USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1063 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 7 TYR OH : rot -155:sc= 0.751 USER MOD Set 1.2: A 103 HIS : no HE2:sc= 0.104 K(o=0.85,f=-5.6!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= -0.275 (180deg=-0.275) USER MOD Single : A 13 LYS NZ :NH3+ -174:sc= 1.07 (180deg=0.663) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -41:sc= 0.0105 USER MOD Single : A 29 LYS NZ :NH3+ -127:sc= 1.09 (180deg=-1.23) USER MOD Single : A 34 TYR OH : rot 171:sc= 0.79 USER MOD Single : A 36 SER OG : rot 59:sc= -0.0528 USER MOD Single : A 38 SER OG : rot -68:sc= -1.67 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -3.56! C(o=-3.6!,f=-9.5!) USER MOD Single : A 54 TYR OH : rot 17:sc= 1.23 USER MOD Single : A 56 LYS NZ :NH3+ 160:sc= -0.26 (180deg=-1.07!) USER MOD Single : A 58 HIS : no HD1:sc= -0.58 K(o=-0.58,f=-2.1) USER MOD Single : A 60 SER OG : rot 180:sc= 0.0702 USER MOD Single : A 61 LYS NZ :NH3+ -158:sc= -0.995 (180deg=-2!) USER MOD Single : A 62 ASN : amide:sc= -4.88 K(o=-4.9,f=-6.1!) USER MOD Single : A 68 CYS SG : rot 70:sc= -0.693 USER MOD Single : A 69 THR OG1 : rot -48:sc= -0.175 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -170:sc= 0.21 (180deg=-0.104) USER MOD Single : A 84 MET CE :methyl -176:sc= -3.8! (180deg=-4.09!) USER MOD Single : A 93 GLN : amide:sc= -4.97! C(o=-5!,f=-8!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.329 X(o=-0.33,f=-0.096) USER MOD Single : A 99 LYS NZ :NH3+ 158:sc= -0.117 (180deg=-0.588) USER MOD Single : A 101 SER OG : rot -106:sc= 0.0293 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -4.03 K(o=-4,f=-3.3) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot -2:sc= 0.0532! USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 180:sc= -0.334 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 104:sc= -0.3! USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= -0.0587 X(o=-0.059,f=0) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -3.292 12.882 3.402 1.00 0.00 N ATOM 22 CA LEU A 4 -3.480 11.744 2.513 1.00 0.00 C ATOM 23 C LEU A 4 -4.610 12.010 1.523 1.00 0.00 C ATOM 24 O LEU A 4 -4.550 11.590 0.369 1.00 0.00 O ATOM 25 CB LEU A 4 -3.785 10.478 3.319 1.00 0.00 C ATOM 26 CG LEU A 4 -3.295 10.480 4.771 1.00 0.00 C ATOM 27 CD1 LEU A 4 -1.856 10.972 4.869 1.00 0.00 C ATOM 28 CD2 LEU A 4 -4.224 11.306 5.654 1.00 0.00 C ATOM 0 HA LEU A 4 -2.555 11.597 1.956 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.864 10.321 3.319 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -3.339 9.626 2.806 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.313 9.452 5.133 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -1.538 10.962 5.912 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -1.208 10.319 4.285 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -1.792 11.988 4.480 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.857 11.293 6.680 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.252 12.333 5.291 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.228 10.882 5.623 1.00 0.00 H new ATOM 40 N ASP A 5 -5.640 12.712 1.980 1.00 0.00 N ATOM 41 CA ASP A 5 -6.783 13.029 1.131 1.00 0.00 C ATOM 42 C ASP A 5 -6.335 13.664 -0.182 1.00 0.00 C ATOM 43 O ASP A 5 -6.788 13.270 -1.256 1.00 0.00 O ATOM 44 CB ASP A 5 -7.747 13.964 1.863 1.00 0.00 C ATOM 45 CG ASP A 5 -9.199 13.637 1.573 1.00 0.00 C ATOM 46 OD1 ASP A 5 -9.727 14.132 0.553 1.00 0.00 O ATOM 47 OD2 ASP A 5 -9.809 12.886 2.363 1.00 0.00 O ATOM 0 H ASP A 5 -5.708 13.072 2.932 1.00 0.00 H new ATOM 0 HA ASP A 5 -7.298 12.096 0.901 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -7.569 13.897 2.936 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -7.543 14.994 1.570 1.00 0.00 H new ATOM 52 N LYS A 6 -5.439 14.642 -0.093 1.00 0.00 N ATOM 53 CA LYS A 6 -4.933 15.316 -1.283 1.00 0.00 C ATOM 54 C LYS A 6 -3.887 14.459 -1.996 1.00 0.00 C ATOM 55 O LYS A 6 -3.429 14.804 -3.086 1.00 0.00 O ATOM 56 CB LYS A 6 -4.336 16.676 -0.913 1.00 0.00 C ATOM 57 CG LYS A 6 -3.270 16.602 0.167 1.00 0.00 C ATOM 58 CD LYS A 6 -2.410 17.857 0.187 1.00 0.00 C ATOM 59 CE LYS A 6 -1.104 17.654 -0.564 1.00 0.00 C ATOM 60 NZ LYS A 6 0.076 18.024 0.264 1.00 0.00 N ATOM 0 H LYS A 6 -5.050 14.984 0.786 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.770 15.471 -1.964 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -3.905 17.129 -1.806 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -5.137 17.335 -0.576 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -3.744 16.469 1.139 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.639 15.730 -0.002 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.962 18.684 -0.260 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -2.197 18.136 1.219 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -1.020 16.611 -0.870 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -1.111 18.254 -1.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.946 17.871 -0.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 0.009 19.026 0.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 0.098 17.434 1.120 1.00 0.00 H new ATOM 74 N TYR A 7 -3.510 13.344 -1.374 1.00 0.00 N ATOM 75 CA TYR A 7 -2.516 12.442 -1.946 1.00 0.00 C ATOM 76 C TYR A 7 -3.166 11.376 -2.823 1.00 0.00 C ATOM 77 O TYR A 7 -2.821 11.234 -3.995 1.00 0.00 O ATOM 78 CB TYR A 7 -1.707 11.773 -0.833 1.00 0.00 C ATOM 79 CG TYR A 7 -0.490 12.562 -0.398 1.00 0.00 C ATOM 80 CD1 TYR A 7 -0.480 13.952 -0.450 1.00 0.00 C ATOM 81 CD2 TYR A 7 0.648 11.916 0.067 1.00 0.00 C ATOM 82 CE1 TYR A 7 0.630 14.673 -0.051 1.00 0.00 C ATOM 83 CE2 TYR A 7 1.762 12.630 0.468 1.00 0.00 C ATOM 84 CZ TYR A 7 1.747 14.007 0.407 1.00 0.00 C ATOM 85 OH TYR A 7 2.854 14.722 0.805 1.00 0.00 O ATOM 0 H TYR A 7 -3.880 13.044 -0.472 1.00 0.00 H new ATOM 0 HA TYR A 7 -1.851 13.037 -2.572 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.354 11.618 0.030 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -1.387 10.788 -1.172 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -1.354 14.476 -0.808 1.00 0.00 H new ATOM 0 HD2 TYR A 7 0.663 10.837 0.116 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.622 15.752 -0.098 1.00 0.00 H new ATOM 0 HE2 TYR A 7 2.639 12.112 0.827 1.00 0.00 H new ATOM 0 HH TYR A 7 3.654 14.163 0.714 1.00 0.00 H new ATOM 135 N ILE A 11 -10.172 9.626 -2.278 1.00 0.00 N ATOM 136 CA ILE A 11 -10.968 9.576 -3.497 1.00 0.00 C ATOM 137 C ILE A 11 -12.156 8.629 -3.344 1.00 0.00 C ATOM 138 O ILE A 11 -12.163 7.768 -2.465 1.00 0.00 O ATOM 139 CB ILE A 11 -10.111 9.133 -4.702 1.00 0.00 C ATOM 140 CG1 ILE A 11 -8.899 10.056 -4.854 1.00 0.00 C ATOM 141 CG2 ILE A 11 -10.939 9.127 -5.978 1.00 0.00 C ATOM 142 CD1 ILE A 11 -7.698 9.382 -5.482 1.00 0.00 C ATOM 0 HA ILE A 11 -11.342 10.584 -3.678 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.758 8.118 -4.521 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -9.182 10.916 -5.462 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -8.619 10.438 -3.872 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.316 8.812 -6.815 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -11.774 8.435 -5.867 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -11.322 10.130 -6.168 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.878 10.096 -5.558 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.389 8.539 -4.864 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -7.961 9.024 -6.478 1.00 0.00 H new ATOM 154 N GLU A 12 -13.158 8.811 -4.212 1.00 0.00 N ATOM 155 CA GLU A 12 -14.386 8.002 -4.218 1.00 0.00 C ATOM 156 C GLU A 12 -14.325 6.804 -3.264 1.00 0.00 C ATOM 157 O GLU A 12 -14.781 6.890 -2.124 1.00 0.00 O ATOM 158 CB GLU A 12 -14.687 7.521 -5.640 1.00 0.00 C ATOM 159 CG GLU A 12 -15.482 8.520 -6.464 1.00 0.00 C ATOM 160 CD GLU A 12 -14.702 9.786 -6.755 1.00 0.00 C ATOM 161 OE1 GLU A 12 -13.638 9.693 -7.402 1.00 0.00 O ATOM 162 OE2 GLU A 12 -15.156 10.873 -6.337 1.00 0.00 O ATOM 0 H GLU A 12 -13.141 9.529 -4.936 1.00 0.00 H new ATOM 0 HA GLU A 12 -15.188 8.647 -3.860 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -13.747 7.309 -6.149 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.240 6.583 -5.588 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.778 8.056 -7.405 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.399 8.776 -5.933 1.00 0.00 H new ATOM 169 N LYS A 13 -13.776 5.686 -3.737 1.00 0.00 N ATOM 170 CA LYS A 13 -13.683 4.478 -2.912 1.00 0.00 C ATOM 171 C LYS A 13 -12.508 3.602 -3.339 1.00 0.00 C ATOM 172 O LYS A 13 -11.931 3.793 -4.410 1.00 0.00 O ATOM 173 CB LYS A 13 -14.983 3.677 -3.006 1.00 0.00 C ATOM 174 CG LYS A 13 -16.020 4.076 -1.968 1.00 0.00 C ATOM 175 CD LYS A 13 -17.369 4.369 -2.606 1.00 0.00 C ATOM 176 CE LYS A 13 -17.341 5.669 -3.394 1.00 0.00 C ATOM 177 NZ LYS A 13 -17.363 6.860 -2.500 1.00 0.00 N ATOM 0 H LYS A 13 -13.392 5.589 -4.677 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.519 4.790 -1.880 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.409 3.806 -4.001 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.756 2.617 -2.892 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.129 3.276 -1.236 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.674 4.957 -1.427 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.647 3.548 -3.267 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -18.134 4.428 -1.832 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -16.446 5.698 -4.015 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -18.198 5.704 -4.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -17.446 7.723 -3.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.176 6.794 -1.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -16.483 6.895 -1.947 1.00 0.00 H new ATOM 191 N LEU A 14 -12.163 2.637 -2.490 1.00 0.00 N ATOM 192 CA LEU A 14 -11.060 1.722 -2.767 1.00 0.00 C ATOM 193 C LEU A 14 -11.583 0.335 -3.140 1.00 0.00 C ATOM 194 O LEU A 14 -12.755 0.025 -2.924 1.00 0.00 O ATOM 195 CB LEU A 14 -10.136 1.621 -1.552 1.00 0.00 C ATOM 196 CG LEU A 14 -9.403 2.913 -1.187 1.00 0.00 C ATOM 197 CD1 LEU A 14 -8.466 2.682 -0.013 1.00 0.00 C ATOM 198 CD2 LEU A 14 -8.637 3.446 -2.388 1.00 0.00 C ATOM 0 H LEU A 14 -12.634 2.469 -1.601 1.00 0.00 H new ATOM 0 HA LEU A 14 -10.496 2.118 -3.612 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -10.725 1.300 -0.693 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.397 0.843 -1.741 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.142 3.658 -0.892 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.954 3.612 0.232 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.040 2.346 0.850 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -7.731 1.922 -0.278 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.121 4.366 -2.112 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -7.907 2.704 -2.713 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.333 3.651 -3.202 1.00 0.00 H new ATOM 210 N ARG A 15 -10.707 -0.496 -3.697 1.00 0.00 N ATOM 211 CA ARG A 15 -11.076 -1.843 -4.095 1.00 0.00 C ATOM 212 C ARG A 15 -10.648 -2.856 -3.050 1.00 0.00 C ATOM 213 O ARG A 15 -9.491 -3.271 -2.992 1.00 0.00 O ATOM 214 CB ARG A 15 -10.459 -2.220 -5.432 1.00 0.00 C ATOM 215 CG ARG A 15 -10.575 -1.140 -6.498 1.00 0.00 C ATOM 216 CD ARG A 15 -11.575 -1.518 -7.583 1.00 0.00 C ATOM 217 NE ARG A 15 -11.446 -2.915 -7.994 1.00 0.00 N ATOM 218 CZ ARG A 15 -10.534 -3.355 -8.859 1.00 0.00 C ATOM 219 NH1 ARG A 15 -9.664 -2.513 -9.402 1.00 0.00 N ATOM 220 NH2 ARG A 15 -10.492 -4.640 -9.182 1.00 0.00 N ATOM 0 H ARG A 15 -9.733 -0.255 -3.882 1.00 0.00 H new ATOM 0 HA ARG A 15 -12.162 -1.857 -4.191 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -9.405 -2.454 -5.280 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -10.938 -3.129 -5.797 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -10.881 -0.203 -6.033 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -9.598 -0.968 -6.949 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -12.587 -1.341 -7.219 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -11.430 -0.872 -8.449 1.00 0.00 H new ATOM 0 HE ARG A 15 -12.094 -3.594 -7.594 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -9.692 -1.523 -9.157 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -8.968 -2.856 -10.064 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -11.158 -5.292 -8.768 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -9.793 -4.977 -9.845 1.00 0.00 H new ATOM 234 N ARG A 16 -11.604 -3.249 -2.244 1.00 0.00 N ATOM 235 CA ARG A 16 -11.380 -4.231 -1.187 1.00 0.00 C ATOM 236 C ARG A 16 -11.495 -5.647 -1.742 1.00 0.00 C ATOM 237 O ARG A 16 -11.794 -5.834 -2.920 1.00 0.00 O ATOM 238 CB ARG A 16 -12.388 -4.037 -0.050 1.00 0.00 C ATOM 239 CG ARG A 16 -11.889 -4.535 1.297 1.00 0.00 C ATOM 240 CD ARG A 16 -12.450 -3.708 2.443 1.00 0.00 C ATOM 241 NE ARG A 16 -12.795 -4.535 3.597 1.00 0.00 N ATOM 242 CZ ARG A 16 -12.991 -4.052 4.822 1.00 0.00 C ATOM 243 NH1 ARG A 16 -12.874 -2.751 5.057 1.00 0.00 N ATOM 244 NH2 ARG A 16 -13.304 -4.873 5.815 1.00 0.00 N ATOM 0 H ARG A 16 -12.562 -2.903 -2.294 1.00 0.00 H new ATOM 0 HA ARG A 16 -10.374 -4.084 -0.795 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -12.632 -2.978 0.031 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -13.312 -4.558 -0.301 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -12.174 -5.579 1.428 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -10.800 -4.496 1.319 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -11.718 -2.957 2.741 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -13.336 -3.172 2.103 1.00 0.00 H new ATOM 0 HE ARG A 16 -12.891 -5.541 3.456 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -12.633 -2.115 4.297 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -13.025 -2.387 5.998 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -13.394 -5.874 5.640 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -13.454 -4.504 6.754 1.00 0.00 H new ATOM 258 N GLY A 17 -11.263 -6.641 -0.891 1.00 0.00 N ATOM 259 CA GLY A 17 -11.353 -8.024 -1.325 1.00 0.00 C ATOM 260 C GLY A 17 -12.655 -8.323 -2.043 1.00 0.00 C ATOM 261 O GLY A 17 -12.736 -8.219 -3.267 1.00 0.00 O ATOM 0 H GLY A 17 -11.015 -6.514 0.090 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -10.517 -8.249 -1.987 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -11.260 -8.680 -0.459 1.00 0.00 H new ATOM 265 N ASP A 18 -13.678 -8.699 -1.279 1.00 0.00 N ATOM 266 CA ASP A 18 -14.982 -9.018 -1.840 1.00 0.00 C ATOM 267 C ASP A 18 -15.432 -7.960 -2.844 1.00 0.00 C ATOM 268 O ASP A 18 -15.844 -8.280 -3.959 1.00 0.00 O ATOM 269 CB ASP A 18 -16.020 -9.152 -0.724 1.00 0.00 C ATOM 270 CG ASP A 18 -15.988 -7.982 0.240 1.00 0.00 C ATOM 271 OD1 ASP A 18 -14.910 -7.711 0.808 1.00 0.00 O ATOM 272 OD2 ASP A 18 -17.041 -7.338 0.426 1.00 0.00 O ATOM 0 H ASP A 18 -13.625 -8.790 -0.264 1.00 0.00 H new ATOM 0 HA ASP A 18 -14.893 -9.968 -2.367 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.014 -9.229 -1.164 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -15.842 -10.076 -0.175 1.00 0.00 H new ATOM 277 N GLY A 19 -15.350 -6.701 -2.436 1.00 0.00 N ATOM 278 CA GLY A 19 -15.750 -5.608 -3.303 1.00 0.00 C ATOM 279 C GLY A 19 -15.193 -4.272 -2.849 1.00 0.00 C ATOM 280 O GLY A 19 -14.083 -4.202 -2.324 1.00 0.00 O ATOM 0 H GLY A 19 -15.012 -6.415 -1.517 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -15.412 -5.812 -4.319 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -16.838 -5.553 -3.334 1.00 0.00 H new ATOM 284 N GLU A 20 -15.965 -3.208 -3.057 1.00 0.00 N ATOM 285 CA GLU A 20 -15.541 -1.868 -2.668 1.00 0.00 C ATOM 286 C GLU A 20 -16.130 -1.479 -1.313 1.00 0.00 C ATOM 287 O GLU A 20 -17.147 -2.027 -0.888 1.00 0.00 O ATOM 288 CB GLU A 20 -15.959 -0.856 -3.737 1.00 0.00 C ATOM 289 CG GLU A 20 -17.446 -0.535 -3.734 1.00 0.00 C ATOM 290 CD GLU A 20 -17.869 0.281 -4.941 1.00 0.00 C ATOM 291 OE1 GLU A 20 -16.992 0.914 -5.565 1.00 0.00 O ATOM 292 OE2 GLU A 20 -19.075 0.287 -5.260 1.00 0.00 O ATOM 0 H GLU A 20 -16.886 -3.249 -3.492 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.455 -1.865 -2.578 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -15.398 0.067 -3.589 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -15.683 -1.243 -4.718 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -18.015 -1.465 -3.711 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -17.694 0.013 -2.825 1.00 0.00 H new ATOM 299 N VAL A 21 -15.483 -0.532 -0.640 1.00 0.00 N ATOM 300 CA VAL A 21 -15.946 -0.072 0.665 1.00 0.00 C ATOM 301 C VAL A 21 -15.686 1.420 0.852 1.00 0.00 C