USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 982 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 SER OG : rot -29:sc= 0.382 USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.553 USER MOD Single : A 8 THR OG1 : rot -90:sc= -1.46 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -3.99! C(o=-4!,f=-3.9!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -112:sc= 0.119 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -3.16! C(o=-3.2!,f=-3.4!) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.19 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.0739 X(o=-0.074,f=-0.39) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 52 ASN : amide:sc= -5.15! C(o=-5.1!,f=-13!) USER MOD Single : A 55 LYS NZ :NH3+ -146:sc= -0.0386 (180deg=-0.699) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 30:sc= 0 USER MOD Single : A 63 ASN : amide:sc= -0.117 X(o=-0.12,f=0) USER MOD Single : A 64 SER OG : rot 103:sc= 1.13 USER MOD Single : B 5 SER OG : rot -34:sc= 0.358 USER MOD Single : B 7 THR OG1 : rot 180:sc= -0.493 USER MOD Single : B 8 THR OG1 : rot -90:sc= -1.45 USER MOD Single : B 14 TYR OH : rot 180:sc= 0 USER MOD Single : B 23 HIS : no HD1:sc= -4.17! C(o=-4.2!,f=-4.1!) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 29 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot 25:sc= 0.21! USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 ASN : amide:sc= -3.23! C(o=-3.2!,f=-3.4!) USER MOD Single : B 43 THR OG1 : rot 180:sc= -0.0857 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 ASN : amide:sc= 0.0852 X(o=0.085,f=0.27) USER MOD Single : B 48 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : B 52 ASN : amide:sc= -5.24! C(o=-5.2!,f=-13!) USER MOD Single : B 55 LYS NZ :NH3+ -115:sc= 0 (180deg=-0.669) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 TYR OH : rot 30:sc= 0 USER MOD Single : B 63 ASN : amide:sc= -0.109 X(o=-0.11,f=0) USER MOD Single : B 64 SER OG : rot 118:sc= 1.13 USER MOD ----------------------------------------------------------------- ATOM 58 N SER A 5 12.453 -6.358 -3.399 1.00 0.00 N ATOM 59 CA SER A 5 13.267 -5.131 -3.615 1.00 0.00 C ATOM 60 C SER A 5 12.641 -4.306 -4.739 1.00 0.00 C ATOM 61 O SER A 5 13.317 -3.872 -5.652 1.00 0.00 O ATOM 62 CB SER A 5 14.692 -5.528 -4.010 1.00 0.00 C ATOM 63 OG SER A 5 14.645 -6.563 -4.981 1.00 0.00 O ATOM 0 HA SER A 5 13.295 -4.543 -2.698 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.224 -4.664 -4.409 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.244 -5.864 -3.132 1.00 0.00 H new ATOM 0 HG SER A 5 13.831 -7.093 -4.855 1.00 0.00 H new ATOM 69 N ASP A 6 11.353 -4.091 -4.688 1.00 0.00 N ATOM 70 CA ASP A 6 10.702 -3.302 -5.768 1.00 0.00 C ATOM 71 C ASP A 6 9.264 -2.943 -5.375 1.00 0.00 C ATOM 72 O ASP A 6 8.944 -2.800 -4.212 1.00 0.00 O ATOM 73 CB ASP A 6 10.714 -4.128 -7.058 1.00 0.00 C ATOM 74 CG ASP A 6 9.803 -5.350 -6.906 1.00 0.00 C ATOM 75 OD1 ASP A 6 10.262 -6.342 -6.364 1.00 0.00 O ATOM 76 OD2 ASP A 6 8.662 -5.271 -7.331 1.00 0.00 O ATOM 0 H ASP A 6 10.731 -4.425 -3.952 1.00 0.00 H new ATOM 0 HA ASP A 6 11.250 -2.373 -5.924 1.00 0.00 H new ATOM 0 HB2 ASP A 6 10.378 -3.516 -7.895 1.00 0.00 H new ATOM 0 HB3 ASP A 6 11.731 -4.448 -7.285 1.00 0.00 H new ATOM 81 N THR A 7 8.403 -2.762 -6.343 1.00 0.00 N ATOM 82 CA THR A 7 7.004 -2.375 -6.032 1.00 0.00 C ATOM 83 C THR A 7 6.264 -3.542 -5.378 1.00 0.00 C ATOM 84 O THR A 7 6.790 -4.627 -5.237 1.00 0.00 O ATOM 85 CB THR A 7 6.286 -1.952 -7.324 1.00 0.00 C ATOM 86 OG1 THR A 7 4.886 -1.907 -7.108 1.00 0.00 O ATOM 87 CG2 THR A 7 6.591 -2.950 -8.444 1.00 0.00 C ATOM 0 H THR A 7 8.613 -2.867 -7.336 1.00 0.00 H new ATOM 0 HA THR A 7 7.014 -1.537 -5.336 1.00 0.00 H new ATOM 0 HB THR A 7 6.641 -0.963 -7.613 1.00 0.00 H new ATOM 0 HG1 THR A 7 4.436 -1.635 -7.935 1.00 0.00 H new ATOM 0 HG21 THR A 7 6.078 -2.642 -9.355 1.00 0.00 H new ATOM 0 HG22 THR A 7 7.666 -2.978 -8.624 1.00 0.00 H new ATOM 0 HG23 THR A 7 6.247 -3.942 -8.151 1.00 0.00 H new ATOM 95 N THR A 8 5.044 -3.318 -4.967 1.00 0.00 N ATOM 96 CA THR A 8 4.262 -4.395 -4.308 1.00 0.00 C ATOM 97 C THR A 8 2.762 -4.106 -4.491 1.00 0.00 C ATOM 98 O THR A 8 2.245 -3.182 -3.896 1.00 0.00 O ATOM 99 CB THR A 8 4.603 -4.412 -2.815 1.00 0.00 C ATOM 100 OG1 THR A 8 5.988 -4.147 -2.647 1.00 0.00 O ATOM 101 CG2 THR A 8 4.272 -5.783 -2.220 1.00 0.00 C ATOM 0 H THR A 8 4.556 -2.428 -5.062 1.00 0.00 H new ATOM 0 HA THR A 8 4.504 -5.362 -4.750 1.00 0.00 H new ATOM 0 HB THR A 8 4.016 -3.649 -2.303 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.486 -4.991 -2.658 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.517 -5.788 -1.158 1.00 0.00 H new ATOM 0 HG22 THR A 8 3.209 -5.988 -2.348 1.00 0.00 H new ATOM 0 HG23 THR A 8 4.854 -6.551 -2.730 1.00 0.00 H new ATOM 109 N PRO A 9 2.100 -4.901 -5.307 1.00 0.00 N ATOM 110 CA PRO A 9 0.663 -4.719 -5.560 1.00 0.00 C ATOM 111 C PRO A 9 -0.093 -4.743 -4.232 1.00 0.00 C ATOM 112 O PRO A 9 -0.467 -5.786 -3.733 1.00 0.00 O ATOM 113 CB PRO A 9 0.271 -5.909 -6.448 1.00 0.00 C ATOM 114 CG PRO A 9 1.562 -6.723 -6.736 1.00 0.00 C ATOM 115 CD PRO A 9 2.718 -6.032 -6.024 1.00 0.00 C ATOM 0 HA PRO A 9 0.427 -3.770 -6.041 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -0.471 -6.532 -5.949 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.178 -5.561 -7.378 1.00 0.00 H new ATOM 0 HG2 PRO A 9 1.454 -7.748 -6.382 1.00 0.00 H new ATOM 0 HG3 PRO A 9 1.750 -6.774 -7.808 1.00 0.00 H new ATOM 0 HD2 PRO A 9 3.219 -6.711 -5.334 1.00 0.00 H new ATOM 0 HD3 PRO A 9 3.470 -5.687 -6.734 1.00 0.00 H new ATOM 123 N CYS A 10 -0.296 -3.594 -3.647 1.00 0.00 N ATOM 124 CA CYS A 10 -1.000 -3.526 -2.338 1.00 0.00 C ATOM 125 C CYS A 10 -2.114 -2.498 -2.398 1.00 0.00 C ATOM 126 O CYS A 10 -1.949 -1.413 -2.913 1.00 0.00 O ATOM 127 CB CYS A 10 -0.003 -3.088 -1.269 1.00 0.00 C ATOM 128 SG CYS A 10 0.509 -4.496 -0.256 1.00 0.00 S ATOM 0 H CYS A 10 -0.001 -2.693 -4.024 1.00 0.00 H new ATOM 0 HA CYS A 10 -1.418 -4.505 -2.105 1.00 0.00 H new ATOM 0 HB2 CYS A 10 0.870 -2.637 -1.742 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -0.453 -2.323 -0.636 1.00 0.00 H new ATOM 133 N CYS A 11 -3.241 -2.819 -1.844 1.00 0.00 N ATOM 134 CA CYS A 11 -4.358 -1.844 -1.849 1.00 0.00 C ATOM 135 C CYS A 11 -4.193 -0.918 -0.632 1.00 0.00 C ATOM 136 O CYS A 11 -3.685 -1.316 0.396 1.00 0.00 O ATOM 137 CB CYS A 11 -5.722 -2.592 -1.882 1.00 0.00 C ATOM 138 SG CYS A 11 -6.817 -2.154 -0.498 1.00 0.00 S ATOM 0 H CYS A 11 -3.438 -3.710 -1.389 1.00 0.00 H new ATOM 0 HA CYS A 11 -4.340 -1.223 -2.745 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -6.228 -2.369 -2.821 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -5.540 -3.667 -1.866 1.00 0.00 H new ATOM 143 N PHE A 12 -4.614 0.312 -0.742 1.00 0.00 N ATOM 144 CA PHE A 12 -4.470 1.247 0.407 1.00 0.00 C ATOM 145 C PHE A 12 -5.810 1.370 1.138 1.00 0.00 C ATOM 146 O PHE A 12 -5.999 0.818 2.204 1.00 0.00 O ATOM 147 CB PHE A 12 -4.030 2.623 -0.109 1.00 0.00 C ATOM 148 CG PHE A 12 -3.998 3.620 1.030 1.00 0.00 C ATOM 149 CD1 PHE A 12 -3.518 3.229 2.301 1.00 0.00 C ATOM 150 CD2 PHE A 12 -4.463 4.938 0.827 1.00 0.00 C ATOM 151 CE1 PHE A 12 -3.505 4.155 3.368 1.00 0.00 C ATOM 152 CE2 PHE A 12 -4.448 5.866 1.894 1.00 0.00 C ATOM 153 CZ PHE A 12 -3.969 5.473 3.164 1.00 0.00 C ATOM 0 H PHE A 12 -5.050 0.708 -1.575 1.00 0.00 H new ATOM 0 HA PHE A 12 -3.719 0.864 1.099 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.043 2.550 -0.566 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -4.716 2.966 -0.884 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -3.161 2.222 2.456 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -4.830 5.237 -0.144 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -3.140 3.855 4.339 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -4.802 6.874 1.738 1.00 0.00 H new ATOM 0 HZ PHE A 12 -3.958 6.181 3.979 1.00 0.00 H new ATOM 163 N ALA A 13 -6.737 2.093 0.577 1.00 0.00 N ATOM 164 CA ALA A 13 -8.059 2.254 1.245 1.00 0.00 C ATOM 165 C ALA A 13 -9.084 1.363 0.566 1.00 0.00 C ATOM 166 O ALA A 13 -8.996 1.079 -0.612 1.00 0.00 O ATOM 167 CB ALA A 13 -8.507 3.714 1.156 1.00 0.00 C ATOM 0 H ALA A 13 -6.638 2.579 -0.314 1.00 0.00 H new ATOM 0 HA ALA A 13 -7.970 1.969 2.293 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -9.474 3.828 1.645 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -7.773 4.351 1.650 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -8.594 4.005 0.109 1.00 0.00 H new ATOM 173 N TYR A 14 -10.060 0.910 1.302 1.00 0.00 N ATOM 174 CA TYR A 14 -11.083 0.030 0.683 1.00 0.00 C ATOM 175 C TYR A 14 -12.401 0.791 0.538 1.00 0.00 C ATOM 176 O TYR A 14 -12.729 1.651 1.330 1.00 0.00 O ATOM 177 CB TYR A 14 -11.298 -1.254 1.504 1.00 0.00 C ATOM 178 CG TYR A 14 -10.838 -1.072 2.931 1.00 0.00 C ATOM 179 CD1 TYR A 14 -9.458 -1.099 3.237 1.00 0.00 C ATOM 180 CD2 TYR A 14 -11.786 -0.863 3.954 1.00 0.00 C ATOM 181 CE1 TYR A 14 -9.029 -0.915 4.568 1.00 0.00 C ATOM 182 CE2 TYR A 14 -11.357 -0.677 5.286 1.00 0.00 C ATOM 183 CZ TYR A 14 -9.977 -0.702 5.594 1.00 0.00 C ATOM 184 OH TYR A 14 -9.557 -0.526 6.896 1.00 0.00 O ATOM 0 H TYR A 14 -10.191 1.109 2.294 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.723 -0.265 -0.302 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -12.354 -1.525 1.491 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -10.752 -2.078 1.045 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -8.733 -1.260 2.453 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -12.840 -0.845 3.718 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -7.975 -0.937 4.803 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -12.082 -0.516 6.070 1.00 0.00 H new ATOM 0 HH TYR A 14 -10.336 -0.390 7.475 1.00 0.00 H new ATOM 194 N ILE A 15 -13.151 0.485 -0.486 1.00 0.00 N ATOM 195 CA ILE A 15 -14.441 1.193 -0.709 1.00 0.00 C ATOM 196 C ILE A 15 -15.552 0.538 0.116 1.00 0.00 C ATOM 197 O ILE A 15 -15.542 -0.652 0.360 1.00 0.00 O ATOM 198 CB ILE A 15 -14.801 1.116 -2.195 1.00 0.00 C ATOM 199 CG1 ILE A 15 -16.111 1.863 -2.445 1.00 0.00 C ATOM 200 CG2 ILE A 15 -14.965 -0.350 -2.605 1.00 0.00 C ATOM 201 CD1 ILE A 15 -16.205 2.240 -3.925 1.00 0.00 C ATOM 0 H ILE A 15 -12.924 -0.228 -1.179 1.00 0.00 H new ATOM 0 HA ILE A 15 -14.338 2.234 -0.401 1.00 0.00 H new ATOM 0 HB ILE A 15 -14.005 1.573 -2.784 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -16.958 1.238 -2.163 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -16.155 2.759 -1.826 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -15.221 -0.405 -3.663 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -14.031 -0.884 -2.430 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -15.760 -0.806 -2.015 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -17.138 2.773 -4.106 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -15.364 2.880 -4.192 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -16.180 1.336 -4.533 1.00 0.00 H new ATOM 213 N ALA A 16 -16.517 1.312 0.538 1.00 0.00 N ATOM 214 CA ALA A 16 -17.639 0.744 1.336 1.00 0.00 C ATOM 215 C ALA A 16 -18.812 0.446 0.401 1.00 0.00 C ATOM 216 O ALA A 16 -19.673 1.276 0.184 1.00 0.00 O ATOM 217 CB ALA A 16 -18.072 1.757 2.397 1.00 0.00 C ATOM 0 H ALA A 16 -16.575 2.315 0.363 1.00 0.00 H new ATOM 0 HA ALA A 16 -17.318 -0.175 1.827 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -18.893 1.343 2.982 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -17.232 1.976 3.056 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -18.400 2.676 1.911 1.00 0.00 H new ATOM 223 N ARG A 17 -18.847 -0.730 -0.162 1.00 0.00 N ATOM 224 CA ARG A 17 -19.955 -1.085 -1.093 1.00 0.00 C ATOM 225 C ARG A 17 -19.648 -2.450 -1.733 1.00 0.00 C ATOM 226 O ARG A 17 -18.774 -2.541 -2.573 1.00 0.00 O ATOM 227 CB ARG A 17 -20.057 -0.024 -2.192 1.00 0.00 C ATOM 228 CG ARG A 17 -21.495 0.494 -2.271 1.00 0.00 C ATOM 229 CD ARG A 17 -21.801 0.929 -3.706 1.00 0.00 C ATOM 230 NE ARG A 17 -21.196 2.267 -3.960 1.00 0.00 N ATOM 231 CZ ARG A 17 -21.354 2.845 -5.118 1.00 0.00 C ATOM 232 NH1 ARG A 17 -22.432 3.540 -5.358 1.00 0.00 N ATOM 233 NH2 ARG A 17 -20.434 2.727 -6.036 1.00 0.00 N ATOM 0 H ARG A 17 -18.153 -1.463 -0.017 1.00 0.00 H new ATOM 0 HA ARG A 17 -20.897 -1.132 -0.546 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -19.374 