 44 -3.578 7.087 -18.216 1.00 0.00 C ATOM 708 O VAL A 44 -3.000 6.765 -19.256 1.00 0.00 O ATOM 709 CB VAL A 44 -1.842 7.692 -16.502 1.00 0.00 C ATOM 710 CG1 VAL A 44 -0.582 7.319 -17.271 1.00 0.00 C ATOM 711 CG2 VAL A 44 -2.212 9.148 -16.751 1.00 0.00 C ATOM 0 H VAL A 44 -1.896 5.086 -17.478 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.796 6.884 -16.108 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.637 7.575 -15.438 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.224 8.003 -17.003 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.291 6.299 -17.020 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.775 7.388 -18.342 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.367 9.787 -16.494 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.463 9.285 -17.803 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -3.070 9.416 -16.135 1.00 0.00 H new ATOM 721 N ILE A 45 -4.731 7.736 -18.189 1.00 0.00 N ATOM 722 CA ILE A 45 -5.421 8.128 -19.390 1.00 0.00 C ATOM 723 C ILE A 45 -5.452 9.652 -19.481 1.00 0.00 C ATOM 724 O ILE A 45 -6.208 10.309 -18.762 1.00 0.00 O ATOM 725 CB ILE A 45 -6.867 7.584 -19.360 1.00 0.00 C ATOM 726 CG1 ILE A 45 -6.877 6.082 -19.032 1.00 0.00 C ATOM 727 CG2 ILE A 45 -7.599 7.854 -20.672 1.00 0.00 C ATOM 728 CD1 ILE A 45 -6.128 5.215 -20.021 1.00 0.00 C ATOM 0 H ILE A 45 -5.209 8.002 -17.328 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.901 7.720 -20.257 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.400 8.115 -18.571 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.445 5.937 -18.042 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -7.911 5.742 -18.981 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.612 7.457 -20.612 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.641 8.928 -20.851 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.068 7.370 -21.491 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.189 4.172 -19.710 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.572 5.325 -21.010 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.083 5.523 -20.056 1.00 0.00 H new ATOM 740 N ASP A 46 -4.608 10.209 -20.340 1.00 0.00 N ATOM 741 CA ASP A 46 -4.567 11.656 -20.534 1.00 0.00 C ATOM 742 C ASP A 46 -5.760 12.075 -21.390 1.00 0.00 C ATOM 743 O ASP A 46 -5.756 11.886 -22.608 1.00 0.00 O ATOM 744 CB ASP A 46 -3.257 12.063 -21.219 1.00 0.00 C ATOM 745 CG ASP A 46 -3.049 13.568 -21.271 1.00 0.00 C ATOM 746 OD1 ASP A 46 -3.992 14.323 -20.935 1.00 0.00 O ATOM 747 OD2 ASP A 46 -1.940 13.997 -21.648 1.00 0.00 O ATOM 0 H ASP A 46 -3.945 9.686 -20.912 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.617 12.155 -19.566 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.421 11.606 -20.690 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -3.247 11.666 -22.234 1.00 0.00 H new ATOM 752 N VAL A 47 -6.768 12.655 -20.748 1.00 0.00 N ATOM 753 CA VAL A 47 -7.991 13.057 -21.441 1.00 0.00 C ATOM 754 C VAL A 47 -7.782 14.209 -22.436 1.00 0.00 C ATOM 755 O VAL A 47 -8.469 14.273 -23.450 1.00 0.00 O ATOM 756 CB VAL A 47 -9.108 13.421 -20.438 1.00 0.00 C ATOM 757 CG1 VAL A 47 -9.389 12.245 -19.506 1.00 0.00 C ATOM 758 CG2 VAL A 47 -8.755 14.663 -19.635 1.00 0.00 C ATOM 0 H VAL A 47 -6.764 12.858 -19.748 1.00 0.00 H new ATOM 0 HA VAL A 47 -8.296 12.188 -22.023 1.00 0.00 H new ATOM 0 HB VAL A 47 -10.009 13.642 -21.010 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.178 12.517 -18.805 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.706 11.383 -20.093 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -8.484 11.994 -18.953 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.564 14.889 -18.940 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -7.836 14.486 -19.077 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.612 15.505 -20.312 1.00 0.00 H new ATOM 768 N LEU A 48 -6.865 15.130 -22.147 1.00 0.00 N ATOM 769 CA LEU A 48 -6.604 16.248 -23.059 1.00 0.00 C ATOM 770 C LEU A 48 -5.885 15.786 -24.324 1.00 0.00 C ATOM 771 O LEU A 48 -6.156 16.281 -25.417 1.00 0.00 O ATOM 772 CB LEU A 48 -5.808 17.364 -22.378 1.00 0.00 C ATOM 773 CG LEU A 48 -6.578 18.155 -21.315 1.00 0.00 C ATOM 774 CD1 LEU A 48 -5.661 19.151 -20.623 1.00 0.00 C ATOM 775 CD2 LEU A 48 -7.769 18.869 -21.938 1.00 0.00 C ATOM 0 H LEU A 48 -6.296 15.128 -21.301 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.576 16.650 -23.344 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -4.924 16.927 -21.914 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.458 18.058 -23.142 1.00 0.00 H new ATOM 0 HG LEU A 48 -6.950 17.454 -20.568 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.225 19.704 -19.872 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.841 18.617 -20.142 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.258 19.847 -21.359 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.303 19.425 -21.168 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.419 19.558 -22.706 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.439 18.136 -22.387 1.00 0.00 H new ATOM 787 N LYS A 49 -4.960 14.842 -24.163 1.00 0.00 N ATOM 788 CA LYS A 49 -4.200 14.309 -25.289 1.00 0.00 C ATOM 789 C LYS A 49 -5.095 13.457 -26.182 1.00 0.00 C ATOM 790 O LYS A 49 -5.019 13.526 -27.410 1.00 0.00 O ATOM 791 CB LYS A 49 -3.028 13.481 -24.775 1.00 0.00 C ATOM 792 CG LYS A 49 -2.141 12.927 -25.873 1.00 0.00 C ATOM 793 CD LYS A 49 -0.968 12.171 -25.288 1.00 0.00 C ATOM 794 CE LYS A 49 -0.064 11.625 -26.377 1.00 0.00 C ATOM 795 NZ LYS A 49 -0.760 10.618 -27.224 1.00 0.00 N ATOM 0 H LYS A 49 -4.719 14.430 -23.261 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.817 15.141 -25.880 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.424 14.098 -24.109 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.414 12.653 -24.180 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.721 12.265 -26.516 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.778 13.742 -26.499 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.397 12.831 -24.635 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.333 11.350 -24.671 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.287 12.446 -27.003 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.817 11.171 -25.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.064 10.124 -27.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.247 9.929 -26.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.456 11.096 -27.831 1.00 0.00 H new ATOM 809 N ASN A 50 -5.945 12.654 -25.555 1.00 0.00 N ATOM 810 CA ASN A 50 -6.868 11.793 -26.284 1.00 0.00 C ATOM 811 C ASN A 50 -8.288 11.967 -25.766 1.00 0.00 C ATOM 812 O ASN A 50 -8.814 11.098 -25.067 1.00 0.00 O ATOM 813 CB ASN A 50 -6.454 10.326 -26.168 1.00 0.00 C ATOM 814 CG ASN A 50 -5.087 10.047 -26.764 1.00 0.00 C ATOM 815 OD1 ASN A 50 -4.149 9.678 -26.055 1.00 0.00 O ATOM 816 ND2 ASN A 50 -4.963 10.220 -28.074 1.00 0.00 N ATOM 0 H ASN A 50 -6.015 12.581 -24.540 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.835 12.085 -27.334 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.452 10.037 -25.117 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -7.196 9.704 -26.668 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -4.067 10.046 -28.529 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -5.764 10.527 -28.626 1.00 0.00 H new ATOM 823 N PRO A 51 -8.928 13.099 -26.105 1.00 0.00 N ATOM 824 CA PRO A 51 -10.298 13.396 -25.676 1.00 0.00 C ATOM 825 C PRO A 51 -11.309 12.376 -26.187 1.00 0.00 C ATOM 826 O PRO A 51 -12.388 12.225 -25.615 1.00 0.00 O ATOM 827 CB PRO A 51 -10.573 14.787 -26.257 1.00 0.00 C ATOM 828 CG PRO A 51 -9.556 14.968 -27.333 1.00 0.00 C ATOM 829 CD PRO A 51 -8.352 14.193 -26.904 1.00 0.00 C ATOM 0 HA PRO A 51 -10.397 13.357 -24.591 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.585 14.854 -26.656 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -10.480 15.559 -25.493 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -9.932 14.605 -28.289 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.313 