ATOM 302 O VAL A 21 -14.896 2.020 0.125 1.00 0.00 O ATOM 303 CB VAL A 21 -15.268 -0.847 1.810 1.00 0.00 C ATOM 304 CG1 VAL A 21 -15.620 -2.324 1.736 1.00 0.00 C ATOM 305 CG2 VAL A 21 -13.760 -0.646 1.775 1.00 0.00 C ATOM 0 H VAL A 21 -14.638 -0.069 -0.976 1.00 0.00 H new ATOM 0 HA VAL A 21 -17.020 -0.256 0.698 1.00 0.00 H new ATOM 0 HB VAL A 21 -15.639 -0.456 2.758 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -15.132 -2.856 2.553 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -16.700 -2.445 1.818 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.281 -2.732 0.784 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -13.300 -1.202 2.592 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.367 -1.006 0.824 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -13.532 0.414 1.884 1.00 0.00 H new ATOM 315 N GLU A 22 -16.364 2.010 1.830 1.00 0.00 N ATOM 316 CA GLU A 22 -16.215 3.433 2.118 1.00 0.00 C ATOM 317 C GLU A 22 -14.790 3.769 2.547 1.00 0.00 C ATOM 318 O GLU A 22 -14.177 3.042 3.329 1.00 0.00 O ATOM 319 CB GLU A 22 -17.193 3.863 3.215 1.00 0.00 C ATOM 320 CG GLU A 22 -17.281 2.886 4.376 1.00 0.00 C ATOM 321 CD GLU A 22 -17.461 3.582 5.710 1.00 0.00 C ATOM 322 OE1 GLU A 22 -18.069 4.672 5.734 1.00 0.00 O ATOM 323 OE2 GLU A 22 -16.994 3.037 6.733 1.00 0.00 O ATOM 0 H GLU A 22 -17.023 1.525 2.438 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.437 3.977 1.200 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -16.891 4.839 3.596 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -18.184 3.984 2.778 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -18.115 2.205 4.210 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -16.376 2.280 4.406 1.00 0.00 H new ATOM 330 N VAL A 23 -14.277 4.885 2.040 1.00 0.00 N ATOM 331 CA VAL A 23 -12.932 5.333 2.376 1.00 0.00 C ATOM 332 C VAL A 23 -12.812 5.604 3.876 1.00 0.00 C ATOM 333 O VAL A 23 -11.731 5.496 4.455 1.00 0.00 O ATOM 334 CB VAL A 23 -12.559 6.612 1.597 1.00 0.00 C ATOM 335 CG1 VAL A 23 -11.216 7.158 2.060 1.00 0.00 C ATOM 336 CG2 VAL A 23 -12.542 6.338 0.101 1.00 0.00 C ATOM 0 H VAL A 23 -14.775 5.497 1.393 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.244 4.536 2.096 1.00 0.00 H new ATOM 0 HB VAL A 23 -13.317 7.368 1.800 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.976 8.059 1.496 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -11.267 7.398 3.122 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -10.442 6.409 1.894 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -12.277 7.251 -0.433 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.808 5.563 -0.119 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.529 6.004 -0.219 1.00 0.00 H new ATOM 346 N LYS A 24 -13.935 5.959 4.495 1.00 0.00 N ATOM 347 CA LYS A 24 -13.973 6.252 5.925 1.00 0.00 C ATOM 348 C LYS A 24 -13.341 5.124 6.737 1.00 0.00 C ATOM 349 O LYS A 24 -12.831 5.348 7.834 1.00 0.00 O ATOM 350 CB LYS A 24 -15.415 6.476 6.382 1.00 0.00 C ATOM 351 CG LYS A 24 -15.865 7.925 6.290 1.00 0.00 C ATOM 352 CD LYS A 24 -16.706 8.173 5.048 1.00 0.00 C ATOM 353 CE LYS A 24 -18.192 8.169 5.371 1.00 0.00 C ATOM 354 NZ LYS A 24 -18.934 9.193 4.585 1.00 0.00 N ATOM 0 H LYS A 24 -14.836 6.051 4.025 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.396 7.161 6.095 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -16.079 5.859 5.777 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.517 6.137 7.413 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -16.441 8.184 7.178 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -14.992 8.577 6.275 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.431 9.131 4.607 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -16.492 7.406 4.304 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.606 7.182 5.164 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -18.333 8.356 6.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.943 9.158 4.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -18.557 10.138 4.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -18.821 9.000 3.569 1.00 0.00 H new ATOM 368 N SER A 25 -13.382 3.911 6.195 1.00 0.00 N ATOM 369 CA SER A 25 -12.814 2.751 6.878 1.00 0.00 C ATOM 370 C SER A 25 -11.314 2.925 7.128 1.00 0.00 C ATOM 371 O SER A 25 -10.726 2.206 7.934 1.00 0.00 O ATOM 372 CB SER A 25 -13.061 1.483 6.057 1.00 0.00 C ATOM 373 OG SER A 25 -12.934 0.323 6.861 1.00 0.00 O ATOM 0 H SER A 25 -13.801 3.705 5.288 1.00 0.00 H new ATOM 0 HA SER A 25 -13.309 2.660 7.845 1.00 0.00 H new ATOM 0 HB2 SER A 25 -14.058 1.518 5.619 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.351 1.437 5.231 1.00 0.00 H new ATOM 0 HG SER A 25 -12.165 0.423 7.460 1.00 0.00 H new ATOM 379 N LEU A 26 -10.702 3.889 6.442 1.00 0.00 N ATOM 380 CA LEU A 26 -9.276 4.159 6.605 1.00 0.00 C ATOM 381 C LEU A 26 -9.072 5.489 7.324 1.00 0.00 C ATOM 382 O LEU A 26 -8.282 6.330 6.893 1.00 0.00 O ATOM 383 CB LEU A 26 -8.565 4.183 5.245 1.00 0.00 C ATOM 384 CG LEU A 26 -9.056 3.157 4.213 1.00 0.00 C ATOM 385 CD1 LEU A 26 -8.033 2.999 3.099 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.337 1.813 4.868 1.00 0.00 C ATOM 0 H LEU A 26 -11.171 4.495 5.769 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.844 3.358 7.205 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.674 5.180 4.818 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.500 4.022 5.411 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.989 3.526 3.786 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.394 2.269 2.375 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.883 3.958 2.604 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.087 2.656 3.519 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.683 1.106 4.114 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.424 1.435 5.328 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -10.105 1.934 5.632 1.00 0.00 H new ATOM 398 N ALA A 27 -9.801 5.672 8.420 1.00 0.00 N ATOM 399 CA ALA A 27 -9.731 6.879 9.205 1.00 0.00 C ATOM 400 C ALA A 27 -9.069 6.621 10.542 1.00 0.00 C ATOM 401 O ALA A 27 -9.714 6.266 11.528 1.00 0.00 O ATOM 402 CB ALA A 27 -11.114 7.422 9.413 1.00 0.00 C ATOM 0 H ALA A 27 -10.456 4.979 8.782 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.128 7.609 8.665 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.061 8.335 10.007 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.567 7.643 8.447 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.720 6.683 9.937 1.00 0.00 H new ATOM 408 N GLY A 28 -7.780 6.813 10.543 1.00 0.00 N ATOM 409 CA GLY A 28 -6.978 6.619 11.737 1.00 0.00 C ATOM 410 C GLY A 28 -6.296 5.266 11.779 1.00 0.00 C ATOM 411 O GLY A 28 -6.442 4.516 12.743 1.00 0.00 O ATOM 0 H GLY A 28 -7.249 7.107 9.724 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.222 7.403 11.792 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.613 6.727 12.616 1.00 0.00 H new ATOM 415 N LYS A 29 -5.544 4.960 10.727 1.00 0.00 N ATOM 416 CA LYS A 29 -4.826 3.699 10.636 1.00 0.00 C ATOM 417 C LYS A 29 -3.633 3.826 9.692 1.00 0.00 C ATOM 418 O LYS A 29 -3.674 4.588 8.727 1.00 0.00 O ATOM 419 CB LYS A 29 -5.774 2.597 10.160 1.00 0.00 C ATOM 420 CG LYS A 29 -6.049 2.616 8.663 1.00 0.00 C ATOM 421 CD LYS A 29 -6.865 1.408 8.232 1.00 0.00 C ATOM 422 CE LYS A 29 -8.193 1.337 8.968 1.00 0.00 C ATOM 423 NZ LYS A 29 -9.077 0.272 8.419 1.00 0.00 N ATOM 0 H LYS A 29 -5.417 5.574 9.922 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.448 3.437 11.624 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.352 1.629 10.428 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.720 2.691 10.693 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.583 3.529 8.402 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.105 2.632 8.119 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -7.046 1.455 7.158 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.295 0.498 8.420 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.012 1.148 10.026 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.699 2.300 8.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -10.005 0.679 8.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.646 -0.129 7.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -9.199 -0.478 9.129 1.00 0.00 H new ATOM 437 N LEU A 30 -2.572 3.076 9.972 1.00 0.00 N ATOM 438 CA LEU A 30 -1.378 3.113 9.137 1.00 0.00 C ATOM 439 C LEU A 30 -1.681 2.538 7.761 1.00 0.00 C ATOM 440 O LEU A 30 -1.793 1.322 7.596 1.00 0.00 O ATOM 441 CB LEU A 30 -0.236 2.336 9.795 1.00 0.00 C ATOM 442 CG LEU A 30 1.136 2.537 9.150 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.738 3.868 9.574 1.00 0.00 C ATOM 444 CD2 LEU A 30 2.066 1.390 9.512 1.00 0.00 C ATOM 0 H LEU A 30 -2.515 2.439 10.766 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.068 4.152 9.024 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.174 2.628 10.843 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.479 1.274 9.773 1.00 0.00 H new ATOM 0 HG LEU A 30 1.009 2.549 8.068 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.714 3.992 9.104 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.080 4.680 9.264 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.852 3.887 10.658 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.038 1.548 9.045 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.186 1.347 10.594 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.641 0.451 9.156 1.00 0.00 H new ATOM 456 N VAL A 31 -1.828 3.418 6.778 1.00 0.00 N ATOM 457 CA VAL A 31 -2.138 2.993 5.418 1.00 0.00 C ATOM 458 C VAL A 31 -0.876 2.787 4.589 1.00 0.00 C ATOM 459 O VAL A 31 -0.191 3.743 4.228 1.00 0.00 O ATOM 460 CB VAL A 31 -3.047 4.009 4.700 1.00 0.00 C ATOM 461 CG1 VAL A 31 -3.680 3.375 3.469 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.118 4.537 5.644 1.00 0.00 C ATOM 0 H VAL A 31 -1.738 4.427 6.896 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.663 2.042 5.508 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.435 4.852 4.379 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.319 4.105 2.972 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.897 3.052 2.783 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.277 2.514 3.769 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.748 5.253 5.116 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -4.730 3.708 6.000 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.644 5.029 6.493 1.00 0.00 H new ATOM 472 N PHE A 32 -0.588 1.528 4.278 1.00 0.00 N ATOM 473 CA PHE A 32 0.579 1.182 3.476 1.00 0.00 C ATOM 474 C PHE A 32 0.235 1.271 1.993 1.00 0.00 C ATOM 475 O PHE A 32 -0.940 1.276 1.624 1.00 0.00 O ATOM 476 CB PHE A 32 1.060 -0.229 3.824 1.00 0.00 C ATOM 477 CG PHE A 32 1.834 -0.305 5.108 1.00 0.00 C ATOM 478 CD1 PHE A 32 3.048 0.348 5.240 1.00 0.00 C ATOM 479 CD2 PHE A 32 1.348 -1.033 6.182 1.00 0.00 C ATOM 480 CE1 PHE A 32 3.763 0.276 6.420 1.00 0.00 C ATOM 481 CE2 PHE A 32 2.058 -1.109 7.363 1.00 0.00 C ATOM 482 CZ PHE A 32 3.268 -0.454 7.483 1.00 0.00 C ATOM 0 H PHE A 32 -1.149 0.728 4.570 1.00 0.00 H new ATOM 0 HA PHE A 32 1.381 1.887 3.696 1.00 0.00 H new ATOM 0 HB2 PHE A 32 0.197 -0.891 3.891 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.684 -0.601 3.012 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.440 0.920 4.412 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.402 -1.547 6.094 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.708 0.790 6.511 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.668 -1.680 8.192 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.826 -0.512 8.406 1.00 0.00 H new ATOM 492 N PHE A 33 1.252 1.344 1.139 1.00 0.00 N ATOM 493 CA PHE A 33 1.017 1.435 -0.298 1.00 0.00 C ATOM 494 C PHE A 33 2.024 0.602 -1.083 1.00 0.00 C ATOM 495 O PHE A 33 3.190 0.972 -1.213 1.00 0.00 O ATOM 496 CB PHE A 33 1.067 2.895 -0.766 1.00 0.00 C ATOM 497 CG PHE A 33 -0.280 3.558 -0.798 1.00 0.00 C ATOM 498 CD1 PHE A 33 -1.235 3.169 -1.722 1.00 0.00 C ATOM 499 CD2 PHE A 33 -0.590 4.570 0.096 1.00 0.00 C ATOM 500 CE1 PHE A 33 -2.476 3.776 -1.755 1.00 0.00 C ATOM 501 CE2 PHE A 33 -1.829 5.182 0.069 1.00 0.00 C ATOM 502 CZ PHE A 33 -2.773 4.784 -0.858 1.00 0.00 C ATOM 0 H PHE A 33 2.235 1.342 1.412 1.00 0.00 H new ATOM 0 HA PHE A 33 0.021 1.035 -0.490 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.725 3.458 -0.105 1.00 0.00 H new ATOM 0 HB3 PHE A 33 1.507 2.934 -1.763 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -1.007 2.382 -2.425 1.00 0.00 H new ATOM 0 HD2 PHE A 33 0.145 4.884 0.822 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.212 3.463 -2.481 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -2.059 5.970 0.771 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.742 5.260 -0.881 1.00 0.00 H new ATOM 512 N TYR A 34 1.553 -0.523 -1.610 1.00 0.00 N ATOM 513 CA TYR A 34 2.396 -1.418 -2.396 1.00 0.00 C ATOM 514 C TYR A 34 2.271 -1.103 -3.886 1.00 0.00 C ATOM 515 O TYR A 34 1.238 -1.369 -4.502 1.00 0.00 O ATOM 516 CB TYR A 34 2.006 -2.874 -2.137 1.00 0.00 C ATOM 517 CG TYR A 34 3.004 -3.878 -2.666 1.00 0.00 C ATOM 518 CD1 TYR A 34 3.228 -4.013 -4.032 1.00 0.00 C ATOM 519 CD2 TYR A 34 3.721 -4.695 -1.800 1.00 0.00 C ATOM 520 CE1 TYR A 34 4.139 -4.932 -4.518 1.00 0.00 C ATOM 521 CE2 TYR A 34 4.633 -5.615 -2.279 1.00 0.00 C ATOM 522 CZ TYR A 34 4.839 -5.730 -3.637 1.00 0.00 C ATOM 523 OH TYR A 34 5.747 -6.647 -4.117 1.00 0.00 O ATOM 0 H TYR A 34 0.588 -0.838 -1.507 1.00 0.00 H new ATOM 0 HA TYR A 34 3.432 -1.268 -2.093 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.889 -3.023 -1.064 1.00 0.00 H new ATOM 0 HB3 TYR A 34 1.035 -3.067 -2.593 1.00 0.00 H new ATOM 0 HD1 TYR A 34 2.681 -3.390 -4.724 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.562 -4.609 -0.735 1.00 0.00 H new ATOM 0 HE1 TYR A 34 4.302 -5.025 -5.582 1.00 0.00 H new ATOM 0 HE2 TYR A 34 5.183 -6.242 -1.592 1.00 0.00 H new ATOM 0 HH TYR A 34 6.252 -7.029 -3.369 1.00 0.00 H new ATOM 533 N PHE A 35 3.328 -0.535 -4.461 1.00 0.00 N ATOM 534 CA PHE A 35 3.332 -0.183 -5.880 1.00 0.00 C ATOM 535 C PHE A 35 3.818 -1.354 -6.734 1.00 0.00 C ATOM 536 O PHE A 35 4.884 -1.913 -6.479 1.00 0.00 O ATOM 537 CB PHE A 35 4.221 1.039 -6.117 1.00 0.00 C ATOM 538 CG PHE A 35 3.657 2.312 -5.551 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.869 2.648 -4.223 1.00 0.00 C ATOM 540 CD2 PHE A 35 2.917 3.170 -6.347 1.00 0.00 C ATOM 541 CE1 PHE A 35 3.352 3.818 -3.700 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.397 4.342 -5.829 1.00 0.00 C ATOM 543 CZ PHE A 35 2.614 4.665 -4.503 1.00 0.00 C ATOM 0 H PHE A 35 4.192 -0.309 -3.968 1.00 0.00 H new ATOM 0 HA PHE A 35 2.309 0.054 -6.173 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.200 0.857 -5.674 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.374 1.164 -7.189 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.444 1.988 -3.590 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.744 2.921 -7.384 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.525 4.070 -2.664 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.822 5.004 -6.460 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.207 5.579 -4.095 1.00 0.00 H new ATOM 553 N SER A 36 3.035 -1.725 -7.749 1.00 0.00 N ATOM 554 CA SER A 36 3.409 -2.830 -8.625 1.00 0.00 C ATOM 555 C SER A 36 2.424 -2.975 -9.781 1.00 0.00 C ATOM 556 O SER A 36 1.449 -2.230 -9.879 1.00 0.00 O ATOM 557 CB SER A 36 3.477 -4.136 -7.829 1.00 0.00 C ATOM 558 OG SER A 36 4.801 -4.637 -7.785 1.00 0.00 O ATOM 0 H SER A 36 2.147 -1.280 -7.981 1.00 0.00 H new ATOM 0 HA SER A 36 4.393 -2.611 -9.041 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.115 -3.967 -6.815 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.819 -4.877 -8.283 1.00 0.00 H new ATOM 0 HG SER A 36 5.388 -3.973 -7.367 1.00 0.00 H new ATOM 564 N ALA A 37 2.683 -3.947 -10.651 1.00 0.00 N ATOM 565 CA ALA A 37 1.821 -4.203 -11.795 1.00 0.00 C ATOM 566 C ALA A 37 1.629 -5.702 -11.999 1.00 0.00 C ATOM 567 O ALA A 37 2.401 -6.512 -11.486 1.00 0.00 O ATOM 568 CB ALA A 37 2.402 -3.563 -13.050 1.00 0.00 C ATOM 0 H ALA A 37 3.487 -4.571 -10.583 1.00 0.00 H new ATOM 0 HA ALA A 37 0.846 -3.758 -11.598 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.746 -3.763 -13.897 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.487 -2.486 -12.903 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.389 -3.981 -13.248 1.00 0.00 H new ATOM 574 N SER A 38 0.593 -6.068 -12.743 1.00 0.00 N ATOM 575 CA SER A 38 0.302 -7.471 -13.008 1.00 0.00 C ATOM 576 C SER A 38 1.081 -7.988 -14.218 1.00 0.00 C ATOM 577 O SER A 38 0.978 -9.162 -14.571 1.00 0.00 O ATOM 578 CB SER A 38 -1.198 -7.661 -13.240 1.00 0.00 C ATOM 579 OG SER A 38 -1.944 -6.618 -12.637 1.00 0.00 O ATOM 0 H SER A 38 -0.060 -5.413 -13.174 1.00 0.00 H new ATOM 0 HA SER A 38 0.613 -8.045 -12.135 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.403 -7.687 -14.310 1.00 0.00 H new ATOM 0 HB3 SER A 38 -1.514 -8.621 -12.831 1.00 0.00 H new ATOM 0 HG SER A 38 -1.884 -6.694 -11.662 1.00 0.00 H new ATOM 585 N TRP A 39 1.846 -7.108 -14.864 1.00 0.00 N ATOM 586 CA TRP A 39 2.615 -7.492 -16.042 1.00 0.00 C ATOM 587 C TRP A 39 4.071 -7.022 -15.973 1.00 0.00 C ATOM 588 O TRP A 39 4.862 -7.328 -16.865 1.00 0.00 O ATOM 589 CB TRP A 39 1.945 -6.921 -17.294 1.00 0.00 C ATOM 590 CG TRP A 39 2.173 -5.449 -17.473 1.00 0.00 C ATOM 591 CD1 TRP A 39 1.850 -4.460 -16.591 1.00 0.00 C ATOM 592 CD2 TRP A 39 2.776 -4.803 -18.600 1.00 0.00 C ATOM 593 NE1 TRP A 39 2.216 -3.238 -17.097 1.00 0.00 N ATOM 594 CE2 TRP A 39 2.785 -3.421 -18.330 1.00 0.00 C ATOM 595 CE3 TRP A 39 3.309 -5.258 -19.810 1.00 0.00 C ATOM 596 CZ2 TRP A 39 3.307 -2.492 -19.227 1.00 0.00 C ATOM 597 CZ3 TRP A 39 3.825 -4.334 -20.699 1.00 0.00 C ATOM 598 CH2 TRP A 39 3.821 -2.964 -20.403 1.00 0.00 C ATOM 0 H TRP A 39 1.948 -6.130 -14.592 1.00 0.00 H new ATOM 0 HA TRP A 39 2.632 -8.581 -16.082 1.00 0.00 H new ATOM 0 HB2 TRP A 39 2.321 -7.449 -18.171 1.00 0.00 H new ATOM 0 HB3 TRP A 39 0.873 -7.111 -17.242 1.00 0.00 H new ATOM 0 HD1 TRP A 39 1.375 -4.616 -15.634 1.00 0.00 H new ATOM 0 HE1 TRP A 39 2.086 -2.340 -16.631 1.00 0.00 H new ATOM 0 HE3 TRP A 39 3.317 -6.312 -20.046 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 3.306 -1.436 -19.