0.799 -1.982 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -19.759 -0.449 -3.151 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -22.191 -0.285 -1.959 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -21.629 1.333 -1.589 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -21.404 0.199 -4.411 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -22.879 0.970 -3.863 1.00 0.00 H new ATOM 0 HE ARG A 17 -20.658 2.731 -3.228 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -23.151 3.631 -4.640 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -22.556 3.992 -6.264 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -19.592 2.183 -5.847 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -20.557 3.179 -6.942 1.00 0.00 H new ATOM 247 N PRO A 18 -20.361 -3.483 -1.323 1.00 0.00 N ATOM 248 CA PRO A 18 -20.143 -4.832 -1.870 1.00 0.00 C ATOM 249 C PRO A 18 -20.224 -4.820 -3.395 1.00 0.00 C ATOM 250 O PRO A 18 -21.291 -4.805 -3.976 1.00 0.00 O ATOM 251 CB PRO A 18 -21.261 -5.691 -1.262 1.00 0.00 C ATOM 252 CG PRO A 18 -22.067 -4.794 -0.288 1.00 0.00 C ATOM 253 CD PRO A 18 -21.431 -3.398 -0.307 1.00 0.00 C ATOM 0 HA PRO A 18 -19.155 -5.220 -1.624 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -21.909 -6.085 -2.045 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -20.841 -6.548 -0.735 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -23.113 -4.742 -0.592 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -22.048 -5.210 0.720 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -22.163 -2.634 -0.567 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -21.028 -3.134 0.671 1.00 0.00 H new ATOM 261 N LEU A 19 -19.092 -4.829 -4.045 1.00 0.00 N ATOM 262 CA LEU A 19 -19.078 -4.823 -5.533 1.00 0.00 C ATOM 263 C LEU A 19 -19.875 -6.035 -6.050 1.00 0.00 C ATOM 264 O LEU A 19 -19.570 -7.153 -5.685 1.00 0.00 O ATOM 265 CB LEU A 19 -17.630 -4.937 -6.025 1.00 0.00 C ATOM 266 CG LEU A 19 -16.752 -3.860 -5.379 1.00 0.00 C ATOM 267 CD1 LEU A 19 -15.358 -3.896 -6.010 1.00 0.00 C ATOM 268 CD2 LEU A 19 -17.365 -2.475 -5.600 1.00 0.00 C ATOM 0 H LEU A 19 -18.172 -4.840 -3.605 1.00 0.00 H new ATOM 0 HA LEU A 19 -19.524 -3.898 -5.900 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -17.236 -5.925 -5.787 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -17.600 -4.835 -7.110 1.00 0.00 H new ATOM 0 HG LEU A 19 -16.683 -4.055 -4.309 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -14.731 -3.131 -5.552 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -14.910 -4.876 -5.848 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -15.438 -3.707 -7.080 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -16.732 -1.719 -5.136 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -17.442 -2.278 -6.669 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -18.358 -2.441 -5.152 1.00 0.00 H new ATOM 280 N PRO A 20 -20.868 -5.803 -6.888 1.00 0.00 N ATOM 281 CA PRO A 20 -21.676 -6.906 -7.437 1.00 0.00 C ATOM 282 C PRO A 20 -20.777 -7.884 -8.196 1.00 0.00 C ATOM 283 O PRO A 20 -20.053 -7.505 -9.093 1.00 0.00 O ATOM 284 CB PRO A 20 -22.671 -6.230 -8.394 1.00 0.00 C ATOM 285 CG PRO A 20 -22.440 -4.700 -8.310 1.00 0.00 C ATOM 286 CD PRO A 20 -21.264 -4.457 -7.352 1.00 0.00 C ATOM 0 HA PRO A 20 -22.185 -7.478 -6.661 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -22.521 -6.584 -9.414 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -23.696 -6.478 -8.118 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -22.220 -4.292 -9.296 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -23.337 -4.197 -7.949 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -20.439 -3.955 -7.858 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -21.559 -3.822 -6.517 1.00 0.00 H new ATOM 294 N ARG A 21 -20.812 -9.140 -7.839 1.00 0.00 N ATOM 295 CA ARG A 21 -19.951 -10.144 -8.534 1.00 0.00 C ATOM 296 C ARG A 21 -20.113 -10.015 -10.051 1.00 0.00 C ATOM 297 O ARG A 21 -19.225 -10.348 -10.810 1.00 0.00 O ATOM 298 CB ARG A 21 -20.355 -11.552 -8.096 1.00 0.00 C ATOM 299 CG ARG A 21 -19.218 -12.530 -8.404 1.00 0.00 C ATOM 300 CD ARG A 21 -19.379 -13.070 -9.827 1.00 0.00 C ATOM 301 NE ARG A 21 -19.739 -14.514 -9.772 1.00 0.00 N ATOM 302 CZ ARG A 21 -20.125 -15.132 -10.854 1.00 0.00 C ATOM 303 NH1 ARG A 21 -19.309 -15.245 -11.866 1.00 0.00 N ATOM 304 NH2 ARG A 21 -21.325 -15.640 -10.924 1.00 0.00 N ATOM 0 H ARG A 21 -21.400 -9.516 -7.095 1.00 0.00 H new ATOM 0 HA ARG A 21 -18.909 -9.963 -8.271 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -20.578 -11.562 -7.029 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -21.263 -11.859 -8.615 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -18.255 -12.029 -8.301 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -19.228 -13.352 -7.689 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -20.152 -12.511 -10.354 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -18.452 -12.936 -10.385 1.00 0.00 H new ATOM 0 HE ARG A 21 -19.684 -15.020 -8.888 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -18.370 -14.850 -11.811 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -19.610 -15.728 -12.712 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -21.962 -15.554 -10.132 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -21.626 -16.123 -11.771 1.00 0.00 H new ATOM 318 N ALA A 22 -21.238 -9.532 -10.502 1.00 0.00 N ATOM 319 CA ALA A 22 -21.445 -9.383 -11.970 1.00 0.00 C ATOM 320 C ALA A 22 -20.544 -8.264 -12.493 1.00 0.00 C ATOM 321 O ALA A 22 -19.888 -8.404 -13.506 1.00 0.00 O ATOM 322 CB ALA A 22 -22.908 -9.036 -12.250 1.00 0.00 C ATOM 0 H ALA A 22 -22.021 -9.235 -9.919 1.00 0.00 H new ATOM 0 HA ALA A 22 -21.196 -10.318 -12.471 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -23.057 -8.927 -13.324 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -23.549 -9.833 -11.873 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -23.162 -8.100 -11.752 1.00 0.00 H new ATOM 328 N HIS A 23 -20.504 -7.155 -11.807 1.00 0.00 N ATOM 329 CA HIS A 23 -19.644 -6.030 -12.263 1.00 0.00 C ATOM 330 C HIS A 23 -18.172 -6.399 -12.076 1.00 0.00 C ATOM 331 O HIS A 23 -17.301 -5.843 -12.717 1.00 0.00 O ATOM 332 CB HIS A 23 -19.947 -4.780 -11.434 1.00 0.00 C ATOM 333 CG HIS A 23 -21.397 -4.406 -11.579 1.00 0.00 C ATOM 334 ND1 HIS A 23 -21.871 -3.147 -11.232 1.00 0.00 N ATOM 335 CD2 HIS A 23 -22.491 -5.114 -12.015 1.00 0.00 C ATOM 336 CE1 HIS A 23 -23.192 -3.133 -11.455 1.00 0.00 C ATOM 337 NE2 HIS A 23 -23.622 -4.310 -11.933 1.00 0.00 N ATOM 0 H HIS A 23 -21.030 -6.980 -10.951 1.00 0.00 H new ATOM 0 HA HIS A 23 -19.846 -5.834 -13.316 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -19.713 -4.964 -10.385 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -19.315 -3.954 -11.762 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -22.475 -6.135 -12.366 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -23.830 -2.281 -11.273 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -24.578 -4.562 -12.184 1.00 0.00 H new ATOM 345 N ILE A 24 -17.878 -7.324 -11.200 1.00 0.00 N ATOM 346 CA ILE A 24 -16.455 -7.699 -10.984 1.00 0.00 C ATOM 347 C ILE A 24 -16.050 -8.790 -11.980 1.00 0.00 C ATOM 348 O ILE A 24 -16.886 -9.423 -12.595 1.00 0.00 O ATOM 349 CB ILE A 24 -16.243 -8.219 -9.563 1.00 0.00 C ATOM 350 CG1 ILE A 24 -16.865 -7.249 -8.556 1.00 0.00 C ATOM 351 CG2 ILE A 24 -14.741 -8.348 -9.290 1.00 0.00 C ATOM 352 CD1 ILE A 24 -16.659 -7.788 -7.138 1.00 0.00 C ATOM 0 H ILE A 24 -18.557 -7.830 -10.631 1.00 0.00 H new ATOM 0 HA ILE A 24 -15.841 -6.811 -11.133 1.00 0.00 H new ATOM 0 HB ILE A 24 -16.720 -9.194 -9.460 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -16.408 -6.264 -8.653 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -17.929 -7.128 -8.760 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -14.586 -8.719 -8.277 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -14.300 -9.045 -10.003 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -14.267 -7.372 -9.396 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -17.101 -7.099 -6.419 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -17.137 -8.763 -7.047 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -15.592 -7.886 -6.938 1.00 0.00 H new ATOM 364 N LYS A 25 -14.775 -9.022 -12.139 1.00 0.00 N ATOM 365 CA LYS A 25 -14.320 -10.079 -13.088 1.00 0.00 C ATOM 366 C LYS A 25 -13.446 -11.100 -12.344 1.00 0.00 C ATOM 367 O LYS A 25 -13.409 -12.266 -12.687 1.00 0.00 O ATOM 368 CB LYS A 25 -13.505 -9.440 -14.217 1.00 0.00 C ATOM 369 CG LYS A 25 -14.409 -8.536 -15.060 1.00 0.00 C ATOM 370 CD LYS A 25 -13.900 -8.513 -16.504 1.00 0.00 C ATOM 371 CE LYS A 25 -14.735 -9.473 -17.355 1.00 0.00 C ATOM 372 NZ LYS A 25 -13.875 -10.078 -18.412 1.00 0.00 N ATOM 0 H LYS A 25 -14.028 -8.525 -11.653 1.00 0.00 H new ATOM 0 HA LYS A 25 -15.190 -10.583 -13.508 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -12.682 -8.860 -13.800 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -13.064 -10.215 -14.844 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -15.436 -8.900 -15.030 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -14.417 -7.526 -14.649 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.965 -7.502 -16.907 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.850 -8.802 -16.535 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -15.162 -10.255 -16.727 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -15.569 -8.940 -17.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.442 -10.730 -18.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.488 -9.326 -19.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.094 -10.600 -17.967 1.00 0.00 H new ATOM 386 N GLU A 26 -12.733 -10.666 -11.337 1.00 0.00 N ATOM 387 CA GLU A 26 -11.848 -11.590 -10.574 1.00 0.00 C ATOM 388 C GLU A 26 -11.502 -10.918 -9.240 1.00 0.00 C ATOM 389 O GLU A 26 -12.172 -9.992 -8.822 1.00 0.00 O ATOM 390 CB GLU A 26 -10.563 -11.872 -11.386 1.00 0.00 C ATOM 391 CG GLU A 26 -10.211 -10.687 -12.297 1.00 0.00 C ATOM 392 CD GLU A 26 -10.582 -11.022 -13.744 1.00 0.00 C ATOM 393 OE1 GLU A 26 -11.353 -11.946 -13.940 1.00 0.00 O ATOM 394 OE2 GLU A 26 -10.094 -10.341 -14.633 1.00 0.00 O ATOM 0 H GLU A 26 -12.728 -9.700 -11.009 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.350 -12.540 -10.392 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.735 -12.069 -10.705 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.700 -12.770 -11.989 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.745 -9.794 -11.972 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.146 -10.465 -12.226 1.00 0.00 H new ATOM 401 N TYR A 27 -10.458 -11.338 -8.570 1.00 0.00 N ATOM 402 CA TYR A 27 -10.096 -10.678 -7.294 1.00 0.00 C ATOM 403 C TYR A 27 -8.623 -10.930 -7.012 1.00 0.00 C ATOM 404 O TYR A 27 -7.952 -11.609 -7.765 1.00 0.00 O ATOM 405 CB TYR A 27 -10.959 -11.228 -6.152 1.00 0.00 C ATOM 406 CG TYR A 27 -10.664 -12.696 -5.944 1.00 0.00 C ATOM 407 CD1 TYR A 27 -9.566 -13.090 -5.145 1.00 0.00 C ATOM 408 CD2 TYR A 27 -11.484 -13.677 -6.548 1.00 0.00 C ATOM 409 CE1 TYR A 27 -9.287 -14.460 -4.952 1.00 0.00 C ATOM 410 CE2 TYR A 27 -11.203 -15.048 -6.355 1.00 0.00 C ATOM 411 CZ TYR A 27 -10.105 -15.440 -5.558 1.00 0.00 C ATOM 412 OH TYR A 27 -9.828 -16.778 -5.374 1.00 0.00 O ATOM 0 H TYR A 27 -9.849 -12.105 -8.855 1.00 0.00 H new ATOM 0 HA TYR A 27 -10.275 -9.605 -7.370 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -10.759 -10.675 -5.235 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -12.015 -11.090 -6.384 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -8.940 -12.342 -4.682 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -12.325 -13.378 -7.157 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -8.448 -14.759 -4.341 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -11.829 -15.797 -6.817 1.00 0.00 H new ATOM 0 HH TYR A 27 -10.487 -17.318 -5.858 1.00 0.00 H new ATOM 422 N PHE A 28 -8.103 -10.388 -5.947 1.00 0.00 N ATOM 423 CA PHE A 28 -6.669 -10.614 -5.664 1.00 0.00 C ATOM 424 C PHE A 28 -6.407 -10.516 -4.158 1.00 0.00 C ATOM 425 O PHE A 28 -5.968 -9.498 -3.663 1.00 0.00 O ATOM 426 CB PHE A 28 -5.834 -9.563 -6.417 1.00 0.00 C ATOM 427 CG PHE A 28 -4.390 -9.605 -5.959 1.00 0.00 C ATOM 428 CD1 PHE A 28 -3.540 -10.652 -6.382 1.00 0.00 C ATOM 429 CD2 PHE A 28 -3.898 -8.601 -5.095 1.00 0.00 C ATOM 430 CE1 PHE A 28 -2.197 -10.692 -5.942 1.00 0.00 C ATOM 431 CE2 PHE A 28 -2.556 -8.642 -4.655 1.00 0.00 C ATOM 432 CZ PHE A 28 -1.705 -9.686 -5.079 1.00 0.00 C ATOM 0 H PHE A 28 -8.603 -9.808 -5.273 1.00 0.00 H new ATOM 0 HA PHE A 28 -6.385 -11.611 -6.000 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -5.887 -9.748 -7.490 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -6.248 -8.569 -6.244 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -3.916 -11.421 -7.041 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -4.548 -7.802 -4.771 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.547 -11.491 -6.265 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -2.181 -7.875 -3.994 1.00 0.00 H new ATOM 0 HZ PHE A 28 -0.679 -9.716 -4.744 1.00 0.00 H new ATOM 442 N TYR A 29 -6.652 -11.568 -3.428 1.00 0.00 N ATOM 443 CA TYR A 29 -6.394 -11.516 -1.964 1.00 0.00 C ATOM 444 C TYR A 29 -4.910 -11.247 -1.731 1.00 0.00 C ATOM 445 O TYR A 29 -4.050 -11.883 -2.305 1.00 0.00 O ATOM 446 CB TYR A 29 -6.778 -12.850 -1.325 1.00 0.00 C ATOM 447 CG TYR A 29 -6.479 -12.815 0.155 1.00 0.00 C ATOM 448 CD1 TYR A 29 -6.974 -11.759 0.949 1.00 0.00 C ATOM 449 CD2 TYR A 29 -5.702 -13.838 0.742 1.00 0.00 C ATOM 450 CE1 TYR A 29 -6.691 -11.723 2.334 1.00 0.00 C ATOM 451 CE2 TYR A 29 -5.421 -13.805 2.126 1.00 0.00 C ATOM 452 CZ TYR A 29 -5.914 -12.746 2.922 1.00 0.00 C ATOM 453 OH TYR A 29 -5.642 -12.716 4.274 1.00 0.00 O ATOM 0 H TYR A 29 -7.017 -12.454 -3.779 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.989 -10.721 -1.515 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -7.837 -13.049 -1.486 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -6.226 -13.662 -1.798 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.569 -10.978 0.499 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -5.323 -14.645 0.133 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -7.069 -10.914 2.942 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -4.830 -14.589 2.576 1.00 0.00 H new ATOM 0 HH TYR A 29 -5.097 -13.494 4.515 1.00 0.00 H new ATOM 463 N THR A 30 -4.610 -10.306 -0.891 1.00 0.00 N ATOM 464 CA THR A 30 -3.181 -9.983 -0.611 1.00 0.00 C ATOM 465 C THR A 30 -2.735 -10.703 0.663 1.00 0.00 C ATOM 466 O THR A 30 -3.434 -10.721 1.656 1.00 0.00 O ATOM 467 CB THR A 30 -3.022 -8.472 -0.425 1.00 0.00 C ATOM 468 OG1 THR A 30 -3.713 -8.065 0.745 1.00 0.00 O ATOM 469 CG2 THR A 30 -3.602 -7.745 -1.641 1.00 0.00 C ATOM 0 H THR A 30 -5.290 -9.742 -0.382 1.00 0.00 H new ATOM 0 HA THR A 30 -2.566 -10.311 -1.449 1.00 0.00 H new ATOM 0 HB THR A 30 -1.965 -8.226 -0.326 1.00 0.00 H new ATOM 0 HG1 THR A 30 -4.482 -7.511 0.495 1.00 0.00 H new ATOM 0 HG21 THR A 30 -3.489 -6.669 -1.509 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.071 -8.058 -2.540 1.00 0.00 H new ATOM 0 HG23 THR A 30 -4.660 -7.989 -1.741 1.00 0.00 H new ATOM 477 N SER A 31 -1.574 -11.298 0.642 1.00 0.00 N ATOM 478 CA SER A 31 -1.082 -12.016 1.850 1.00 0.00 C ATOM 479 C SER A 31 -0.965 -11.032 3.013 1.00 0.00 C ATOM 480 O SER A 31 -1.202 -11.373 4.155 1.00 0.00 O ATOM 481 CB SER A 31 0.292 -12.621 1.559 1.00 0.00 C ATOM 482 OG SER A 31 0.173 -14.031 1.451 1.00 0.00 O ATOM 0 H SER A 31 -0.945 -11.318 -0.161 1.00 0.00 H new ATOM 0 HA SER A 31 -1.782 -12.810 2.111 1.00 0.00 H new ATOM 0 HB2 SER A 31 0.695 -12.207 0.635 1.00 0.00 H new ATOM 0 HB3 SER A 31 0.991 -12.364 2.355 1.00 0.00 H new ATOM 0 HG SER A 31 1.053 -14.420 1.263 1.00 0.00 H new ATOM 488 N GLY A 32 -0.591 -9.814 2.732 1.00 0.00 N ATOM 489 CA GLY A 32 -0.449 -8.807 3.820 1.00 0.00 C ATOM 490 C GLY A 32 1.035 -8.492 4.015 1.00 0.00 C ATOM 491 O GLY A 32 1.623 -8.836 5.022 1.00 0.00 O ATOM 0 H GLY A 32 -0.378 -9.473 1.795 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.997 -7.899 3.567 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -0.878 -9.190 4.746 1.00 0.00 H new ATOM 495 N LYS A 33 1.647 -7.852 3.055 1.00 0.00 N ATOM 496 CA LYS A 33 3.095 -7.530 3.183 1.00 0.00 C ATOM 497 C LYS A 33 3.285 -6.024 3.389 1.00 0.00 C ATOM 498 O LYS A 33 4.248 -5.591 3.991 1.00 0.00 O ATOM 499 CB LYS A 33 3.827 -7.958 1.907 1.00 0.00 C ATOM 500 CG LYS A 33 3.606 -9.451 1.656 1.00 0.00 C ATOM 501 CD LYS A 33 4.921 -10.090 1.199 1.00 0.00 C ATOM 502 CE LYS A 33 4.633 -11.410 0.482 1.00 0.00 C ATOM 503 NZ LYS A 33 5.494 -12.483 1.053 1.00 0.00 N ATOM 0 H LYS A 33 1.207 -7.539 2.190 1.00 0.00 H new ATOM 0 HA LYS A 33 3.501 -8.064 4.042 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.464 -7.380 1.057 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.893 -7.750 2.002 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.250 -9.935 2.565 1.00 0.00 H new ATOM 0 HG3 LYS A 33 2.837 -9.594 0.897 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.453 -9.412 0.532 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.569 -10.266 2.058 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.582 -11.675 0.593 1.00 0.00 H new ATOM 0 HE3 LYS A 33 4.824 -11.305 -0.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.299 -13.381 0.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 6.495 -12.230 0.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 5.291 -12.588 2.067 1.00 0.00 H new ATOM 517 N CYS A 34 2.392 -5.217 2.884 1.00 0.00 N ATOM 518 CA CYS A 34 2.557 -3.741 3.050 1.00 0.00 C ATOM 519 C CYS A 34 1.706 -3.250 4.219 1.00 0.00 C ATOM 520 O CYS A 34 1.277 -2.116 4.239 1.00 0.00 O ATOM 521 CB CYS A 34 2.108 -2.988 1.786 1.00 0.00 C ATOM 522 SG CYS A 34 2.380 -3.971 0.287 1.00 0.00 S ATOM 0 H CYS A 34 1.562 -5.510 2.368 1.00 0.00 H new ATOM 0 HA CYS A 34 3.614 -3.547 3.234 1.00 0.00 H new ATOM 0 HB2 CYS A 34 1.051 -2.736 1.869 1.00 0.00 H new ATOM 0 HB3 CYS A 34 2.655 -2.048 1.709 1.00 0.00 H new ATOM 527 N SER A 35 1.449 -4.076 5.191 1.00 0.00 N ATOM 528 CA SER A 35 0.620 -3.612 6.341 1.00 0.00 C ATOM 529 C SER A 35 -0.786 -3.256 5.843 1.00 0.00 C ATOM 530 O SER A 35 -1.508 -2.514 6.479 1.00 0.00 O ATOM 531 CB SER A 35 1.262 -2.362 6.953 1.00 0.00 C ATOM 532 OG SER A 35 1.787 -2.671 8.233 1.00 0.00 O ATOM 0 H SER A 35 1.772 -5.042 5.242 1.00 0.00 H new ATOM 0 HA SER A 35 0.558 -4.403 7.089 1.00 0.00 H new ATOM 0 HB2 SER A 35 2.056 -1.994 6.303 1.00 0.00 H new ATOM 0 HB3 SER A 35 0.523 -1.565 7.035 1.00 0.00 H new ATOM 0 HG SER A 35 2.198 -1.870 8.620 1.00 0.00 H new ATOM 538 N ASN A 36 -1.176 -3.770 4.707 1.00 0.00 N ATOM 539 CA ASN A 36 -2.529 -3.449 4.167 1.00 0.00 C ATOM 540 C ASN A 36 -3.239 -4.744 3.743 1.00 0.00 C ATOM 541 O ASN A 36 -3.548 -4.917 2.581 1.00 0.00 O ATOM 542 CB ASN A 36 -2.380 -2.528 2.952 1.00 0.00 C ATOM 543 CG ASN A 36 -2.437 -1.065 3.401 1.00 0.00 C ATOM 544 OD1 ASN A 36 -1.851 -0.203 2.776 1.00 0.00 O ATOM 545 ND2 ASN A 36 -3.129 -0.744 4.459 1.00 0.00 N ATOM 0 H ASN A 36 -0.616 -4.398 4.130 1.00 0.00 H new ATOM 0 HA ASN A 36 -3.119 -2.952 4.937 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.435 -2.727 2.447 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -3.174 -2.728 2.232 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -3.178 0.229 4.761 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -3.621 -1.466 4.985 1.00 0.00 H new ATOM 552 N PRO A 37 -3.490 -5.618 4.697 1.00 0.00 N ATOM 553 CA PRO A 37 -4.176 -6.892 4.415 1.00 0.00 C ATOM 554 C PRO A 37 -5.570 -6.613 3.846 1.00 0.00 C ATOM 555 O PRO A 37 -6.326 -5.835 4.393 1.00 0.00 O ATOM 556 CB PRO A 37 -4.280 -7.593 5.779 1.00 0.00 C ATOM 557 CG PRO A 37 -3.617 -6.672 6.836 1.00 0.00 C ATOM 558 CD PRO A 37 -3.116 -5.414 6.113 1.00 0.00 C ATOM 0 HA PRO A 37 -3.646 -7.502 3.684 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.323 -7.779 6.035 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.781 -8.562 5.750 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.333 -6.406 7.614 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -2.790 -7.186 7.326 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.578 -4.514 6.519 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.038 -5.296 6.224 1.00 0.00 H new ATOM 566 N ALA A 38 -5.918 -7.228 2.745 1.00 0.00 N ATOM 567 CA ALA A 38 -7.261 -6.969 2.155 1.00 0.00 C ATOM 568 C ALA A 38 -7.514 -7.917 0.987 1.00 0.00 C ATOM 569 O ALA A 38 -6.886 -8.947 0.855 1.00 0.00 O ATOM 570 CB ALA A 38 -7.313 -5.521 1.654 1.00 0.00 C ATOM 0 H ALA A 38 -5.335 -7.892 2.235 1.00 0.00 H new ATOM 0 HA ALA A 38 -8.026 -7.132 2.914 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -8.293 -5.321 1.220 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -7.140 -4.841 2.488 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -6.543 -5.370 0.897 1.00 0.00 H new ATOM 576 N VAL A 39 -8.422 -7.554 0.132 1.00 0.00 N ATOM 577 CA VAL A 39 -8.734 -8.384 -1.050 1.00 0.00 C ATOM 578 C VAL A 39 -8.916 -7.392 -2.176 1.00 0.00 C ATOM 579 O VAL A 39 -9.490 -6.336 -1.982 1.00 0.00 O ATOM 580 CB VAL A 39 -9.990 -9.241 -0.772 1.00 0.00 C ATOM 581 CG1 VAL A 39 -11.249 -8.683 -1.457 1.00 0.00 C ATOM 582 CG2 VAL A 39 -9.739 -10.671 -1.253 1.00 0.00 C ATOM 0 H VAL A 39 -8.971 -6.698 0.207 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.954 -9.101 -1.304 1.00 0.00 H new ATOM 0 HB VAL A 39 -10.171 -9.221 0.303 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.101 -9.323 -1.229 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.445 -7.674 -1.093 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -11.095 -8.656 -2.536 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -10.622 -11.280 -1.059 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.531 -10.664 -2.323 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.885 -11.090 -0.720 1.00 0.00 H new ATOM 592 N VAL A 40 -8.383 -7.667 -3.317 1.00 0.00 N ATOM 593 CA VAL A 40 -8.485 -6.659 -4.396 1.00 0.00 C ATOM 594 C VAL A 40 -9.250 -7.170 -5.598 1.00 0.00 C ATOM 595 O VAL A 40 -8.787 -7.995 -6.356 1.00 0.00 O ATOM 596 CB VAL A 40 -7.076 -6.237 -4.775 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.092 -5.316 -5.988 1.00 0.00 C ATOM 598 CG2 VAL A 40 -6.498 -5.476 -3.594 1.00 0.00 C ATOM 0 H VAL A 40 -7.889 -8.528 -3.552 1.00 0.00 H new ATOM 0 HA VAL A 40 -9.053 -5.803 -4.032 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.483 -7.118 -5.020 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -6.071 -5.028 -6.240 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.541 -5.836 -6.834 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.675 -4.424 -5.760 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -5.483 -5.155 -3.829 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -7.116 -4.602 -3.387 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -6.480 -6.124 -2.717 1.00 0.00 H new ATOM 608 N PHE A 41 -10.418 -6.644 -5.787 1.00 0.00 N ATOM 609 CA PHE A 41 -11.230 -7.060 -6.933 1.00 0.00 C ATOM 610 C PHE A 41 -10.739 -6.411 -8.209 1.00 0.00 C ATOM 611 O PHE A 41 -10.316 -5.275 -8.245 1.00 0.00 O ATOM 612 CB PHE A 41 -12.691 -6.666 -6.706 1.00 0.00 C ATOM 613 CG PHE A 41 -13.317 -7.570 -5.674 1.00 0.00 C ATOM 614 CD1 PHE A 41 -13.392 -8.964 -5.900 1.00 0.00 C ATOM 615 CD2 PHE A 41 -13.887 -7.012 -4.510 1.00 0.00 C ATOM 616 CE1 PHE A 41 -14.030 -9.798 -4.953 1.00 0.00 C ATOM 617 CE2 PHE A 41 -14.535 -7.843 -3.572 1.00 0.00 C ATOM 618 CZ PHE A 41 -14.607 -9.236 -3.793 1.00 0.00 C ATOM 0 H PHE A 41 -10.843 -5.937 -5.187 1.00 0.00 H new ATOM 0 HA PHE A 41 -11.145 -8.142 -7.031 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -12.749 -5.629 -6.375 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -13.244 -6.733 -7.643 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -12.963 -9.391 -6.794 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -13.827 -5.948 -4.337 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -14.076 -10.865 -5.117 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -14.976 -7.414 -2.685 1.00 0.00 H new ATOM 0 HZ PHE A 41 -15.103 -9.872 -3.075 1.00 0.00 H new ATOM 628 N VAL A 42 -10.836 -7.151 -9.258 1.00 0.00 N ATOM 629 CA VAL A 42 -10.440 -6.665 -10.601 1.00 0.00 C ATOM 630 C VAL A 42 -11.752 -6.700 -11.421 1.00 0.00 C ATOM 631 O VAL A 42 -12.092 -7.700 -12.019 1.00 0.00 O ATOM 632 CB VAL A 42 -9.378 -7.598 -11.209 1.00 0.00 C ATOM 633 CG1 VAL A 42 -8.066 -6.833 -11.306 1.00 0.00 C ATOM 634 CG2 