16.022 -27.466 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -7.790 13.816 -27.758 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.667 14.804 -26.316 1.00 0.00 H new ATOM 837 N GLN A 52 -10.958 11.684 -27.268 1.00 0.00 N ATOM 838 CA GLN A 52 -11.820 10.654 -27.832 1.00 0.00 C ATOM 839 C GLN A 52 -11.987 9.537 -26.822 1.00 0.00 C ATOM 840 O GLN A 52 -13.083 9.019 -26.632 1.00 0.00 O ATOM 841 CB GLN A 52 -11.216 10.091 -29.123 1.00 0.00 C ATOM 842 CG GLN A 52 -11.178 11.088 -30.273 1.00 0.00 C ATOM 843 CD GLN A 52 -9.857 11.832 -30.359 1.00 0.00 C ATOM 844 OE1 GLN A 52 -9.120 11.933 -29.377 1.00 0.00 O ATOM 845 NE2 GLN A 52 -9.550 12.359 -31.536 1.00 0.00 N ATOM 0 H GLN A 52 -10.081 11.820 -27.770 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.789 11.094 -28.066 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -10.202 9.748 -28.919 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -11.791 9.218 -29.431 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -11.356 10.562 -31.211 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -11.988 11.807 -30.152 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -10.188 12.253 -32.325 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -8.676 12.871 -31.653 1.00 0.00 H new ATOM 854 N LEU A 53 -10.891 9.196 -26.151 1.00 0.00 N ATOM 855 CA LEU A 53 -10.914 8.145 -25.149 1.00 0.00 C ATOM 856 C LEU A 53 -11.672 8.622 -23.919 1.00 0.00 C ATOM 857 O LEU A 53 -12.380 7.847 -23.271 1.00 0.00 O ATOM 858 CB LEU A 53 -9.498 7.699 -24.785 1.00 0.00 C ATOM 859 CG LEU A 53 -8.738 7.000 -25.915 1.00 0.00 C ATOM 860 CD1 LEU A 53 -7.298 6.732 -25.508 1.00 0.00 C ATOM 861 CD2 LEU A 53 -9.434 5.705 -26.307 1.00 0.00 C ATOM 0 H LEU A 53 -9.979 9.633 -26.285 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.430 7.279 -25.563 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.927 8.571 -24.467 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.552 7.025 -23.930 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.730 7.661 -26.782 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.775 6.235 -26.325 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.802 7.676 -25.281 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.282 6.093 -24.625 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.879 5.223 -27.112 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -9.476 5.039 -25.445 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.447 5.924 -26.646 1.00 0.00 H new ATOM 873 N ALA A 54 -11.514 9.911 -23.600 1.00 0.00 N ATOM 874 CA ALA A 54 -12.194 10.511 -22.460 1.00 0.00 C ATOM 875 C ALA A 54 -13.700 10.480 -22.673 1.00 0.00 C ATOM 876 O ALA A 54 -14.460 10.190 -21.755 1.00 0.00 O ATOM 877 CB ALA A 54 -11.724 11.941 -22.257 1.00 0.00 C ATOM 0 H ALA A 54 -10.919 10.556 -24.120 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.952 9.935 -21.567 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.241 12.376 -21.402 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.650 11.948 -22.074 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.944 12.526 -23.150 1.00 0.00 H new ATOM 883 N GLU A 55 -14.116 10.798 -23.897 1.00 0.00 N ATOM 884 CA GLU A 55 -15.527 10.785 -24.269 1.00 0.00 C ATOM 885 C GLU A 55 -16.063 9.362 -24.247 1.00 0.00 C ATOM 886 O GLU A 55 -17.200 9.126 -23.837 1.00 0.00 O ATOM 887 CB GLU A 55 -15.735 11.407 -25.652 1.00 0.00 C ATOM 888 CG GLU A 55 -17.199 11.498 -26.065 1.00 0.00 C ATOM 889 CD GLU A 55 -17.392 12.151 -27.419 1.00 0.00 C ATOM 890 OE1 GLU A 55 -16.380 12.529 -28.047 1.00 0.00 O ATOM 891 OE2 GLU A 55 -18.555 12.285 -27.851 1.00 0.00 O ATOM 0 H GLU A 55 -13.488 11.070 -24.654 1.00 0.00 H new ATOM 0 HA GLU A 55 -16.076 11.382 -23.541 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.301 12.407 -25.661 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -15.193 10.818 -26.392 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -17.628 10.496 -26.086 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.749 12.064 -25.313 1.00 0.00 H new ATOM 898 N GLU A 56 -15.238 8.419 -24.691 1.00 0.00 N ATOM 899 CA GLU A 56 -15.624 7.014 -24.720 1.00 0.00 C ATOM 900 C GLU A 56 -15.933 6.517 -23.308 1.00 0.00 C ATOM 901 O GLU A 56 -16.880 5.760 -23.105 1.00 0.00 O ATOM 902 CB GLU A 56 -14.509 6.169 -25.349 1.00 0.00 C ATOM 903 CG GLU A 56 -14.316 6.417 -26.841 1.00 0.00 C ATOM 904 CD GLU A 56 -15.561 6.121 -27.655 1.00 0.00 C ATOM 905 OE1 GLU A 56 -16.141 5.030 -27.478 1.00 0.00 O ATOM 906 OE2 GLU A 56 -15.956 6.981 -28.468 1.00 0.00 O ATOM 0 H GLU A 56 -14.296 8.604 -25.036 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.523 6.914 -25.328 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -13.572 6.377 -24.832 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -14.733 5.114 -25.192 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -14.025 7.456 -26.997 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.495 5.798 -27.204 1.00 0.00 H new ATOM 913 N ASP A 57 -15.131 6.943 -22.330 1.00 0.00 N ATOM 914 CA ASP A 57 -15.364 6.549 -20.940 1.00 0.00 C ATOM 915 C ASP A 57 -16.144 7.630 -20.188 1.00 0.00 C ATOM 916 O ASP A 57 -16.306 7.549 -18.969 1.00 0.00 O ATOM 917 CB ASP A 57 -14.050 6.209 -20.217 1.00 0.00 C ATOM 918 CG ASP A 57 -13.436 4.903 -20.683 1.00 0.00 C ATOM 919 OD1 ASP A 57 -14.134 4.122 -21.362 1.00 0.00 O ATOM 920 OD2 ASP A 57 -12.252 4.662 -20.362 1.00 0.00 O ATOM 0 H ASP A 57 -14.325 7.552 -22.472 1.00 0.00 H new ATOM 0 HA ASP A 57 -15.969 5.643 -20.954 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.335 7.017 -20.376 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -14.236 6.154 -19.144 1.00 0.00 H new ATOM 925 N LYS A 58 -16.627 8.628 -20.936 1.00 0.00 N ATOM 926 CA LYS A 58 -17.426 9.733 -20.390 1.00 0.00 C ATOM 927 C LYS A 58 -16.768 10.416 -19.191 1.00 0.00 C ATOM 928 O LYS A 58 -17.380 10.563 -18.129 1.00 0.00 O ATOM 929 CB LYS A 58 -18.832 9.246 -20.028 1.00 0.00 C ATOM 930 CG LYS A 58 -19.637 8.784 -21.235 1.00 0.00 C ATOM 931 CD LYS A 58 -21.029 8.323 -20.834 1.00 0.00 C ATOM 932 CE LYS A 58 -21.818 7.821 -22.034 1.00 0.00 C ATOM 933 NZ LYS A 58 -22.037 8.894 -23.044 1.00 0.00 N ATOM 0 H LYS A 58 -16.474 8.693 -21.942 1.00 0.00 H new ATOM 0 HA LYS A 58 -17.494 10.487 -21.174 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -18.753 8.424 -19.316 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -19.370 10.051 -19.527 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -19.716 9.599 -21.954 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -19.112 7.969 -21.733 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -20.950 7.529 -20.091 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -21.565 9.148 -20.364 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -21.285 6.990 -22.497 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -22.781 7.435 -21.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -22.741 8.577 -23.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -22.382 9.753 -22.