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 4.238 -4.673 -21.637 1.00 0.00 H new ATOM 0 HH2 TRP A 39 4.232 -2.267 -21.118 1.00 0.00 H new ATOM 609 N CYS A 40 4.429 -6.272 -14.930 1.00 0.00 N ATOM 610 CA CYS A 40 5.798 -5.771 -14.800 1.00 0.00 C ATOM 611 C CYS A 40 6.821 -6.900 -14.952 1.00 0.00 C ATOM 612 O CYS A 40 6.467 -8.078 -14.932 1.00 0.00 O ATOM 613 CB CYS A 40 5.998 -5.048 -13.464 1.00 0.00 C ATOM 614 SG CYS A 40 5.145 -5.808 -12.044 1.00 0.00 S ATOM 0 H CYS A 40 3.801 -6.001 -14.173 1.00 0.00 H new ATOM 0 HA CYS A 40 5.959 -5.055 -15.606 1.00 0.00 H new ATOM 0 HB2 CYS A 40 7.065 -5.005 -13.247 1.00 0.00 H new ATOM 0 HB3 CYS A 40 5.652 -4.020 -13.569 1.00 0.00 H new ATOM 619 N PRO A 41 8.106 -6.548 -15.133 1.00 0.00 N ATOM 620 CA PRO A 41 9.181 -7.532 -15.314 1.00 0.00 C ATOM 621 C PRO A 41 9.312 -8.521 -14.151 1.00 0.00 C ATOM 622 O PRO A 41 9.431 -9.726 -14.374 1.00 0.00 O ATOM 623 CB PRO A 41 10.447 -6.677 -15.432 1.00 0.00 C ATOM 624 CG PRO A 41 9.965 -5.322 -15.828 1.00 0.00 C ATOM 625 CD PRO A 41 8.608 -5.164 -15.204 1.00 0.00 C ATOM 0 HA PRO A 41 8.987 -8.161 -16.183 1.00 0.00 H new ATOM 0 HB2 PRO A 41 10.989 -6.642 -14.487 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.131 -7.085 -16.176 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.648 -4.548 -15.478 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.908 -5.230 -16.913 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.670 -4.707 -14.216 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.958 -4.531 -15.808 1.00 0.00 H new ATOM 633 N PRO A 42 9.310 -8.038 -12.893 1.00 0.00 N ATOM 634 CA PRO A 42 9.446 -8.897 -11.725 1.00 0.00 C ATOM 635 C PRO A 42 8.109 -9.454 -11.225 1.00 0.00 C ATOM 636 O PRO A 42 7.739 -10.577 -11.569 1.00 0.00 O ATOM 637 CB PRO A 42 10.085 -7.978 -10.680 1.00 0.00 C ATOM 638 CG PRO A 42 9.834 -6.570 -11.140 1.00 0.00 C ATOM 639 CD PRO A 42 9.190 -6.629 -12.505 1.00 0.00 C ATOM 0 HA PRO A 42 10.036 -9.786 -11.947 1.00 0.00 H new ATOM 0 HB2 PRO A 42 9.649 -8.148 -9.695 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.154 -8.173 -10.593 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.185 -6.050 -10.435 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.769 -6.012 -11.184 1.00 0.00 H new ATOM 0 HD2 PRO A 42 8.148 -6.312 -12.469 1.00 0.00 H new ATOM 0 HD3 PRO A 42 9.697 -5.975 -13.214 1.00 0.00 H new ATOM 647 N CYS A 43 7.393 -8.665 -10.413 1.00 0.00 N ATOM 648 CA CYS A 43 6.091 -9.076 -9.853 1.00 0.00 C ATOM 649 C CYS A 43 5.956 -10.593 -9.768 1.00 0.00 C ATOM 650 O CYS A 43 5.365 -11.231 -10.639 1.00 0.00 O ATOM 651 CB CYS A 43 4.941 -8.491 -10.672 1.00 0.00 C ATOM 652 SG CYS A 43 5.419 -7.802 -12.290 1.00 0.00 S ATOM 0 H CYS A 43 7.692 -7.733 -10.126 1.00 0.00 H new ATOM 0 HA CYS A 43 6.042 -8.682 -8.838 1.00 0.00 H new ATOM 0 HB2 CYS A 43 4.196 -9.270 -10.832 1.00 0.00 H new ATOM 0 HB3 CYS A 43 4.461 -7.706 -10.087 1.00 0.00 H new ATOM 657 N ARG A 44 6.508 -11.155 -8.702 1.00 0.00 N ATOM 658 CA ARG A 44 6.459 -12.592 -8.470 1.00 0.00 C ATOM 659 C ARG A 44 6.644 -12.893 -6.988 1.00 0.00 C ATOM 660 O ARG A 44 5.911 -13.696 -6.409 1.00 0.00 O ATOM 661 CB ARG A 44 7.541 -13.302 -9.288 1.00 0.00 C ATOM 662 CG ARG A 44 7.381 -14.814 -9.325 1.00 0.00 C ATOM 663 CD ARG A 44 6.839 -15.287 -10.665 1.00 0.00 C ATOM 664 NE ARG A 44 5.639 -14.554 -11.060 1.00 0.00 N ATOM 665 CZ ARG A 44 4.771 -14.990 -11.971 1.00 0.00 C ATOM 666 NH1 ARG A 44 4.967 -16.151 -12.584 1.00 0.00 N ATOM 667 NH2 ARG A 44 3.703 -14.263 -12.270 1.00 0.00 N ATOM 0 H ARG A 44 7.000 -10.632 -7.977 1.00 0.00 H new ATOM 0 HA ARG A 44 5.483 -12.960 -8.786 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.524 -12.918 -10.308 1.00 0.00 H new ATOM 0 HB3 ARG A 44 8.518 -13.058 -8.872 1.00 0.00 H new ATOM 0 HG2 ARG A 44 8.344 -15.287 -9.134 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.708 -15.129 -8.528 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.606 -15.165 -11.430 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.611 -16.351 -10.609 1.00 0.00 H new ATOM 0 HE ARG A 44 5.455 -13.656 -10.612 1.00 0.00 H new ATOM 0 HH11 ARG A 44 5.786 -16.715 -12.358 1.00 0.00 H new ATOM 0 HH12 ARG A 44 4.298 -16.479 -13.281 1.00 0.00 H new ATOM 0 HH21 ARG A 44 3.547 -13.370 -11.802 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.038 -14.597 -12.968 1.00 0.00 H new ATOM 681 N GLY A 45 7.622 -12.233 -6.378 1.00 0.00 N ATOM 682 CA GLY A 45 7.885 -12.428 -4.966 1.00 0.00 C ATOM 683 C GLY A 45 7.443 -11.239 -4.136 1.00 0.00 C ATOM 684 O GLY A 45 7.049 -10.208 -4.681 1.00 0.00 O ATOM 0 H GLY A 45 8.239 -11.564 -6.839 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.367 -13.323 -4.621 1.00 0.00 H new ATOM 0 HA3 GLY A 45 8.951 -12.598 -4.816 1.00 0.00 H new ATOM 688 N PHE A 46 7.505 -11.381 -2.817 1.00 0.00 N ATOM 689 CA PHE A 46 7.105 -10.307 -1.914 1.00 0.00 C ATOM 690 C PHE A 46 5.620 -9.981 -2.067 1.00 0.00 C ATOM 691 O PHE A 46 5.163 -8.921 -1.637 1.00 0.00 O ATOM 692 CB PHE A 46 7.942 -9.051 -2.174 1.00 0.00 C ATOM 693 CG PHE A 46 7.691 -7.945 -1.188 1.00 0.00 C ATOM 694 CD1 PHE A 46 7.502 -8.227 0.156 1.00 0.00 C ATOM 695 CD2 PHE A 46 7.642 -6.625 -1.604 1.00 0.00 C ATOM 696 CE1 PHE A 46 7.270 -7.214 1.066 1.00 0.00 C ATOM 697 CE2 PHE A 46 7.411 -5.606 -0.699 1.00 0.00 C ATOM 698 CZ PHE A 46 7.224 -5.902 0.638 1.00 0.00 C ATOM 0 H PHE A 46 7.828 -12.228 -2.349 1.00 0.00 H new ATOM 0 HA PHE A 46 7.279 -10.648 -0.894 1.00 0.00 H new ATOM 0 HB2 PHE A 46 8.999 -9.317 -2.147 1.00 0.00 H new ATOM 0 HB3 PHE A 46 7.731 -8.685 -3.179 1.00 0.00 H new ATOM 0 HD1 PHE A 46 7.537 -9.252 0.496 1.00 0.00 H new ATOM 0 HD2 PHE A 46 7.786 -6.389 -2.648 1.00 0.00 H new ATOM 0 HE1 PHE A 46 7.125 -7.448 2.110 1.00 0.00 H new ATOM 0 HE2 PHE A 46 7.377 -4.581 -1.036 1.00 0.00 H new ATOM 0 HZ PHE A 46 7.042 -5.108 1.347 1.00 0.00 H new ATOM 708 N THR A 47 4.869 -10.894 -2.678 1.00 0.00 N ATOM 709 CA THR A 47 3.435 -10.692 -2.881 1.00 0.00 C ATOM 710 C THR A 47 2.618 -11.253 -1.712 1.00 0.00 C ATOM 711 O THR A 47 1.682 -10.605 -1.243 1.00 0.00 O ATOM 712 CB THR A 47 2.962 -11.309 -4.213 1.00 0.00 C ATOM 713 OG1 THR A 47 1.939 -12.268 -3.999 1.00 0.00 O ATOM 714 CG2 THR A 47 4.059 -11.984 -5.013 1.00 0.00 C ATOM 0 H THR A 47 5.227 -11.778 -3.040 1.00 0.00 H new ATOM 0 HA THR A 47 3.267 -9.616 -2.926 1.00 0.00 H new ATOM 0 HB THR A 47 2.597 -10.458 -4.788 1.00 0.00 H new ATOM 0 HG1 THR A 47 1.656 -12.642 -4.859 1.00 0.00 H new ATOM 0 HG21 THR A 47 3.640 -12.390 -5.934 1.00 0.00 H new ATOM 0 HG22 THR A 47 4.832 -11.256 -5.256 1.00 0.00 H new ATOM 0 HG23 THR A 47 4.494 -12.792 -4.425 1.00 0.00 H new ATOM 722 N PRO A 48 2.948 -12.465 -1.222 1.00 0.00 N ATOM 723 CA PRO A 48 2.224 -13.083 -0.113 1.00 0.00 C ATOM 724 C PRO A 48 2.735 -12.628 1.253 1.00 0.00 C ATOM 725 O PRO A 48 2.309 -13.144 2.286 1.00 0.00 O ATOM 726 CB PRO A 48 2.505 -14.567 -0.321 1.00 0.00 C ATOM 727 CG PRO A 48 3.874 -14.607 -0.911 1.00 0.00 C ATOM 728 CD PRO A 48 4.042 -13.333 -1.703 1.00 0.00 C ATOM 0 HA PRO A 48 1.166 -12.819 -0.112 1.00 0.00 H new ATOM 0 HB2 PRO A 48 2.462 -15.115 0.620 1.00 0.00 H new ATOM 0 HB3 PRO A 48 1.772 -15.020 -0.988 1.00 0.00 H new ATOM 0 HG2 PRO A 48 4.630 -14.679 -0.129 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.994 -15.480 -1.552 1.00 0.00 H new ATOM 0 HD2 PRO A 48 5.018 -12.880 -1.527 1.00 0.00 H new ATOM 0 HD3 PRO A 48 3.964 -13.516 -2.775 1.00 0.00 H new ATOM 736 N GLN A 49 3.641 -11.654 1.253 1.00 0.00 N ATOM 737 CA GLN A 49 4.195 -11.132 2.495 1.00 0.00 C ATOM 738 C GLN A 49 3.198 -10.189 3.154 1.00 0.00 C ATOM 739 O GLN A 49 3.106 -10.121 4.380 1.00 0.00 O ATOM 740 CB GLN A 49 5.530 -10.416 2.240 1.00 0.00 C ATOM 741 CG GLN A 49 6.602 -11.321 1.650 1.00 0.00 C ATOM 742 CD GLN A 49 6.737 -12.634 2.398 1.00 0.00 C ATOM 743 OE1 GLN A 49 7.604 -12.786 3.258 1.00 0.00 O ATOM 744 NE2 GLN A 49 5.878 -13.592 2.070 1.00 0.00 N ATOM 0 H GLN A 49 4.005 -11.213 0.409 1.00 0.00 H new ATOM 0 HA GLN A 49 4.386 -11.968 3.168 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.360 -9.578 1.563 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.894 -9.999 3.179 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.365 -11.525 0.606 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.559 -10.800 1.663 1.00 0.00 H new ATOM 0 HE21 GLN A 49 5.175 -13.422 1.351 1.00 0.00 H new ATOM 0 HE22 GLN A 49 5.921 -14.498 2.537 1.00 0.00 H new ATOM 753 N LEU A 50 2.450 -9.464 2.327 1.00 0.00 N ATOM 754 CA LEU A 50 1.455 -8.528 2.818 1.00 0.00 C ATOM 755 C LEU A 50 0.304 -9.249 3.498 1.00 0.00 C ATOM 756 O LEU A 50 -0.102 -8.896 4.605 1.00 0.00 O ATOM 757 CB LEU A 50 0.900 -7.718 1.653 1.00 0.00 C ATOM 758 CG LEU A 50 0.733 -6.225 1.907 1.00 0.00 C ATOM 759 CD1 LEU A 50 0.218 -5.948 3.319 1.00 0.00 C ATOM 760 CD2 LEU A 50 2.050 -5.511 1.662 1.00 0.00 C ATOM 0 H LEU A 50 2.518 -9.510 1.310 1.00 0.00 H new ATOM 0 HA LEU A 50 1.939 -7.876 3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.560 -7.850 0.795 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -0.070 -8.132 1.376 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.014 -5.842 1.212 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.112 -4.873 3.463 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.750 -6.430 3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.925 -6.344 4.048 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.925 -4.444 1.845 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.810 -5.908 2.335 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.362 -5.668 0.630 1.00 0.00 H new ATOM 772 N ILE A 51 -0.226 -10.254 2.819 1.00 0.00 N ATOM 773 CA ILE A 51 -1.345 -11.018 3.353 1.00 0.00 C ATOM 774 C ILE A 51 -0.945 -11.764 4.621 1.00 0.00 C ATOM 775 O ILE A 51 -1.661 -11.723 5.623 1.00 0.00 O ATOM 776 CB ILE A 51 -1.913 -12.023 2.325 1.00 0.00 C ATOM 777 CG1 ILE A 51 -2.470 -11.282 1.103 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.992 -12.882 2.974 1.00 0.00 C ATOM 779 CD1 ILE A 51 -1.883 -11.759 -0.208 1.00 0.00 C ATOM 0 H ILE A 51 0.098 -10.560 1.901 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.125 -10.294 3.588 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.107 -12.675 1.988 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.553 -11.406 1.074 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.274 -10.215 1.214 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.386 -13.587 2.241 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.564 -13.431 3.813 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.799 -12.243 3.333 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.321 -11.193 -1.030 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.803 -11.610 -0.199 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.102 -12.819 -0.340 1.00 0.00 H new ATOM 791 N GLU A 52 0.195 -12.444 4.579 1.00 0.00 N ATOM 792 CA GLU A 52 0.668 -13.189 5.736 1.00 0.00 C ATOM 793 C GLU A 52 0.870 -12.254 6.917 1.00 0.00 C ATOM 794 O GLU A 52 0.359 -12.499 8.009 1.00 0.00 O ATOM 795 CB GLU A 52 1.970 -13.923 5.411 1.00 0.00 C ATOM 796 CG GLU A 52 1.758 -15.342 4.907 1.00 0.00 C ATOM 797 CD GLU A 52 3.055 -16.120 4.795 1.00 0.00 C ATOM 798 OE1 GLU A 52 3.512 -16.663 5.823 1.00 0.00 O ATOM 799 OE2 GLU A 52 3.612 -16.186 3.679 1.00 0.00 O ATOM 0 H GLU A 52 0.804 -12.494 3.762 1.00 0.00 H new ATOM 0 HA GLU A 52 -0.087 -13.930 6.000 1.00 0.00 H new ATOM 0 HB2 GLU A 52 2.519 -13.357 4.658 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.594 -13.953 6.305 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.081 -15.866 5.582 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.273 -15.309 3.931 1.00 0.00 H new ATOM 806 N PHE A 53 1.598 -11.169 6.688 1.00 0.00 N ATOM 807 CA PHE A 53 1.835 -10.194 7.738 1.00 0.00 C ATOM 808 C PHE A 53 0.511 -9.584 8.177 1.00 0.00 C ATOM 809 O PHE A 53 0.143 -9.642 9.349 1.00 0.00 O ATOM 810 CB PHE A 53 2.791 -9.093 7.260 1.00 0.00 C ATOM 811 CG PHE A 53 3.160 -8.107 8.336 1.00 0.00 C ATOM 812 CD1 PHE A 53 3.327 -8.519 9.651 1.00 0.00 C ATOM 813 CD2 PHE A 53 3.338 -6.767 8.033 1.00 0.00 C ATOM 814 CE1 PHE A 53 3.662 -7.611 10.640 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.673 -5.856 9.018 1.00 0.00 C ATOM 816 CZ PHE A 53 3.836 -6.279 10.323 1.00 0.00 C ATOM 0 H PHE A 53 2.030 -10.945 5.792 1.00 0.00 H new ATOM 0 HA PHE A 53 2.300 -10.701 8.584 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.700 -9.555 6.875 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.329 -8.557 6.431 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.194 -9.560 9.905 1.00 0.00 H new ATOM 0 HD2 PHE A 53 3.214 -6.430 7.015 1.00 0.00 H new ATOM 0 HE1 PHE A 53 3.787 -7.944 11.660 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.807 -4.814 8.767 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.099 -5.569 11.093 1.00 0.00 H new ATOM 826 N TYR A 54 -0.203 -9.006 7.216 1.00 0.00 N ATOM 827 CA TYR A 54 -1.492 -8.379 7.479 1.00 0.00 C ATOM 828 C TYR A 54 -2.418 -9.298 8.271 1.00 0.00 C ATOM 829 O TYR A 54 -2.951 -8.905 9.307 1.00 0.00 O ATOM 830 CB TYR A 54 -2.163 -7.976 6.164 1.00 0.00 C ATOM 831 CG TYR A 54 -3.522 -7.336 6.346 1.00 0.00 C ATOM 832 CD1 TYR A 54 -3.645 -5.970 6.564 1.00 0.00 C ATOM 833 CD2 TYR A 54 -4.681 -8.101 6.299 1.00 0.00 C ATOM 834 CE1 TYR A 54 -4.885 -5.384 6.732 1.00 0.00 C ATOM 835 CE2 TYR A 54 -5.924 -7.521 6.465 1.00 0.00 C ATOM 836 CZ TYR A 54 -6.021 -6.164 6.681 1.00 0.00 C ATOM 837 OH TYR A 54 -7.258 -5.583 6.848 1.00 0.00 O ATOM 0 H TYR A 54 0.093 -8.959 6.241 1.00 0.00 H new ATOM 0 HA TYR A 54 -1.306 -7.490 8.081 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.512 -7.282 5.632 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -2.269 -8.860 5.534 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -2.757 -5.356 6.603 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.609 -9.165 6.130 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -4.964 -4.320 6.902 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.816 -8.129 6.426 1.00 0.00 H new ATOM 0 HH TYR A 54 -7.184 -4.614 6.721 1.00 0.00 H new ATOM 847 N ASP A 55 -2.621 -10.518 7.783 1.00 0.00 N ATOM 848 CA ASP A 55 -3.502 -11.460 8.461 1.00 0.00 C ATOM 849 C ASP A 55 -3.085 -11.683 9.915 1.00 0.00 C ATOM 850 O ASP A 55 -3.910 -12.042 10.756 1.00 0.00 O ATOM 851 CB ASP A 55 -3.517 -12.797 7.715 1.00 0.00 C ATOM 852 CG ASP A 55 -4.228 -12.705 6.379 1.00 0.00 C ATOM 853 OD1 ASP A 55 -4.231 -11.607 5.783 1.00 0.00 O ATOM 854 OD2 ASP A 55 -4.781 -13.730 5.929 1.00 0.00 O ATOM 0 H ASP A 55 -2.192 -10.874 6.929 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.504 -11.030 8.463 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -2.492 -13.133 7.556 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -4.007 -13.549 8.333 1.00 0.00 H new ATOM 859 N LYS A 56 -1.799 -11.500 10.204 1.00 0.00 N ATOM 860 CA LYS A 56 -1.283 -11.716 11.548 1.00 0.00 C ATOM 861 C LYS A 56 -1.215 -10.441 12.399 1.00 0.00 C ATOM 862 O LYS A 56 -1.008 -10.529 13.609 1.00 0.00 O ATOM 863 CB LYS A 56 0.104 -12.351 11.478 1.00 0.00 C ATOM 864 CG LYS A 56 0.156 -13.603 10.619 1.00 0.00 C ATOM 865 CD LYS A 56 1.553 -13.850 10.074 1.00 0.00 C ATOM 866 CE LYS A 56 2.473 -14.427 11.139 1.00 0.00 C ATOM 867 NZ LYS A 56 1.821 -15.533 11.895 1.00 0.00 N ATOM 0 H LYS A 56 -1.098 -11.203 9.525 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.991 -12.383 12.039 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.810 -11.620 11.083 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.433 -12.599 12.487 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.162 -14.463 11.208 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.546 -13.506 9.791 1.00 0.00 H new ATOM 0 HD2 LYS A 56 1.499 -14.536 9.228 1.00 0.00 H new ATOM 0 HD3 LYS A 56 1.969 -12.915 9.700 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.385 -14.796 10.670 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.767 -13.638 11.