VAL A 42 -9.138 -8.831 -10.333 1.00 0.00 C ATOM 0 H VAL A 42 -11.186 -8.109 -9.246 1.00 0.00 H new ATOM 0 HA VAL A 42 -9.998 -5.669 -10.581 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.733 -7.927 -12.186 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -7.299 -7.478 -11.735 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.201 -5.958 -11.942 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -7.756 -6.514 -10.311 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.382 -9.465 -10.796 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -8.794 -8.516 -9.348 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -10.068 -9.391 -10.230 1.00 0.00 H new ATOM 644 N THR A 43 -12.539 -5.653 -11.343 1.00 0.00 N ATOM 645 CA THR A 43 -13.903 -5.647 -11.997 1.00 0.00 C ATOM 646 C THR A 43 -13.896 -5.311 -13.499 1.00 0.00 C ATOM 647 O THR A 43 -12.978 -5.657 -14.204 1.00 0.00 O ATOM 648 CB THR A 43 -14.793 -4.638 -11.248 1.00 0.00 C ATOM 649 OG1 THR A 43 -14.473 -3.320 -11.671 1.00 0.00 O ATOM 650 CG2 THR A 43 -14.576 -4.754 -9.735 1.00 0.00 C ATOM 0 H THR A 43 -12.300 -4.792 -10.852 1.00 0.00 H new ATOM 0 HA THR A 43 -14.287 -6.665 -11.930 1.00 0.00 H new ATOM 0 HB THR A 43 -15.837 -4.855 -11.472 1.00 0.00 H new ATOM 0 HG1 THR A 43 -15.040 -2.677 -11.196 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.212 -4.034 -9.220 1.00 0.00 H new ATOM 0 HG22 THR A 43 -14.830 -5.762 -9.407 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.532 -4.548 -9.500 1.00 0.00 H new ATOM 658 N ARG A 44 -14.978 -4.687 -13.979 1.00 0.00 N ATOM 659 CA ARG A 44 -15.137 -4.334 -15.434 1.00 0.00 C ATOM 660 C ARG A 44 -14.222 -3.161 -15.789 1.00 0.00 C ATOM 661 O ARG A 44 -14.650 -2.066 -16.063 1.00 0.00 O ATOM 662 CB ARG A 44 -16.578 -3.896 -15.676 1.00 0.00 C ATOM 663 CG ARG A 44 -16.951 -2.846 -14.623 1.00 0.00 C ATOM 664 CD ARG A 44 -17.550 -1.618 -15.305 1.00 0.00 C ATOM 665 NE ARG A 44 -18.740 -2.025 -16.098 1.00 0.00 N ATOM 666 CZ ARG A 44 -19.937 -1.858 -15.608 1.00 0.00 C ATOM 667 NH1 ARG A 44 -20.127 -1.903 -14.317 1.00 0.00 N ATOM 668 NH2 ARG A 44 -20.943 -1.638 -16.409 1.00 0.00 N ATOM 0 H ARG A 44 -15.768 -4.407 -13.398 1.00 0.00 H new ATOM 0 HA ARG A 44 -14.882 -5.201 -16.043 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -16.685 -3.481 -16.678 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -17.250 -4.752 -15.612 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -17.666 -3.265 -13.916 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -16.068 -2.561 -14.052 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -17.833 -0.876 -14.559 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -16.809 -1.151 -15.954 1.00 0.00 H new ATOM 0 HE ARG A 44 -18.620 -2.434 -17.024 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -19.339 -2.069 -13.691 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -21.063 -1.772 -13.934 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -20.793 -1.597 -17.417 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -21.880 -1.507 -16.027 1.00 0.00 H new ATOM 682 N LYS A 45 -12.980 -3.418 -15.760 1.00 0.00 N ATOM 683 CA LYS A 45 -11.908 -2.422 -16.031 1.00 0.00 C ATOM 684 C LYS A 45 -10.660 -3.095 -15.469 1.00 0.00 C ATOM 685 O LYS A 45 -9.581 -3.029 -16.017 1.00 0.00 O ATOM 686 CB LYS A 45 -12.164 -1.095 -15.304 1.00 0.00 C ATOM 687 CG LYS A 45 -10.981 -0.155 -15.552 1.00 0.00 C ATOM 688 CD LYS A 45 -11.063 0.399 -16.977 1.00 0.00 C ATOM 689 CE LYS A 45 -9.809 1.223 -17.283 1.00 0.00 C ATOM 690 NZ LYS A 45 -10.192 2.646 -17.503 1.00 0.00 N ATOM 0 H LYS A 45 -12.617 -4.347 -15.544 1.00 0.00 H new ATOM 0 HA LYS A 45 -11.837 -2.168 -17.089 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.088 -0.641 -15.663 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -12.289 -1.269 -14.235 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -10.994 0.662 -14.831 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -10.042 -0.690 -15.411 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -11.155 -0.419 -17.691 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -11.953 1.019 -17.086 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -9.102 1.149 -16.457 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -9.309 0.829 -18.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -9.341 3.206 -17.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -10.852 2.708 -18.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -10.651 3.018 -16.647 1.00 0.00 H new ATOM 704 N ASN A 46 -10.870 -3.812 -14.387 1.00 0.00 N ATOM 705 CA ASN A 46 -9.817 -4.604 -13.741 1.00 0.00 C ATOM 706 C ASN A 46 -8.848 -3.744 -12.997 1.00 0.00 C ATOM 707 O ASN A 46 -7.792 -4.204 -12.607 1.00 0.00 O ATOM 708 CB ASN A 46 -9.093 -5.456 -14.779 1.00 0.00 C ATOM 709 CG ASN A 46 -9.477 -6.926 -14.601 1.00 0.00 C ATOM 710 OD1 ASN A 46 -10.637 -7.246 -14.428 1.00 0.00 O ATOM 711 ND2 ASN A 46 -8.547 -7.840 -14.644 1.00 0.00 N ATOM 0 H ASN A 46 -11.775 -3.870 -13.920 1.00 0.00 H new ATOM 0 HA ASN A 46 -10.293 -5.258 -13.010 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -9.353 -5.122 -15.783 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -8.015 -5.337 -14.673 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.793 -8.824 -14.532 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.574 -7.571 -14.789 1.00 0.00 H new ATOM 718 N ARG A 47 -9.228 -2.538 -12.671 1.00 0.00 N ATOM 719 CA ARG A 47 -8.331 -1.744 -11.797 1.00 0.00 C ATOM 720 C ARG A 47 -8.249 -2.615 -10.559 1.00 0.00 C ATOM 721 O ARG A 47 -9.124 -3.439 -10.364 1.00 0.00 O ATOM 722 CB ARG A 47 -8.945 -0.387 -11.448 1.00 0.00 C ATOM 723 CG ARG A 47 -9.092 0.461 -12.710 1.00 0.00 C ATOM 724 CD ARG A 47 -8.017 1.549 -12.718 1.00 0.00 C ATOM 725 NE ARG A 47 -8.657 2.880 -12.520 1.00 0.00 N ATOM 726 CZ ARG A 47 -8.003 3.836 -11.917 1.00 0.00 C ATOM 727 NH1 ARG A 47 -7.773 3.762 -10.635 1.00 0.00 N ATOM 728 NH2 ARG A 47 -7.584 4.868 -12.597 1.00 0.00 N ATOM 0 H ARG A 47 -10.093 -2.083 -12.963 1.00 0.00 H new ATOM 0 HA ARG A 47 -7.369 -1.519 -12.257 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -9.919 -0.529 -10.980 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -8.316 0.130 -10.724 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.997 -0.166 -13.596 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.083 0.913 -12.744 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -7.289 1.362 -11.928 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.474 1.532 -13.663 1.00 0.00 H new ATOM 0 HE ARG A 47 -9.606 3.044 -12.856 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.104 2.957 -10.103 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -7.262 4.509 -10.165 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.767 4.927 -13.599 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.073 5.615 -12.127 1.00 0.00 H new ATOM 742 N GLN A 48 -7.237 -2.540 -9.772 1.00 0.00 N ATOM 743 CA GLN A 48 -7.205 -3.471 -8.635 1.00 0.00 C ATOM 744 C GLN A 48 -7.970 -2.860 -7.481 1.00 0.00 C ATOM 745 O GLN A 48 -7.431 -2.424 -6.493 1.00 0.00 O ATOM 746 CB GLN A 48 -5.772 -3.816 -8.304 1.00 0.00 C ATOM 747 CG GLN A 48 -5.466 -5.147 -8.989 1.00 0.00 C ATOM 748 CD GLN A 48 -4.020 -5.560 -8.701 1.00 0.00 C ATOM 749 OE1 GLN A 48 -3.125 -4.738 -8.734 1.00 0.00 O ATOM 750 NE2 GLN A 48 -3.753 -6.802 -8.406 1.00 0.00 N ATOM 0 H GLN A 48 -6.451 -1.896 -9.858 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.696 -4.413 -8.878 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -5.096 -3.036 -8.656 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -5.633 -3.896 -7.226 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -6.151 -5.916 -8.632 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -5.621 -5.057 -10.064 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -4.503 -7.492 -8.378 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -2.794 -7.083 -8.203 1.00 0.00 H new ATOM 759 N VAL A 49 -9.254 -2.847 -7.653 1.00 0.00 N ATOM 760 CA VAL A 49 -10.186 -2.280 -6.653 1.00 0.00 C ATOM 761 C VAL A 49 -10.016 -3.033 -5.333 1.00 0.00 C ATOM 762 O VAL A 49 -9.615 -4.175 -5.314 1.00 0.00 O ATOM 763 CB VAL A 49 -11.646 -2.428 -7.143 1.00 0.00 C ATOM 764 CG1 VAL A 49 -12.416 -1.170 -6.746 1.00 0.00 C ATOM 765 CG2 VAL A 49 -11.738 -2.602 -8.689 1.00 0.00 C ATOM 0 H VAL A 49 -9.714 -3.223 -8.482 1.00 0.00 H new ATOM 0 HA VAL A 49 -9.965 -1.222 -6.512 1.00 0.00 H new ATOM 0 HB VAL A 49 -12.067 -3.322 -6.683 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -13.449 -1.254 -7.083 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -12.396 -1.058 -5.662 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -11.953 -0.299 -7.210 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -12.783 -2.702 -8.982 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -11.305 -1.730 -9.180 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -11.190 -3.496 -8.988 1.00 0.00 H new ATOM 775 N CYS A 50 -10.322 -2.411 -4.230 1.00 0.00 N ATOM 776 CA CYS A 50 -10.184 -3.110 -2.925 1.00 0.00 C ATOM 777 C CYS A 50 -11.581 -3.364 -2.360 1.00 0.00 C ATOM 778 O CYS A 50 -12.573 -3.164 -3.034 1.00 0.00 O ATOM 779 CB CYS A 50 -9.410 -2.238 -1.944 1.00 0.00 C ATOM 780 SG CYS A 50 -8.401 -3.288 -0.874 1.00 0.00 S ATOM 0 H CYS A 50 -10.661 -1.451 -4.176 1.00 0.00 H new ATOM 0 HA CYS A 50 -9.649 -4.049 -3.071 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -8.776 -1.536 -2.486 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -10.101 -1.645 -1.344 1.00 0.00 H new ATOM 785 N ALA A 51 -11.676 -3.785 -1.122 1.00 0.00 N ATOM 786 CA ALA A 51 -13.019 -4.029 -0.516 1.00 0.00 C ATOM 787 C ALA A 51 -12.891 -4.756 0.819 1.00 0.00 C ATOM 788 O ALA A 51 -13.772 -5.487 1.207 1.00 0.00 O ATOM 789 CB ALA A 51 -13.863 -4.875 -1.467 1.00 0.00 C ATOM 0 H ALA A 51 -10.883 -3.969 -0.508 1.00 0.00 H new ATOM 0 HA ALA A 51 -13.498 -3.065 -0.345 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -14.843 -5.053 -1.024 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -13.983 -4.348 -2.414 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -13.366 -5.829 -1.643 1.00 0.00 H new ATOM 795 N ASN A 52 -11.824 -4.543 1.540 1.00 0.00 N ATOM 796 CA ASN A 52 -11.671 -5.206 2.862 1.00 0.00 C ATOM 797 C ASN A 52 -11.538 -6.725 2.682 1.00 0.00 C ATOM 798 O ASN A 52 -12.187 -7.294 1.826 1.00 0.00 O ATOM 799 CB ASN A 52 -12.908 -4.902 3.704 1.00 0.00 C ATOM 800 CG ASN A 52 -12.676 -5.349 5.149 1.00 0.00 C ATOM 801 OD1 ASN A 52 -13.184 -6.369 5.571 1.00 0.00 O ATOM 802 ND2 ASN A 52 -11.912 -4.631 5.927 1.00 0.00 N ATOM 0 H ASN A 52 -11.051 -3.936 1.268 1.00 0.00 H new ATOM 0 HA ASN A 52 -10.774 -4.832 3.356 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -13.125 -3.834 3.675 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -13.776 -5.415 3.290 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -11.742 -4.926 6.888 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -11.485 -3.775 5.573 1.00 0.00 H new ATOM 809 N PRO A 53 -10.701 -7.351 3.492 1.00 0.00 N ATOM 810 CA PRO A 53 -10.493 -8.801 3.419 1.00 0.00 C ATOM 811 C PRO A 53 -11.573 -9.531 4.222 1.00 0.00 C ATOM 812 O PRO A 53 -11.937 -10.651 3.922 1.00 0.00 O ATOM 813 CB PRO A 53 -9.146 -9.014 4.119 1.00 0.00 C ATOM 814 CG PRO A 53 -8.900 -7.766 5.001 1.00 0.00 C ATOM 815 CD PRO A 53 -9.882 -6.680 4.530 1.00 0.00 C ATOM 0 HA PRO A 53 -10.524 -9.172 2.394 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -9.164 -9.919 4.726 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -8.346 -9.136 3.389 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -9.060 -8.000 6.053 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.870 -7.423 4.904 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.500 -6.319 5.352 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -9.355 -5.816 4.124 1.00 0.00 H new ATOM 823 N GLU A 54 -12.056 -8.914 5.274 1.00 0.00 N ATOM 824 CA GLU A 54 -13.073 -9.585 6.134 1.00 0.00 C ATOM 825 C GLU A 54 -14.414 -8.841 6.111 1.00 0.00 C ATOM 826 O GLU A 54 -15.104 -8.773 7.109 1.00 0.00 O ATOM 827 CB GLU A 54 -12.549 -9.624 7.571 1.00 0.00 C ATOM 828 CG GLU A 54 -11.258 -10.443 7.621 1.00 0.00 C ATOM 829 CD GLU A 54 -10.790 -10.572 9.071 1.00 0.00 C ATOM 830 OE1 GLU A 54 -11.612 -10.401 9.956 1.00 0.00 O ATOM 831 OE2 GLU A 54 -9.615 -10.835 9.272 1.00 0.00 O ATOM 0 H GLU A 54 -11.788 -7.976 5.571 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.239 -10.591 5.749 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -12.364 -8.611 7.930 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -13.297 -10.064 8.230 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.425 -11.431 7.193 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.486 -9.962 7.020 1.00 0.00 H new ATOM 838 N LYS A 55 -14.808 -8.303 4.989 1.00 0.00 N ATOM 839 CA LYS A 55 -16.125 -7.593 4.927 1.00 0.00 C ATOM 840 C LYS A 55 -17.233 -8.592 4.546 1.00 0.00 C ATOM 841 O LYS A 55 -18.191 -8.246 3.885 1.00 0.00 O ATOM 842 CB LYS A 55 -16.074 -6.461 3.894 1.00 0.00 C ATOM 843 CG LYS A 55 -15.924 -5.116 4.608 1.00 0.00 C ATOM 844 CD LYS A 55 -17.308 -4.531 4.901 1.00 0.00 C ATOM 845 CE LYS A 55 -17.393 -4.145 6.380 1.00 0.00 C ATOM 846 NZ LYS A 55 -17.978 -5.276 7.155 1.00 0.00 N ATOM 0 H LYS A 55 -14.281 -8.322 4.116 1.00 0.00 H new ATOM 0 HA LYS A 55 -16.340 -7.165 5.906 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -15.238 -6.616 3.211 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -16.982 -6.464 3.292 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -15.369 -5.246 5.537 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -15.351 -4.426 3.989 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -17.486 -3.657 4.275 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -18.082 -5.259 4.659 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -16.401 -3.903 6.761 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -18.007 -3.252 6.