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -21.141 9.103 -23.529 1.00 0.00 H new ATOM 947 N ILE A 59 -15.524 10.836 -19.366 1.00 0.00 N ATOM 948 CA ILE A 59 -14.788 11.515 -18.306 1.00 0.00 C ATOM 949 C ILE A 59 -15.031 13.022 -18.374 1.00 0.00 C ATOM 950 O ILE A 59 -14.562 13.696 -19.293 1.00 0.00 O ATOM 951 CB ILE A 59 -13.275 11.227 -18.420 1.00 0.00 C ATOM 952 CG1 ILE A 59 -13.014 9.718 -18.397 1.00 0.00 C ATOM 953 CG2 ILE A 59 -12.503 11.922 -17.303 1.00 0.00 C ATOM 954 CD1 ILE A 59 -13.485 9.036 -17.130 1.00 0.00 C ATOM 0 H ILE A 59 -15.001 10.719 -20.234 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.146 11.136 -17.349 1.00 0.00 H new ATOM 0 HB ILE A 59 -12.924 11.625 -19.372 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -13.511 9.260 -19.252 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -11.945 9.542 -18.518 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -11.440 11.704 -17.405 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -12.660 12.999 -17.367 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -12.856 11.561 -16.337 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -13.266 7.970 -17.188 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -12.969 9.467 -16.272 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -14.560 9.180 -17.017 1.00 0.00 H new ATOM 966 N LEU A 60 -15.772 13.546 -17.398 1.00 0.00 N ATOM 967 CA LEU A 60 -16.083 14.974 -17.359 1.00 0.00 C ATOM 968 C LEU A 60 -15.302 15.706 -16.265 1.00 0.00 C ATOM 969 O LEU A 60 -15.369 16.931 -16.168 1.00 0.00 O ATOM 970 CB LEU A 60 -17.586 15.183 -17.146 1.00 0.00 C ATOM 971 CG LEU A 60 -18.489 14.576 -18.224 1.00 0.00 C ATOM 972 CD1 LEU A 60 -19.955 14.779 -17.867 1.00 0.00 C ATOM 973 CD2 LEU A 60 -18.185 15.187 -19.586 1.00 0.00 C ATOM 0 H LEU A 60 -16.166 13.006 -16.628 1.00 0.00 H new ATOM 0 HA LEU A 60 -15.784 15.394 -18.319 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -17.862 14.757 -16.181 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.783 16.254 -17.090 1.00 0.00 H new ATOM 0 HG LEU A 60 -18.289 13.506 -18.275 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -20.583 14.342 -18.644 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -20.168 14.295 -16.914 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -20.166 15.845 -17.788 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -18.837 14.742 -20.338 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -18.355 16.263 -19.548 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -17.145 14.993 -19.848 1.00 0.00 H new ATOM 985 N ALA A 61 -14.563 14.961 -15.447 1.00 0.00 N ATOM 986 CA ALA A 61 -13.788 15.565 -14.367 1.00 0.00 C ATOM 987 C ALA A 61 -12.471 14.830 -14.156 1.00 0.00 C ATOM 988 O ALA A 61 -12.413 13.610 -14.267 1.00 0.00 O ATOM 989 CB ALA A 61 -14.596 15.572 -13.075 1.00 0.00 C ATOM 0 H ALA A 61 -14.485 13.946 -15.510 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.562 16.593 -14.651 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.005 16.025 -12.279 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.510 16.147 -13.221 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.851 14.549 -12.800 1.00 0.00 H new ATOM 995 N THR A 62 -11.423 15.585 -13.838 1.00 0.00 N ATOM 996 CA THR A 62 -10.101 15.028 -13.604 1.00 0.00 C ATOM 997 C THR A 62 -9.459 15.667 -12.374 1.00 0.00 C ATOM 998 O THR A 62 -9.705 16.837 -12.075 1.00 0.00 O ATOM 999 CB THR A 62 -9.165 15.271 -14.811 1.00 0.00 C ATOM 1000 OG1 THR A 62 -9.091 16.674 -15.091 1.00 0.00 O ATOM 1001 CG2 THR A 62 -9.634 14.529 -16.054 1.00 0.00 C ATOM 0 H THR A 62 -11.470 16.599 -13.736 1.00 0.00 H new ATOM 0 HA THR A 62 -10.231 13.956 -13.452 1.00 0.00 H new ATOM 0 HB THR A 62 -8.179 14.888 -14.546 1.00 0.00 H new ATOM 0 HG1 THR A 62 -9.566 16.866 -15.927 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.948 14.728 -16.877 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.657 13.458 -15.852 1.00 0.00 H new ATOM 0 HG23 THR A 62 -10.634 14.869 -16.325 1.00 0.00 H new ATOM 1009 N PRO A 63 -8.617 14.911 -11.652 1.00 0.00 N ATOM 1010 CA PRO A 63 -8.329 13.517 -11.977 1.00 0.00 C ATOM 1011 C PRO A 63 -9.459 12.572 -11.573 1.00 0.00 C ATOM 1012 O PRO A 63 -10.213 12.837 -10.636 1.00 0.00 O ATOM 1013 CB PRO A 63 -7.064 13.225 -11.175 1.00 0.00 C ATOM 1014 CG PRO A 63 -7.134 14.136 -10.004 1.00 0.00 C ATOM 1015 CD PRO A 63 -7.861 15.373 -10.471 1.00 0.00 C ATOM 0 HA PRO A 63 -8.214 13.364 -13.050 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -7.027 12.182 -10.862 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.169 13.412 -11.768 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.662 13.664 -9.176 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.135 14.385 -9.645 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -8.524 15.763 -9.699 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -7.166 16.173 -10.728 1.00 0.00 H new ATOM 1023 N THR A 64 -9.561 11.470 -12.295 1.00 0.00 N ATOM 1024 CA THR A 64 -10.568 10.453 -12.023 1.00 0.00 C ATOM 1025 C THR A 64 -9.882 9.125 -11.730 1.00 0.00 C ATOM 1026 O THR A 64 -9.087 8.643 -12.535 1.00 0.00 O ATOM 1027 CB THR A 64 -11.530 10.249 -13.210 1.00 0.00 C ATOM 1028 OG1 THR A 64 -11.322 11.267 -14.194 1.00 0.00 O ATOM 1029 CG2 THR A 64 -12.983 10.261 -12.752 1.00 0.00 C ATOM 0 H THR A 64 -8.952 11.253 -13.084 1.00 0.00 H new ATOM 0 HA THR A 64 -11.148 10.796 -11.166 1.00 0.00 H new ATOM 0 HB THR A 64 -11.319 9.274 -13.649 1.00 0.00 H new ATOM 0 HG1 THR A 64 -11.591 12.135 -13.828 1.00 0.00 H new ATOM 0 HG21 THR A 64 -13.637 10.115 -13.612 1.00 0.00 H new ATOM 0 HG22 THR A 64 -13.144 9.458 -12.033 1.00 0.00 H new ATOM 0 HG23 THR A 64 -13.209 11.219 -12.283 1.00 0.00 H new ATOM 1037 N LEU A 65 -10.183 8.539 -10.585 1.00 0.00 N ATOM 1038 CA LEU A 65 -9.588 7.266 -10.206 1.00 0.00 C ATOM 1039 C LEU A 65 -10.607 6.151 -10.383 1.00 0.00 C ATOM 1040 O LEU A 65 -11.655 6.161 -9.748 1.00 0.00 O ATOM 1041 CB LEU A 65 -9.113 7.317 -8.750 1.00 0.00 C ATOM 1042 CG LEU A 65 -8.423 6.045 -8.246 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -7.159 5.777 -9.049 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -8.096 6.161 -6.764 1.00 0.00 C ATOM 0 H LEU A 65 -10.835 8.922 -9.901 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.728 7.071 -10.847 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.424 8.154 -8.638 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -9.972 7.523 -8.111 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.107 5.207 -8.380 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.679 4.871 -8.680 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.416 5.649 -10.101 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.475 6.619 -8.942 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.607 5.247 -6.427 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.431 7.009 -6.604 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.016 6.310 -6.199 1.00 0.00 H new ATOM 1056 N ALA A 66 -10.305 5.192 -11.247 1.00 0.00 N ATOM 1057 CA ALA A 66 -11.224 4.089 -11.486 1.00 0.00 C ATOM 1058 C ALA A 66 -10.492 2.772 -11.686 1.00 0.00 C ATOM 1059 O ALA A 66 -9.462 2.705 -12.352 1.00 0.00 O ATOM 1060 CB ALA A 66 -12.103 4.367 -12.695 1.00 0.00 C ATOM 0 H ALA A 66 -9.441 5.155 -11.788 1.00 0.00 H new ATOM 0 HA ALA A 66 -11.848 4.002 -10.596 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -12.781 3.528 -12.853 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.682 5.274 -12.523 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -11.477 4.498 -13.578 1.00 0.00 H new ATOM 1066 N LYS A 67 -11.045 1.725 -11.092 1.00 0.00 N ATOM 1067 CA LYS A 67 -10.493 0.395 -11.220 1.00 0.00 C ATOM 1068 C LYS A 67 -11.300 -0.347 -12.269 1.00 0.00 C ATOM 1069 O LYS A 67 -12.431 -0.766 -12.010 1.00 0.00 O ATOM 1070 CB LYS A 67 -10.550 -0.341 -9.877 1.00 0.00 C ATOM 1071 CG LYS A 67 -10.232 -1.830 -9.973 1.00 0.00 C ATOM 1072 CD LYS A 67 -10.400 -2.549 -8.637 1.00 0.00 C ATOM 1073 CE LYS A 67 -11.860 -2.869 -8.317 1.00 0.00 C ATOM 1074 NZ LYS A 67 -12.706 -2.975 -9.541 1.00 0.00 N ATOM 0 H LYS A 67 -11.883 1.778 -10.513 1.00 0.00 H new ATOM 0 HA LYS A 67 -9.447 0.449 -11.521 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -9.847 0.127 -9.188 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -11.545 -0.219 -9.449 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -10.884 -2.291 -10.715 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -9.208 -1.958 -10.325 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -9.825 -3.475 -8.653 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -9.986 -1.930 -7.841 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -11.910 -3.807 -7.763 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -12.264 -2.093 -7.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -13.674 -3.243 -9.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -12.724 -2.058 -10.