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.549 -16.115 12.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 1.188 -15.134 12.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.270 -16.124 11.240 1.00 0.00 H new ATOM 881 N PHE A 57 -1.361 -9.264 11.792 1.00 0.00 N ATOM 882 CA PHE A 57 -1.278 -8.022 12.560 1.00 0.00 C ATOM 883 C PHE A 57 -2.416 -7.060 12.231 1.00 0.00 C ATOM 884 O PHE A 57 -2.459 -5.946 12.754 1.00 0.00 O ATOM 885 CB PHE A 57 0.080 -7.342 12.314 1.00 0.00 C ATOM 886 CG PHE A 57 0.102 -6.410 11.130 1.00 0.00 C ATOM 887 CD1 PHE A 57 -0.352 -5.106 11.245 1.00 0.00 C ATOM 888 CD2 PHE A 57 0.572 -6.840 9.902 1.00 0.00 C ATOM 889 CE1 PHE A 57 -0.339 -4.254 10.158 1.00 0.00 C ATOM 890 CE2 PHE A 57 0.588 -5.992 8.811 1.00 0.00 C ATOM 891 CZ PHE A 57 0.129 -4.698 8.940 1.00 0.00 C ATOM 0 H PHE A 57 -1.533 -9.144 10.794 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.372 -8.283 13.614 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.360 -6.783 13.207 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.838 -8.112 12.169 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.721 -4.751 12.196 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.931 -7.853 9.794 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -0.696 -3.240 10.262 1.00 0.00 H new ATOM 0 HE2 PHE A 57 0.959 -6.342 7.859 1.00 0.00 H new ATOM 0 HZ PHE A 57 0.136 -4.034 8.088 1.00 0.00 H new ATOM 901 N HIS A 58 -3.329 -7.471 11.358 1.00 0.00 N ATOM 902 CA HIS A 58 -4.427 -6.604 10.980 1.00 0.00 C ATOM 903 C HIS A 58 -5.457 -6.467 12.100 1.00 0.00 C ATOM 904 O HIS A 58 -6.172 -5.470 12.174 1.00 0.00 O ATOM 905 CB HIS A 58 -5.105 -7.096 9.699 1.00 0.00 C ATOM 906 CG HIS A 58 -5.956 -8.318 9.882 1.00 0.00 C ATOM 907 ND1 HIS A 58 -5.613 -9.363 10.716 1.00 0.00 N ATOM 908 CD2 HIS A 58 -7.146 -8.657 9.332 1.00 0.00 C ATOM 909 CE1 HIS A 58 -6.552 -10.290 10.669 1.00 0.00 C ATOM 910 NE2 HIS A 58 -7.494 -9.886 9.836 1.00 0.00 N ATOM 0 H HIS A 58 -3.328 -8.386 10.907 1.00 0.00 H new ATOM 0 HA HIS A 58 -4.000 -5.619 10.794 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.724 -6.293 9.298 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.338 -7.310 8.955 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -7.716 -8.070 8.627 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -6.550 -11.220 11.218 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -8.342 -10.403 9.605 1.00 0.00 H new ATOM 919 N GLU A 59 -5.547 -7.477 12.957 1.00 0.00 N ATOM 920 CA GLU A 59 -6.508 -7.463 14.053 1.00 0.00 C ATOM 921 C GLU A 59 -6.020 -6.631 15.233 1.00 0.00 C ATOM 922 O GLU A 59 -6.735 -5.766 15.738 1.00 0.00 O ATOM 923 CB GLU A 59 -6.776 -8.890 14.520 1.00 0.00 C ATOM 924 CG GLU A 59 -5.531 -9.649 14.951 1.00 0.00 C ATOM 925 CD GLU A 59 -5.776 -11.139 15.086 1.00 0.00 C ATOM 926 OE1 GLU A 59 -6.675 -11.524 15.863 1.00 0.00 O ATOM 927 OE2 GLU A 59 -5.068 -11.921 14.417 1.00 0.00 O ATOM 0 H GLU A 59 -4.967 -8.315 12.914 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.425 -7.008 13.678 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -7.477 -8.862 15.354 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -7.262 -9.439 13.713 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -4.736 -9.479 14.224 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -5.181 -9.254 15.905 1.00 0.00 H new ATOM 934 N SER A 60 -4.807 -6.914 15.671 1.00 0.00 N ATOM 935 CA SER A 60 -4.215 -6.210 16.805 1.00 0.00 C ATOM 936 C SER A 60 -3.887 -4.762 16.457 1.00 0.00 C ATOM 937 O SER A 60 -4.510 -3.833 16.971 1.00 0.00 O ATOM 938 CB SER A 60 -2.949 -6.931 17.270 1.00 0.00 C ATOM 939 OG SER A 60 -2.279 -7.540 16.180 1.00 0.00 O ATOM 0 H SER A 60 -4.207 -7.629 15.260 1.00 0.00 H new ATOM 0 HA SER A 60 -4.948 -6.205 17.611 1.00 0.00 H new ATOM 0 HB2 SER A 60 -2.282 -6.222 17.760 1.00 0.00 H new ATOM 0 HB3 SER A 60 -3.209 -7.688 18.010 1.00 0.00 H new ATOM 0 HG SER A 60 -1.472 -7.993 16.504 1.00 0.00 H new ATOM 945 N LYS A 61 -2.895 -4.578 15.595 1.00 0.00 N ATOM 946 CA LYS A 61 -2.466 -3.245 15.188 1.00 0.00 C ATOM 947 C LYS A 61 -3.560 -2.504 14.414 1.00 0.00 C ATOM 948 O LYS A 61 -3.479 -1.289 14.233 1.00 0.00 O ATOM 949 CB LYS A 61 -1.195 -3.345 14.344 1.00 0.00 C ATOM 950 CG LYS A 61 0.070 -2.959 15.103 1.00 0.00 C ATOM 951 CD LYS A 61 1.242 -3.880 14.778 1.00 0.00 C ATOM 952 CE LYS A 61 0.976 -5.324 15.271 1.00 0.00 C ATOM 953 NZ LYS A 61 2.096 -6.240 14.916 1.00 0.00 N ATOM 0 H LYS A 61 -2.370 -5.338 15.162 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.260 -2.670 16.091 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.092 -4.366 13.976 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.296 -2.701 13.471 1.00 0.00 H new ATOM 0 HG2 LYS A 61 0.339 -1.932 14.858 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -0.128 -2.990 16.174 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.414 -3.887 13.702 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.149 -3.496 15.244 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.837 -5.320 16.352 1.00 0.00 H new ATOM 0 HE3 LYS A 61 0.049 -5.694 14.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 1.753 -7.222 14.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.459 -5.996 13.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.859 -6.143 15.616 1.00 0.00 H new ATOM 967 N ASN A 62 -4.585 -3.233 13.969 1.00 0.00 N ATOM 968 CA ASN A 62 -5.695 -2.638 13.229 1.00 0.00 C ATOM 969 C ASN A 62 -5.220 -1.615 12.195 1.00 0.00 C ATOM 970 O ASN A 62 -5.406 -0.411 12.366 1.00 0.00 O ATOM 971 CB ASN A 62 -6.679 -1.997 14.205 1.00 0.00 C ATOM 972 CG ASN A 62 -6.083 -0.821 14.957 1.00 0.00 C ATOM 973 OD1 ASN A 62 -5.297 -0.999 15.887 1.00 0.00 O ATOM 974 ND2 ASN A 62 -6.461 0.389 14.559 1.00 0.00 N ATOM 0 H ASN A 62 -4.668 -4.240 14.110 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.194 -3.436 12.679 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -7.560 -1.663 13.658 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -7.014 -2.748 14.921 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.097 1.218 15.030 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.115 0.489 13.783 1.00 0.00 H new ATOM 981 N PHE A 63 -4.620 -2.109 11.115 1.00 0.00 N ATOM 982 CA PHE A 63 -4.130 -1.245 10.041 1.00 0.00 C ATOM 983 C PHE A 63 -4.601 -1.768 8.687 1.00 0.00 C ATOM 984 O PHE A 63 -5.152 -2.866 8.598 1.00 0.00 O ATOM 985 CB PHE A 63 -2.602 -1.147 10.069 1.00 0.00 C ATOM 986 CG PHE A 63 -2.051 -0.549 11.337 1.00 0.00 C ATOM 987 CD1 PHE A 63 -2.761 0.418 12.034 1.00 0.00 C ATOM 988 CD2 PHE A 63 -0.823 -0.956 11.829 1.00 0.00 C ATOM 989 CE1 PHE A 63 -2.254 0.966 13.196 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.312 -0.411 12.992 1.00 0.00 C ATOM 991 CZ PHE A 63 -1.028 0.551 13.676 1.00 0.00 C ATOM 0 H PHE A 63 -4.461 -3.104 10.959 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.537 -0.246 10.196 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -2.181 -2.144 9.937 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -2.271 -0.546 9.222 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.721 0.746 11.664 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.258 -1.708 11.298 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -2.816 1.719 13.729 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.647 -0.738 13.366 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.630 0.978 14.585 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.393 -0.982 7.634 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.805 -1.376 6.306 1.00 0.00 C ATOM 1003 C GLU A 64 -3.691 -1.141 5.294 1.00 0.00 C ATOM 1004 O GLU A 64 -2.993 -0.128 5.330 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.054 -0.608 5.881 1.00 0.00 C ATOM 1006 CG GLU A 64 -6.806 -1.257 4.732 1.00 0.00 C ATOM 1007 CD GLU A 64 -7.146 -2.710 5.006 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -7.652 -3.003 6.109 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -6.907 -3.553 4.116 1.00 0.00 O ATOM 0 H GLU A 64 -3.941 -0.069 7.683 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.032 -2.442 6.333 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.723 -0.517 6.737 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.768 0.403 5.592 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.725 -0.702 4.544 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -6.204 -1.193 3.826 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.549 -2.091 4.393 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.544 -2.036 3.338 1.00 0.00 C ATOM 1018 C VAL A 65 -3.216 -1.858 1.981 1.00 0.00 C ATOM 1019 O VAL A 65 -4.120 -2.611 1.631 1.00 0.00 O ATOM 1020 CB VAL A 65 -1.689 -3.326 3.324 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -0.778 -3.387 2.098 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -0.880 -3.438 4.608 1.00 0.00 C ATOM 0 H VAL A 65 -4.128 -2.930 4.367 1.00 0.00 H new ATOM 0 HA VAL A 65 -1.892 -1.185 3.536 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.368 -4.176 3.264 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.194 -4.307 2.124 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.385 -3.368 1.193 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.105 -2.530 2.102 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.284 -4.350 4.584 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.220 -2.575 4.699 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.556 -3.469 5.462 1.00 0.00 H new ATOM 1032 N VAL A 66 -2.784 -0.859 1.221 1.00 0.00 N ATOM 1033 CA VAL A 66 -3.366 -0.609 -0.090 1.00 0.00 C ATOM 1034 C VAL A 66 -2.380 -0.954 -1.205 1.00 0.00 C ATOM 1035 O VAL A 66 -1.179 -0.721 -1.072 1.00 0.00 O ATOM 1036 CB VAL A 66 -3.806 0.860 -0.241 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -4.579 1.062 -1.535 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.637 1.293 0.958 1.00 0.00 C ATOM 0 H VAL A 66 -2.040 -0.215 1.487 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.243 -1.251 -0.174 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.912 1.483 -0.282 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.879 2.106 -1.620 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.946 0.796 -2.382 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.466 0.428 -1.532 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -4.939 2.333 0.835 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.524 0.664 1.032 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.044 1.193 1.867 1.00 0.00 H new ATOM 1048 N PHE A 67 -2.886 -1.516 -2.303 1.00 0.00 N ATOM 1049 CA PHE A 67 -2.032 -1.890 -3.424 1.00 0.00 C ATOM 1050 C PHE A 67 -2.105 -0.862 -4.549 1.00 0.00 C ATOM 1051 O PHE A 67 -3.116 -0.757 -5.243 1.00 0.00 O ATOM 1052 CB PHE A 67 -2.418 -3.270 -3.949 1.00 0.00 C ATOM 1053 CG PHE A 67 -2.015 -3.526 -5.377 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -0.685 -3.460 -5.757 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -2.969 -3.834 -6.335 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -0.312 -3.696 -7.067 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -2.601 -4.070 -7.646 1.00 0.00 C ATOM 1058 CZ PHE A 67 -1.271 -4.001 -8.012 1.00 0.00 C ATOM 0 H PHE A 67 -3.876 -1.720 -2.437 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.004 -1.920 -3.062 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -1.961 -4.028 -3.313 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.498 -3.390 -3.862 1.00 0.00 H new ATOM 0 HD1 PHE A 67 0.069 -3.221 -5.022 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -4.010 -3.890 -6.054 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.729 -3.642 -7.351 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -3.353 -4.308 -8.384 1.00 0.00 H new ATOM 0 HZ PHE A 67 -0.982 -4.185 -9.036 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.018 -0.124 -4.742 1.00 0.00 N ATOM 1069 CA CYS A 68 -0.955 0.871 -5.802 1.00 0.00 C ATOM 1070 C CYS A 68 -0.545 0.199 -7.107 1.00 0.00 C ATOM 1071 O CYS A 68 0.555 -0.338 -7.218 1.00 0.00 O ATOM 1072 CB CYS A 68 0.039 1.978 -5.442 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.737 3.497 -4.843 1.00 0.00 S ATOM 0 H CYS A 68 -0.171 -0.197 -4.179 1.00 0.00 H new ATOM 0 HA CYS A 68 -1.940 1.323 -5.923 1.00 0.00 H new ATOM 0 HB2 CYS A 68 0.721 1.605 -4.678 1.00 0.00 H new ATOM 0 HB3 CYS A 68 0.641 2.212 -6.320 1.00 0.00 H new ATOM 0 HG CYS A 68 -1.243 3.290 -3.663 1.00 0.00 H new ATOM 1079 N THR A 69 -1.437 0.210 -8.086 1.00 0.00 N ATOM 1080 CA THR A 69 -1.151 -0.422 -9.367 1.00 0.00 C ATOM 1081 C THR A 69 -0.231 0.444 -10.224 1.00 0.00 C ATOM 1082 O THR A 69 -0.156 1.659 -10.050 1.00 0.00 O ATOM 1083 CB THR A 69 -2.448 -0.732 -10.122 1.00 0.00 C ATOM 1084 OG1 THR A 69 -2.220 -1.697 -11.134 1.00 0.00 O ATOM 1085 CG2 THR A 69 -3.066 0.482 -10.780 1.00 0.00 C ATOM 0 H THR A 69 -2.357 0.645 -8.021 1.00 0.00 H new ATOM 0 HA THR A 69 -0.634 -1.360 -9.162 1.00 0.00 H new ATOM 0 HB THR A 69 -3.138 -1.105 -9.365 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.430 -1.443 -11.656 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.980 0.190 -11.296 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.300 1.228 -10.020 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.363 0.904 -11.498 1.00 0.00 H new ATOM 1093 N TRP A 70 0.461 -0.203 -11.150 1.00 0.00 N ATOM 1094 CA TRP A 70 1.385 0.480 -12.053 1.00 0.00 C ATOM 1095 C TRP A 70 1.268 -0.069 -13.476 1.00 0.00 C ATOM 1096 O TRP A 70 2.255 -0.137 -14.209 1.00 0.00 O ATOM 1097 CB TRP A 70 2.823 0.321 -11.551 1.00 0.00 C ATOM 1098 CG TRP A 70 3.373 1.560 -10.915 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.536 1.790 -9.579 1.00 0.00 C ATOM 1100 CD2 TRP A 70 3.837 2.737 -11.585 1.00 0.00 C ATOM 1101 NE1 TRP A 70 4.073 3.038 -9.378 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.267 3.639 -10.595 1.00 0.00 C ATOM 1103 CE3 TRP A 70 3.932 3.114 -12.928 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 4.782 4.896 -10.904 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 4.444 4.362 -13.234 1.00 0.00 C ATOM 1106 CH2 TRP A 70 4.864 5.239 -12.226 1.00 0.00 C ATOM 0 H TRP A 70 0.401 -1.210 -11.299 1.00 0.00 H new ATOM 0 HA TRP A 70 1.123 1.538 -12.071 1.00 0.00 H new ATOM 0 HB2 TRP A 70 2.860 -0.495 -10.830 1.00 0.00 H new ATOM 0 HB3 TRP A 70 3.462 0.037 -12.387 1.00 0.00 H new ATOM 0 HD1 TRP A 70 3.280 1.093 -8.795 1.00 0.00 H new ATOM 0 HE1 TRP A 70 4.292 3.451 -8.471 1.00 0.00 H new ATOM 0 HE3 TRP A 70 3.612 2.443 -13.712 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 5.105 5.575 -10.128 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 4.521 4.665 -14.268 1.00 0.00 H new ATOM 0 HH2 TRP A 70 5.261 6.206 -12.498 1.00 0.00 H new ATOM 1117 N ASP A 71 0.058 -0.464 -13.858 1.00 0.00 N ATOM 1118 CA ASP A 71 -0.190 -1.010 -15.187 1.00 0.00 C ATOM 1119 C ASP A 71 -0.793 0.039 -16.114 1.00 0.00 C ATOM 1120 O ASP A 71 -1.129 1.144 -15.688 1.00 0.00 O ATOM 1121 CB ASP A 71 -1.133 -2.210 -15.097 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.725 -3.187 -14.014 1.00 0.00 C ATOM 1123 OD1 ASP A 71 -0.704 -2.787 -12.831 1.00 0.00 O ATOM 1124 OD2 ASP A 71 -0.431 -4.353 -14.348 1.00 0.00 O ATOM 0 H ASP A 71 -0.769 -0.416 -13.263 1.00 0.00 H new ATOM 0 HA ASP A 71 0.768 -1.326 -15.599 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.146 -1.858 -14.902 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.154 -2.725 -16.058 1.00 0.00 H new ATOM 1129 N GLU A 72 -0.932 -0.324 -17.384 1.00 0.00 N ATOM 1130 CA GLU A 72 -1.502 0.574 -18.382 1.00 0.00 C ATOM 1131 C GLU A 72 -2.882 0.090 -18.823 1.00 0.00 C ATOM 1132 O GLU A 72 -3.728 0.885 -19.230 1.00 0.00 O ATOM 1133 CB GLU A 72 -0.574 0.678 -19.594 1.00 0.00 C ATOM 1134 CG GLU A 72 -0.535 2.066 -20.212 1.00 0.00 C ATOM 1135 CD GLU A 72 -1.492 2.210 -21.381 1.00 0.00 C ATOM 1136 OE1 GLU A 72 -2.711 2.332 -21.139 1.00 0.00 O ATOM 1137 OE2 GLU A 72 -1.021 2.201 -22.538 1.00 0.00 O ATOM 0 H GLU A 72 -0.657 -1.236 -17.748 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.609 1.560 -17.930 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.435 0.394 -19.294 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -0.895 -0.038 -20.350 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -0.783 2.806 -19.451 1.00 0.00 H new ATOM 0 HG3 GLU A 72 0.479 2.282 -20.548 1.00 0.00 H new ATOM 1144 N GLU A 73 -3.102 -1.221 -18.739 1.00 0.00 N ATOM 1145 CA GLU A 73 -4.378 -1.809 -19.131 1.00 0.00 C ATOM 1146 C GLU A 73 -5.209 -2.180 -17.906 1.00 0.00 C ATOM 1147 O GLU A 73 -4.716 -2.820 -16.977 1.00 0.00 O ATOM 1148 CB GLU A 73 -4.146 -3.048 -19.998 1.00 0.00 C ATOM 1149 CG GLU A 73 -5.407 -3.565 -20.671 1.00 0.00 C ATOM 1150 CD GLU A 73 -5.185 -4.877 -21.397 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -4.030 -5.150 -21.789 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -6.163 -5.632 -21.574 1.00 0.00 O ATOM 0 H GLU A 73 -2.413 -1.894 -18.403 1.00 0.00 H new ATOM 0 HA GLU A 73 -4.929 -1.066 -19.708 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -3.406 -2.812 -20.763 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.724 -3.840 -19.380 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -6.187 -3.697 -19.921 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -5.768 -2.819 -21.379 1.00 0.00 H new ATOM 1159 N GLU A 74 -6.472 -1.770 -17.914 1.00 0.00 N ATOM 1160 CA GLU A 74 -7.381 -2.051 -16.805 1.00 0.00 C ATOM 1161 C GLU A 74 -7.526 -3.553 -16.570 1.00 0.00 C ATOM 1162 O GLU A 74 -7.510 -4.016 -15.430 1.00 0.00 O ATOM 1163 CB GLU A 74 -8.763 -1.443 -17.071 1.00 0.00 C ATOM 1164 CG GLU A 74 -9.184 -1.469 -18.533 1.00 0.00 C ATOM 1165 CD GLU A 74 -8.990 -0.131 -19.219 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -7.853 0.387 -19.201 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -9.974 0.400 -19.774 1.00 0.00 O ATOM 0 H GLU A 74 -6.892 -1.240 -18.678 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.951 -1.598 -15.911 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.504 -1.982 -16.481 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.767 -0.411 -16.722 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.608 -2.230 -19.060 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.233 -1.759 -18.600 1.00 0.00 H new ATOM 1174 N ASP A 75 -7.679 -4.301 -17.655 1.00 0.00 N ATOM 1175 CA ASP A 75 -7.844 -5.750 -17.574 1.00 0.00 C ATOM 1176 C ASP A 75 -6.694 -6.405 -16.810 1.00 0.00 C ATOM 1177 O ASP A 75 -6.912 -7.294 -15.988 1.00 0.00 O ATOM 1178 CB ASP A 75 -7.940 -6.350 -18.977 1.00 0.00 C ATOM 1179 CG ASP A 75 -9.358 -6.344 -19.513 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -9.791 -5.295 -20.036 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -10.037 -7.386 -19.409 1.00 0.00 O ATOM 0 H ASP A 75 -7.693 -3.929 -18.605 1.00 0.00 H new ATOM 0 HA ASP A 75 -8.768 -5.947 -17.030 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -7.296 -5.788 -19.654 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -7.566 -7.374 -18.958 1.00 0.00 H new ATOM 1186 N GLY A 76 -5.471 -5.964 -17.089 1.00 0.00 N ATOM 1187 CA GLY A 76 -4.312 -6.527 -16.418 1.00 0.00 C ATOM 1188 C GLY A 76 -4.375 -6.370 -14.909 1.00 0.00 C ATOM 1189 O GLY A 76 -4.287 -7.350 -14.171 1.00 0.00 O ATOM 0 H GLY A 76 -5.262 -5.230 -17.765 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -4.232 -7.585 -16.666 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -3.410 -6.043 -16.792 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.523 -5.132 -14.455 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.594 -4.836 -13.027 1.00 0.00 C ATOM 1195 C PHE A 77 -5.824 -5.485 -12.389 1.00 0.00 C ATOM 1196 O PHE A 77 -5.833 -5.775 -11.193 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.612 -3.315 -12.816 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.261 -2.870 -11.532 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -4.840 -3.376 -10.313 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -6.290 -1.943 -11.551 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -5.436 -2.966 -9.135 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -6.890 -1.530 -10.377 1.00 0.00 C ATOM 1203 CZ PHE A 77 -6.463 -2.041 -9.168 1.00 0.00 C ATOM 0 H PHE A 77 -4.597 -4.312 -15.057 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.713 -5.254 -12.540 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.587 -2.946 -12.837 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.135 -2.851 -13.652 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -4.038 -4.098 -10.283 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -6.627 -1.539 -12.494 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -5.100 -3.368 -8.190 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -7.693 -0.808 -10.405 1.00 0.00 H new ATOM 0 HZ PHE A 77 -6.930 -1.719 -8.249 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.862 -5.699 -13.190 1.00 0.00 N ATOM 1214 CA ALA A 78 -8.098 -6.302 -12.700 1.00 0.00 C ATOM 1215 C ALA A 78 -7.913 -7.762 -12.342 1.00 0.00 C ATOM 1216 O ALA A 78 -8.212 -8.184 -11.225 1.00 0.00 O ATOM 1217 CB ALA A 78 -9.154 -6.209 -13.757 1.00 0.00 C ATOM 0 H ALA A 78 -6.873 -5.464 -14.182 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.391 -5.757 -11.803 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -10.076 -6.659 -13.390 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -9.333 -5.162 -14.001 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.822 -6.738 -14.650 1.00 0.00 H new ATOM 1223 N GLY A 79 -7.388 -8.531 -13.294 1.00 0.00 N ATOM 1224 CA GLY A 79 -7.141 -9.935 -13.052 1.00 0.00 C ATOM 1225 C GLY A 79 -6.243 -10.111 -11.854 1.00 0.00 C ATOM 1226 O GLY A 79 -6.105 -11.207 -11.312 1.00 0.00 O ATOM 0 H GLY A 79 -7.131 -8.204 -14.225 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.085 -10.454 -12.886 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.679 -10.386 -13.930 1.00 0.00 H new ATOM 1230 N TYR A 80 -5.624 -9.006 -11.454 1.00 0.00 N ATOM 1231 CA TYR A 80 -4.714 -9.011 -10.312 1.00 0.00 C ATOM 1232 C TYR A 80 -5.453 -8.731 -9.002 1.00 0.00 C ATOM 1233 O TYR A 80 -4.959 -9.051 -7.922 1.00 0.00 O ATOM 1234 CB TYR A 80 -3.599 -7.979 -10.516 1.00 0.00 C ATOM 1235 CG TYR A 80 -2.220 -8.505 -10.185 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -1.809 -9.756 -10.626 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -1.329 -7.748 -9.435 1.00 0.00 C ATOM 1238 CE1 TYR A 80 -0.549 -10.239 -10.327 1.00 0.00 C ATOM 1239 CE2 TYR A 80 -0.068 -8.224 -9.132 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.318 -9.469 -9.581 1.00 0.00 C ATOM 1241 OH TYR A 80 1.573 -9.947 -9.282 1.00 0.00 O ATOM 0 H TYR A 80 -5.735 -8.096 -11.902 1.00 0.00 H new ATOM 0 HA TYR A 80 -4.275 -10.006 -10.244 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -3.611 -7.643 -11.553 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.805 -7.107 -9.896 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -2.485 -10.361 -11.212 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -1.627 -6.771 -9.083 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -0.245 -11.215 -10.676 1.00 0.00 H new ATOM 0 HE2 TYR A 80 0.612 -7.624 -8.546 1.00 0.00 H new ATOM 0 HH TYR A 80 2.058 -9.282 -8.751 1.00 0.00 H new ATOM 1251 N PHE A 81 -6.634 -8.130 -9.105 1.00 0.00 N ATOM 1252 CA PHE A 81 -7.437 -7.803 -7.925 1.00 0.00 C ATOM 1253 C PHE A 81 -8.186 -9.028 -7.392 1.00 0.00 C ATOM 1254 O PHE A 81 -8.731 -8.996 -6.289 1.00 0.00 O ATOM 1255 CB PHE A 81 -8.432 -6.678 -8.257 1.00 0.00 C ATOM 1256 CG PHE A 81 -9.600 -6.586 -7.314 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -10.701 -7.411 -7.477 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -9.600 -5.671 -6.273 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -11.779 -7.328 -6.618 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -10.676 -5.583 -5.411 1.00 0.00 C ATOM 1261 CZ PHE A 81 -11.768 -6.413 -5.584 1.00 0.00 C ATOM 0 H PHE A 81 -7.059 -7.858 -9.992 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.756 -7.465 -7.144 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -7.901 -5.726 -8.253 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -8.808 -6.829 -9.269 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -10.716 -8.127 -8.285 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -8.750 -5.020 -6.134 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -12.630 -7.978 -6.755 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -10.664 -4.867 -4.603 1.00 0.00 H new ATOM 0 HZ PHE A 81 -12.611 -6.346 -4.912 1.00 0.00 H new ATOM 1271 N ALA A 82 -8.227 -10.096 -8.182 1.00 0.00 N ATOM 1272 CA ALA A 82 -8.930 -11.311 -7.783 1.00 0.00 C ATOM 1273 C ALA A 82 -8.124 -12.156 -6.794 1.00 0.00 C ATOM 1274 O ALA A 82 -8.643 -13.123 -6.236 1.00 0.00 O ATOM 1275 CB ALA A 82 -9.280 -12.134 -9.014 1.00 0.00 C ATOM 0 H ALA A 82 -7.784 -10.145 -9.099 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.843 -11.006 -7.272 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -9.805 -13.040 -8.709 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.920 -11.548 -9.673 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.366 -12.405 -9.543 1.00 0.00 H new ATOM 1281 N LYS A 83 -6.856 -11.808 -6.587 1.00 0.00 N ATOM 1282 CA LYS A 83 -6.004 -12.565 -5.677 1.00 0.00 C ATOM 1283 C LYS A 83 -5.587 -11.744 -4.456 1.00 0.00 C ATOM 1284 O LYS A 83 -5.184 -12.304 -3.437 1.00 0.00 O ATOM 1285 CB LYS A 83 -4.762 -13.053 -6.420 1.00 0.00 C ATOM 1286 CG LYS A 83 -5.077 -13.756 -7.729 1.00 0.00 C ATOM 1287 CD LYS A 83 -3.893 -14.571 -8.225 1.00 0.00 C ATOM 1288 CE LYS A 83 -2.675 -13.694 -8.466 1.00 0.00 C ATOM 1289 NZ LYS A 83 -3.022 -12.450 -9.207 1.00 0.00 N ATOM 0 H LYS A 83 -6.400 -11.013 -7.034 1.00 0.00 H new ATOM 0 HA LYS A 83 -6.583 -13.415 -5.317 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -4.111 -12.202 -6.621 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.207 -13.734 -5.775 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -5.938 -14.410 -7.593 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -5.353 -13.018 -8.482 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -3.649 -15.342 -7.494 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -4.163 -15.082 -9.149 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -2.222 -13.432 -7.510 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.929 -14.256 -9.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -2.150 -11.965 -9.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -3.582 -12.692 -10.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -3.578 -11.823 -8.591 1.00 0.00 H new ATOM 1303 N MET A 84 -5.666 -10.422 -4.563 1.00 0.00 N ATOM 1304 CA MET A 84 -5.273 -9.549 -3.459 1.00 0.00 C ATOM 1305 C MET A 84 -6.470 -9.142 -2.598 1.00 0.00 C ATOM 1306 O MET A 84 -7.435 -8.564 -3.097 1.00 0.00 O ATOM 1307 CB MET A 84 -4.587 -8.294 -3.997 1.00 0.00 C ATOM 1308 CG MET A 84 -5.319 -7.649 -5.164 1.00 0.00 C ATOM 1309 SD MET A 84 -5.475 -5.862 -4.987 1.00 0.00 S ATOM 1310 CE MET A 84 -6.951 -5.747 -3.979 1.00 0.00 C ATOM 0 H MET A 84 -5.996 -9.933 -5.395 1.00 0.00 H new ATOM 0 HA MET A 84 -4.581 -10.112 -2.833 1.00 0.00 H new ATOM 0 HB2 MET A 84 -4.496 -7.567 -3.190 1.00 0.00 H new ATOM 0 HB3 MET A 84 -3.575 -8.550 -4.311 1.00 0.00 H new ATOM 0 HG2 MET A 84 -4.788 -7.873 -6.089 1.00 0.00 H new ATOM 0 HG3 MET A 84 -6.312 -8.089 -5.252 1.00 0.00 H new ATOM 0 HE1 MET A 84 -7.218 -4.699 -3.843 1.00 0.00 H new ATOM 0 HE2 MET A 84 -7.771 -6.269 -4.473 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.764 -6.203 -3.007 1.00 0.00 H new ATOM 1320 N PRO A 85 -6.417 -9.429 -1.281 1.00 0.00 N ATOM 1321 CA PRO A 85 -7.491 -9.077 -0.352 1.00 0.00 C ATOM 1322 C PRO A 85 -7.412 -7.617 0.089 1.00 0.00 C ATOM 1323 O PRO A 85 -8.434 -6.947 0.243 1.00 0.00 O ATOM 1324 CB PRO A 85 -7.232 -10.006 0.830 1.00 0.00 C ATOM 1325 CG PRO A 85 -5.752 -10.183 0.845 1.00 0.00 C ATOM 1326 CD PRO A 85 -5.301 -10.111 -0.592 1.00 0.00 C ATOM 0 HA PRO A 85 -8.480 -9.187 -0.796 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -7.590 -9.571 1.763 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.745 -10.960 0.706 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -5.274 -9.406 1.442 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.480 -11.140 1.290 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -4.370 -9.553 -0.691 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -5.123 -11.104 -1.005 1.00 0.00 H new ATOM 1334 N TRP A 86 -6.187 -7.130 0.282 1.00 0.00 N ATOM 1335 CA TRP A 86 -5.957 -5.747 0.699 1.00 0.00 C ATOM 1336 C TRP A 86 -6.727 -4.781 -0.198 1.00 0.00 C ATOM 1337 O TRP A 86 -7.159 -5.164 -1.285 1.00 0.00 O ATOM 1338 CB TRP A 86 -4.458 -5.434 0.648 1.00 0.00 C ATOM 1339 CG TRP A 86 -3.797 -5.778 -0.646 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -3.958 -5.132 -1.835 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -2.853 -6.828 -0.882 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -3.174 -5.713 -2.797 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -2.487 -6.759 -2.239 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -2.282 -7.821 -0.080 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -1.576 -7.643 -2.811 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -1.378 -8.699 -0.649 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.032 -8.604 -2.002 1.00 0.00 C ATOM 0 H TRP A 86 -5.335 -7.676 0.156 1.00 0.00 H new ATOM 0 HA TRP A 86 -6.314 -5.625 1.721 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -4.315 -4.371 0.843 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -3.959 -5.976 1.452 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -4.609 -4.285 -1.996 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -3.112 -5.415 -3.771 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -2.542 -7.901 0.965 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.308 -7.573 -3.855 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -0.932 -9.471 -0.040 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -0.321 -9.303 -2.416 1.00 0.00 H new ATOM 1358 N LEU A 87 -6.919 -3.532 0.246 1.00 0.00 N ATOM 1359 CA LEU A 87 -7.654 -2.586 -0.560 1.00 0.00 C ATOM 1360 C LEU A 87 -6.756 -1.939 -1.605 1.00 0.00 C ATOM 1361 O LEU A 87 -5.684 -1.434 -1.295 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.288 -1.503 0.313 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.479 -1.956 1.159 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -9.337 -1.469 2.594 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -10.780 -1.455 0.552 1.00 0.00 C ATOM 0 H LEU A 87 -6.580 -3.172 1.138 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.443 -3.138 -1.071 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.523 -1.102 0.978 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.611 -0.685 -0.330 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.498 -3.046 1.170 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.195 -1.802 3.178 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.423 -1.875 3.027 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -9.291 -0.380 2.606 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.619 -1.785 1.165 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.767 -0.366 0.512 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.888 -1.854 -0.456 1.00 0.00 H new ATOM 1377 N ALA A 88 -7.206 -1.967 -2.852 1.00 0.00 N ATOM 1378 CA ALA A 88 -6.445 -1.392 -3.951 1.00 0.00 C ATOM 1379 C ALA A 88 -7.238 -0.310 -4.670 1.00 0.00 C ATOM 1380 O ALA A 88 -8.434 -0.463 -4.915 1.00 0.00 O ATOM 1381 CB ALA A 88 -6.047 -2.485 -4.927 1.00 0.00 C ATOM 0 H ALA A 88 -8.096 -2.383 -3.127 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.549 -0.929 -3.538 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.477 -2.050 -5.748 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.435 -3.226 -4.413 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -6.943 -2.965 -5.321 1.00 0.00 H new ATOM 1387 N VAL A 89 -6.565 0.782 -5.010 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.214 1.883 -5.709 1.00 0.00 C ATOM 1389 C VAL A 89 -7.627 1.462 -7.118 1.00 0.00 C ATOM 1390 O VAL A 89 -6.841 0.858 -7.846 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.296 3.116 -5.809 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.015 4.266 -6.502 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -5.811 