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -18.552 -4.901 7.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -18.578 -5.851 6.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -17.213 -5.866 7.539 1.00 0.00 H new ATOM 860 N LYS A 56 -17.111 -9.825 4.975 1.00 0.00 N ATOM 861 CA LYS A 56 -18.150 -10.857 4.669 1.00 0.00 C ATOM 862 C LYS A 56 -18.401 -10.964 3.157 1.00 0.00 C ATOM 863 O LYS A 56 -17.799 -11.771 2.477 1.00 0.00 O ATOM 864 CB LYS A 56 -19.453 -10.491 5.385 1.00 0.00 C ATOM 865 CG LYS A 56 -19.396 -10.987 6.830 1.00 0.00 C ATOM 866 CD LYS A 56 -20.129 -9.997 7.737 1.00 0.00 C ATOM 867 CE LYS A 56 -19.110 -9.235 8.586 1.00 0.00 C ATOM 868 NZ LYS A 56 -19.543 -7.816 8.723 1.00 0.00 N ATOM 0 H LYS A 56 -16.326 -10.164 5.531 1.00 0.00 H new ATOM 0 HA LYS A 56 -17.790 -11.824 5.020 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -19.601 -9.411 5.365 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -20.302 -10.938 4.869 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -19.853 -11.974 6.906 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -18.359 -11.091 7.150 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -20.712 -9.299 7.136 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -20.831 -10.527 8.381 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -19.022 -9.696 9.570 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -18.125 -9.283 8.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -18.851 -7.296 9.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -19.606 -7.380 7.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -20.475 -7.780 9.184 1.00 0.00 H new ATOM 882 N TRP A 57 -19.307 -10.177 2.637 1.00 0.00 N ATOM 883 CA TRP A 57 -19.637 -10.237 1.180 1.00 0.00 C ATOM 884 C TRP A 57 -18.368 -10.321 0.317 1.00 0.00 C ATOM 885 O TRP A 57 -18.384 -10.900 -0.753 1.00 0.00 O ATOM 886 CB TRP A 57 -20.462 -9.002 0.815 1.00 0.00 C ATOM 887 CG TRP A 57 -19.633 -7.792 0.955 1.00 0.00 C ATOM 888 CD1 TRP A 57 -19.698 -6.876 1.945 1.00 0.00 C ATOM 889 CD2 TRP A 57 -18.690 -7.306 -0.001 1.00 0.00 C ATOM 890 NE1 TRP A 57 -18.804 -5.858 1.661 1.00 0.00 N ATOM 891 CE2 TRP A 57 -18.154 -6.079 0.463 1.00 0.00 C ATOM 892 CE3 TRP A 57 -18.248 -7.825 -1.228 1.00 0.00 C ATOM 893 CZ2 TRP A 57 -17.199 -5.377 -0.285 1.00 0.00 C ATOM 894 CZ3 TRP A 57 -17.317 -7.125 -1.997 1.00 0.00 C ATOM 895 CH2 TRP A 57 -16.790 -5.899 -1.533 1.00 0.00 C ATOM 0 H TRP A 57 -19.839 -9.486 3.166 1.00 0.00 H new ATOM 0 HA TRP A 57 -20.214 -11.140 0.981 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -20.829 -9.087 -0.208 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -21.336 -8.932 1.462 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -20.339 -6.929 2.812 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -18.646 -5.048 2.260 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -18.631 -8.772 -1.579 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -16.782 -4.452 0.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -16.998 -7.522 -2.950 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -16.073 -5.359 -2.134 1.00 0.00 H new ATOM 906 N VAL A 58 -17.273 -9.765 0.757 1.00 0.00 N ATOM 907 CA VAL A 58 -16.026 -9.847 -0.074 1.00 0.00 C ATOM 908 C VAL A 58 -15.653 -11.310 -0.305 1.00 0.00 C ATOM 909 O VAL A 58 -15.471 -11.735 -1.423 1.00 0.00 O ATOM 910 CB VAL A 58 -14.844 -9.145 0.604 1.00 0.00 C ATOM 911 CG1 VAL A 58 -14.817 -7.686 0.185 1.00 0.00 C ATOM 912 CG2 VAL A 58 -14.950 -9.244 2.116 1.00 0.00 C ATOM 0 H VAL A 58 -17.182 -9.264 1.641 1.00 0.00 H new ATOM 0 HA VAL A 58 -16.233 -9.348 -1.021 1.00 0.00 H new ATOM 0 HB VAL A 58 -13.922 -9.636 0.293 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -13.977 -7.185 0.666 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -14.707 -7.620 -0.897 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -15.747 -7.204 0.485 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -14.100 -8.738 2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -15.875 -8.772 2.448 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -14.951 -10.293 2.413 1.00 0.00 H new ATOM 922 N ARG A 59 -15.527 -12.082 0.742 1.00 0.00 N ATOM 923 CA ARG A 59 -15.158 -13.515 0.573 1.00 0.00 C ATOM 924 C ARG A 59 -16.275 -14.231 -0.180 1.00 0.00 C ATOM 925 O ARG A 59 -16.037 -15.155 -0.933 1.00 0.00 O ATOM 926 CB ARG A 59 -14.973 -14.163 1.946 1.00 0.00 C ATOM 927 CG ARG A 59 -13.487 -14.433 2.194 1.00 0.00 C ATOM 928 CD ARG A 59 -13.301 -15.880 2.660 1.00 0.00 C ATOM 929 NE ARG A 59 -12.769 -16.701 1.536 1.00 0.00 N ATOM 930 CZ ARG A 59 -12.669 -17.997 1.664 1.00 0.00 C ATOM 931 NH1 ARG A 59 -13.617 -18.669 2.259 1.00 0.00 N ATOM 932 NH2 ARG A 59 -11.624 -18.621 1.195 1.00 0.00 N ATOM 0 H ARG A 59 -15.664 -11.780 1.707 1.00 0.00 H new ATOM 0 HA ARG A 59 -14.227 -13.590 0.012 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -15.368 -13.509 2.723 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -15.535 -15.095 1.997 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -12.917 -14.258 1.281 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -13.102 -13.745 2.947 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -12.615 -15.915 3.506 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -14.252 -16.287 3.003 1.00 0.00 H new ATOM 0 HE ARG A 59 -12.483 -16.251 0.667 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -14.436 -18.182 2.624 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -13.539 -19.681 2.359 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.884 -18.097 0.728 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -11.547 -19.633 1.295 1.00 0.00 H new ATOM 946 N GLU A 60 -17.491 -13.805 0.009 1.00 0.00 N ATOM 947 CA GLU A 60 -18.622 -14.458 -0.705 1.00 0.00 C ATOM 948 C GLU A 60 -18.410 -14.295 -2.210 1.00 0.00 C ATOM 949 O GLU A 60 -18.864 -15.095 -3.003 1.00 0.00 O ATOM 950 CB GLU A 60 -19.941 -13.799 -0.298 1.00 0.00 C ATOM 951 CG GLU A 60 -20.584 -14.606 0.832 1.00 0.00 C ATOM 952 CD GLU A 60 -22.042 -14.176 1.005 1.00 0.00 C ATOM 953 OE1 GLU A 60 -22.259 -13.067 1.467 1.00 0.00 O ATOM 954 OE2 GLU A 60 -22.915 -14.963 0.679 1.00 0.00 O ATOM 0 H GLU A 60 -17.751 -13.035 0.625 1.00 0.00 H new ATOM 0 HA GLU A 60 -18.661 -15.516 -0.446 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -19.763 -12.774 0.028 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -20.615 -13.749 -1.153 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -20.533 -15.671 0.606 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -20.036 -14.450 1.761 1.00 0.00 H new ATOM 961 N TYR A 61 -17.714 -13.265 -2.605 1.00 0.00 N ATOM 962 CA TYR A 61 -17.460 -13.047 -4.054 1.00 0.00 C ATOM 963 C TYR A 61 -16.130 -13.701 -4.436 1.00 0.00 C ATOM 964 O TYR A 61 -15.921 -14.085 -5.569 1.00 0.00 O ATOM 965 CB TYR A 61 -17.399 -11.542 -4.347 1.00 0.00 C ATOM 966 CG TYR A 61 -18.705 -10.856 -3.967 1.00 0.00 C ATOM 967 CD1 TYR A 61 -19.871 -11.609 -3.671 1.00 0.00 C ATOM 968 CD2 TYR A 61 -18.759 -9.444 -3.932 1.00 0.00 C ATOM 969 CE1 TYR A 61 -21.075 -10.950 -3.339 1.00 0.00 C ATOM 970 CE2 TYR A 61 -19.966 -8.787 -3.603 1.00 0.00 C ATOM 971 CZ TYR A 61 -21.122 -9.540 -3.305 1.00 0.00 C ATOM 972 OH TYR A 61 -22.300 -8.897 -2.986 1.00 0.00 O ATOM 0 H TYR A 61 -17.310 -12.564 -1.984 1.00 0.00 H new ATOM 0 HA TYR A 61 -18.266 -13.492 -4.637 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -16.574 -11.094 -3.793 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -17.195 -11.382 -5.406 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -19.837 -12.688 -3.700 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -17.875 -8.866 -4.157 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -21.960 -11.525 -3.111 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -20.004 -7.708 -3.580 1.00 0.00 H new ATOM 0 HH TYR A 61 -22.826 -9.460 -2.380 1.00 0.00 H new ATOM 982 N ILE A 62 -15.228 -13.838 -3.499 1.00 0.00 N ATOM 983 CA ILE A 62 -13.921 -14.475 -3.817 1.00 0.00 C ATOM 984 C ILE A 62 -14.184 -15.928 -4.249 1.00 0.00 C ATOM 985 O ILE A 62 -13.727 -16.370 -5.285 1.00 0.00 O ATOM 986 CB ILE A 62 -13.010 -14.402 -2.568 1.00 0.00 C ATOM 987 CG1 ILE A 62 -12.153 -13.136 -2.646 1.00 0.00 C ATOM 988 CG2 ILE A 62 -12.073 -15.616 -2.474 1.00 0.00 C ATOM 989 CD1 ILE A 62 -13.034 -11.895 -2.491 1.00 0.00 C ATOM 0 H ILE A 62 -15.342 -13.537 -2.531 1.00 0.00 H new ATOM 0 HA ILE A 62 -13.414 -13.958 -4.632 1.00 0.00 H new ATOM 0 HB ILE A 62 -13.652 -14.391 -1.687 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -11.394 -13.153 -1.864 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -11.627 -13.102 -3.600 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -11.450 -15.527 -1.584 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -12.665 -16.529 -2.412 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -11.438 -15.655 -3.359 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -12.415 -11.000 -2.548 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -13.776 -11.874 -3.289 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -13.539 -11.926 -1.526 1.00 0.00 H new ATOM 1001 N ASN A 63 -14.917 -16.668 -3.463 1.00 0.00 N ATOM 1002 CA ASN A 63 -15.207 -18.083 -3.828 1.00 0.00 C ATOM 1003 C ASN A 63 -16.224 -18.115 -4.971 1.00 0.00 C ATOM 1004 O ASN A 63 -16.125 -18.912 -5.883 1.00 0.00 O ATOM 1005 CB ASN A 63 -15.780 -18.817 -2.615 1.00 0.00 C ATOM 1006 CG ASN A 63 -14.674 -19.630 -1.940 1.00 0.00 C ATOM 1007 OD1 ASN A 63 -14.456 -20.778 -2.275 1.00 0.00 O ATOM 1008 ND2 ASN A 63 -13.961 -19.080 -0.996 1.00 0.00 N ATOM 0 H ASN A 63 -15.328 -16.354 -2.584 1.00 0.00 H new ATOM 0 HA ASN A 63 -14.286 -18.572 -4.146 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -16.202 -18.101 -1.909 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -16.592 -19.475 -2.925 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -13.221 -19.613 -0.539 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -14.144 -18.117 -0.715 1.00 0.00 H new ATOM 1015 N SER A 64 -17.202 -17.252 -4.929 1.00 0.00 N ATOM 1016 CA SER A 64 -18.227 -17.230 -6.011 1.00 0.00 C ATOM 1017 C SER A 64 -17.557 -16.900 -7.348 1.00 0.00 C ATOM 1018 O SER A 64 -18.084 -17.187 -8.404 1.00 0.00 O ATOM 1019 CB SER A 64 -19.279 -16.166 -5.694 1.00 0.00 C ATOM 1020 OG SER A 64 -20.054 -16.581 -4.579 1.00 0.00 O ATOM 0 H SER A 64 -17.336 -16.560 -4.191 1.00 0.00 H new ATOM 0 HA SER A 64 -18.704 -18.208 -6.077 1.00 0.00 H new ATOM 0 HB2 SER A 64 -18.794 -15.214 -5.479 1.00 0.00 H new ATOM 0 HB3 SER A 64 -19.923 -16.008 -6.559 1.00 0.00 H new ATOM 0 HG SER A 64 -19.765 -16.093 -3.780 1.00 0.00 H new ATOM 1026 