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.310 -3.698 -10.175 1.00 0.00 H new ATOM 1088 N VAL A 68 -10.732 -0.496 -13.452 1.00 0.00 N ATOM 1089 CA VAL A 68 -11.424 -1.165 -14.539 1.00 0.00 C ATOM 1090 C VAL A 68 -11.381 -2.678 -14.390 1.00 0.00 C ATOM 1091 O VAL A 68 -12.290 -3.379 -14.835 1.00 0.00 O ATOM 1092 CB VAL A 68 -10.846 -0.756 -15.908 1.00 0.00 C ATOM 1093 CG1 VAL A 68 -11.110 0.720 -16.179 1.00 0.00 C ATOM 1094 CG2 VAL A 68 -9.356 -1.056 -15.984 1.00 0.00 C ATOM 0 H VAL A 68 -9.796 -0.164 -13.684 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.465 -0.847 -14.490 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.347 -1.345 -16.676 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.695 0.992 -17.150 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -12.184 0.903 -16.179 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.639 1.322 -15.402 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.974 -0.758 -16.960 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -8.833 -0.501 -15.205 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.192 -2.124 -15.841 1.00 0.00 H new ATOM 1104 N LEU A 69 -10.327 -3.179 -13.756 1.00 0.00 N ATOM 1105 CA LEU A 69 -10.181 -4.619 -13.563 1.00 0.00 C ATOM 1106 C LEU A 69 -9.758 -4.939 -12.135 1.00 0.00 C ATOM 1107 O LEU A 69 -8.866 -4.289 -11.592 1.00 0.00 O ATOM 1108 CB LEU A 69 -9.146 -5.192 -14.541 1.00 0.00 C ATOM 1109 CG LEU A 69 -9.480 -5.037 -16.029 1.00 0.00 C ATOM 1110 CD1 LEU A 69 -8.304 -5.478 -16.887 1.00 0.00 C ATOM 1111 CD2 LEU A 69 -10.724 -5.834 -16.388 1.00 0.00 C ATOM 0 H LEU A 69 -9.568 -2.618 -13.370 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.151 -5.078 -13.754 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.187 -4.709 -14.351 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.017 -6.253 -14.325 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.679 -3.983 -16.225 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.558 -5.361 -17.940 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.433 -4.865 -16.654 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.076 -6.524 -16.682 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.942 -5.709 -17.449 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.554 -6.889 -16.174 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.568 -5.476 -15.799 1.00 0.00 H new ATOM 1123 N PRO A 70 -10.375 -5.959 -11.507 1.00 0.00 N ATOM 1124 CA PRO A 70 -11.448 -6.767 -12.103 1.00 0.00 C ATOM 1125 C PRO A 70 -12.812 -6.066 -12.043 1.00 0.00 C ATOM 1126 O PRO A 70 -13.079 -5.313 -11.106 1.00 0.00 O ATOM 1127 CB PRO A 70 -11.473 -8.037 -11.228 1.00 0.00 C ATOM 1128 CG PRO A 70 -10.321 -7.904 -10.281 1.00 0.00 C ATOM 1129 CD PRO A 70 -10.055 -6.433 -10.161 1.00 0.00 C ATOM 0 HA PRO A 70 -11.265 -6.958 -13.160 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.416 -8.121 -10.687 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -11.375 -8.934 -11.839 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -10.561 -8.338 -9.310 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -9.444 -8.430 -10.657 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -10.683 -5.965 -9.403 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -9.020 -6.226 -9.890 1.00 0.00 H new ATOM 1137 N PRO A 71 -13.682 -6.296 -13.049 1.00 0.00 N ATOM 1138 CA PRO A 71 -15.036 -5.714 -13.090 1.00 0.00 C ATOM 1139 C PRO A 71 -15.890 -6.179 -11.905 1.00 0.00 C ATOM 1140 O PRO A 71 -15.651 -7.258 -11.359 1.00 0.00 O ATOM 1141 CB PRO A 71 -15.620 -6.244 -14.406 1.00 0.00 C ATOM 1142 CG PRO A 71 -14.434 -6.612 -15.222 1.00 0.00 C ATOM 1143 CD PRO A 71 -13.415 -7.112 -14.242 1.00 0.00 C ATOM 0 HA PRO A 71 -15.016 -4.626 -13.031 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -16.266 -7.105 -14.235 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -16.225 -5.487 -14.905 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -14.684 -7.379 -15.954 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -14.057 -5.753 -15.777 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -13.537 -8.176 -14.040 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -12.398 -6.972 -14.609 1.00 0.00 H new ATOM 1151 N PRO A 72 -16.913 -5.397 -11.488 1.00 0.00 N ATOM 1152 CA PRO A 72 -17.293 -4.105 -12.094 1.00 0.00 C ATOM 1153 C PRO A 72 -16.268 -2.994 -11.868 1.00 0.00 C ATOM 1154 O PRO A 72 -15.447 -3.064 -10.953 1.00 0.00 O ATOM 1155 CB PRO A 72 -18.613 -3.747 -11.392 1.00 0.00 C ATOM 1156 CG PRO A 72 -19.063 -5.008 -10.736 1.00 0.00 C ATOM 1157 CD PRO A 72 -17.804 -5.737 -10.372 1.00 0.00 C ATOM 0 HA PRO A 72 -17.367 -4.196 -13.178 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -18.467 -2.953 -10.660 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -19.354 -3.389 -12.106 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -19.665 -4.798 -9.852 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -19.681 -5.602 -11.409 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -17.403 -5.403 -9.415 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -17.965 -6.812 -10.293 1.00 0.00 H new ATOM 1165 N VAL A 73 -16.335 -1.965 -12.709 1.00 0.00 N ATOM 1166 CA VAL A 73 -15.425 -0.829 -12.615 1.00 0.00 C ATOM 1167 C VAL A 73 -15.772 0.041 -11.404 1.00 0.00 C ATOM 1168 O VAL A 73 -16.915 0.467 -11.237 1.00 0.00 O ATOM 1169 CB VAL A 73 -15.480 0.032 -13.901 1.00 0.00 C ATOM 1170 CG1 VAL A 73 -14.559 1.241 -13.793 1.00 0.00 C ATOM 1171 CG2 VAL A 73 -15.129 -0.807 -15.120 1.00 0.00 C ATOM 0 H VAL A 73 -17.014 -1.896 -13.467 1.00 0.00 H new ATOM 0 HA VAL A 73 -14.415 -1.223 -12.497 1.00 0.00 H new ATOM 0 HB VAL A 73 -16.499 0.400 -14.018 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -14.618 1.827 -14.710 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -14.866 1.858 -12.948 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -13.533 0.905 -13.643 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.173 -0.185 -16.014 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -14.122 -1.210 -15.007 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.840 -1.628 -15.214 1.00 0.00 H new ATOM 1181 N ARG A 74 -14.774 0.299 -10.565 1.00 0.00 N ATOM 1182 CA ARG A 74 -14.960 1.109 -9.365 1.00 0.00 C ATOM 1183 C ARG A 74 -14.348 2.489 -9.537 1.00 0.00 C ATOM 1184 O ARG A 74 -13.144 2.622 -9.734 1.00 0.00 O ATOM 1185 CB ARG A 74 -14.338 0.398 -8.154 1.00 0.00 C ATOM 1186 CG ARG A 74 -14.242 1.255 -6.898 1.00 0.00 C ATOM 1187 CD ARG A 74 -15.616 1.668 -6.385 1.00 0.00 C ATOM 1188 NE ARG A 74 -16.411 0.520 -5.954 1.00 0.00 N ATOM 1189 CZ ARG A 74 -17.685 0.602 -5.582 1.00 0.00 C ATOM 1190 NH1 ARG A 74 -18.304 1.777 -5.585 1.00 0.00 N ATOM 1191 NH2 ARG A 74 -18.339 -0.489 -5.207 1.00 0.00 N ATOM 0 H ARG A 74 -13.822 -0.043 -10.695 1.00 0.00 H new ATOM 0 HA ARG A 74 -16.030 1.234 -9.197 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -14.928 -0.490 -7.928 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -13.338 0.057 -8.423 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.716 0.702 -6.120 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.651 2.146 -7.111 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -15.498 2.360 -5.551 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -16.150 2.203 -7.170 1.00 0.00 H new ATOM 0 HE ARG A 74 -15.963 -0.396 -5.938 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -17.802 2.617 -5.873 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -19.281 1.839 -5.300 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -17.865 -1.392 -5.204 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -19.316 -0.425 -4.922 1.00 0.00 H new ATOM 1205 N ARG A 75 -15.183 3.517 -9.451 1.00 0.00 N ATOM 1206 CA ARG A 75 -14.708 4.882 -9.581 1.00 0.00 C ATOM 1207 C ARG A 75 -14.660 5.565 -8.225 1.00 0.00 C ATOM 1208 O ARG A 75 -15.658 5.635 -7.507 1.00 0.00 O ATOM 1209 CB ARG A 75 -15.574 5.691 -10.539 1.00 0.00 C ATOM 1210 CG ARG A 75 -15.424 5.283 -11.993 1.00 0.00 C ATOM 1211 CD ARG A 75 -16.270 6.151 -12.902 1.00 0.00 C ATOM 1212 NE ARG A 75 -16.110 5.783 -14.305 1.00 0.00 N ATOM 1213 CZ ARG A 75 -16.639 6.468 -15.316 1.00 0.00 C ATOM 1214 NH1 ARG A 75 -17.360 7.556 -15.080 1.00 0.00 N ATOM 1215 NH2 ARG A 75 -16.442 6.063 -16.563 1.00 0.00 N ATOM 0 H ARG A 75 -16.187 3.429 -9.293 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.700 4.836 -9.993 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -16.619 5.585 -10.247 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -15.321 6.747 -10.440 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -14.377 5.358 -12.287 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -15.714 4.239 -12.111 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -17.319 6.059 -12.619 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -15.994 7.197 -12.767 1.00 0.00 H new ATOM 0 HE ARG A 75 -15.560 4.952 -14.524 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -17.510 7.870 -14.121 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -17.764 8.079 -15.857 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -15.886 5.228 -16.746 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -16.847 6.587 -17.339 1.00 0.00 H new ATOM 1229 N ILE A 76 -13.487 6.065 -7.894 1.00 0.00 N ATOM 1230 CA ILE A 76 -13.265 6.759 -6.637 1.00 0.00 C ATOM 1231 C ILE A 76 -13.153 8.265 -6.883 1.00 0.00 C ATOM 1232 O ILE A 76 -12.252 8.722 -7.589 1.00 0.00 O ATOM 1233 CB ILE A 76 -11.984 6.248 -5.954 1.00 0.00 C ATOM 1234 CG1 ILE A 76 -12.087 4.736 -5.745 1.00 0.00 C ATOM 1235 CG2 ILE A 76 -11.752 6.961 -4.627 1.00 0.00 C ATOM 1236 CD1 ILE A 76 -10.826 4.117 -5.209 1.00 0.00 C ATOM 0 H ILE A 76 -12.659 6.003 -8.487 1.00 0.00 H new ATOM 0 HA ILE A 76 -14.113 6.562 -5.981 1.00 0.00 H new ATOM 0 HB ILE A 76 -11.131 6.463 -6.597 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -12.906 4.527 -5.056 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.340 4.263 -6.694 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.841 6.582 -4.165 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.651 8.032 -4.802 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -12.598 6.780 -3.964 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.971 3.044 -5.086 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.008 4.294 -5.907 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -10.583 4.563 -4.245 1.00 0.00 H new ATOM 1248 N ILE A 77 -14.076 9.033 -6.307 1.00 0.00 N ATOM 1249 CA ILE A 77 -14.077 10.483 -6.482 1.00 0.00 C ATOM 1250 C ILE A 77 -13.933 11.194 -5.137 1.00 0.00 C ATOM 1251 O ILE A 77 -14.678 10.919 -4.197 1.00 0.00 O ATOM 1252 CB ILE A 77 -15.367 10.968 -7.185 1.00 0.00 C ATOM 1253 CG1 ILE A 77 -15.587 10.200 -8.491 1.00 0.00 C ATOM 1254 CG2 ILE A 77 -15.302 12.467 -7.463 1.00 0.00 C ATOM 1255 CD1 ILE A 77 -16.758 9.244 -8.442 1.00 0.00 C ATOM 0 H ILE A 77 -14.829 8.677 -5.718 1.00 0.00 H new ATOM 0 HA ILE A 77 -13.223 10.730 -7.113 1.00 0.00 H new ATOM 0 HB ILE A 77 -16.208 10.776 -6.518 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -15.745 10.913 -9.300 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -14.682 9.641 -8.731 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -16.220 12.785 -7.958 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -15.190 13.007 -6.523 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -14.449 12.681 -8.108 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -16.853 8.736 -9.401 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -16.594 8.507 -7.656 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -17.673 9.799 -8.234 1.00 0.00 H new ATOM 1267 N GLY A 78 -12.965 12.101 -5.053 1.00 0.00 N ATOM 1268 CA GLY A 78 -12.733 12.838 -3.823 1.00 0.00 C ATOM 1269 C GLY A 78 -11.403 13.560 -3.847 1.00 0.00 C ATOM 1270 O GLY A 78 -10.852 13.812 -4.919 1.00 0.00 O ATOM 0 H GLY A 78 -12.334 12.340 -5.818 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.536 13.559 -3.674 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -12.760 12.152 -2.977 1.00 0.00 H new ATOM 1274 N ASP A 79 -10.882 13.898 -2.673 1.00 0.00 N ATOM 1275 CA ASP A 79 -9.596 14.584 -2.586 1.00 0.00 C ATOM 1276 C ASP A 79 -8.474 13.553 -2.671 1.00 0.00 C ATOM 1277 O ASP A 79 -8.106 12.938 -1.672 1.00 0.00 O ATOM 1278 CB ASP A 79 -9.494 15.374 -1.274 1.00 0.00 C ATOM 1279 CG ASP A 79 -8.215 16.188 -1.167 1.00 0.00 C ATOM 1280 OD1 ASP A 79 -7.428 16.204 -2.138 1.00 0.00 O ATOM 1281 OD2 ASP A 79 -8.001 16.811 -0.107 1.00 0.00 O ATOM 0 H ASP A 79 -11.325 13.710 -1.774 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.508 15.289 -3.413 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -10.351 16.042 -1.192 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.548 14.681 -0.434 1.00 0.00 H new ATOM 1286 N LEU A 80 -7.928 13.383 -3.869 1.00 0.00 N ATOM 1287 CA LEU A 80 -6.870 12.405 -4.095 1.00 0.00 C ATOM 1288 C LEU A 80 -5.484 12.966 -3.789 1.00 0.00 C ATOM 1289 O LEU A 80 -4.494 12.237 -3.844 1.00 0.00 O ATOM 1290 CB LEU A 80 -6.908 11.904 -5.539 1.00 0.00 C ATOM 1291 CG LEU A 80 -7.952 10.824 -5.823 1.00 0.00 C ATOM 1292 CD1 LEU A 80 -9.168 11.418 -6.518 1.00 0.00 C ATOM 1293 CD2 LEU A 80 -7.345 9.715 -6.663 1.00 0.00 C ATOM 0 H LEU A 80 -8.200 13.909 -4.699 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.054 11.578 -3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.097 12.752 -6.197 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.924 11.513 -5.798 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.279 10.402 -4.873 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -9.898 10.631 -6.710 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -9.616 12.180 -5.880 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -8.863 11.869 -7.462 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -8.099 8.952 -6.858 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -6.992 10.126 -7.609 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -6.508 9.269 -6.126 1.00 0.00 H new ATOM 1305 N SER A 81 -5.408 14.256 -3.490 1.00 0.00 N ATOM 1306 CA SER A 81 -4.127 14.882 -3.164 1.00 0.00 C ATOM 1307 C SER A 81 -3.620 14.370 -1.818 1.00 0.00 C ATOM 1308 O SER A 81 -2.430 14.449 -1.512 1.00 0.00 O ATOM 1309 CB SER A 81 -4.261 16.405 -3.143 1.00 0.00 C ATOM 1310 OG SER A 81 -4.632 16.902 -4.420 1.00 0.00 O ATOM 0 H SER A 81 -6.209 14.887 -3.466 1.00 0.00 H new ATOM 0 HA SER A 81 -3.404 14.615 -3.934 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.007 16.698 -2.404 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.316 16.852 -2.836 1.00 0.00 H new ATOM 0 HG SER A 81 -4.713 17.878 -4.380 1.00 0.00 H new ATOM 1316 N ASN A 82 -4.545 13.859 -1.015 1.00 0.00 N ATOM 1317 CA ASN A 82 -4.218 13.303 0.289 1.00 0.00 C ATOM 1318 C ASN A 82 -3.792 11.844 0.132 1.00 0.00 C ATOM 1319 O ASN A 82 -4.570 11.008 -0.331 1.00 0.00 O ATOM 1320 CB ASN A 82 -5.419 13.421 1.227 1.00 0.00 C ATOM 1321 CG ASN A 82 -5.150 12.845 2.602 1.00 0.00 C ATOM 1322 OD1 ASN A 82 -5.506 11.706 2.887 1.00 0.00 O ATOM 1323 ND2 ASN A 82 -4.518 13.632 3.464 1.00 0.00 N ATOM 0 H ASN A 82 -5.537 13.819 -1.249 1.00 0.00 H new ATOM 0 HA ASN A 82 -3.391 13.863 0.725 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -5.695 14.471 1.326 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.272 12.907 0.784 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -4.311 13.296 4.404 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -4.239 14.573 3.186 1.00 0.00 H new ATOM 1330 N ARG A 83 -2.550 11.551 0.518 1.00 0.00 N ATOM 1331 CA ARG A 83 -2.002 10.199 0.386 1.00 0.00 C ATOM 1332 C ARG A 83 -2.804 9.169 1.180 1.00 0.00 C ATOM 1333 O ARG A 83 -2.970 8.039 0.727 1.00 0.00 O ATOM 1334 CB ARG A 83 -0.527 10.158 0.792 1.00 0.00 C ATOM 1335 CG ARG A 83 0.405 10.860 -0.185 1.00 0.00 C ATOM 1336 CD ARG A 83 1.823 10.940 0.362 1.00 0.00 C ATOM 1337 NE ARG A 83 2.401 9.615 0.581 1.00 0.00 N ATOM 1338 CZ ARG A 83 3.548 9.408 1.221 1.00 0.00 C ATOM 1339 NH1 ARG A 83 4.243 10.436 1.693 1.00 0.00 N ATOM 1340 NH2 ARG A 83 3.999 8.172 1.392 1.00 0.00 N ATOM 0 H ARG A 83 -1.905 12.229 0.924 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.080 9.932 -0.668 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -0.419 