3.534 -4.429 1.00 0.00 C ATOM 0 H VAL A 89 -5.575 0.928 -4.814 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.097 2.148 -5.128 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.426 2.850 -6.409 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.350 5.127 -6.563 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.306 3.960 -7.507 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.905 4.534 -5.933 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.164 4.406 -4.520 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.667 3.781 -3.802 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.254 2.714 -3.976 1.00 0.00 H new ATOM 1403 N PRO A 90 -8.866 1.786 -7.527 1.00 0.00 N ATOM 1404 CA PRO A 90 -9.360 1.442 -8.862 1.00 0.00 C ATOM 1405 C PRO A 90 -8.593 2.178 -9.951 1.00 0.00 C ATOM 1406 O PRO A 90 -8.158 3.313 -9.754 1.00 0.00 O ATOM 1407 CB PRO A 90 -10.823 1.898 -8.836 1.00 0.00 C ATOM 1408 CG PRO A 90 -10.882 2.933 -7.767 1.00 0.00 C ATOM 1409 CD PRO A 90 -9.871 2.517 -6.736 1.00 0.00 C ATOM 0 HA PRO A 90 -9.242 0.381 -9.084 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.127 2.307 -9.800 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -11.493 1.066 -8.618 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -10.650 3.920 -8.166 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -11.881 2.991 -7.334 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.436 3.378 -6.228 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.316 1.885 -5.967 1.00 0.00 H new ATOM 1417 N PHE A 91 -8.428 1.533 -11.103 1.00 0.00 N ATOM 1418 CA PHE A 91 -7.709 2.144 -12.219 1.00 0.00 C ATOM 1419 C PHE A 91 -8.206 3.566 -12.467 1.00 0.00 C ATOM 1420 O PHE A 91 -7.461 4.422 -12.946 1.00 0.00 O ATOM 1421 CB PHE A 91 -7.865 1.304 -13.490 1.00 0.00 C ATOM 1422 CG PHE A 91 -9.235 0.710 -13.664 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -10.330 1.520 -13.918 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -9.424 -0.659 -13.575 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -11.589 0.974 -14.080 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -10.681 -1.211 -13.736 1.00 0.00 C ATOM 1427 CZ PHE A 91 -11.765 -0.393 -13.989 1.00 0.00 C ATOM 0 H PHE A 91 -8.780 0.594 -11.288 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.652 2.184 -11.956 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -7.637 1.927 -14.355 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -7.130 0.499 -13.474 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -10.198 2.589 -13.990 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -8.580 -1.303 -13.378 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -12.435 1.616 -14.278 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -10.815 -2.280 -13.664 1.00 0.00 H new ATOM 0 HZ PHE A 91 -12.748 -0.821 -14.115 1.00 0.00 H new ATOM 1437 N ALA A 92 -9.470 3.808 -12.132 1.00 0.00 N ATOM 1438 CA ALA A 92 -10.074 5.124 -12.311 1.00 0.00 C ATOM 1439 C ALA A 92 -9.233 6.228 -11.667 1.00 0.00 C ATOM 1440 O ALA A 92 -9.137 7.331 -12.205 1.00 0.00 O ATOM 1441 CB ALA A 92 -11.483 5.134 -11.739 1.00 0.00 C ATOM 0 H ALA A 92 -10.097 3.108 -11.734 1.00 0.00 H new ATOM 0 HA ALA A 92 -10.117 5.326 -13.381 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -11.925 6.121 -11.878 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -12.090 4.389 -12.254 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -11.445 4.899 -10.675 1.00 0.00 H new ATOM 1447 N GLN A 93 -8.629 5.936 -10.514 1.00 0.00 N ATOM 1448 CA GLN A 93 -7.809 6.922 -9.818 1.00 0.00 C ATOM 1449 C GLN A 93 -6.325 6.607 -9.965 1.00 0.00 C ATOM 1450 O GLN A 93 -5.512 7.022 -9.140 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.175 6.981 -8.333 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.655 6.775 -8.048 1.00 0.00 C ATOM 1453 CD GLN A 93 -9.925 6.385 -6.608 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -9.033 6.433 -5.762 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -11.162 5.996 -6.322 1.00 0.00 N ATOM 0 H GLN A 93 -8.693 5.031 -10.047 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.007 7.892 -10.274 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -7.604 6.221 -7.799 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.870 7.948 -7.933 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.196 7.692 -8.279 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.044 6.000 -8.709 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -11.871 5.971 -7.055 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -11.403 5.722 -5.370 1.00 0.00 H new ATOM 1464 N SER A 94 -5.972 5.875 -11.018 1.00 0.00 N ATOM 1465 CA SER A 94 -4.579 5.519 -11.255 1.00 0.00 C ATOM 1466 C SER A 94 -3.712 6.769 -11.356 1.00 0.00 C ATOM 1467 O SER A 94 -2.512 6.728 -11.083 1.00 0.00 O ATOM 1468 CB SER A 94 -4.444 4.680 -12.526 1.00 0.00 C ATOM 1469 OG SER A 94 -4.397 5.502 -13.679 1.00 0.00 O ATOM 0 H SER A 94 -6.627 5.520 -11.715 1.00 0.00 H new ATOM 0 HA SER A 94 -4.235 4.925 -10.408 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.540 4.074 -12.471 1.00 0.00 H new ATOM 0 HB3 SER A 94 -5.285 3.991 -12.601 1.00 0.00 H new ATOM 0 HG SER A 94 -4.309 4.941 -14.478 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.329 7.885 -11.740 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.612 9.148 -11.862 1.00 0.00 C ATOM 1477 C GLU A 95 -2.907 9.483 -10.552 1.00 0.00 C ATOM 1478 O GLU A 95 -1.817 10.054 -10.546 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.575 10.274 -12.241 1.00 0.00 C ATOM 1480 CG GLU A 95 -3.899 11.625 -12.407 1.00 0.00 C ATOM 1481 CD GLU A 95 -4.703 12.760 -11.806 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -5.272 12.568 -10.710 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -4.767 13.839 -12.431 1.00 0.00 O ATOM 0 H GLU A 95 -5.321 7.938 -11.971 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.865 9.047 -12.649 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.078 10.012 -13.172 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.346 10.355 -11.474 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.915 11.594 -11.938 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.741 11.819 -13.468 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.538 9.107 -9.444 1.00 0.00 N ATOM 1491 CA ALA A 96 -2.974 9.347 -8.124 1.00 0.00 C ATOM 1492 C ALA A 96 -1.702 8.540 -7.935 1.00 0.00 C ATOM 1493 O ALA A 96 -0.724 9.019 -7.373 1.00 0.00 O ATOM 1494 CB ALA A 96 -3.976 8.976 -7.044 1.00 0.00 C ATOM 0 H ALA A 96 -4.442 8.634 -9.436 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.738 10.408 -8.043 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.539 9.161 -6.063 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.876 9.580 -7.160 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.233 7.920 -7.133 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.737 7.303 -8.406 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.603 6.401 -8.297 1.00 0.00 C ATOM 1502 C VAL A 97 0.621 6.952 -9.012 1.00 0.00 C ATOM 1503 O VAL A 97 1.756 6.740 -8.585 1.00 0.00 O ATOM 1504 CB VAL A 97 -0.965 5.027 -8.869 1.00 0.00 C ATOM 1505 CG1 VAL A 97 0.237 4.099 -8.843 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.136 4.451 -8.092 1.00 0.00 C ATOM 0 H VAL A 97 -2.549 6.898 -8.872 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.359 6.302 -7.239 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.262 5.135 -9.912 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.043 3.129 -9.254 1.00 0.00 H new ATOM 0 HG12 VAL A 97 1.041 4.528 -9.441 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.577 3.973 -7.815 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.396 3.473 -8.497 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.861 4.347 -7.042 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -2.993 5.119 -8.178 1.00 0.00 H new ATOM 1516 N GLN A 98 0.377 7.660 -10.097 1.00 0.00 N ATOM 1517 CA GLN A 98 1.448 8.255 -10.887 1.00 0.00 C ATOM 1518 C GLN A 98 2.072 9.436 -10.151 1.00 0.00 C ATOM 1519 O GLN A 98 3.294 9.577 -10.108 1.00 0.00 O ATOM 1520 CB GLN A 98 0.916 8.710 -12.247 1.00 0.00 C ATOM 1521 CG GLN A 98 0.133 7.635 -12.986 1.00 0.00 C ATOM 1522 CD GLN A 98 0.722 7.312 -14.345 1.00 0.00 C ATOM 1523 OE1 GLN A 98 -0.001 7.173 -15.330 1.00 0.00 O ATOM 1524 NE2 GLN A 98 2.043 7.190 -14.402 1.00 0.00 N ATOM 0 H GLN A 98 -0.560 7.841 -10.458 1.00 0.00 H new ATOM 0 HA GLN A 98 2.216 7.498 -11.042 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.276 9.581 -12.104 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.754 9.029 -12.867 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.108 6.729 -12.381 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.899 7.964 -13.111 1.00 0.00 H new ATOM 0 HE21 GLN A 98 2.603 7.314 -13.559 1.00 0.00 H new ATOM 0 HE22 GLN A 98 2.497 6.972 -15.289 1.00 0.00 H new ATOM 1533 N LYS A 99 1.225 10.279 -9.572 1.00 0.00 N ATOM 1534 CA LYS A 99 1.692 11.448 -8.836 1.00 0.00 C ATOM 1535 C LYS A 99 2.124 11.064 -7.425 1.00 0.00 C ATOM 1536 O LYS A 99 3.118 11.575 -6.909 1.00 0.00 O ATOM 1537 CB LYS A 99 0.594 12.512 -8.777 1.00 0.00 C ATOM 1538 CG LYS A 99 0.335 13.194 -10.109 1.00 0.00 C ATOM 1539 CD LYS A 99 1.593 13.853 -10.652 1.00 0.00 C ATOM 1540 CE LYS A 99 1.286 14.735 -11.851 1.00 0.00 C ATOM 1541 NZ LYS A 99 0.339 15.832 -11.508 1.00 0.00 N ATOM 0 H LYS A 99 0.211 10.175 -9.598 1.00 0.00 H new ATOM 0 HA LYS A 99 2.555 11.858 -9.361 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -0.330 12.050 -8.430 1.00 0.00 H new ATOM 0 HB3 LYS A 99 0.870 13.266 -8.040 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -0.033 12.462 -10.828 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.447 13.944 -9.989 1.00 0.00 H new ATOM 0 HD2 LYS A 99 2.059 14.451 -9.869 1.00 0.00 H new ATOM 0 HD3 LYS A 99 2.313 13.086 -10.938 1.00 0.00 H new ATOM 0 HE2 LYS A 99 2.213 15.162 -12.234 1.00 0.00 H new ATOM 0 HE3 LYS A 99 0.862 14.126 -12.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 0.437 16.603 -12.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -0.635 15.469 -11.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 0.554 16.191 -10.556 1.00 0.00 H new ATOM 1555 N LEU A 100 1.369 10.163 -6.804 1.00 0.00 N ATOM 1556 CA LEU A 100 1.676 9.712 -5.450 1.00 0.00 C ATOM 1557 C LEU A 100 2.950 8.870 -5.431 1.00 0.00 C ATOM 1558 O LEU A 100 3.656 8.823 -4.423 1.00 0.00 O ATOM 1559 CB LEU A 100 0.500 8.913 -4.875 1.00 0.00 C ATOM 1560 CG LEU A 100 0.767 8.217 -3.546 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.755 9.233 -2.420 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.266 7.122 -3.311 1.00 0.00 C ATOM 0 H LEU A 100 0.542 9.731 -7.215 1.00 0.00 H new ATOM 0 HA LEU A 100 1.841 10.592 -4.828 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.347 9.587 -4.748 1.00 0.00 H new ATOM 0 HB3 LEU A 100 0.203 8.161 -5.606 1.00 0.00 H new ATOM 0 HG LEU A 100 1.752 7.750 -3.574 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.946 8.729 -1.473 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.529 9.980 -2.596 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.219 9.721 -2.381 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.066 6.631 -2.359 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.263 7.561 -3.290 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.209 6.389 -4.116 1.00 0.00 H new ATOM 1574 N SER A 101 3.239 8.210 -6.548 1.00 0.00 N ATOM 1575 CA SER A 101 4.431 7.374 -6.652 1.00 0.00 C ATOM 1576 C SER A 101 5.697 8.224 -6.601 1.00 0.00 C ATOM 1577 O SER A 101 6.616 7.940 -5.833 1.00 0.00 O ATOM 1578 CB SER A 101 4.403 6.562 -7.947 1.00 0.00 C ATOM 1579 OG SER A 101 4.108 7.387 -9.061 1.00 0.00 O ATOM 0 H SER A 101 2.666 8.237 -7.392 1.00 0.00 H new ATOM 0 HA SER A 101 4.437 6.690 -5.804 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.367 6.076 -8.096 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.656 5.772 -7.868 1.00 0.00 H new ATOM 0 HG SER A 101 3.188 7.221 -9.356 1.00 0.00 H new ATOM 1585 N LYS A 102 5.737 9.267 -7.424 1.00 0.00 N ATOM 1586 CA LYS A 102 6.891 10.159 -7.472 1.00 0.00 C ATOM 1587 C LYS A 102 7.157 10.772 -6.101 1.00 0.00 C ATOM 1588 O LYS A 102 8.290 10.774 -5.619 1.00 0.00 O ATOM 1589 CB LYS A 102 6.666 11.263 -8.505 1.00 0.00 C ATOM 1590 CG LYS A 102 7.897 11.575 -9.340 1.00 0.00 C ATOM 1591 CD LYS A 102 8.253 10.419 -10.260 1.00 0.00 C ATOM 1592 CE LYS A 102 9.204 10.857 -11.362 1.00 0.00 C ATOM 1593 NZ LYS A 102 10.610 10.945 -10.881 1.00 0.00 N ATOM 0 H LYS A 102 4.985 9.515 -8.066 1.00 0.00 H new ATOM 0 HA LYS A 102 7.763 9.573 -7.764 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.853 10.968 -9.168 1.00 0.00 H new ATOM 0 HB3 LYS A 102 6.346 12.170 -7.992 1.00 0.00 H new ATOM 0 HG2 LYS A 102 7.718 12.472 -9.933 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.739 11.791 -8.682 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.711 9.618 -9.679 1.00 0.00 H new ATOM 0 HD3 LYS A 102 7.344 10.012 -10.703 1.00 0.00 H new ATOM 0 HE2 LYS A 102 9.148 10.152 -12.191 1.00 0.00 H new ATOM 0 HE3 LYS A 102 8.891 11.827 -11.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 11.226 11.247 -11.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 10.669 11.637 -10.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 10.918 10.013 -10.537 1.00 0.00 H new ATOM 1607 N HIS A 103 6.103 11.286 -5.477 1.00 0.00 N ATOM 1608 CA HIS A 103 6.219 11.897 -4.158 1.00 0.00 C ATOM 1609 C HIS A 103 6.724 10.889 -3.131 1.00 0.00 C ATOM 1610 O HIS A 103 7.283 11.264 -2.101 1.00 0.00 O ATOM 1611 CB HIS A 103 4.866 12.455 -3.713 1.00 0.00 C ATOM 1612 CG HIS A 103 4.931 13.224 -2.430 1.00 0.00 C ATOM 1613 ND1 HIS A 103 4.953 14.602 -2.378 1.00 0.00 N ATOM 1614 CD2 HIS A 103 4.978 12.800 -1.145 1.00 0.00 C ATOM 1615 CE1 HIS A 103 5.013 14.992 -1.118 1.00 0.00 C ATOM 1616 NE2 HIS A 103 5.028 13.918 -0.350 1.00 0.00 N ATOM 0 H HIS A 103 5.159 11.292 -5.863 1.00 0.00 H new ATOM 0 HA HIS A 103 6.940 12.712 -4.226 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.474 13.103 -4.497 1.00 0.00 H new ATOM 0 HB3 HIS A 103 4.162 11.631 -3.598 1.00 0.00 H new ATOM 0 HD1 HIS A 103 4.927 15.223 -3.187 1.00 0.00 H new ATOM 0 HD2 HIS A 103 4.976 11.774 -0.808 1.00 0.00 H new ATOM 0 HE1 HIS A 103 5.044 16.015 -0.774 1.00 0.00 H new ATOM 1625 N PHE A 104 6.523 9.605 -3.420 1.00 0.00 N ATOM 1626 CA PHE A 104 6.957 8.541 -2.521 1.00 0.00 C ATOM 1627 C PHE A 104 8.397 8.115 -2.810 1.00 0.00 C ATOM 1628 O PHE A 104 8.840 7.062 -2.353 1.00 0.00 O ATOM 1629 CB PHE A 104 6.022 7.336 -2.644 1.00 0.00 C ATOM 1630 CG PHE A 104 4.904 7.336 -1.639 1.00 0.00 C ATOM 1631 CD1 PHE A 104 5.146 7.642 -0.309 1.00 0.00 C ATOM 1632 CD2 PHE A 104 3.609 7.029 -2.027 1.00 0.00 C ATOM 1633 CE1 PHE A 104 4.119 7.642 0.615 1.00 0.00 C ATOM 1634 CE2 PHE A 104 2.577 7.027 -1.107 1.00 0.00 C ATOM 1635 CZ PHE A 104 2.833 7.334 0.216 1.00 0.00 C ATOM 0 H PHE A 104 6.063 9.278 -4.269 1.00 0.00 H new ATOM 0 HA PHE A 104 6.919 8.928 -1.503 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.597 7.318 -3.648 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.604 6.422 -2.527 1.00 0.00 H new ATOM 0 HD1 PHE A 104 6.150 7.883 0.009 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.404 6.789 -3.060 1.00 0.00 H new ATOM 0 HE1 PHE A 104 4.321 7.883 1.648 1.00 0.00 H new ATOM 0 HE2 PHE A 104 1.572 6.786 -1.422 1.00 0.00 H new ATOM 0 HZ PHE A 104 2.029 7.333 0.937 1.00 0.00 H new ATOM 1645 N ASN A 105 9.122 8.938 -3.569 1.00 0.00 N ATOM 1646 CA ASN A 105 10.513 8.651 -3.915 1.00 0.00 C ATOM 1647 C ASN A 105 10.707 7.191 -4.324 1.00 0.00 C ATOM 1648 O ASN A 105 11.666 6.542 -3.906 1.00 0.00 O ATOM 1649 CB ASN A 105 11.433 8.995 -2.741 1.00 0.00 C ATOM 1650 CG ASN A 105 11.212 8.093 -1.542 1.00 0.00 C ATOM 1651 OD1 ASN A 105 11.856 7.052 -1.408 1.00 0.00 O ATOM 1652 ND2 ASN A 105 10.299 8.489 -0.663 1.00 0.00 N ATOM 0 H ASN A 105 8.766 9.812 -3.957 1.00 0.00 H new ATOM 0 HA ASN A 105 10.773 9.273 -4.772 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.471 8.917 -3.063 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.268 10.031 -2.447 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.108 7.923 0.164 1.00 0.00 H new ATOM 0 HD22 ASN A 105 9.789 9.359 -0.814 1.00 0.00 H new ATOM 1659 N VAL A 106 9.797 6.683 -5.149 1.00 0.00 N ATOM 1660 CA VAL A 106 9.880 5.302 -5.614 1.00 0.00 C ATOM 1661 C VAL A 106 10.762 5.199 -6.853 1.00 0.00 C ATOM 1662 O VAL A 106 10.308 5.436 -7.973 1.00 0.00 O ATOM 1663 CB VAL A 106 8.490 4.718 -5.941 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.585 3.216 -6.168 1.00 