N LEU A 65 -16.400 -16.296 -7.311 1.00 0.00 N ATOM 1027 CA LEU A 65 -15.702 -15.948 -8.580 1.00 0.00 C ATOM 1028 C LEU A 65 -14.959 -17.177 -9.107 1.00 0.00 C ATOM 1029 O LEU A 65 -14.359 -17.919 -8.355 1.00 0.00 O ATOM 1030 CB LEU A 65 -14.702 -14.820 -8.319 1.00 0.00 C ATOM 1031 CG LEU A 65 -15.423 -13.472 -8.370 1.00 0.00 C ATOM 1032 CD1 LEU A 65 -14.618 -12.433 -7.585 1.00 0.00 C ATOM 1033 CD2 LEU A 65 -15.558 -13.018 -9.825 1.00 0.00 C ATOM 0 H LEU A 65 -15.909 -16.029 -6.458 1.00 0.00 H new ATOM 0 HA LEU A 65 -16.433 -15.621 -9.319 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -14.232 -14.956 -7.345 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.906 -14.846 -9.063 1.00 0.00 H new ATOM 0 HG LEU A 65 -16.414 -13.575 -7.929 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -15.131 -11.472 -7.621 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -14.522 -12.755 -6.548 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -13.627 -12.332 -8.026 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -16.072 -12.057 -9.860 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -14.567 -12.916 -10.268 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -16.131 -13.757 -10.385 1.00 0.00 H new ATOM 1147 N SER B 5 -9.588 3.295 -3.357 1.00 0.00 N ATOM 1148 CA SER B 5 -10.409 2.055 -3.342 1.00 0.00 C ATOM 1149 C SER B 5 -9.857 1.075 -4.375 1.00 0.00 C ATOM 1150 O SER B 5 -10.590 0.518 -5.169 1.00 0.00 O ATOM 1151 CB SER B 5 -11.860 2.400 -3.694 1.00 0.00 C ATOM 1152 OG SER B 5 -11.879 3.287 -4.803 1.00 0.00 O ATOM 0 HA SER B 5 -10.373 1.604 -2.351 1.00 0.00 H new ATOM 0 HB2 SER B 5 -12.414 1.492 -3.931 1.00 0.00 H new ATOM 0 HB3 SER B 5 -12.354 2.860 -2.838 1.00 0.00 H new ATOM 0 HG SER B 5 -11.099 3.879 -4.762 1.00 0.00 H new ATOM 1158 N ASP B 6 -8.567 0.863 -4.382 1.00 0.00 N ATOM 1159 CA ASP B 6 -7.986 -0.074 -5.378 1.00 0.00 C ATOM 1160 C ASP B 6 -6.524 -0.381 -5.034 1.00 0.00 C ATOM 1161 O ASP B 6 -6.126 -0.357 -3.886 1.00 0.00 O ATOM 1162 CB ASP B 6 -8.087 0.561 -6.769 1.00 0.00 C ATOM 1163 CG ASP B 6 -7.173 1.787 -6.852 1.00 0.00 C ATOM 1164 OD1 ASP B 6 -7.600 2.848 -6.428 1.00 0.00 O ATOM 1165 OD2 ASP B 6 -6.062 1.642 -7.337 1.00 0.00 O ATOM 0 H ASP B 6 -7.898 1.296 -3.745 1.00 0.00 H new ATOM 0 HA ASP B 6 -8.538 -1.014 -5.364 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -7.805 -0.166 -7.531 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -9.118 0.851 -6.971 1.00 0.00 H new ATOM 1170 N THR B 7 -5.728 -0.704 -6.021 1.00 0.00 N ATOM 1171 CA THR B 7 -4.311 -1.051 -5.751 1.00 0.00 C ATOM 1172 C THR B 7 -3.532 0.194 -5.321 1.00 0.00 C ATOM 1173 O THR B 7 -4.053 1.291 -5.302 1.00 0.00 O ATOM 1174 CB THR B 7 -3.678 -1.657 -7.014 1.00 0.00 C ATOM 1175 OG1 THR B 7 -2.266 -1.677 -6.889 1.00 0.00 O ATOM 1176 CG2 THR B 7 -4.061 -0.828 -8.243 1.00 0.00 C ATOM 0 H THR B 7 -6.004 -0.741 -7.002 1.00 0.00 H new ATOM 0 HA THR B 7 -4.273 -1.782 -4.943 1.00 0.00 H new ATOM 0 HB THR B 7 -4.047 -2.676 -7.132 1.00 0.00 H new ATOM 0 HG1 THR B 7 -1.872 -2.066 -7.697 1.00 0.00 H new ATOM 0 HG21 THR B 7 -3.608 -1.265 -9.133 1.00 0.00 H new ATOM 0 HG22 THR B 7 -5.145 -0.822 -8.354 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.703 0.194 -8.119 1.00 0.00 H new ATOM 1184 N THR B 8 -2.288 0.024 -4.963 1.00 0.00 N ATOM 1185 CA THR B 8 -1.467 1.180 -4.518 1.00 0.00 C ATOM 1186 C THR B 8 0.018 0.860 -4.757 1.00 0.00 C ATOM 1187 O THR B 8 0.578 0.026 -4.072 1.00 0.00 O ATOM 1188 CB THR B 8 -1.709 1.411 -3.023 1.00 0.00 C ATOM 1189 OG1 THR B 8 -3.079 1.180 -2.728 1.00 0.00 O ATOM 1190 CG2 THR B 8 -1.344 2.850 -2.652 1.00 0.00 C ATOM 0 H THR B 8 -1.804 -0.874 -4.961 1.00 0.00 H new ATOM 0 HA THR B 8 -1.741 2.075 -5.076 1.00 0.00 H new ATOM 0 HB THR B 8 -1.087 0.725 -2.448 1.00 0.00 H new ATOM 0 HG1 THR B 8 -3.580 2.016 -2.826 1.00 0.00 H new ATOM 0 HG21 THR B 8 -1.519 3.007 -1.588 1.00 0.00 H new ATOM 0 HG22 THR B 8 -0.293 3.028 -2.877 1.00 0.00 H new ATOM 0 HG23 THR B 8 -1.960 3.541 -3.227 1.00 0.00 H new ATOM 1198 N PRO B 9 0.621 1.525 -5.720 1.00 0.00 N ATOM 1199 CA PRO B 9 2.039 1.304 -6.037 1.00 0.00 C ATOM 1200 C PRO B 9 2.882 1.512 -4.779 1.00 0.00 C ATOM 1201 O PRO B 9 3.284 2.612 -4.460 1.00 0.00 O ATOM 1202 CB PRO B 9 2.367 2.353 -7.110 1.00 0.00 C ATOM 1203 CG PRO B 9 1.057 3.125 -7.426 1.00 0.00 C ATOM 1204 CD PRO B 9 -0.046 2.548 -6.547 1.00 0.00 C ATOM 0 HA PRO B 9 2.247 0.294 -6.391 1.00 0.00 H new ATOM 0 HB2 PRO B 9 3.138 3.036 -6.755 1.00 0.00 H new ATOM 0 HB3 PRO B 9 2.755 1.874 -8.009 1.00 0.00 H new ATOM 0 HG2 PRO B 9 1.184 4.190 -7.230 1.00 0.00 H new ATOM 0 HG3 PRO B 9 0.798 3.023 -8.480 1.00 0.00 H new ATOM 0 HD2 PRO B 9 -0.502 3.320 -5.928 1.00 0.00 H new ATOM 0 HD3 PRO B 9 -0.843 2.111 -7.149 1.00 0.00 H new ATOM 1212 N CYS B 10 3.127 0.456 -4.052 1.00 0.00 N ATOM 1213 CA CYS B 10 3.917 0.569 -2.795 1.00 0.00 C ATOM 1214 C CYS B 10 5.027 -0.463 -2.781 1.00 0.00 C ATOM 1215 O CYS B 10 4.829 -1.611 -3.121 1.00 0.00 O ATOM 1216 CB CYS B 10 2.994 0.295 -1.612 1.00 0.00 C ATOM 1217 SG CYS B 10 2.545 1.835 -0.779 1.00 0.00 S ATOM 0 H CYS B 10 2.811 -0.487 -4.278 1.00 0.00 H new ATOM 0 HA CYS B 10 4.347 1.568 -2.732 1.00 0.00 H new ATOM 0 HB2 CYS B 10 2.094 -0.213 -1.957 1.00 0.00 H new ATOM 0 HB3 CYS B 10 3.487 -0.375 -0.907 1.00 0.00 H new ATOM 1222 N CYS B 11 6.189 -0.074 -2.359 1.00 0.00 N ATOM 1223 CA CYS B 11 7.305 -1.047 -2.301 1.00 0.00 C ATOM 1224 C CYS B 11 7.225 -1.790 -0.955 1.00 0.00 C ATOM 1225 O CYS B 11 6.784 -1.245 0.037 1.00 0.00 O ATOM 1226 CB CYS B 11 8.662 -0.320 -2.531 1.00 0.00 C ATOM 1227 SG CYS B 11 9.847 -0.564 -1.174 1.00 0.00 S ATOM 0 H CYS B 11 6.415 0.872 -2.052 1.00 0.00 H new ATOM 0 HA CYS B 11 7.228 -1.789 -3.096 1.00 0.00 H new ATOM 0 HB2 CYS B 11 9.105 -0.678 -3.460 1.00 0.00 H new ATOM 0 HB3 CYS B 11 8.478 0.747 -2.656 1.00 0.00 H new ATOM 1232 N PHE B 12 7.641 -3.026 -0.917 1.00 0.00 N ATOM 1233 CA PHE B 12 7.578 -3.786 0.360 1.00 0.00 C ATOM 1234 C PHE B 12 8.963 -3.810 1.011 1.00 0.00 C ATOM 1235 O PHE B 12 9.222 -3.113 1.972 1.00 0.00 O ATOM 1236 CB PHE B 12 7.111 -5.219 0.077 1.00 0.00 C ATOM 1237 CG PHE B 12 7.160 -6.044 1.347 1.00 0.00 C ATOM 1238 CD1 PHE B 12 6.765 -5.473 2.578 1.00 0.00 C ATOM 1239 CD2 PHE B 12 7.616 -7.381 1.302 1.00 0.00 C ATOM 1240 CE1 PHE B 12 6.826 -6.238 3.763 1.00 0.00 C ATOM 1241 CE2 PHE B 12 7.674 -8.147 2.488 1.00 0.00 C ATOM 1242 CZ PHE B 12 7.280 -7.575 3.719 1.00 0.00 C ATOM 0 H PHE B 12 8.020 -3.540 -1.712 1.00 0.00 H new ATOM 0 HA PHE B 12 6.873 -3.304 1.038 1.00 0.00 H new ATOM 0 HB2 PHE B 12 6.096 -5.207 -0.319 1.00 0.00 H new ATOM 0 HB3 PHE B 12 7.745 -5.672 -0.685 1.00 0.00 H new ATOM 0 HD1 PHE B 12 6.416 -4.451 2.612 1.00 0.00 H new ATOM 0 HD2 PHE B 12 7.920 -7.817 0.362 1.00 0.00 H new ATOM 0 HE1 PHE B 12 6.525 -5.801 4.704 1.00 0.00 H new ATOM 0 HE2 PHE B 12 8.019 -9.170 2.454 1.00 0.00 H new ATOM 0 HZ PHE B 12 7.326 -8.160 4.626 1.00 0.00 H new ATOM 1252 N ALA B 13 9.854 -4.613 0.499 1.00 0.00 N ATOM 1253 CA ALA B 13 11.218 -4.684 1.093 1.00 0.00 C ATOM 1254 C ALA B 13 12.193 -3.904 0.229 1.00 0.00 C ATOM 1255 O ALA B 13 12.024 -3.789 -0.969 1.00 0.00 O ATOM 1256 CB ALA B 13 11.666 -6.143 1.183 1.00 0.00 C ATOM 0 H ALA B 13 9.697 -5.222 -0.304 1.00 0.00 H new ATOM 0 HA ALA B 13 11.197 -4.252 2.093 1.00 0.00 H new ATOM 0 HB1 ALA B 13 12.664 -6.191 1.618 1.00 0.00 H new ATOM 0 HB2 ALA B 13 10.970 -6.699 1.810 1.00 0.00 H new ATOM 0 HB3 ALA B 13 11.684 -6.580 0.185 1.00 0.00 H new ATOM 1262 N TYR B 14 13.214 -3.358 0.826 1.00 0.00 N ATOM 1263 CA TYR B 14 14.190 -2.580 0.022 1.00 0.00 C ATOM 1264 C TYR B 14 15.499 -3.360 -0.100 1.00 0.00 C ATOM 1265 O TYR B 14 15.884 -4.099 0.785 1.00 0.00 O ATOM 1266 CB TYR B 14 14.452 -1.193 0.636 1.00 0.00 C ATOM 1267 CG TYR B 14 14.090 -1.168 2.102 1.00 0.00 C ATOM 1268 CD1 TYR B 14 12.734 -1.090 2.493 1.00 0.00 C ATOM 1269 CD2 TYR B 14 15.106 -1.235 3.078 1.00 0.00 C ATOM 1270 CE1 TYR B 14 12.396 -1.080 3.862 1.00 0.00 C ATOM 1271 CE2 TYR B 14 14.768 -1.227 4.449 1.00 0.00 C ATOM 1272 CZ TYR B 14 13.412 -1.151 4.842 1.00 0.00 C ATOM 1273 OH TYR B 14 13.082 -1.138 6.182 1.00 0.00 O ATOM 0 H TYR B 14 13.412 -3.416 1.825 1.00 0.00 H new ATOM 0 HA TYR B 14 13.765 -2.426 -0.970 1.00 0.00 H new ATOM 0 HB2 TYR B 14 15.503 -0.931 0.514 1.00 0.00 H new ATOM 0 HB3 TYR B 14 13.871 -0.440 0.102 1.00 0.00 H new ATOM 0 HD1 TYR B 14 11.958 -1.038 1.744 1.00 0.00 H new ATOM 0 HD2 TYR B 14 16.142 -1.292 2.777 1.00 0.00 H new ATOM 0 HE1 TYR B 14 11.360 -1.018 4.162 1.00 0.00 H new ATOM 0 HE2 TYR B 14 15.545 -1.279 5.197 1.00 0.00 H new ATOM 0 HH TYR B 14 13.899 -1.195 6.721 1.00 0.00 H new ATOM 1283 N ILE B 15 16.177 -3.209 -1.204 1.00 0.00 N ATOM 1284 CA ILE B 15 17.454 -3.947 -1.410 1.00 0.00 C ATOM 1285 C ILE B 15 18.614 -3.189 -0.761 1.00 0.00 C ATOM 1286 O ILE B 15 18.614 -1.976 -0.687 1.00 0.00 O ATOM 1287 CB ILE B 15 17.714 -4.082 -2.912 1.00 0.00 C ATOM 1288 CG1 ILE B 15 19.007 -4.866 -3.140 1.00 0.00 C ATOM 1289 CG2 ILE B 15 17.844 -2.691 -3.535 1.00 0.00 C ATOM 1290 CD1 ILE B 15 19.002 -5.450 -4.554 1.00 0.00 C ATOM 0 H ILE B 15 15.900 -2.603 -1.976 1.00 0.00 H new ATOM 0 HA ILE B 15 17.377 -4.933 -0.952 1.00 0.00 H new ATOM 0 HB ILE B 15 16.883 -4.612 -3.377 1.00 0.00 H new ATOM 0 HG12 ILE B 15 19.870 -4.213 -3.007 1.00 0.00 H new ATOM 0 HG13 ILE B 15 19.096 -5.665 -2.404 1.00 0.00 H new ATOM 0 HG21 ILE B 15 18.029 -2.787 -4.605 1.00 0.00 H new ATOM 0 HG22 ILE B 15 16.921 -2.133 -3.375 1.00 0.00 H new ATOM 0 HG23 ILE B 15 18.674 -2.160 -3.069 1.00 0.00 H new ATOM 0 HD11 ILE B 15 19.923 -6.010 -4.720 1.00 0.00 H new ATOM 0 HD12 ILE B 15 18.147 -6.116 -4.670 1.00 0.00 H new ATOM 0 HD13 ILE B 15 18.933 -4.641 -5.281 1.00 0.00 H new ATOM 1302 N ALA B 16 19.608 -3.899 -0.300 1.00 0.00 N ATOM 1303 CA ALA B 16 20.778 -3.230 0.334 1.00 0.00 C ATOM 1304 C ALA B 16 21.886 -3.075 -0.710 1.00 0.00 C ATOM 1305 O ALA B 16 22.733 -3.932 -0.864 1.00 0.00 O ATOM 1306 CB ALA B 16 21.285 -4.084 1.498 1.00 0.00 C ATOM 0 H ALA B 16 19.659 -4.917 -0.336 1.00 0.00 H new ATOM 0 HA ALA B 16 20.486 -2.249 0.710 1.00 0.00 H new ATOM 0 HB1 ALA B 16 22.141 -3.595 1.962 1.00 0.00 H new ATOM 0 HB2 ALA B 16 20.491 -4.202 2.235 1.00 0.00 H new ATOM 0 HB3 ALA B 16 21.584 -5.064 1.127 1.00 0.00 H new ATOM 1312 N ARG B 17 21.879 -1.990 -1.435 1.00 0.00 N ATOM 1313 CA ARG B 17 22.920 -1.778 -2.477 1.00 0.00 C ATOM 1314 C ARG B 17 22.566 -0.515 -3.283 1.00 0.00 C ATOM 1315 O ARG B 17 21.638 -0.541 -4.067 1.00 0.00 O ATOM 1316 CB ARG B 17 22.954 -2.984 -3.420 1.00 0.00 C ATOM 1317 CG ARG B 17 24.384 -3.516 -3.519 1.00 0.00 C ATOM 1318 CD ARG B 17 24.598 -4.152 -4.894 1.00 0.00 C ATOM 1319 NE ARG B 17 23.983 -5.510 -4.914 1.00 0.00 N ATOM 1320 CZ ARG B 17 24.065 -6.247 -5.988 1.00 0.00 C ATOM 1321 NH1 ARG B 17 25.127 -6.975 -6.199 1.00 0.00 N ATOM 1322 NH2 ARG B 17 23.085 -6.256 -6.851 1.00 0.00 N ATOM 0 H ARG B 17 21.194 -1.239 -1.349 1.00 0.00 H new ATOM 0 HA ARG B 17 23.895 -1.660 -2.005 1.00 0.00 H new ATOM 0 HB2 ARG B 17 22.289 -3.765 -3.052 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.593 -2.697 -4.407 1.00 0.00 H new ATOM 0 HG2 ARG B 17 25.096 -2.705 -3.367 1.00 0.00 H new ATOM 0 HG3 ARG B 17 24.565 -4.251 -2.735 1.00 0.00 H new ATOM 0 HD2 ARG B 17 24.153 -3.528 -5.669 1.00 0.00 H new ATOM 0 HD3 ARG B 17 25.664 -4.220 -5.113 1.00 0.00 H new ATOM 0 HE ARG B 17 23.498 -5.863 -4.089 1.00 0.00 H new ATOM 0 HH11 ARG B 17 25.892 -6.968 -5.525 1.00 0.00 H new ATOM 0 HH12 ARG B 17 25.192 -7.551 -7.038 1.00 0.00 H new ATOM 0 HH21 ARG B 17 22.255 -5.687 -6.686 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.150 -6.832 -7.690 1.00 0.00 H new ATOM 1336 N PRO B 18 23.299 0.561 -3.074 1.00 0.00 N ATOM 1337 CA PRO B 18 23.038 1.820 -3.791 1.00 0.00 C ATOM 1338 C PRO B 18 23.019 1.585 -5.300 1.00 0.00 C ATOM 1339 O PRO B 18 24.046 1.478 -5.940 1.00 0.00 O ATOM 1340 CB PRO B 18 24.191 2.750 -3.389 1.00 0.00 C ATOM 1341 CG PRO B 18 25.065 1.998 -2.354 1.00 0.00 C ATOM 1342 CD PRO B 18 24.434 0.617 -2.128 1.00 0.00 C ATOM 0 HA PRO B 18 22.068 2.247 -3.538 1.00 0.00 H new ATOM 0 HB2 PRO B 18 24.783 3.024 -4.262 1.00 0.00 H new ATOM 0 HB3 PRO B 18 23.805 3.676 -2.962 1.00 0.00 H new ATOM 0 HG2 PRO B 18 26.087 1.897 -2.718 1.00 0.00 H new ATOM 0 HG3 PRO B 18 25.114 2.554 -1.418 1.00 0.00 