10.617 1.775 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.217 9.118 0.890 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.409 10.325 -1.135 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.034 11.865 -0.387 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.449 11.498 -0.334 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.819 11.493 1.301 1.00 0.00 H new ATOM 0 HE ARG A 83 1.896 8.804 0.223 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.897 11.387 1.565 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.123 10.275 2.184 1.00 0.00 H new ATOM 0 HH21 ARG A 83 3.466 7.380 1.032 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.879 8.014 1.883 1.00 0.00 H new ATOM 1354 N GLU A 84 -3.295 9.545 2.358 1.00 0.00 N ATOM 1355 CA GLU A 84 -4.084 8.624 3.174 1.00 0.00 C ATOM 1356 C GLU A 84 -5.347 8.157 2.461 1.00 0.00 C ATOM 1357 O GLU A 84 -5.655 6.971 2.498 1.00 0.00 O ATOM 1358 CB GLU A 84 -4.445 9.261 4.513 1.00 0.00 C ATOM 1359 CG GLU A 84 -3.280 9.303 5.483 1.00 0.00 C ATOM 1360 CD GLU A 84 -3.604 10.062 6.755 1.00 0.00 C ATOM 1361 OE1 GLU A 84 -3.782 11.296 6.679 1.00 0.00 O ATOM 1362 OE2 GLU A 84 -3.679 9.422 7.824 1.00 0.00 O ATOM 0 H GLU A 84 -3.163 10.470 2.766 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.462 7.747 3.350 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.804 10.276 4.341 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.266 8.704 4.964 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.988 8.284 5.737 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.423 9.768 4.995 1.00 0.00 H new ATOM 1369 N LYS A 85 -6.078 9.057 1.803 1.00 0.00 N ATOM 1370 CA LYS A 85 -7.288 8.638 1.092 1.00 0.00 C ATOM 1371 C LYS A 85 -6.936 7.687 -0.046 1.00 0.00 C ATOM 1372 O LYS A 85 -7.634 6.699 -0.266 1.00 0.00 O ATOM 1373 CB LYS A 85 -8.089 9.825 0.554 1.00 0.00 C ATOM 1374 CG LYS A 85 -8.793 10.650 1.615 1.00 0.00 C ATOM 1375 CD LYS A 85 -9.581 11.782 0.973 1.00 0.00 C ATOM 1376 CE LYS A 85 -10.224 12.682 2.018 1.00 0.00 C ATOM 1377 NZ LYS A 85 -11.207 11.943 2.860 1.00 0.00 N ATOM 0 H LYS A 85 -5.864 10.053 1.746 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.918 8.121 1.816 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.417 10.475 -0.005 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.833 9.454 -0.151 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.464 10.014 2.193 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.061 11.058 2.312 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.919 12.374 0.341 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -10.353 11.367 0.325 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.450 13.109 2.655 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.724 13.514 1.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -11.720 12.615 3.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -11.883 11.444 2.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -10.705 11.254 3.455 1.00 0.00 H new ATOM 1391 N VAL A 86 -5.860 7.986 -0.762 1.00 0.00 N ATOM 1392 CA VAL A 86 -5.410 7.128 -1.850 1.00 0.00 C ATOM 1393 C VAL A 86 -4.985 5.759 -1.313 1.00 0.00 C ATOM 1394 O VAL A 86 -5.337 4.725 -1.876 1.00 0.00 O ATOM 1395 CB VAL A 86 -4.255 7.778 -2.647 1.00 0.00 C ATOM 1396 CG1 VAL A 86 -3.656 6.794 -3.641 1.00 0.00 C ATOM 1397 CG2 VAL A 86 -4.762 9.020 -3.363 1.00 0.00 C ATOM 0 H VAL A 86 -5.284 8.814 -0.610 1.00 0.00 H new ATOM 0 HA VAL A 86 -6.249 6.993 -2.533 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.468 8.065 -1.949 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.846 7.277 -4.188 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.267 5.928 -3.106 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.426 6.471 -4.342 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.946 9.476 -3.924 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -5.563 8.743 -4.049 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.141 9.733 -2.631 1.00 0.00 H new ATOM 1407 N LEU A 87 -4.250 5.766 -0.205 1.00 0.00 N ATOM 1408 CA LEU A 87 -3.779 4.531 0.420 1.00 0.00 C ATOM 1409 C LEU A 87 -4.937 3.726 1.003 1.00 0.00 C ATOM 1410 O LEU A 87 -5.044 2.528 0.754 1.00 0.00 O ATOM 1411 CB LEU A 87 -2.773 4.844 1.528 1.00 0.00 C ATOM 1412 CG LEU A 87 -1.404 4.184 1.393 1.00 0.00 C ATOM 1413 CD1 LEU A 87 -0.452 4.749 2.439 1.00 0.00 C ATOM 1414 CD2 LEU A 87 -1.525 2.672 1.529 1.00 0.00 C ATOM 0 H LEU A 87 -3.966 6.616 0.281 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.296 3.936 -0.355 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.631 5.924 1.569 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.207 4.543 2.482 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.002 4.401 0.403 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.524 4.274 2.337 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.349 5.824 2.294 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.849 4.554 3.435 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.539 2.218 1.430 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.941 2.427 2.506 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.181 2.288 0.748 1.00 0.00 H new ATOM 1426 N ILE A 88 -5.803 4.386 1.761 1.00 0.00 N ATOM 1427 CA ILE A 88 -6.942 3.717 2.380 1.00 0.00 C ATOM 1428 C ILE A 88 -7.874 3.118 1.325 1.00 0.00 C ATOM 1429 O ILE A 88 -8.289 1.962 1.442 1.00 0.00 O ATOM 1430 CB ILE A 88 -7.712 4.686 3.304 1.00 0.00 C ATOM 1431 CG1 ILE A 88 -6.849 4.991 4.534 1.00 0.00 C ATOM 1432 CG2 ILE A 88 -9.060 4.102 3.715 1.00 0.00 C ATOM 1433 CD1 ILE A 88 -7.318 6.181 5.338 1.00 0.00 C ATOM 0 H ILE A 88 -5.739 5.384 1.963 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.557 2.898 2.988 1.00 0.00 H new ATOM 0 HB ILE A 88 -7.915 5.611 2.764 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -6.833 4.113 5.180 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.823 5.167 4.210 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -9.579 4.807 4.365 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -9.663 3.917 2.826 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -8.903 3.164 4.248 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -6.654 6.329 6.190 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -7.306 7.072 4.710 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -8.332 6.002 5.695 1.00 0.00 H new ATOM 1445 N ALA A 89 -8.189 3.896 0.292 1.00 0.00 N ATOM 1446 CA ALA A 89 -9.054 3.421 -0.783 1.00 0.00 C ATOM 1447 C ALA A 89 -8.412 2.248 -1.527 1.00 0.00 C ATOM 1448 O ALA A 89 -9.089 1.277 -1.865 1.00 0.00 O ATOM 1449 CB ALA A 89 -9.391 4.550 -1.742 1.00 0.00 C ATOM 0 H ALA A 89 -7.859 4.854 0.177 1.00 0.00 H new ATOM 0 HA ALA A 89 -9.982 3.066 -0.336 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -10.037 4.173 -2.535 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.906 5.345 -1.202 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.473 4.943 -2.178 1.00 0.00 H new ATOM 1455 N LEU A 90 -7.103 2.343 -1.766 1.00 0.00 N ATOM 1456 CA LEU A 90 -6.372 1.284 -2.460 1.00 0.00 C ATOM 1457 C LEU A 90 -6.306 0.016 -1.605 1.00 0.00 C ATOM 1458 O LEU A 90 -6.409 -1.093 -2.131 1.00 0.00 O ATOM 1459 CB LEU A 90 -4.960 1.753 -2.851 1.00 0.00 C ATOM 1460 CG LEU A 90 -4.788 2.223 -4.302 1.00 0.00 C ATOM 1461 CD1 LEU A 90 -5.879 3.210 -4.702 1.00 0.00 C ATOM 1462 CD2 LEU A 90 -3.415 2.851 -4.485 1.00 0.00 C ATOM 0 H LEU A 90 -6.530 3.140 -1.490 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.914 1.048 -3.376 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.673 2.569 -2.188 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.263 0.935 -2.669 1.00 0.00 H new ATOM 0 HG LEU A 90 -4.875 1.352 -4.952 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.726 3.522 -5.735 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.854 2.732 -4.607 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.837 4.082 -4.050 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -3.301 3.182 -5.517 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.314 3.706 -3.817 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.645 2.116 -4.252 1.00 0.00 H new ATOM 1474 N ARG A 91 -6.133 0.177 -0.286 1.00 0.00 N ATOM 1475 CA ARG A 91 -6.084 -0.971 0.623 1.00 0.00 C ATOM 1476 C ARG A 91 -7.418 -1.706 0.636 1.00 0.00 C ATOM 1477 O ARG A 91 -7.456 -2.938 0.629 1.00 0.00 O ATOM 1478 CB ARG A 91 -5.732 -0.535 2.048 1.00 0.00 C ATOM 1479 CG ARG A 91 -4.292 -0.085 2.215 1.00 0.00 C ATOM 1480 CD ARG A 91 -4.016 0.396 3.631 1.00 0.00 C ATOM 1481 NE ARG A 91 -4.179 -0.673 4.614 1.00 0.00 N ATOM 1482 CZ ARG A 91 -4.145 -0.480 5.930 1.00 0.00 C ATOM 1483 NH1 ARG A 91 -3.948 0.737 6.420 1.00 0.00 N ATOM 1484 NH2 ARG A 91 -4.307 -1.507 6.755 1.00 0.00 N ATOM 0 H ARG A 91 -6.026 1.083 0.170 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.306 -1.642 0.258 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -6.394 0.280 2.342 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -5.925 -1.364 2.729 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.622 -0.910 1.973 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.077 0.717 1.509 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.001 0.790 3.689 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -4.691 1.217 3.873 1.00 0.00 H new ATOM 0 HE ARG A 91 -4.327 -1.622 4.271 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.822 1.527 5.787 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -3.922 0.882 7.429 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.457 -2.444 6.380 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.281 -1.360 7.764 1.00 0.00 H new ATOM 1498 N LEU A 92 -8.512 -0.947 0.659 1.00 0.00 N ATOM 1499 CA LEU A 92 -9.849 -1.536 0.648 1.00 0.00 C ATOM 1500 C LEU A 92 -10.088 -2.281 -0.662 1.00 0.00 C ATOM 1501 O LEU A 92 -10.688 -3.359 -0.673 1.00 0.00 O ATOM 1502 CB LEU A 92 -10.918 -0.460 0.857 1.00 0.00 C ATOM 1503 CG LEU A 92 -10.961 0.153 2.260 1.00 0.00 C ATOM 1504 CD1 LEU A 92 -11.892 1.356 2.287 1.00 0.00 C ATOM 1505 CD2 LEU A 92 -11.397 -0.885 3.284 1.00 0.00 C ATOM 0 H LEU A 92 -8.499 0.073 0.685 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.918 -2.247 1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.753 0.339 0.134 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -11.894 -0.893 0.637 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.957 0.489 2.520 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.911 1.779 3.291 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.535 2.108 1.583 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.898 1.044 2.006 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.422 -0.431 4.275 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -12.391 -1.253 3.029 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.691 -1.716 3.283 1.00 0.00 H new ATOM 1517 N LEU A 93 -9.615 -1.700 -1.762 1.00 0.00 N ATOM 1518 CA LEU A 93 -9.756 -2.320 -3.075 1.00 0.00 C ATOM 1519 C LEU A 93 -8.955 -3.619 -3.149 1.00 0.00 C ATOM 1520 O LEU A 93 -9.417 -4.613 -3.711 1.00 0.00 O ATOM 1521 CB LEU A 93 -9.290 -1.370 -4.178 1.00 0.00 C ATOM 1522 CG LEU A 93 -10.186 -0.158 -4.431 1.00 0.00 C ATOM 1523 CD1 LEU A 93 -9.508 0.806 -5.392 1.00 0.00 C ATOM 1524 CD2 LEU A 93 -11.536 -0.597 -4.978 1.00 0.00 C ATOM 0 H LEU A 93 -9.131 -0.802 -1.769 1.00 0.00 H new ATOM 0 HA LEU A 93 -10.812 -2.544 -3.223 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.291 -1.014 -3.927 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.204 -1.935 -5.106 1.00 0.00 H new ATOM 0 HG LEU A 93 -10.352 0.355 -3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -10.157 1.665 -5.564 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -8.565 1.144 -4.963 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.316 0.301 -6.339 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -12.160 0.279 -5.152 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -11.392 -1.132 -5.917 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -12.024 -1.253 -4.258 1.00 0.00 H new ATOM 1536 N ALA A 94 -7.749 -3.597 -2.574 1.00 0.00 N ATOM 1537 CA ALA A 94 -6.871 -4.765 -2.573 1.00 0.00 C ATOM 1538 C ALA A 94 -7.480 -5.927 -1.800 1.00 0.00 C ATOM 1539 O ALA A 94 -7.352 -7.085 -2.205 1.00 0.00 O ATOM 1540 CB ALA A 94 -5.500 -4.408 -2.020 1.00 0.00 C ATOM 0 H ALA A 94 -7.360 -2.780 -2.103 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.753 -5.087 -3.608 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.863 -5.292 -2.028 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.050 -3.630 -2.637 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.603 -4.045 -0.997 1.00 0.00 H new ATOM 1546 N GLU A 95 -8.135 -5.620 -0.683 1.00 0.00 N ATOM 1547 CA GLU A 95 -8.771 -6.644 0.137 1.00 0.00 C ATOM 1548 C GLU A 95 -9.876 -7.347 -0.646 1.00 0.00 C ATOM 1549 O GLU A 95 -10.069 -8.559 -0.523 1.00 0.00 O ATOM 1550 CB GLU A 95 -9.339 -6.020 1.413 1.00 0.00 C ATOM 1551 CG GLU A 95 -8.271 -5.568 2.399 1.00 0.00 C ATOM 1552 CD GLU A 95 -8.839 -4.769 3.557 1.00 0.00 C ATOM 1553 OE1 GLU A 95 -9.995 -4.308 3.452 1.00 0.00 O ATOM 1554 OE2 GLU A 95 -8.127 -4.609 4.570 1.00 0.00 O ATOM 0 H GLU A 95 -8.238 -4.670 -0.326 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.020 -7.384 0.412 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.959 -5.164 1.144 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.990 -6.744 1.903 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.749 -6.442 2.788 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.532 -4.963 1.874 1.00 0.00 H new ATOM 1561 N GLU A 96 -10.598 -6.568 -1.449 1.00 0.00 N ATOM 1562 CA GLU A 96 -11.679 -7.093 -2.279 1.00 0.00 C ATOM 1563 C GLU A 96 -11.133 -8.102 -3.286 1.00 0.00 C ATOM 1564 O GLU A 96 -11.756 -9.131 -3.555 1.00 0.00 O ATOM 1565 CB GLU A 96 -12.362 -5.946 -3.030 1.00 0.00 C ATOM 1566 CG GLU A 96 -13.164 -5.013 -2.132 1.00 0.00 C ATOM 1567 CD GLU A 96 -14.274 -5.725 -1.384 1.00 0.00 C ATOM 1568 OE1 GLU A 96 -15.048 -6.463 -2.030 1.00 0.00 O ATOM 1569 OE2 GLU A 96 -14.369 -5.545 -0.152 1.00 0.00 O ATOM 0 H GLU A 96 -10.452 -5.563 -1.542 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.403 -7.590 -1.633 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.603 -5.366 -3.555 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -13.025 -6.364 -3.788 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -12.493 -4.542 -1.414 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -13.594 -4.215 -2.737 1.00 0.00 H new ATOM 1576 N ILE A 97 -9.964 -7.786 -3.831 1.00 0.00 N ATOM 1577 CA ILE A 97 -9.298 -8.635 -4.813 1.00 0.00 C ATOM 1578 C ILE A 97 -8.943 -9.993 -4.212 1.00 0.00 C ATOM 1579 O ILE A 97 -9.173 -11.031 -4.827 1.00 0.00 O ATOM 1580 CB ILE A 97 -8.024 -7.942 -5.328 1.00 0.00 C ATOM 1581 CG1 ILE A 97 -8.417 -6.684 -6.090 1.00 0.00 C ATOM 1582 CG2 ILE A 97 -7.211 -8.874 -6.224 1.00 0.00 C ATOM 1583 CD1 ILE A 97 -7.272 -5.731 -6.286 1.00 0.00 C ATOM 0 H ILE A 97 -9.451 -6.934 -3.605 1.00 0.00 H new ATOM 0 HA ILE A 97 -9.984 -8.797 -5.644 1.00 0.00 H new ATOM 0 HB ILE A 97 -7.397 -7.677 -4.476 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -8.817 -6.967 -7.064 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -9.217 -6.176 -5.552 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -6.317 -8.356 -6.572 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -6.920 -9.760 -5.659 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -7.814 -9.172 -7.081 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -7.617 -4.855 -6.835 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -6.886 -5.421 -5.315 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -6.481 -6.224 -6.850 1.00 0.00 H new ATOM 1595 N GLY A 98 -8.376 -9.972 -3.005 1.00 0.00 N ATOM 1596 CA GLY A 98 -8.011 -11.209 -2.331 1.00 0.00 C ATOM 1597 C GLY A 98 -9.217 -12.078 -2.023 1.00 0.00 C ATOM 1598 O GLY A 98 -9.141 -13.304 -2.084 1.00 0.00 O ATOM 0 H GLY A 98 -8.164 -9.122 -2.483 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -7.314 -11.768 -2.956 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.490 -10.974 -1.403 1.00 0.00 H new ATOM 1602 N ASP A 99 -10.327 -11.428 -1.671 1.00 0.00 N ATOM 1603 CA ASP A 99 -11.575 -12.123 -1.358 1.00 0.00 C ATOM 1604 C ASP A 99 -12.144 -12.830 -2.589 1.00 0.00 C ATOM 1605 O ASP A 99 -12.652 -13.947 -2.495 1.00 0.00 O ATOM 1606 CB ASP A 99 -12.608 -11.141 -0.801 1.00 0.00 C ATOM 1607 CG ASP A 99 -13.862 -11.836 -0.308 1.00 0.00 C ATOM 1608 OD1 ASP A 99 -13.767 -12.598 0.677 1.00 0.00 O ATOM 1609 OD2 ASP A 99 -14.937 -11.612 -0.902 1.00 0.00 O ATOM 0 H ASP A 99 -10.386 -10.413 -1.595 1.00 0.00 H new ATOM 0 HA ASP A 99 -11.352 -12.877 -0.603 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -12.163 -10.577 0.019 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.875 -10.422 -1.575 1.00 0.00 H new ATOM 1614 N TYR A 100 -12.065 -12.164 -3.737 1.00 0.00 N ATOM 1615 CA TYR A 100 -12.580 -12.721 -4.981 1.00 0.00 C ATOM 1616 C TYR A 100 -11.554 -13.647 -5.624 1.00 0.00 C ATOM 1617 O TYR A 100 -10.528 -13.202 -6.137 1.00 0.00 O ATOM 1618 CB TYR A 100 -12.952 -11.592 -5.951 1.00 0.00 C ATOM 1619 CG TYR A 100 -13.457 -12.072 -7.295 1.00 0.00 C ATOM 1620 CD1 TYR A 100 -14.736 -12.598 -7.434 1.00 0.00 C ATOM 1621 CD2 TYR A 100 -12.653 -11.997 -8.427 1.00 0.00 C ATOM 1622 CE1 TYR A 100 -15.198 -13.036 -8.661 1.00 0.00 C ATOM 1623 CE2 TYR A 100 -13.109 -12.433 -9.656 1.00 0.00 C ATOM 1624 CZ TYR A 100 -14.381 -12.951 -9.768 1.00 0.00 C ATOM 1625 OH TYR A 100 -14.836 -13.388 -10.991 1.00 0.00 O ATOM 0 H TYR A 100 -11.649 -11.237 -3.830 1.00 0.00 H new ATOM 0 HA TYR A 100 -13.473 -13.303 -4.753 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -13.717 -10.968 -5.489 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -12.078 -10.960 -6.108 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -15.379 -12.666 -6.569 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -11.656 -11.591 -8.344 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -16.194 -13.443 -8.752 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -12.471 -12.368 -10.525 1.00 0.00 H new ATOM 0 HH TYR A 100 -14.138 -13.257 -11.666 1.00 0.00 H new ATOM 1635 N LYS A 101 -11.844 -14.939 -5.603 1.00 0.00 N ATOM 1636 CA LYS A 101 -10.947 -15.925 -6.188 1.00 0.00 C ATOM 1637 C LYS A 101 -11.569 -16.539 -7.436 1.00 0.00 C ATOM 1638 O LYS A 101 -12.704 -17.015 -7.404 1.00 0.00 O ATOM 1639 CB LYS A 101 -10.627 -17.020 -5.166 1.00 0.00 C ATOM 1640 CG LYS A 101 -9.955 -16.494 -3.906 1.00 0.00 C ATOM 1641 CD LYS A 101 -9.620 -17.614 -2.935 1.00 0.00 C ATOM 1642 CE LYS A 101 -9.064 -17.069 -1.631 1.00 0.00 C ATOM 1643 NZ LYS A 101 -7.816 -16.284 -1.842 1.00 0.00 N ATOM 0 H LYS A 101 -12.691 -15.329 -5.189 1.00 0.00 H new ATOM 0 HA LYS A 101 -10.021 -15.425 -6.472 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -11.550 -17.530 -4.890 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -9.979 -17.763 -5.631 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -9.043 -15.962 -4.176 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.611 -15.774 -3.418 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -10.515 -18.202 -2.733 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -8.893 -18.286 -3.390 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -9.813 -16.438 -1.153 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -8.862 -17.895 -0.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -7.189 -16.402 -1.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -7.333 -16.623 -2.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -8.054 -15.278 -1.954 1.00 0.00 H new ATOM 1657 N ASP A 102 -10.822 -16.526 -8.535 1.00 0.00 N ATOM 1658 CA ASP A 102 -11.302 -17.081 -9.796 1.00 0.00 C ATOM 1659 C ASP A 102 -10.159 -17.735 -10.564 1.00 0.00 C ATOM 1660 O ASP A 102 -9.298 -17.048 -11.116 1.00 0.00 O ATOM 1661 CB ASP A 102 -11.951 -15.987 -10.650 1.00 0.00 C ATOM 1662 CG ASP A 102 -12.523 -16.525 -11.944 1.00 0.00 C ATOM 1663 OD1 ASP A 102 -13.463 -17.345 -11.884 1.00 0.00 O ATOM 1664 OD2 ASP A 102 -12.030 -16.126 -13.022 1.00 0.00 O ATOM 0 H ASP A 102 -9.880 -16.137 -8.578 1.00 0.00 H new ATOM 0 HA ASP A 102 -12.050 -17.841 -9.571 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -12.745 -15.507 -10.078 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -11.211 -15.219 -10.875 1.00 0.00 H new ATOM 1669 N ASP A 103 -10.151 -19.063 -10.595 1.00 0.00 N ATOM 1670 CA ASP A 103 -9.106 -19.802 -11.298 1.00 0.00 C ATOM 1671 C ASP A 103 -9.505 -20.038 -12.752 1.00 0.00 C ATOM 1672 O ASP A 103 -10.355 -20.879 -13.040 1.00 0.00 O ATOM 1673 CB ASP A 103 -8.840 -21.142 -10.602 1.00 0.00 C ATOM 1674 CG ASP A 103 -7.680 -21.910 -11.214 1.00 0.00 C ATOM 1675 OD1 ASP A 103 -6.995 -21.355 -12.104 1.00 0.00 O ATOM 1676 OD2 ASP A 103 -7.453 -23.065 -10.800 1.00 0.00 O ATOM 0 H ASP A 103 -10.853 -19.649 -10.144 1.00 0.00 H new ATOM 0 HA ASP A 103 -8.192 -19.208 -11.278 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -8.633 -20.962 -9.547 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -9.740 -21.755 -10.650 1.00 0.00 H new ATOM 1681 N ASP A 104 -8.889 -19.289 -13.660 1.00 0.00 N ATOM 1682 CA ASP A 104 -9.181 -19.419 -15.086 1.00 0.00 C ATOM 1683 C ASP A 104 -8.057 -20.162 -15.808 1.00 0.00 C ATOM 1684 O ASP A 104 -7.984 -20.160 -17.036 1.00 0.00 O ATOM 1685 CB ASP A 104 -9.386 -18.038 -15.717 1.00 0.00 C ATOM 1686 CG ASP A 104 -10.209 -18.095 -16.990 1.00 0.00 C ATOM 1687 OD1 ASP A 104 -10.997 -19.052 -17.148 1.00 0.00 O ATOM 1688 OD2 ASP A 104 -10.070 -17.179 -17.827 1.00 0.00 O ATOM 0 H ASP A 104 -8.185 -18.586 -13.436 1.00 0.00 H new ATOM 0 HA ASP A 104 -10.099 -19.997 -15.191 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -9.880 -17.384 -14.998 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.415 -17.595 -15.936 1.00 0.00 H new ATOM 1693 N ASP A 105 -7.175 -20.790 -15.038 1.00 0.00 N ATOM 1694 CA ASP A 105 -6.056 -21.531 -15.611 1.00 0.00 C ATOM 1695 C ASP A 105 -6.444 -22.987 -15.854 1.00 0.00 C ATOM 1696 O ASP A 105 -6.507 -23.781 -14.915 1.00 0.00 O ATOM 1697 CB ASP A 105 -4.838 -21.465 -14.685 1.00 0.00 C ATOM 1698 CG ASP A 105 -3.603 -22.103 -15.294 1.00 0.00 C ATOM 1699 OD1 ASP A 105 -3.551 -22.236 -16.536 1.00 0.00 O ATOM 1700 OD2 ASP A 105 -2.688 -22.468 -14.529 1.00 0.00 O ATOM 0 H ASP A 105 -7.212 -20.801 -14.019 1.00 0.00 H new ATOM 0 HA ASP A 105 -5.799 -21.072 -16.566 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.624 -20.423 -14.447 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -5.074 -21.964 -13.745 1.00 0.00 H new ATOM 1705 N LYS A 106 -6.700 -23.322 -17.120 1.00 0.00 N ATOM 1706 CA LYS A 106 -7.081 -24.681 -17.515 1.00 0.00 C ATOM 1707 C LYS A 106 -8.344 -25.143 -16.782 1.00 0.00 C ATOM 1708 O LYS A 106 -8.369 -26.301 -16.312 1.00 0.00 O ATOM 1709 CB LYS A 106 -5.931 -25.662 -17.258 1.00 0.00 C ATOM 1710 CG LYS A 106 -4.868 -25.658 -18.347 1.00 0.00 C ATOM 1711 CD LYS A 106 -3.673 -26.526 -17.972 1.00 0.00 C ATOM 1712 CE LYS A 106 -4.028 -28.006 -17.980 1.00 0.00 C ATOM 1713 NZ LYS A 106 -4.358 -28.492 -19.348 1.00 0.00 N ATOM 1714 OXT LYS A 106 -9.299 -24.342 -16.693 1.00 0.00 O ATOM 0 H LYS A 106 -6.650 -22.663 -17.897 1.00 0.00 H new ATOM 0 HA LYS A 106 -7.297 -24.664 -18.583 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -5.463 -25.417 -16.305 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -6.338 -26.669 -17.164 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -5.301 -26.019 -19.280 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -4.534 -24.636 -18.525 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.857 -26.344 -18.671 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -3.314 -26.243 -16.982 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -3.192 -28.582 -17.582 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -4.877 -28.179 -17.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -4.344 -29.532 -19.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -5.304 -28.155 -19.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.656 -28.129 -20.024 1.00 0.00 H new TER 1728 LYS A 106