0.00 C ATOM 1665 CG2 VAL A 106 7.501 5.033 -4.830 1.00 0.00 C ATOM 0 H VAL A 106 8.997 7.204 -5.508 1.00 0.00 H new ATOM 0 HA VAL A 106 10.318 4.725 -4.799 1.00 0.00 H new ATOM 0 HB VAL A 106 8.128 5.182 -6.859 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.596 2.819 -6.398 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.259 3.016 -7.001 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.969 2.736 -5.268 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.527 4.612 -5.080 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.854 4.599 -3.895 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.412 6.114 -4.718 1.00 0.00 H new ATOM 1675 N GLU A 107 12.026 4.843 -6.646 1.00 0.00 N ATOM 1676 CA GLU A 107 12.974 4.708 -7.748 1.00 0.00 C ATOM 1677 C GLU A 107 12.453 3.727 -8.792 1.00 0.00 C ATOM 1678 O GLU A 107 12.594 3.951 -9.995 1.00 0.00 O ATOM 1679 CB GLU A 107 14.334 4.243 -7.225 1.00 0.00 C ATOM 1680 CG GLU A 107 15.395 4.130 -8.308 1.00 0.00 C ATOM 1681 CD GLU A 107 16.794 4.382 -7.782 1.00 0.00 C ATOM 1682 OE1 GLU A 107 17.006 5.433 -7.140 1.00 0.00 O ATOM 1683 OE2 GLU A 107 17.678 3.531 -8.011 1.00 0.00 O ATOM 0 H GLU A 107 12.418 4.643 -5.726 1.00 0.00 H new ATOM 0 HA GLU A 107 13.090 5.684 -8.218 1.00 0.00 H new ATOM 0 HB2 GLU A 107 14.678 4.941 -6.462 1.00 0.00 H new ATOM 0 HB3 GLU A 107 14.216 3.274 -6.741 1.00 0.00 H new ATOM 0 HG2 GLU A 107 15.351 3.135 -8.752 1.00 0.00 H new ATOM 0 HG3 GLU A 107 15.176 4.843 -9.102 1.00 0.00 H new ATOM 1690 N SER A 108 11.849 2.640 -8.325 1.00 0.00 N ATOM 1691 CA SER A 108 11.301 1.624 -9.214 1.00 0.00 C ATOM 1692 C SER A 108 10.668 0.491 -8.418 1.00 0.00 C ATOM 1693 O SER A 108 11.083 0.195 -7.297 1.00 0.00 O ATOM 1694 CB SER A 108 12.392 1.067 -10.131 1.00 0.00 C ATOM 1695 OG SER A 108 13.513 0.630 -9.383 1.00 0.00 O ATOM 0 H SER A 108 11.727 2.440 -7.332 1.00 0.00 H new ATOM 0 HA SER A 108 10.530 2.094 -9.825 1.00 0.00 H new ATOM 0 HB2 SER A 108 11.993 0.236 -10.713 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.701 1.834 -10.841 1.00 0.00 H new ATOM 0 HG SER A 108 14.195 0.277 -9.992 1.00 0.00 H new ATOM 1701 N ILE A 109 9.659 -0.143 -9.006 1.00 0.00 N ATOM 1702 CA ILE A 109 8.966 -1.247 -8.352 1.00 0.00 C ATOM 1703 C ILE A 109 9.773 -2.542 -8.460 1.00 0.00 C ATOM 1704 O ILE A 109 10.622 -2.677 -9.341 1.00 0.00 O ATOM 1705 CB ILE A 109 7.550 -1.461 -8.940 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.549 -1.381 -10.475 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.592 -0.429 -8.367 1.00 0.00 C ATOM 1708 CD1 ILE A 109 8.699 -2.106 -11.142 1.00 0.00 C ATOM 0 H ILE A 109 9.303 0.088 -9.933 1.00 0.00 H new ATOM 0 HA ILE A 109 8.863 -0.980 -7.300 1.00 0.00 H new ATOM 0 HB ILE A 109 7.223 -2.463 -8.661 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.611 -1.793 -10.847 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.576 -0.332 -10.772 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.597 -0.585 -8.785 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.551 -0.533 -7.283 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.940 0.572 -8.622 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.619 -1.997 -12.224 1.00 0.00 H new ATOM 0 HD12 ILE A 109 9.643 -1.680 -10.803 1.00 0.00 H new ATOM 0 HD13 ILE A 109 8.663 -3.163 -10.880 1.00 0.00 H new ATOM 1720 N PRO A 110 9.529 -3.516 -7.561 1.00 0.00 N ATOM 1721 CA PRO A 110 8.531 -3.401 -6.490 1.00 0.00 C ATOM 1722 C PRO A 110 8.991 -2.494 -5.352 1.00 0.00 C ATOM 1723 O PRO A 110 10.188 -2.300 -5.142 1.00 0.00 O ATOM 1724 CB PRO A 110 8.385 -4.841 -5.996 1.00 0.00 C ATOM 1725 CG PRO A 110 9.708 -5.465 -6.271 1.00 0.00 C ATOM 1726 CD PRO A 110 10.220 -4.819 -7.531 1.00 0.00 C ATOM 0 HA PRO A 110 7.602 -2.955 -6.846 1.00 0.00 H new ATOM 0 HB2 PRO A 110 8.144 -4.874 -4.934 1.00 0.00 H new ATOM 0 HB3 PRO A 110 7.584 -5.361 -6.521 1.00 0.00 H new ATOM 0 HG2 PRO A 110 10.396 -5.301 -5.442 1.00 0.00 H new ATOM 0 HG3 PRO A 110 9.612 -6.543 -6.397 1.00 0.00 H new ATOM 0 HD2 PRO A 110 11.303 -4.698 -7.507 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.986 -5.417 -8.412 1.00 0.00 H new ATOM 1734 N THR A 111 8.026 -1.946 -4.620 1.00 0.00 N ATOM 1735 CA THR A 111 8.317 -1.062 -3.498 1.00 0.00 C ATOM 1736 C THR A 111 7.154 -1.061 -2.511 1.00 0.00 C ATOM 1737 O THR A 111 6.028 -1.409 -2.868 1.00 0.00 O ATOM 1738 CB THR A 111 8.592 0.359 -3.996 1.00 0.00 C ATOM 1739 OG1 THR A 111 9.707 0.376 -4.870 1.00 0.00 O ATOM 1740 CG2 THR A 111 8.872 1.345 -2.881 1.00 0.00 C ATOM 0 H THR A 111 7.031 -2.100 -4.785 1.00 0.00 H new ATOM 0 HA THR A 111 9.208 -1.429 -2.988 1.00 0.00 H new ATOM 0 HB THR A 111 7.680 0.665 -4.508 1.00 0.00 H new ATOM 0 HG1 THR A 111 10.080 -0.527 -4.941 1.00 0.00 H new ATOM 0 HG21 THR A 111 9.058 2.331 -3.306 1.00 0.00 H new ATOM 0 HG22 THR A 111 8.011 1.394 -2.214 1.00 0.00 H new ATOM 0 HG23 THR A 111 9.748 1.020 -2.320 1.00 0.00 H new ATOM 1748 N LEU A 112 7.426 -0.659 -1.275 1.00 0.00 N ATOM 1749 CA LEU A 112 6.377 -0.610 -0.249 1.00 0.00 C ATOM 1750 C LEU A 112 6.628 0.537 0.726 1.00 0.00 C ATOM 1751 O LEU A 112 7.735 0.696 1.238 1.00 0.00 O ATOM 1752 CB LEU A 112 6.262 -1.960 0.506 1.00 0.00 C ATOM 1753 CG LEU A 112 5.185 -2.055 1.599 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.920 -1.303 1.239 1.00 0.00 C ATOM 1755 CD2 LEU A 112 4.853 -3.502 1.894 1.00 0.00 C ATOM 0 H LEU A 112 8.349 -0.365 -0.956 1.00 0.00 H new ATOM 0 HA LEU A 112 5.427 -0.430 -0.753 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.072 -2.744 -0.227 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.228 -2.178 0.962 1.00 0.00 H new ATOM 0 HG LEU A 112 5.603 -1.585 2.489 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.194 -1.404 2.046 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.153 -0.249 1.091 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.501 -1.714 0.321 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.089 -3.549 2.670 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.481 -3.982 0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.750 -4.019 2.236 1.00 0.00 H new ATOM 1767 N ILE A 113 5.596 1.340 0.974 1.00 0.00 N ATOM 1768 CA ILE A 113 5.711 2.474 1.883 1.00 0.00 C ATOM 1769 C ILE A 113 4.505 2.567 2.815 1.00 0.00 C ATOM 1770 O ILE A 113 3.421 2.081 2.494 1.00 0.00 O ATOM 1771 CB ILE A 113 5.847 3.796 1.103 1.00 0.00 C ATOM 1772 CG1 ILE A 113 7.024 3.714 0.128 1.00 0.00 C ATOM 1773 CG2 ILE A 113 6.023 4.967 2.062 1.00 0.00 C ATOM 1774 CD1 ILE A 113 7.312 5.015 -0.590 1.00 0.00 C ATOM 0 H ILE A 113 4.672 1.225 0.558 1.00 0.00 H new ATOM 0 HA ILE A 113 6.608 2.312 2.480 1.00 0.00 H new ATOM 0 HB ILE A 113 4.934 3.960 0.531 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.916 3.406 0.674 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.819 2.939 -0.611 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.117 5.892 1.493 1.00 0.00 H new ATOM 0 HG22 ILE A 113 5.156 5.032 2.720 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.922 4.816 2.660 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.158 4.879 -1.263 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.436 5.315 -1.165 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.550 5.789 0.140 1.00 0.00 H new ATOM 1786 N GLY A 114 4.704 3.196 3.972 1.00 0.00 N ATOM 1787 CA GLY A 114 3.627 3.345 4.934 1.00 0.00 C ATOM 1788 C GLY A 114 3.416 4.787 5.351 1.00 0.00 C ATOM 1789 O GLY A 114 4.377 5.530 5.547 1.00 0.00 O ATOM 0 H GLY A 114 5.593 3.605 4.259 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.704 2.956 4.504 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.846 2.744 5.816 1.00 0.00 H new ATOM 1793 N VAL A 115 2.156 5.184 5.492 1.00 0.00 N ATOM 1794 CA VAL A 115 1.823 6.538 5.892 1.00 0.00 C ATOM 1795 C VAL A 115 0.767 6.529 6.991 1.00 0.00 C ATOM 1796 O VAL A 115 0.021 5.562 7.148 1.00 0.00 O ATOM 1797 CB VAL A 115 1.319 7.377 4.700 1.00 0.00 C ATOM 1798 CG1 VAL A 115 2.291 7.286 3.534 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.076 6.937 4.274 1.00 0.00 C ATOM 0 H VAL A 115 1.348 4.581 5.333 1.00 0.00 H new ATOM 0 HA VAL A 115 2.737 6.995 6.271 1.00 0.00 H new ATOM 0 HB VAL A 115 1.260 8.418 5.019 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.919 7.884 2.702 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.266 7.662 3.843 1.00 0.00 H new ATOM 0 HG13 VAL A 115 2.386 6.247 3.219 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.408 7.544 3.432 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.052 5.888 3.978 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.768 7.063 5.107 1.00 0.00 H new ATOM 1809 N ASP A 116 0.711 7.615 7.741 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.253 7.752 8.825 1.00 0.00 C ATOM 1811 C ASP A 116 -1.397 8.668 8.411 1.00 0.00 C ATOM 1812 O ASP A 116 -1.190 9.848 8.132 1.00 0.00 O ATOM 1813 CB ASP A 116 0.429 8.301 10.079 1.00 0.00 C ATOM 1814 CG ASP A 116 0.903 7.201 11.009 1.00 0.00 C ATOM 1815 OD1 ASP A 116 1.812 6.442 10.615 1.00 0.00 O ATOM 1816 OD2 ASP A 116 0.365 7.102 12.132 1.00 0.00 O ATOM 0 H ASP A 116 1.324 8.421 7.620 1.00 0.00 H new ATOM 0 HA ASP A 116 -0.659 6.765 9.048 1.00 0.00 H new ATOM 0 HB2 ASP A 116 1.279 8.917 9.786 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -0.266 8.950 10.613 1.00 0.00 H new ATOM 1821 N ALA A 117 -2.606 8.116 8.367 1.00 0.00 N ATOM 1822 CA ALA A 117 -3.778 8.888 7.978 1.00 0.00 C ATOM 1823 C ALA A 117 -4.092 9.972 9.005 1.00 0.00 C ATOM 1824 O ALA A 117 -4.237 11.144 8.658 1.00 0.00 O ATOM 1825 CB ALA A 117 -4.976 7.970 7.792 1.00 0.00 C ATOM 0 H ALA A 117 -2.798 7.141 8.595 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.559 9.379 7.030 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -5.845 8.560 7.501 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -4.757 7.239 7.014 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.186 7.452 8.728 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.192 9.573 10.268 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.487 10.515 11.343 1.00 0.00 C ATOM 1833 C ASP A 118 -3.381 11.559 11.475 1.00 0.00 C ATOM 1834 O ASP A 118 -3.624 12.678 11.926 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.662 9.770 12.668 1.00 0.00 C ATOM 1836 CG ASP A 118 -5.063 10.693 13.801 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -4.261 11.584 14.154 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -6.178 10.527 14.337 1.00 0.00 O ATOM 0 H ASP A 118 -4.074 8.607 10.573 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.416 11.028 11.096 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -5.419 8.995 12.549 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.730 9.267 12.925 1.00 0.00 H new ATOM 1843 N SER A 119 -2.166 11.185 11.086 1.00 0.00 N ATOM 1844 CA SER A 119 -1.025 12.091 11.167 1.00 0.00 C ATOM 1845 C SER A 119 -1.056 13.118 10.039 1.00 0.00 C ATOM 1846 O SER A 119 -0.817 14.305 10.262 1.00 0.00 O ATOM 1847 CB SER A 119 0.285 11.301 11.115 1.00 0.00 C ATOM 1848 OG SER A 119 1.390 12.124 11.446 1.00 0.00 O ATOM 0 H SER A 119 -1.946 10.262 10.712 1.00 0.00 H new ATOM 0 HA SER A 119 -1.086 12.623 12.117 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.234 10.460 11.806 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.423 10.885 10.117 1.00 0.00 H new ATOM 0 HG SER A 119 2.215 11.596 11.407 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.351 12.656 8.828 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.406 13.551 7.687 1.00 0.00 C ATOM 1856 C GLY A 120 -0.043 13.778 7.060 1.00 0.00 C ATOM 1857 O GLY A 120 0.285 14.897 6.666 1.00 0.00 O ATOM 0 H GLY A 120 -1.553 11.679 8.617 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.083 13.139 6.938 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.822 14.508 8.000 1.00 0.00 H new ATOM 1861 N ASP A 121 0.752 12.717 6.966 1.00 0.00 N ATOM 1862 CA ASP A 121 2.086 12.812 6.382 1.00 0.00 C ATOM 1863 C ASP A 121 2.753 11.440 6.313 1.00 0.00 C ATOM 1864 O ASP A 121 2.291 10.482 6.932 1.00 0.00 O ATOM 1865 CB ASP A 121 2.954 13.773 7.195 1.00 0.00 C ATOM 1866 CG ASP A 121 4.009 14.457 6.348 1.00 0.00 C ATOM 1867 OD1 ASP A 121 3.756 14.671 5.143 1.00 0.00 O ATOM 1868 OD2 ASP A 121 5.088 14.780 6.889 1.00 0.00 O ATOM 0 H ASP A 121 0.497 11.783 7.286 1.00 0.00 H new ATOM 0 HA ASP A 121 1.983 13.196 5.367 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.319 14.528 7.659 1.00 0.00 H new ATOM 0 HB3 ASP A 121 3.440 13.225 8.002 1.00 0.00 H new ATOM 1873 N VAL A 122 3.843 11.356 5.555 1.00 0.00 N ATOM 1874 CA VAL A 122 4.576 10.106 5.403 1.00 0.00 C ATOM 1875 C VAL A 122 5.350 9.764 6.671 1.00 0.00 C ATOM 1876 O VAL A 122 6.015 10.620 7.255 1.00 0.00 O ATOM 1877 CB VAL A 122 5.557 10.176 4.219 1.00 0.00 C ATOM 1878 CG1 VAL A 122 6.157 8.807 3.942 1.00 0.00 C ATOM 1879 CG2 VAL A 122 4.863 10.721 2.980 1.00 0.00 C ATOM 0 H VAL A 122 4.237 12.141 5.036 1.00 0.00 H new ATOM 0 HA VAL A 122 3.839 9.326 5.211 1.00 0.00 H new ATOM 0 HB VAL A 122 6.366 10.857 4.483 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.848 8.876 3.102 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.693 8.459 4.825 1.00 0.00 H new ATOM 0 HG13 VAL A 122 5.361 8.103 3.700 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.573 10.763 2.154 1.00 0.00 H new ATOM 0 HG22 VAL A 122 4.032 10.068 2.712 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.486 11.723 3.185 1.00 0.00 H new ATOM 1889 N VAL A 123 5.254 8.507 7.096 1.00 0.00 N ATOM 1890 CA VAL A 123 5.940 8.053 8.299 1.00 0.00 C ATOM 1891 C VAL A 123 7.135 7.162 7.966 1.00 0.00 C ATOM 1892 O VAL A 123 8.105 7.107 8.720 1.00 0.00 O ATOM 1893 CB VAL A 123 4.986 7.283 9.230 1.00 0.00 C ATOM 1894 CG1 VAL A 123 5.651 7.016 10.572 1.00 0.00 C ATOM 1895 CG2 VAL A 123 3.683 8.048 9.413 1.00 0.00 C ATOM 0 H VAL A 123 4.708 7.786 6.624 1.00 0.00 H new ATOM 0 HA VAL A 123 6.297 8.948 8.808 1.00 0.00 H new ATOM 0 HB VAL A 123 4.753 6.323 8.769 1.00 0.00 H new ATOM 0 HG11 VAL A 123 4.962 6.471 11.217 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.552 6.422 10.420 1.00 0.00 H new ATOM 0 HG13 VAL A 123 5.916 7.963 11.042 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.022 7.488 10.074 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.892 9.024 9.851 1.00 0.00 H new ATOM 0 HG23 VAL A 123 3.200 8.181 8.445 1.00 0.00 H new ATOM 1905 N THR A 124 7.060 6.461 6.837 1.00 0.00 N ATOM 1906 CA THR A 124 8.140 5.573 6.419 1.00 0.00 C ATOM 1907 C THR A 124 8.329 5.636 4.906 1.00 0.00 C ATOM 1908 O THR A 124 7.522 6.235 4.195 1.00 0.00 O ATOM 1909 CB THR A 124 7.865 4.127 6.869 1.00 0.00 C ATOM 1910 OG1 THR A 124 8.016 3.219 5.790 1.00 0.00 O ATOM 1911 CG2 THR A 124 6.480 3.915 7.451 1.00 0.00 C ATOM 0 H THR A 124 6.266 6.491 6.198 1.00 0.00 H new ATOM 0 HA THR A 124 9.060 5.908 6.897 1.00 0.00 H new ATOM 0 HB THR A 124 8.600 3.940 7.652 1.00 0.00 H new ATOM 0 HG1 THR A 124 7.838 2.307 6.102 1.00 0.00 H new ATOM 0 HG21 THR A 124 6.364 2.872 7.744 1.00 0.00 H new ATOM 0 HG22 THR A 124 6.351 4.554 8.325 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.728 4.167 6.703 1.00 0.00 H new ATOM 1919 N THR A 125 9.401 5.016 4.422 1.00 0.00 N ATOM 1920 CA THR A 125 9.696 5.002 2.994 1.00 0.00 C ATOM 1921 C THR A 125 10.590 3.818 2.637 1.00 0.00 C ATOM 1922 O THR A 125 11.558 3.956 1.888 1.00 0.00 O ATOM 1923 CB THR A 125 10.364 6.314 2.581 1.00 0.00 C ATOM 1924 OG1 THR A 125 11.514 6.563 3.369 1.00 0.00 O ATOM 1925 CG2 THR A 125 9.450 7.513 2.710 1.00 0.00 C ATOM 0 H THR A 125 10.079 4.517 4.998 1.00 0.00 H new ATOM 0 HA THR A 125 8.757 4.897 2.450 1.00 0.00 H new ATOM 0 HB THR A 125 10.628 6.187 1.531 1.00 0.00 H new ATOM 0 HG1 THR A 125 11.927 7.406 3.088 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.984 8.412 2.402 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.576 7.374 2.074 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.131 7.618 3.747 1.00 0.00 H new ATOM 1933 N ARG A 126 10.251 2.655 3.180 1.00 0.00 N ATOM 1934 CA ARG A 126 11.008 1.434 2.931 1.00 0.00 C ATOM 1935 C ARG A 126 10.336 0.249 3.617 1.00 0.00 C ATOM 1936 O ARG A 126 10.955 -0.463 4.408 1.00 0.00 O ATOM 1937 CB ARG A 126 12.451 1.584 3.424 1.00 0.00 C ATOM 1938 CG ARG A 126 12.574 2.335 4.741 1.00 0.00 C ATOM 1939 CD ARG A 126 12.223 1.447 5.923 1.00 0.00 C ATOM 1940 NE ARG A 126 12.533 2.089 7.199 1.00 0.00 N ATOM 1941 CZ ARG A 126 13.757 2.155 7.718 1.00 0.00 C ATOM 1942 NH1 ARG A 126 14.788 1.618 7.075 1.00 0.00 N ATOM 1943 NH2 ARG A 126 13.952 2.758 8.883 1.00 0.00 N ATOM 0 H ARG A 126 9.451 2.532 3.800 1.00 0.00 H new ATOM 0 HA ARG A 126 11.029 1.253 1.856 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.891 0.593 