H new ATOM 0 HD2 PRO B 18 25.150 -0.182 -2.322 1.00 0.00 H new ATOM 0 HD3 PRO B 18 24.097 0.500 -1.098 1.00 0.00 H new ATOM 1350 N LEU B 19 21.847 1.510 -5.872 1.00 0.00 N ATOM 1351 CA LEU B 19 21.744 1.287 -7.341 1.00 0.00 C ATOM 1352 C LEU B 19 22.497 2.413 -8.074 1.00 0.00 C ATOM 1353 O LEU B 19 22.209 3.571 -7.849 1.00 0.00 O ATOM 1354 CB LEU B 19 20.269 1.322 -7.764 1.00 0.00 C ATOM 1355 CG LEU B 19 19.435 0.372 -6.899 1.00 0.00 C ATOM 1356 CD1 LEU B 19 18.000 0.329 -7.432 1.00 0.00 C ATOM 1357 CD2 LEU B 19 20.029 -1.037 -6.948 1.00 0.00 C ATOM 0 H LEU B 19 20.956 1.594 -5.383 1.00 0.00 H new ATOM 0 HA LEU B 19 22.176 0.318 -7.593 1.00 0.00 H new ATOM 0 HB2 LEU B 19 19.883 2.337 -7.673 1.00 0.00 H new ATOM 0 HB3 LEU B 19 20.180 1.040 -8.813 1.00 0.00 H new ATOM 0 HG LEU B 19 19.440 0.730 -5.870 1.00 0.00 H new ATOM 0 HD11 LEU B 19 17.404 -0.346 -6.818 1.00 0.00 H new ATOM 0 HD12 LEU B 19 17.568 1.329 -7.395 1.00 0.00 H new ATOM 0 HD13 LEU B 19 18.005 -0.026 -8.462 1.00 0.00 H new ATOM 0 HD21 LEU B 19 19.430 -1.706 -6.330 1.00 0.00 H new ATOM 0 HD22 LEU B 19 20.029 -1.396 -7.977 1.00 0.00 H new ATOM 0 HD23 LEU B 19 21.052 -1.014 -6.572 1.00 0.00 H new ATOM 1369 N PRO B 20 23.434 2.062 -8.934 1.00 0.00 N ATOM 1370 CA PRO B 20 24.197 3.073 -9.685 1.00 0.00 C ATOM 1371 C PRO B 20 23.245 3.939 -10.511 1.00 0.00 C ATOM 1372 O PRO B 20 22.459 3.440 -11.289 1.00 0.00 O ATOM 1373 CB PRO B 20 25.129 2.265 -10.601 1.00 0.00 C ATOM 1374 CG PRO B 20 24.914 0.764 -10.286 1.00 0.00 C ATOM 1375 CD PRO B 20 23.805 0.661 -9.230 1.00 0.00 C ATOM 0 HA PRO B 20 24.753 3.746 -9.033 1.00 0.00 H new ATOM 0 HB2 PRO B 20 24.909 2.471 -11.648 1.00 0.00 H new ATOM 0 HB3 PRO B 20 26.169 2.546 -10.433 1.00 0.00 H new ATOM 0 HG2 PRO B 20 24.634 0.221 -11.188 1.00 0.00 H new ATOM 0 HG3 PRO B 20 25.836 0.315 -9.917 1.00 0.00 H new ATOM 0 HD2 PRO B 20 22.952 0.097 -9.606 1.00 0.00 H new ATOM 0 HD3 PRO B 20 24.157 0.148 -8.335 1.00 0.00 H new ATOM 1383 N ARG B 21 23.301 5.234 -10.342 1.00 0.00 N ATOM 1384 CA ARG B 21 22.391 6.132 -11.113 1.00 0.00 C ATOM 1385 C ARG B 21 22.454 5.790 -12.603 1.00 0.00 C ATOM 1386 O ARG B 21 21.515 6.014 -13.341 1.00 0.00 O ATOM 1387 CB ARG B 21 22.816 7.587 -10.907 1.00 0.00 C ATOM 1388 CG ARG B 21 21.657 8.516 -11.277 1.00 0.00 C ATOM 1389 CD ARG B 21 21.721 8.847 -12.769 1.00 0.00 C ATOM 1390 NE ARG B 21 22.079 10.282 -12.944 1.00 0.00 N ATOM 1391 CZ ARG B 21 22.387 10.738 -14.127 1.00 0.00 C ATOM 1392 NH1 ARG B 21 21.506 10.710 -15.088 1.00 0.00 N ATOM 1393 NH2 ARG B 21 23.578 11.224 -14.348 1.00 0.00 N ATOM 0 H ARG B 21 23.938 5.709 -9.703 1.00 0.00 H new ATOM 0 HA ARG B 21 21.370 5.993 -10.758 1.00 0.00 H new ATOM 0 HB2 ARG B 21 23.108 7.748 -9.869 1.00 0.00 H new ATOM 0 HB3 ARG B 21 23.687 7.813 -11.522 1.00 0.00 H new ATOM 0 HG2 ARG B 21 20.706 8.039 -11.040 1.00 0.00 H new ATOM 0 HG3 ARG B 21 21.710 9.432 -10.688 1.00 0.00 H new ATOM 0 HD2 ARG B 21 22.459 8.214 -13.261 1.00 0.00 H new ATOM 0 HD3 ARG B 21 20.760 8.641 -13.240 1.00 0.00 H new ATOM 0 HE ARG B 21 22.083 10.908 -12.139 1.00 0.00 H new ATOM 0 HH11 ARG B 21 20.575 10.331 -14.915 1.00 0.00 H new ATOM 0 HH12 ARG B 21 21.748 11.067 -16.012 1.00 0.00 H new ATOM 0 HH21 ARG B 21 24.267 11.247 -13.596 1.00 0.00 H new ATOM 0 HH22 ARG B 21 23.820 11.581 -15.272 1.00 0.00 H new ATOM 1407 N ALA B 22 23.549 5.243 -13.054 1.00 0.00 N ATOM 1408 CA ALA B 22 23.658 4.886 -14.496 1.00 0.00 C ATOM 1409 C ALA B 22 22.728 3.711 -14.794 1.00 0.00 C ATOM 1410 O ALA B 22 22.008 3.709 -15.772 1.00 0.00 O ATOM 1411 CB ALA B 22 25.101 4.494 -14.821 1.00 0.00 C ATOM 0 H ALA B 22 24.370 5.028 -12.488 1.00 0.00 H new ATOM 0 HA ALA B 22 23.373 5.742 -15.107 1.00 0.00 H new ATOM 0 HB1 ALA B 22 25.178 4.233 -15.877 1.00 0.00 H new ATOM 0 HB2 ALA B 22 25.763 5.332 -14.605 1.00 0.00 H new ATOM 0 HB3 ALA B 22 25.391 3.637 -14.213 1.00 0.00 H new ATOM 1417 N HIS B 23 22.736 2.713 -13.955 1.00 0.00 N ATOM 1418 CA HIS B 23 21.849 1.542 -14.191 1.00 0.00 C ATOM 1419 C HIS B 23 20.392 1.944 -13.960 1.00 0.00 C ATOM 1420 O HIS B 23 19.485 1.316 -14.466 1.00 0.00 O ATOM 1421 CB HIS B 23 22.208 0.413 -13.222 1.00 0.00 C ATOM 1422 CG HIS B 23 23.648 0.017 -13.400 1.00 0.00 C ATOM 1423 ND1 HIS B 23 24.149 -1.183 -12.911 1.00 0.00 N ATOM 1424 CD2 HIS B 23 24.709 0.648 -14.002 1.00 0.00 C ATOM 1425 CE1 HIS B 23 25.450 -1.237 -13.215 1.00 0.00 C ATOM 1426 NE2 HIS B 23 25.846 -0.143 -13.883 1.00 0.00 N ATOM 0 H HIS B 23 23.317 2.658 -13.118 1.00 0.00 H new ATOM 0 HA HIS B 23 21.982 1.202 -15.218 1.00 0.00 H new ATOM 0 HB2 HIS B 23 22.036 0.736 -12.195 1.00 0.00 H new ATOM 0 HB3 HIS B 23 21.562 -0.447 -13.398 1.00 0.00 H new ATOM 0 HD2 HIS B 23 24.667 1.610 -14.492 1.00 0.00 H new ATOM 0 HE1 HIS B 23 26.101 -2.059 -12.955 1.00 0.00 H new ATOM 0 HE2 HIS B 23 26.783 0.064 -14.230 1.00 0.00 H new ATOM 1434 N ILE B 24 20.150 2.979 -13.195 1.00 0.00 N ATOM 1435 CA ILE B 24 18.738 3.385 -12.947 1.00 0.00 C ATOM 1436 C ILE B 24 18.270 4.328 -14.059 1.00 0.00 C ATOM 1437 O ILE B 24 19.065 4.870 -14.800 1.00 0.00 O ATOM 1438 CB ILE B 24 18.605 4.099 -11.600 1.00 0.00 C ATOM 1439 CG1 ILE B 24 19.259 3.270 -10.495 1.00 0.00 C ATOM 1440 CG2 ILE B 24 17.122 4.283 -11.270 1.00 0.00 C ATOM 1441 CD1 ILE B 24 19.207 4.048 -9.179 1.00 0.00 C ATOM 0 H ILE B 24 20.860 3.552 -12.738 1.00 0.00 H new ATOM 0 HA ILE B 24 18.122 2.486 -12.933 1.00 0.00 H new ATOM 0 HB ILE B 24 19.100 5.068 -11.664 1.00 0.00 H new ATOM 0 HG12 ILE B 24 18.743 2.316 -10.387 1.00 0.00 H new ATOM 0 HG13 ILE B 24 20.293 3.045 -10.757 1.00 0.00 H new ATOM 0 HG21 ILE B 24 17.023 4.791 -10.311 1.00 0.00 H new ATOM 0 HG22 ILE B 24 16.648 4.881 -12.048 1.00 0.00 H new ATOM 0 HG23 ILE B 24 16.638 3.308 -11.215 1.00 0.00 H new ATOM 0 HD11 ILE B 24 19.673 3.459 -8.389 1.00 0.00 H new ATOM 0 HD12 ILE B 24 19.742 4.991 -9.292 1.00 0.00 H new ATOM 0 HD13 ILE B 24 18.169 4.250 -8.916 1.00 0.00 H new ATOM 1453 N LYS B 25 16.985 4.534 -14.176 1.00 0.00 N ATOM 1454 CA LYS B 25 16.469 5.450 -15.233 1.00 0.00 C ATOM 1455 C LYS B 25 15.644 6.571 -14.586 1.00 0.00 C ATOM 1456 O LYS B 25 15.588 7.680 -15.081 1.00 0.00 O ATOM 1457 CB LYS B 25 15.580 4.665 -16.204 1.00 0.00 C ATOM 1458 CG LYS B 25 16.426 3.641 -16.964 1.00 0.00 C ATOM 1459 CD LYS B 25 15.825 3.418 -18.354 1.00 0.00 C ATOM 1460 CE LYS B 25 16.599 4.241 -19.384 1.00 0.00 C ATOM 1461 NZ LYS B 25 15.671 4.697 -20.458 1.00 0.00 N ATOM 0 H LYS B 25 16.271 4.107 -13.585 1.00 0.00 H new ATOM 0 HA LYS B 25 17.310 5.882 -15.775 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.785 4.159 -15.656 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.100 5.347 -16.906 1.00 0.00 H new ATOM 0 HG2 LYS B 25 17.453 3.995 -17.052 1.00 0.00 H new ATOM 0 HG3 LYS B 25 16.459 2.700 -16.415 1.00 0.00 H new ATOM 0 HD2 LYS B 25 15.866 2.360 -18.614 1.00 0.00 H new ATOM 0 HD3 LYS B 25 14.774 3.707 -18.358 1.00 0.00 H new ATOM 0 HE2 LYS B 25 17.064 5.101 -18.902 1.00 0.00 H new ATOM 0 HE3 LYS B 25 17.402 3.643 -19.813 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 16.199 5.257 -21.158 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 15.247 3.870 -20.925 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 14.919 5.283 -20.042 1.00 0.00 H new ATOM 1475 N GLU B 26 14.997 6.286 -13.488 1.00 0.00 N ATOM 1476 CA GLU B 26 14.162 7.314 -12.805 1.00 0.00 C ATOM 1477 C GLU B 26 13.912 6.839 -11.368 1.00 0.00 C ATOM 1478 O GLU B 26 14.617 5.983 -10.869 1.00 0.00 O ATOM 1479 CB GLU B 26 12.824 7.487 -13.559 1.00 0.00 C ATOM 1480 CG GLU B 26 12.415 6.186 -14.268 1.00 0.00 C ATOM 1481 CD GLU B 26 12.688 6.310 -15.769 1.00 0.00 C ATOM 1482 OE1 GLU B 26 13.442 7.193 -16.144 1.00 0.00 O ATOM 1483 OE2 GLU B 26 12.145 5.515 -16.518 1.00 0.00 O ATOM 0 H GLU B 26 15.012 5.374 -13.031 1.00 0.00 H new ATOM 0 HA GLU B 26 14.671 8.278 -12.795 1.00 0.00 H new ATOM 0 HB2 GLU B 26 12.044 7.783 -12.858 1.00 0.00 H new ATOM 0 HB3 GLU B 26 12.917 8.290 -14.291 1.00 0.00 H new ATOM 0 HG2 GLU B 26 12.972 5.345 -13.855 1.00 0.00 H new ATOM 0 HG3 GLU B 26 11.358 5.983 -14.096 1.00 0.00 H new ATOM 1490 N TYR B 27 12.913 7.352 -10.697 1.00 0.00 N ATOM 1491 CA TYR B 27 12.646 6.883 -9.319 1.00 0.00 C ATOM 1492 C TYR B 27 11.195 7.190 -8.969 1.00 0.00 C ATOM 1493 O TYR B 27 10.473 7.764 -9.762 1.00 0.00 O ATOM 1494 CB TYR B 27 13.603 7.577 -8.343 1.00 0.00 C ATOM 1495 CG TYR B 27 13.309 9.062 -8.302 1.00 0.00 C ATOM 1496 CD1 TYR B 27 12.260 9.558 -7.494 1.00 0.00 C ATOM 1497 CD2 TYR B 27 14.072 9.953 -9.090 1.00 0.00 C ATOM 1498 CE1 TYR B 27 11.978 10.944 -7.474 1.00 0.00 C ATOM 1499 CE2 TYR B 27 13.790 11.337 -9.072 1.00 0.00 C ATOM 1500 CZ TYR B 27 12.743 11.832 -8.264 1.00 0.00 C ATOM 1501 OH TYR B 27 12.465 13.184 -8.248 1.00 0.00 O ATOM 0 H TYR B 27 12.279 8.070 -11.047 1.00 0.00 H new ATOM 0 HA TYR B 27 12.809 5.808 -9.247 1.00 0.00 H new ATOM 0 HB2 TYR B 27 13.495 7.148 -7.347 1.00 0.00 H new ATOM 0 HB3 TYR B 27 14.635 7.410 -8.651 1.00 0.00 H new ATOM 0 HD1 TYR B 27 11.674 8.879 -6.892 1.00 0.00 H new ATOM 0 HD2 TYR B 27 14.873 9.575 -9.708 1.00 0.00 H new ATOM 0 HE1 TYR B 27 11.178 11.324 -6.855 1.00 0.00 H new ATOM 0 HE2 TYR B 27 14.374 12.016 -9.675 1.00 0.00 H new ATOM 0 HH TYR B 27 13.084 13.652 -8.846 1.00 0.00 H new ATOM 1511 N PHE B 28 10.747 6.805 -7.806 1.00 0.00 N ATOM 1512 CA PHE B 28 9.333 7.083 -7.464 1.00 0.00 C ATOM 1513 C PHE B 28 9.170 7.202 -5.945 1.00 0.00 C ATOM 1514 O PHE B 28 8.767 6.266 -5.282 1.00 0.00 O ATOM 1515 CB PHE B 28 8.450 5.942 -8.003 1.00 0.00 C ATOM 1516 CG PHE B 28 7.040 6.058 -7.460 1.00 0.00 C ATOM 1517 CD1 PHE B 28 6.158 7.036 -7.972 1.00 0.00 C ATOM 1518 CD2 PHE B 28 6.609 5.189 -6.431 1.00 0.00 C ATOM 1519 CE1 PHE B 28 4.847 7.145 -7.455 1.00 0.00 C ATOM 1520 CE2 PHE B 28 5.298 5.296 -5.916 1.00 0.00 C ATOM 1521 CZ PHE B 28 4.417 6.274 -6.429 1.00 0.00 C ATOM 0 H PHE B 28 11.290 6.319 -7.093 1.00 0.00 H new ATOM 0 HA PHE B 28 9.028 8.026 -7.919 1.00 0.00 H new ATOM 0 HB2 PHE B 28 8.430 5.974 -9.092 1.00 0.00 H new ATOM 0 HB3 PHE B 28 8.877 4.980 -7.720 1.00 0.00 H new ATOM 0 HD1 PHE B 28 6.485 7.700 -8.758 1.00 0.00 H new ATOM 0 HD2 PHE B 28 7.283 4.442 -6.038 1.00 0.00 H new ATOM 0 HE1 PHE B 28 4.174 7.894 -7.844 1.00 0.00 H new ATOM 0 HE2 PHE B 28 4.970 4.631 -5.131 1.00 0.00 H new ATOM 0 HZ PHE B 28 3.414 6.356 -6.037 1.00 0.00 H new ATOM 1531 N TYR B 29 9.457 8.343 -5.388 1.00 0.00 N ATOM 1532 CA TYR B 29 9.295 8.503 -3.918 1.00 0.00 C ATOM 1533 C TYR B 29 7.830 8.277 -3.554 1.00 0.00 C ATOM 1534 O TYR B 29 6.932 8.830 -4.156 1.00 0.00 O ATOM 1535 CB TYR B 29 9.714 9.911 -3.503 1.00 0.00 C ATOM 1536 CG TYR B 29 9.514 10.088 -2.017 1.00 0.00 C ATOM 1537 CD1 TYR B 29 10.067 9.153 -1.115 1.00 0.00 C ATOM 1538 CD2 TYR B 29 8.774 11.187 -1.531 1.00 0.00 C ATOM 1539 CE1 TYR B 29 9.877 9.317 0.275 1.00 0.00 C ATOM 1540 CE2 TYR B 29 8.584 11.352 -0.141 1.00 0.00 C ATOM 1541 CZ TYR B 29 9.134 10.415 0.762 1.00 0.00 C ATOM 1542 OH TYR B 29 8.953 10.578 2.121 1.00 0.00 O ATOM 0 H TYR B 29 9.795 9.168 -5.884 1.00 0.00 H new ATOM 0 HA TYR B 29 9.922 7.778 -3.398 1.00 0.00 H new ATOM 0 HB2 TYR B 29 10.759 10.080 -3.761 1.00 0.00 H new ATOM 0 HB3 TYR B 29 9.128 10.650 -4.049 1.00 0.00 H new ATOM 0 HD1 TYR B 29 10.635 8.313 -1.488 1.00 0.00 H new ATOM 0 HD2 TYR B 29 8.353 11.902 -2.222 1.00 0.00 H new ATOM 0 HE1 TYR B 29 10.300 8.603 0.966 1.00 0.00 H new ATOM 0 HE2 TYR B 29 8.019 12.194 0.231 1.00 0.00 H new ATOM 0 HH TYR B 29 8.420 11.384 2.286 1.00 0.00 H new ATOM 1552 N THR B 30 7.589 7.467 -2.570 1.00 0.00 N ATOM 1553 CA THR B 30 6.183 7.194 -2.152 1.00 0.00 C ATOM 1554 C THR B 30 5.819 8.090 -0.968 1.00 0.00 C ATOM 1555 O THR B 30 6.583 8.244 -0.035 1.00 0.00 O ATOM 1556 CB THR B 30 6.044 5.726 -1.744 1.00 0.00 C ATOM 1557 OG1 THR B 30 6.815 5.485 -0.578 1.00 0.00 O ATOM 1558 CG2 THR B 30 6.545 4.831 -2.880 1.00 0.00 C ATOM 0 H THR B 30 8.304 6.978 -2.032 1.00 0.00 H new ATOM 0 HA THR B 30 5.512 7.402 -2.985 1.00 0.00 H new ATOM 0 HB THR B 30 4.997 5.503 -1.540 1.00 0.00 H new ATOM 0 HG1 THR B 30 6.931 6.323 -0.084 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.446 3.785 -2.590 1.00 0.00 H new ATOM 0 HG22 THR B 30 5.954 5.016 -3.777 1.00 0.00 H new ATOM 0 HG23 THR B 30 7.592 5.054 -3.084 1.00 0.00 H new ATOM 1566 N SER B 31 4.658 8.684 -0.998 1.00 0.00 