3.539 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.033 2.105 2.664 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.592 2.708 4.855 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.915 3.203 4.729 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.162 1.201 5.889 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.771 0.508 5.847 1.00 0.00 H new ATOM 0 HE ARG A 126 11.766 2.511 7.723 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.644 1.152 6.179 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.724 1.671 7.477 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.164 3.171 9.382 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.890 2.808 9.280 1.00 0.00 H new ATOM 1957 N ALA A 127 9.058 0.059 3.314 1.00 0.00 N ATOM 1958 CA ALA A 127 8.276 -1.022 3.902 1.00 0.00 C ATOM 1959 C ALA A 127 8.403 -2.318 3.110 1.00 0.00 C ATOM 1960 O ALA A 127 7.690 -3.285 3.378 1.00 0.00 O ATOM 1961 CB ALA A 127 6.813 -0.609 3.990 1.00 0.00 C ATOM 0 H ALA A 127 8.538 0.644 2.660 1.00 0.00 H new ATOM 0 HA ALA A 127 8.670 -1.209 4.901 1.00 0.00 H new ATOM 0 HB1 ALA A 127 6.232 -1.420 4.430 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.723 0.281 4.612 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.435 -0.393 2.991 1.00 0.00 H new ATOM 1967 N ARG A 128 9.300 -2.340 2.133 1.00 0.00 N ATOM 1968 CA ARG A 128 9.490 -3.533 1.315 1.00 0.00 C ATOM 1969 C ARG A 128 10.057 -4.685 2.143 1.00 0.00 C ATOM 1970 O ARG A 128 9.507 -5.786 2.148 1.00 0.00 O ATOM 1971 CB ARG A 128 10.411 -3.235 0.126 1.00 0.00 C ATOM 1972 CG ARG A 128 11.614 -2.370 0.472 1.00 0.00 C ATOM 1973 CD ARG A 128 12.924 -3.074 0.151 1.00 0.00 C ATOM 1974 NE ARG A 128 13.103 -3.275 -1.286 1.00 0.00 N ATOM 1975 CZ ARG A 128 12.871 -4.426 -1.916 1.00 0.00 C ATOM 1976 NH1 ARG A 128 12.440 -5.489 -1.248 1.00 0.00 N ATOM 1977 NH2 ARG A 128 13.068 -4.513 -3.224 1.00 0.00 N ATOM 0 H ARG A 128 9.903 -1.554 1.888 1.00 0.00 H new ATOM 0 HA ARG A 128 8.513 -3.833 0.935 1.00 0.00 H new ATOM 0 HB2 ARG A 128 10.764 -4.178 -0.292 1.00 0.00 H new ATOM 0 HB3 ARG A 128 9.832 -2.738 -0.652 1.00 0.00 H new ATOM 0 HG2 ARG A 128 11.559 -1.433 -0.082 1.00 0.00 H new ATOM 0 HG3 ARG A 128 11.587 -2.116 1.532 1.00 0.00 H new ATOM 0 HD2 ARG A 128 13.755 -2.487 0.541 1.00 0.00 H new ATOM 0 HD3 ARG A 128 12.950 -4.039 0.658 1.00 0.00 H new ATOM 0 HE ARG A 128 13.426 -2.483 -1.842 1.00 0.00 H new ATOM 0 HH11 ARG A 128 12.283 -5.430 -0.242 1.00 0.00 H new ATOM 0 HH12 ARG A 128 12.266 -6.365 -1.741 1.00 0.00 H new ATOM 0 HH21 ARG A 128 13.396 -3.700 -3.745 1.00 0.00 H new ATOM 0 HH22 ARG A 128 12.891 -5.393 -3.709 1.00 0.00 H new ATOM 1991 N ALA A 129 11.166 -4.428 2.827 1.00 0.00 N ATOM 1992 CA ALA A 129 11.820 -5.442 3.644 1.00 0.00 C ATOM 1993 C ALA A 129 11.222 -5.549 5.045 1.00 0.00 C ATOM 1994 O ALA A 129 11.121 -6.639 5.603 1.00 0.00 O ATOM 1995 CB ALA A 129 13.305 -5.134 3.748 1.00 0.00 C ATOM 0 H ALA A 129 11.633 -3.521 2.831 1.00 0.00 H new ATOM 0 HA ALA A 129 11.662 -6.401 3.152 1.00 0.00 H new ATOM 0 HB1 ALA A 129 13.792 -5.894 4.359 1.00 0.00 H new ATOM 0 HB2 ALA A 129 13.747 -5.132 2.752 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.442 -4.155 4.208 1.00 0.00 H new ATOM 2001 N THR A 130 10.872 -4.410 5.627 1.00 0.00 N ATOM 2002 CA THR A 130 10.345 -4.366 6.971 1.00 0.00 C ATOM 2003 C THR A 130 8.980 -5.023 7.104 1.00 0.00 C ATOM 2004 O THR A 130 8.766 -5.822 8.013 1.00 0.00 O ATOM 2005 CB THR A 130 10.300 -2.919 7.433 1.00 0.00 C ATOM 2006 OG1 THR A 130 9.428 -2.156 6.622 1.00 0.00 O ATOM 2007 CG2 THR A 130 11.660 -2.249 7.411 1.00 0.00 C ATOM 0 H THR A 130 10.948 -3.498 5.177 1.00 0.00 H new ATOM 0 HA THR A 130 11.011 -4.946 7.610 1.00 0.00 H new ATOM 0 HB THR A 130 9.942 -2.953 8.462 1.00 0.00 H new ATOM 0 HG1 THR A 130 8.591 -1.992 7.105 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.563 -1.218 7.751 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.341 -2.786 8.071 1.00 0.00 H new ATOM 0 HG23 THR A 130 12.055 -2.260 6.395 1.00 0.00 H new ATOM 2015 N LEU A 131 8.055 -4.700 6.216 1.00 0.00 N ATOM 2016 CA LEU A 131 6.726 -5.289 6.289 1.00 0.00 C ATOM 2017 C LEU A 131 6.821 -6.811 6.360 1.00 0.00 C ATOM 2018 O LEU A 131 6.017 -7.464 7.024 1.00 0.00 O ATOM 2019 CB LEU A 131 5.886 -4.870 5.078 1.00 0.00 C ATOM 2020 CG LEU A 131 4.604 -5.685 4.862 1.00 0.00 C ATOM 2021 CD1 LEU A 131 3.376 -4.791 4.939 1.00 0.00 C ATOM 2022 CD2 LEU A 131 4.656 -6.413 3.527 1.00 0.00 C ATOM 0 H LEU A 131 8.194 -4.044 5.447 1.00 0.00 H new ATOM 0 HA LEU A 131 6.239 -4.926 7.194 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.616 -3.820 5.188 1.00 0.00 H new ATOM 0 HB3 LEU A 131 6.503 -4.948 4.183 1.00 0.00 H new ATOM 0 HG LEU A 131 4.532 -6.427 5.657 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.479 -5.390 4.783 1.00 0.00 H new ATOM 0 HD12 LEU A 131 3.331 -4.319 5.920 1.00 0.00 H new ATOM 0 HD13 LEU A 131 3.437 -4.022 4.169 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.739 -6.986 3.389 1.00 0.00 H new ATOM 0 HD22 LEU A 131 4.754 -5.687 2.720 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.512 -7.088 3.514 1.00 0.00 H new ATOM 2034 N VAL A 132 7.810 -7.367 5.671 1.00 0.00 N ATOM 2035 CA VAL A 132 8.010 -8.808 5.656 1.00 0.00 C ATOM 2036 C VAL A 132 8.916 -9.278 6.795 1.00 0.00 C ATOM 2037 O VAL A 132 8.591 -10.226 7.509 1.00 0.00 O ATOM 2038 CB VAL A 132 8.581 -9.282 4.300 1.00 0.00 C ATOM 2039 CG1 VAL A 132 9.666 -8.348 3.789 1.00 0.00 C ATOM 2040 CG2 VAL A 132 9.114 -10.701 4.402 1.00 0.00 C ATOM 0 H VAL A 132 8.485 -6.841 5.116 1.00 0.00 H new ATOM 0 HA VAL A 132 7.027 -9.257 5.802 1.00 0.00 H new ATOM 0 HB VAL A 132 7.761 -9.267 3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.042 -8.715 2.834 1.00 0.00 H new ATOM 0 HG12 VAL A 132 9.253 -7.348 3.656 1.00 0.00 H new ATOM 0 HG13 VAL A 132 10.483 -8.310 4.510 1.00 0.00 H new ATOM 0 HG21 VAL A 132 9.510 -11.011 3.435 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.908 -10.739 5.148 1.00 0.00 H new ATOM 0 HG23 VAL A 132 8.307 -11.372 4.696 1.00 0.00 H new ATOM 2050 N LYS A 133 10.063 -8.624 6.940 1.00 0.00 N ATOM 2051 CA LYS A 133 11.036 -8.987 7.971 1.00 0.00 C ATOM 2052 C LYS A 133 10.690 -8.401 9.344 1.00 0.00 C ATOM 2053 O LYS A 133 11.536 -8.376 10.238 1.00 0.00 O ATOM 2054 CB LYS A 133 12.439 -8.538 7.553 1.00 0.00 C ATOM 2055 CG LYS A 133 13.135 -9.517 6.624 1.00 0.00 C ATOM 2056 CD LYS A 133 14.445 -8.954 6.097 1.00 0.00 C ATOM 2057 CE LYS A 133 14.308 -8.475 4.661 1.00 0.00 C ATOM 2058 NZ LYS A 133 14.793 -9.492 3.687 1.00 0.00 N ATOM 0 H LYS A 133 10.345 -7.837 6.356 1.00 0.00 H new ATOM 0 HA LYS A 133 11.006 -10.072 8.067 1.00 0.00 H new ATOM 0 HB2 LYS A 133 12.370 -7.568 7.061 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.049 -8.400 8.446 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.327 -10.450 7.155 1.00 0.00 H new ATOM 0 HG3 LYS A 133 12.478 -9.755 5.787 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.767 -8.126 6.729 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.220 -9.718 6.154 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.263 -8.243 4.454 1.00 0.00 H new ATOM 0 HE3 LYS A 133 14.871 -7.551 4.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 14.682 -9.127 2.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 15.797 -9.695 3.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 14.239 -10.366 3.793 1.00 0.00 H new ATOM 2072 N ASP A 134 9.452 -7.946 9.521 1.00 0.00 N ATOM 2073 CA ASP A 134 9.025 -7.385 10.801 1.00 0.00 C ATOM 2074 C ASP A 134 7.868 -8.194 11.381 1.00 0.00 C ATOM 2075 O ASP A 134 6.711 -7.775 11.317 1.00 0.00 O ATOM 2076 CB ASP A 134 8.611 -5.921 10.642 1.00 0.00 C ATOM 2077 CG ASP A 134 8.360 -5.244 11.975 1.00 0.00 C ATOM 2078 OD1 ASP A 134 9.182 -5.425 12.897 1.00 0.00 O ATOM 2079 OD2 ASP A 134 7.341 -4.532 12.097 1.00 0.00 O ATOM 0 H ASP A 134 8.731 -7.954 8.800 1.00 0.00 H new ATOM 0 HA ASP A 134 9.869 -7.434 11.489 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.391 -5.382 10.105 1.00 0.00 H new ATOM 0 HB3 ASP A 134 7.708 -5.865 10.034 1.00 0.00 H new ATOM 2084 N PRO A 135 8.166 -9.375 11.949 1.00 0.00 N ATOM 2085 CA PRO A 135 7.151 -10.252 12.532 1.00 0.00 C ATOM 2086 C PRO A 135 6.777 -9.872 13.964 1.00 0.00 C ATOM 2087 O PRO A 135 6.081 -10.624 14.647 1.00 0.00 O ATOM 2088 CB PRO A 135 7.837 -11.614 12.507 1.00 0.00 C ATOM 2089 CG PRO A 135 9.284 -11.307 12.691 1.00 0.00 C ATOM 2090 CD PRO A 135 9.519 -9.957 12.057 1.00 0.00 C ATOM 0 HA PRO A 135 6.209 -10.205 11.985 1.00 0.00 H new ATOM 0 HB2 PRO A 135 7.464 -12.261 13.301 1.00 0.00 H new ATOM 0 HB3 PRO A 135 7.658 -12.131 11.564 1.00 0.00 H new ATOM 0 HG2 PRO A 135 9.546 -11.290 13.749 1.00 0.00 H new ATOM 0 HG3 PRO A 135 9.905 -12.070 12.222 1.00 0.00 H new ATOM 0 HD2 PRO A 135 10.173 -9.336 12.669 1.00 0.00 H new ATOM 0 HD3 PRO A 135 9.992 -10.052 11.080 1.00 0.00 H new ATOM 2098 N GLU A 136 7.234 -8.709 14.420 1.00 0.00 N ATOM 2099 CA GLU A 136 6.934 -8.256 15.770 1.00 0.00 C ATOM 2100 C GLU A 136 6.072 -7.000 15.739 1.00 0.00 C ATOM 2101 O GLU A 136 5.340 -6.717 16.688 1.00 0.00 O ATOM 2102 CB GLU A 136 8.230 -7.979 16.534 1.00 0.00 C ATOM 2103 CG GLU A 136 9.207 -9.143 16.512 1.00 0.00 C ATOM 2104 CD GLU A 136 8.864 -10.212 17.532 1.00 0.00 C ATOM 2105 OE1 GLU A 136 8.784 -9.882 18.733 1.00 0.00 O ATOM 2106 OE2 GLU A 136 8.676 -11.379 17.128 1.00 0.00 O ATOM 0 H GLU A 136 7.811 -8.068 13.876 1.00 0.00 H new ATOM 0 HA GLU A 136 6.380 -9.044 16.280 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.714 -7.101 16.107 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.988 -7.738 17.569 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.216 -9.586 15.516 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.213 -8.771 16.705 1.00 0.00 H new ATOM 2113 N GLY A 137 6.168 -6.242 14.649 1.00 0.00 N ATOM 2114 CA GLY A 137 5.397 -5.021 14.531 1.00 0.00 C ATOM 2115 C GLY A 137 5.656 -4.079 15.688 1.00 0.00 C ATOM 2116 O GLY A 137 4.827 -3.228 16.007 1.00 0.00 O ATOM 0 H GLY A 137 6.765 -6.453 13.849 1.00 0.00 H new ATOM 0 HA2 GLY A 137 5.646 -4.523 13.594 1.00 0.00 H new ATOM 0 HA3 GLY A 137 4.335 -5.264 14.491 1.00 0.00 H new ATOM 2120 N GLU A 138 6.814 -4.243 16.323 1.00 0.00 N ATOM 2121 CA GLU A 138 7.184 -3.407 17.463 1.00 0.00 C ATOM 2122 C GLU A 138 7.593 -2.001 17.022 1.00 0.00 C ATOM 2123 O GLU A 138 7.672 -1.088 17.842 1.00 0.00 O ATOM 2124 CB GLU A 138 8.305 -4.063 18.284 1.00 0.00 C ATOM 2125 CG GLU A 138 9.603 -4.293 17.522 1.00 0.00 C ATOM 2126 CD GLU A 138 10.829 -4.102 18.394 1.00 0.00 C ATOM 2127 OE1 GLU A 138 10.823 -3.174 19.230 1.00 0.00 O ATOM 2128 OE2 GLU A 138 11.793 -4.881 18.242 1.00 0.00 O ATOM 0 H GLU A 138 7.510 -4.944 16.069 1.00 0.00 H new ATOM 0 HA GLU A 138 6.302 -3.313 18.096 1.00 0.00 H new ATOM 0 HB2 GLU A 138 8.515 -3.437 19.151 1.00 0.00 H new ATOM 0 HB3 GLU A 138 7.947 -5.021 18.662 1.00 0.00 H new ATOM 0 HG2 GLU A 138 9.606 -5.303 17.112 1.00 0.00 H new ATOM 0 HG3 GLU A 138 9.651 -3.606 16.677 1.00 0.00 H new ATOM 2135 N GLN A 139 7.846 -1.826 15.725 1.00 0.00 N ATOM 2136 CA GLN A 139 8.236 -0.532 15.189 1.00 0.00 C ATOM 2137 C GLN A 139 7.498 -0.259 13.890 1.00 0.00 C ATOM 2138 O GLN A 139 8.009 0.444 13.027 1.00 0.00 O ATOM 2139 CB GLN A 139 9.739 -0.503 14.908 1.00 0.00 C ATOM 2140 CG GLN A 139 10.555 -1.498 15.713 1.00 0.00 C ATOM 2141 CD GLN A 139 11.936 -0.976 16.056 1.00 0.00 C ATOM 2142 OE1 GLN A 139 12.946 -1.518 15.609 1.00 0.00 O ATOM 2143 NE2 GLN A 139 11.987 0.083 16.855 1.00 0.00 N ATOM 0 H GLN A 139 7.786 -2.569 15.029 1.00 0.00 H new ATOM 0 HA GLN A 139 7.984 0.229 15.927 1.00 0.00 H new ATOM 0 HB2 GLN A 139 9.900 -0.696 13.847 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.113 0.501 15.110 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.023 -1.739 16.633 1.00 0.00 H new ATOM 0 HG3 GLN A 139 10.651 -2.425 15.148 1.00 0.00 H new ATOM 0 HE21 GLN A 139 11.124 0.501 17.203 1.00 0.00 H new ATOM 0 HE22 GLN A 139 12.889 0.478 17.121 1.00 0.00 H new ATOM 2152 N PHE A 140 6.313 -0.849 13.746 1.00 0.00 N ATOM 2153 CA PHE A 140 5.509 -0.714 12.529 1.00 0.00 C ATOM 2154 C PHE A 140 5.707 0.601 11.783 1.00 0.00 C ATOM 2155 O PHE A 140 5.905 0.574 10.567 1.00 0.00 O ATOM 2156 CB PHE A 140 4.035 -1.000 12.799 1.00 0.00 C ATOM 2157 CG PHE A 140 3.411 -0.143 13.864 1.00 0.00 C ATOM 2158 CD1 PHE A 140 3.731 -0.324 15.202 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.497 0.844 13.526 1.00 0.00 C ATOM 2160 CE1 PHE A 140 3.152 0.463 16.179 1.00 0.00 C ATOM 2161 CE2 PHE A 140 1.916 1.633 14.500 1.00 0.00 C ATOM 2162 CZ PHE A 140 2.244 1.442 15.828 1.00 0.00 C ATOM 0 H PHE A 140 5.883 -1.432 14.465 1.00 0.00 H new ATOM 0 HA PHE A 140 5.886 -1.478 11.849 1.00 0.00 H new ATOM 0 HB2 PHE A 140 3.478 -0.866 11.872 1.00 0.00 H new ATOM 0 HB3 PHE A 140 3.929 -2.046 13.086 1.00 0.00 H new ATOM 0 HD1 PHE A 140 4.440 -1.088 15.483 1.00 0.00 H new ATOM 0 HD2 PHE A 140 2.236 0.998 12.489 1.00 0.00 H new ATOM 0 HE1 PHE A 140 3.410 0.312 17.217 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.206 2.398 14.223 1.00 0.00 H new ATOM 0 HZ PHE A 140 1.791 2.058 16.591 1.00 0.00 H new ATOM 2172 N PRO A 141 5.703 1.769 12.444 1.00 0.00 N ATOM 2173 CA PRO A 141 5.937 3.025 11.729 1.00 0.00 C ATOM 2174 C PRO A 141 7.333 3.052 11.091 1.00 0.00 C ATOM 2175 O PRO A 141 7.730 4.062 10.514 1.00 0.00 O ATOM 2176 CB PRO A 141 5.819 4.093 12.821 1.00 0.00 C ATOM 2177 CG PRO A 141 6.080 3.363 14.094 1.00 0.00 C ATOM 2178 CD PRO A 141 5.516 1.986 13.893 1.00 0.00 C ATOM 0 HA PRO A 141 5.235 3.174 10.909 1.00 0.00 H new ATOM 0 HB2 PRO A 141 6.541 4.896 12.670 1.00 0.00 H new ATOM 0 HB3 PRO A 141 4.830 4.550 12.822 1.00 0.00 H new ATOM 0 HG2 PRO A 141 7.148 3.322 14.310 1.00 0.00 H new ATOM 0 HG3 PRO A 141 5.603 3.863 14.937 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.046 1.241 14.486 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.465 1.933 14.179 1.00 0.00 H new ATOM 2186 N TRP A 142 8.061 1.922 11.214 1.00 0.00 N ATOM 2187 CA TRP A 142 9.424 1.755 10.679 1.00 0.00 C ATOM 2188 C TRP A 142 9.984 3.040 10.078 1.00 0.00 C ATOM 2189 O TRP A 142 10.252 3.118 8.878 1.00 0.00 O ATOM 2190 CB TRP A 142 9.461 0.627 9.640 1.00 0.00 C ATOM 2191 CG TRP A 142 8.528 -0.509 9.946 1.00 0.00 C ATOM 2192 CD1 TRP A 142 8.466 -1.247 11.099 1.00 0.00 C ATOM 2193 CD2 TRP A 142 7.523 -1.041 9.076 1.00 0.00 C ATOM 2194 NE1 TRP A 142 7.464 -2.184 11.003 1.00 0.00 N ATOM 2195 CE2 TRP A 142 6.878 -2.084 9.768 1.00 0.00 C ATOM 2196 CE3 TRP A 142 7.102 -0.733 7.780 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 5.836 -2.816 9.209 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 6.068 -1.463 7.225 1.00 0.00 C ATOM 2199 CH2 TRP A 142 5.446 -2.494 7.939 1.00 0.00 C ATOM 0 H TRP A 142 7.713 1.092 11.694 1.00 0.00 H new ATOM 0 HA TRP A 142 10.060 1.492 11.524 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.210 1.038 8.662 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.478 0.241 9.572 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.109 -1.113 11.956 1.00 0.00 H new ATOM 0 HE1 TRP A 142 7.200 -2.846 11.733 1.00 0.00 H new ATOM 0 HE3 TRP A 142 7.576 0.061 7.222 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 5.352 -3.610 9.758 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 5.734 -1.234 6.224 1.00 0.00 H new ATOM 0 HH2 TRP A 142 4.641 -3.047 7.477 1.00 0.00 H new ATOM 2210 N LYS A 143 10.158 4.045 10.926 1.00 0.00 N ATOM 2211 CA LYS A 143 10.687 5.334 10.492 1.00 0.00 C ATOM 2212 C LYS A 143 12.209 5.363 10.600 1.00 0.00 C ATOM 2213 O LYS A 143 12.834 4.369 10.968 1.00 0.00 O ATOM 2214 CB LYS A 143 10.080 6.464 11.324 1.00 0.00 C ATOM 2215 CG LYS A 143 10.462 6.411 12.796 1.00 0.00 C ATOM 2216 CD LYS A 143 9.267 6.687 13.694 1.00 0.00 C ATOM 2217 CE LYS A 143 9.095 8.175 13.950 1.00 0.00 C ATOM 2218 NZ LYS A 143 8.042 8.770 13.081 1.00 0.00 N ATOM 0 H LYS A 143 9.940 3.993 11.921 1.00 0.00 H new ATOM 0 HA LYS A 143 10.414 5.477 9.446 1.00 0.00 H new ATOM 0 HB2 LYS A 143 10.398 7.420 10.909 1.00 0.00 H new ATOM 0 HB3 LYS A 143 8.994 6.424 11.238 1.00 0.00 H new ATOM 0 HG2 LYS A 143 10.875 5.430 13.030 1.00 0.00 H new ATOM 0 HG3 LYS A 143 11.245 7.143 12.996 1.00 0.00 H new ATOM 0 HD2 LYS A 143 8.364 6.289 13.232 1.00 0.00 H new ATOM 0 HD3 LYS A 143 9.395 6.166 14.643 1.00 0.00 H new ATOM 0 HE2 LYS A 143 8.836 8.336 14.996 1.00 0.00 H new ATOM 0 HE3 LYS A 143 10.042 8.685 13.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 7.956 9.786 13.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 8.301 8.639 12.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 7.133 8.301 13.267 1.00 0.00 H new