N ATOM 1567 CA SER B 31 4.245 9.569 0.128 1.00 0.00 C ATOM 1568 C SER B 31 4.208 8.760 1.424 1.00 0.00 C ATOM 1569 O SER B 31 4.520 9.257 2.487 1.00 0.00 O ATOM 1570 CB SER B 31 2.852 10.134 -0.156 1.00 0.00 C ATOM 1571 OG SER B 31 2.958 11.513 -0.470 1.00 0.00 O ATOM 0 H SER B 31 3.978 8.595 -1.753 1.00 0.00 H new ATOM 0 HA SER B 31 4.959 10.387 0.229 1.00 0.00 H new ATOM 0 HB2 SER B 31 2.391 9.596 -0.984 1.00 0.00 H new ATOM 0 HB3 SER B 31 2.208 9.996 0.712 1.00 0.00 H new ATOM 0 HG SER B 31 2.067 11.876 -0.654 1.00 0.00 H new ATOM 1577 N GLY B 32 3.821 7.517 1.343 1.00 0.00 N ATOM 1578 CA GLY B 32 3.756 6.675 2.570 1.00 0.00 C ATOM 1579 C GLY B 32 2.289 6.400 2.907 1.00 0.00 C ATOM 1580 O GLY B 32 1.767 6.886 3.890 1.00 0.00 O ATOM 0 H GLY B 32 3.547 7.048 0.480 1.00 0.00 H new ATOM 0 HA2 GLY B 32 4.288 5.737 2.412 1.00 0.00 H new ATOM 0 HA3 GLY B 32 4.245 7.183 3.402 1.00 0.00 H new ATOM 1584 N LYS B 33 1.617 5.633 2.091 1.00 0.00 N ATOM 1585 CA LYS B 33 0.181 5.341 2.358 1.00 0.00 C ATOM 1586 C LYS B 33 0.011 3.881 2.789 1.00 0.00 C ATOM 1587 O LYS B 33 -0.909 3.543 3.507 1.00 0.00 O ATOM 1588 CB LYS B 33 -0.635 5.587 1.086 1.00 0.00 C ATOM 1589 CG LYS B 33 -0.438 7.029 0.611 1.00 0.00 C ATOM 1590 CD LYS B 33 -1.783 7.602 0.158 1.00 0.00 C ATOM 1591 CE LYS B 33 -1.548 8.804 -0.760 1.00 0.00 C ATOM 1592 NZ LYS B 33 -2.372 9.954 -0.291 1.00 0.00 N ATOM 0 H LYS B 33 2.001 5.197 1.252 1.00 0.00 H new ATOM 0 HA LYS B 33 -0.170 5.995 3.157 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -0.326 4.892 0.305 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -1.691 5.400 1.279 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -0.024 7.636 1.416 1.00 0.00 H new ATOM 0 HG3 LYS B 33 0.278 7.059 -0.210 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.357 6.838 -0.367 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -2.371 7.903 1.025 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -0.492 9.075 -0.760 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -1.811 8.549 -1.786 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -2.213 10.772 -0.914 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -3.378 9.692 -0.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -2.100 10.202 0.682 1.00 0.00 H new ATOM 1606 N CYS B 34 0.872 3.004 2.345 1.00 0.00 N ATOM 1607 CA CYS B 34 0.724 1.568 2.729 1.00 0.00 C ATOM 1608 C CYS B 34 1.652 1.243 3.898 1.00 0.00 C ATOM 1609 O CYS B 34 2.086 0.121 4.052 1.00 0.00 O ATOM 1610 CB CYS B 34 1.092 0.641 1.560 1.00 0.00 C ATOM 1611 SG CYS B 34 0.716 1.401 -0.042 1.00 0.00 S ATOM 0 H CYS B 34 1.664 3.216 1.739 1.00 0.00 H new ATOM 0 HA CYS B 34 -0.318 1.408 3.007 1.00 0.00 H new ATOM 0 HB2 CYS B 34 2.154 0.399 1.608 1.00 0.00 H new ATOM 0 HB3 CYS B 34 0.546 -0.298 1.654 1.00 0.00 H new ATOM 1616 N SER B 35 1.972 2.198 4.724 1.00 0.00 N ATOM 1617 CA SER B 35 2.877 1.898 5.871 1.00 0.00 C ATOM 1618 C SER B 35 4.248 1.466 5.336 1.00 0.00 C ATOM 1619 O SER B 35 5.015 0.821 6.022 1.00 0.00 O ATOM 1620 CB SER B 35 2.282 0.750 6.695 1.00 0.00 C ATOM 1621 OG SER B 35 1.842 1.241 7.951 1.00 0.00 O ATOM 0 H SER B 35 1.651 3.164 4.658 1.00 0.00 H new ATOM 0 HA SER B 35 2.985 2.787 6.493 1.00 0.00 H new ATOM 0 HB2 SER B 35 1.448 0.298 6.158 1.00 0.00 H new ATOM 0 HB3 SER B 35 3.028 -0.031 6.840 1.00 0.00 H new ATOM 0 HG SER B 35 1.461 0.505 8.474 1.00 0.00 H new ATOM 1627 N ASN B 36 4.559 1.811 4.114 1.00 0.00 N ATOM 1628 CA ASN B 36 5.873 1.409 3.538 1.00 0.00 C ATOM 1629 C ASN B 36 6.549 2.627 2.889 1.00 0.00 C ATOM 1630 O ASN B 36 6.780 2.633 1.696 1.00 0.00 O ATOM 1631 CB ASN B 36 5.648 0.325 2.479 1.00 0.00 C ATOM 1632 CG ASN B 36 5.743 -1.060 3.125 1.00 0.00 C ATOM 1633 OD1 ASN B 36 5.120 -1.998 2.669 1.00 0.00 O ATOM 1634 ND2 ASN B 36 6.505 -1.231 4.170 1.00 0.00 N ATOM 0 H ASN B 36 3.960 2.353 3.492 1.00 0.00 H new ATOM 0 HA ASN B 36 6.515 1.022 4.330 1.00 0.00 H new ATOM 0 HB2 ASN B 36 4.670 0.454 2.016 1.00 0.00 H new ATOM 0 HB3 ASN B 36 6.391 0.418 1.687 1.00 0.00 H new ATOM 0 HD21 ASN B 36 6.577 -2.152 4.603 1.00 0.00 H new ATOM 0 HD22 ASN B 36 7.029 -0.444 4.554 1.00 0.00 H new ATOM 1641 N PRO B 37 6.858 3.626 3.691 1.00 0.00 N ATOM 1642 CA PRO B 37 7.517 4.843 3.188 1.00 0.00 C ATOM 1643 C PRO B 37 8.870 4.477 2.573 1.00 0.00 C ATOM 1644 O PRO B 37 9.664 3.782 3.176 1.00 0.00 O ATOM 1645 CB PRO B 37 7.711 5.729 4.428 1.00 0.00 C ATOM 1646 CG PRO B 37 7.124 4.972 5.647 1.00 0.00 C ATOM 1647 CD PRO B 37 6.579 3.627 5.144 1.00 0.00 C ATOM 0 HA PRO B 37 6.936 5.348 2.416 1.00 0.00 H new ATOM 0 HB2 PRO B 37 8.769 5.942 4.584 1.00 0.00 H new ATOM 0 HB3 PRO B 37 7.209 6.687 4.295 1.00 0.00 H new ATOM 0 HG2 PRO B 37 7.891 4.814 6.405 1.00 0.00 H new ATOM 0 HG3 PRO B 37 6.330 5.556 6.114 1.00 0.00 H new ATOM 0 HD2 PRO B 37 7.070 2.790 5.642 1.00 0.00 H new ATOM 0 HD3 PRO B 37 5.511 3.534 5.342 1.00 0.00 H new ATOM 1655 N ALA B 38 9.140 4.923 1.376 1.00 0.00 N ATOM 1656 CA ALA B 38 10.440 4.572 0.743 1.00 0.00 C ATOM 1657 C ALA B 38 10.614 5.345 -0.559 1.00 0.00 C ATOM 1658 O ALA B 38 9.992 6.364 -0.785 1.00 0.00 O ATOM 1659 CB ALA B 38 10.464 3.067 0.452 1.00 0.00 C ATOM 0 H ALA B 38 8.522 5.510 0.815 1.00 0.00 H new ATOM 0 HA ALA B 38 11.254 4.833 1.420 1.00 0.00 H new ATOM 0 HB1 ALA B 38 11.414 2.801 -0.012 1.00 0.00 H new ATOM 0 HB2 ALA B 38 10.349 2.514 1.384 1.00 0.00 H new ATOM 0 HB3 ALA B 38 9.647 2.814 -0.223 1.00 0.00 H new ATOM 1665 N VAL B 39 11.455 4.853 -1.416 1.00 0.00 N ATOM 1666 CA VAL B 39 11.694 5.514 -2.711 1.00 0.00 C ATOM 1667 C VAL B 39 11.822 4.376 -3.704 1.00 0.00 C ATOM 1668 O VAL B 39 12.421 3.360 -3.405 1.00 0.00 O ATOM 1669 CB VAL B 39 12.956 6.394 -2.594 1.00 0.00 C ATOM 1670 CG1 VAL B 39 14.180 5.771 -3.278 1.00 0.00 C ATOM 1671 CG2 VAL B 39 12.673 7.770 -3.190 1.00 0.00 C ATOM 0 H VAL B 39 11.996 4.002 -1.266 1.00 0.00 H new ATOM 0 HA VAL B 39 10.900 6.189 -3.032 1.00 0.00 H new ATOM 0 HB VAL B 39 13.195 6.481 -1.534 1.00 0.00 H new ATOM 0 HG11 VAL B 39 15.038 6.434 -3.163 1.00 0.00 H new ATOM 0 HG12 VAL B 39 14.402 4.808 -2.819 1.00 0.00 H new ATOM 0 HG13 VAL B 39 13.971 5.628 -4.338 1.00 0.00 H new ATOM 0 HG21 VAL B 39 13.564 8.392 -3.108 1.00 0.00 H new ATOM 0 HG22 VAL B 39 12.401 7.663 -4.240 1.00 0.00 H new ATOM 0 HG23 VAL B 39 11.852 8.239 -2.648 1.00 0.00 H new ATOM 1681 N VAL B 40 11.206 4.488 -4.833 1.00 0.00 N ATOM 1682 CA VAL B 40 11.243 3.336 -5.766 1.00 0.00 C ATOM 1683 C VAL B 40 11.923 3.667 -7.079 1.00 0.00 C ATOM 1684 O VAL B 40 11.405 4.376 -7.916 1.00 0.00 O ATOM 1685 CB VAL B 40 9.813 2.874 -5.990 1.00 0.00 C ATOM 1686 CG1 VAL B 40 9.749 1.793 -7.063 1.00 0.00 C ATOM 1687 CG2 VAL B 40 9.317 2.290 -4.679 1.00 0.00 C ATOM 0 H VAL B 40 10.687 5.307 -5.151 1.00 0.00 H new ATOM 0 HA VAL B 40 11.840 2.539 -5.322 1.00 0.00 H new ATOM 0 HB VAL B 40 9.203 3.716 -6.317 1.00 0.00 H new ATOM 0 HG11 VAL B 40 8.714 1.480 -7.203 1.00 0.00 H new ATOM 0 HG12 VAL B 40 10.139 2.188 -8.001 1.00 0.00 H new ATOM 0 HG13 VAL B 40 10.348 0.937 -6.753 1.00 0.00 H new ATOM 0 HG21 VAL B 40 8.290 1.946 -4.800 1.00 0.00 H new ATOM 0 HG22 VAL B 40 9.950 1.450 -4.392 1.00 0.00 H new ATOM 0 HG23 VAL B 40 9.355 3.054 -3.903 1.00 0.00 H new ATOM 1697 N PHE B 41 13.078 3.115 -7.270 1.00 0.00 N ATOM 1698 CA PHE B 41 13.807 3.357 -8.520 1.00 0.00 C ATOM 1699 C PHE B 41 13.230 2.535 -9.653 1.00 0.00 C ATOM 1700 O PHE B 41 12.808 1.410 -9.496 1.00 0.00 O ATOM 1701 CB PHE B 41 15.280 2.995 -8.339 1.00 0.00 C ATOM 1702 CG PHE B 41 15.969 4.035 -7.489 1.00 0.00 C ATOM 1703 CD1 PHE B 41 16.012 5.383 -7.911 1.00 0.00 C ATOM 1704 CD2 PHE B 41 16.613 3.648 -6.294 1.00 0.00 C ATOM 1705 CE1 PHE B 41 16.696 6.345 -7.133 1.00 0.00 C ATOM 1706 CE2 PHE B 41 17.302 4.607 -5.521 1.00 0.00 C ATOM 1707 CZ PHE B 41 17.345 5.955 -5.939 1.00 0.00 C ATOM 0 H PHE B 41 13.548 2.502 -6.604 1.00 0.00 H new ATOM 0 HA PHE B 41 13.710 4.414 -8.768 1.00 0.00 H new ATOM 0 HB2 PHE B 41 15.367 2.015 -7.870 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.768 2.927 -9.311 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.523 5.678 -8.827 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.578 2.618 -5.971 1.00 0.00 H new ATOM 0 HE1 PHE B 41 16.723 7.377 -7.450 1.00 0.00 H new ATOM 0 HE2 PHE B 41 17.797 4.309 -4.608 1.00 0.00 H new ATOM 0 HZ PHE B 41 17.873 6.688 -5.347 1.00 0.00 H new ATOM 1717 N VAL B 42 13.252 3.117 -10.803 1.00 0.00 N ATOM 1718 CA VAL B 42 12.763 2.450 -12.034 1.00 0.00 C ATOM 1719 C VAL B 42 14.013 2.357 -12.939 1.00 0.00 C ATOM 1720 O VAL B 42 14.324 3.270 -13.676 1.00 0.00 O ATOM 1721 CB VAL B 42 11.661 3.296 -12.694 1.00 0.00 C ATOM 1722 CG1 VAL B 42 10.347 2.536 -12.592 1.00 0.00 C ATOM 1723 CG2 VAL B 42 11.481 4.643 -11.987 1.00 0.00 C ATOM 0 H VAL B 42 13.601 4.064 -10.951 1.00 0.00 H new ATOM 0 HA VAL B 42 12.324 1.471 -11.842 1.00 0.00 H new ATOM 0 HB VAL B 42 11.947 3.480 -13.730 1.00 0.00 H new ATOM 0 HG11 VAL B 42 9.552 3.120 -13.055 1.00 0.00 H new ATOM 0 HG12 VAL B 42 10.440 1.579 -13.105 1.00 0.00 H new ATOM 0 HG13 VAL B 42 10.107 2.364 -11.543 1.00 0.00 H new ATOM 0 HG21 VAL B 42 10.694 5.212 -12.482 1.00 0.00 H new ATOM 0 HG22 VAL B 42 11.206 4.474 -10.946 1.00 0.00 H new ATOM 0 HG23 VAL B 42 12.415 5.204 -12.029 1.00 0.00 H new ATOM 1733 N THR B 43 14.794 1.314 -12.785 1.00 0.00 N ATOM 1734 CA THR B 43 16.109 1.211 -13.520 1.00 0.00 C ATOM 1735 C THR B 43 16.015 0.719 -14.981 1.00 0.00 C ATOM 1736 O THR B 43 15.055 0.967 -15.678 1.00 0.00 O ATOM 1737 CB THR B 43 17.044 0.292 -12.713 1.00 0.00 C ATOM 1738 OG1 THR B 43 16.679 -1.062 -12.930 1.00 0.00 O ATOM 1739 CG2 THR B 43 16.939 0.616 -11.220 1.00 0.00 C ATOM 0 H THR B 43 14.581 0.521 -12.179 1.00 0.00 H new ATOM 0 HA THR B 43 16.498 2.226 -13.598 1.00 0.00 H new ATOM 0 HB THR B 43 18.071 0.452 -13.041 1.00 0.00 H new ATOM 0 HG1 THR B 43 17.275 -1.648 -12.418 1.00 0.00 H new ATOM 0 HG21 THR B 43 17.604 -0.039 -10.658 1.00 0.00 H new ATOM 0 HG22 THR B 43 17.225 1.654 -11.052 1.00 0.00 H new ATOM 0 HG23 THR B 43 15.913 0.464 -10.886 1.00 0.00 H new ATOM 1747 N ARG B 44 17.081 0.085 -15.458 1.00 0.00 N ATOM 1748 CA ARG B 44 17.164 -0.374 -16.886 1.00 0.00 C ATOM 1749 C ARG B 44 16.005 -1.292 -17.273 1.00 0.00 C ATOM 1750 O ARG B 44 15.745 -1.522 -18.432 1.00 0.00 O ATOM 1751 CB ARG B 44 18.504 -1.086 -17.127 1.00 0.00 C ATOM 1752 CG ARG B 44 18.871 -1.960 -15.922 1.00 0.00 C ATOM 1753 CD ARG B 44 19.523 -3.258 -16.404 1.00 0.00 C ATOM 1754 NE ARG B 44 20.658 -2.943 -17.318 1.00 0.00 N ATOM 1755 CZ ARG B 44 21.888 -3.066 -16.899 1.00 0.00 C ATOM 1756 NH1 ARG B 44 22.177 -2.846 -15.645 1.00 0.00 N ATOM 1757 NH2 ARG B 44 22.831 -3.406 -17.737 1.00 0.00 N ATOM 0 H ARG B 44 17.907 -0.133 -14.900 1.00 0.00 H new ATOM 0 HA ARG B 44 17.096 0.512 -17.517 1.00 0.00 H new ATOM 0 HB2 ARG B 44 18.439 -1.702 -18.024 1.00 0.00 H new ATOM 0 HB3 ARG B 44 19.288 -0.349 -17.302 1.00 0.00 H new ATOM 0 HG2 ARG B 44 19.554 -1.421 -15.265 1.00 0.00 H new ATOM 0 HG3 ARG B 44 17.978 -2.185 -15.339 1.00 0.00 H new ATOM 0 HD2 ARG B 44 19.880 -3.835 -15.551 1.00 0.00 H new ATOM 0 HD3 ARG B 44 18.788 -3.875 -16.921 1.00 0.00 H new ATOM 0 HE ARG B 44 20.473 -2.631 -18.271 1.00 0.00 H new ATOM 0 HH11 ARG B 44 21.441 -2.578 -14.992 1.00 0.00 H new ATOM 0 HH12 ARG B 44 23.139 -2.942 -15.319 1.00 0.00 H new ATOM 0 HH21 ARG B 44 22.606 -3.575 -18.717 1.00 0.00 H new ATOM 0 HH22 ARG B 44 23.793 -3.502 -17.411 1.00 0.00 H new ATOM 1771 N LYS B 45 15.293 -1.780 -16.327 1.00 0.00 N ATOM 1772 CA LYS B 45 14.109 -2.627 -16.622 1.00 0.00 C ATOM 1773 C LYS B 45 12.880 -1.817 -16.190 1.00 0.00 C ATOM 1774 O LYS B 45 11.776 -2.010 -16.662 1.00 0.00 O ATOM 1775 CB LYS B 45 14.210 -3.924 -15.824 1.00 0.00 C ATOM 1776 CG LYS B 45 12.933 -4.745 -16.000 1.00 0.00 C ATOM 1777 CD LYS B 45 12.964 -5.455 -17.354 1.00 0.00 C ATOM 1778 CE LYS B 45 11.712 -6.320 -17.500 1.00 0.00 C ATOM 1779 NZ LYS B 45 12.104 -7.757 -17.524 1.00 0.00 N ATOM 0 H LYS B 45 15.475 -1.632 -15.334 1.00 0.00 H new ATOM 0 HA LYS B 45 14.044 -2.889 -17.678 1.00 0.00 H new ATOM 0 HB2 LYS B 45 15.072 -4.501 -16.159 1.00 0.00 H new ATOM 0 HB3 LYS B 45 14.366 -3.700 -14.769 1.00 0.00 H new ATOM 0 HG2 LYS B 45 12.845 -5.476 -15.196 1.00 0.00 H new ATOM 0 HG3 LYS B 45 12.060 -4.096 -15.938 1.00 0.00 H new ATOM 0 HD2 LYS B 45 13.010 -4.723 -18.160 1.00 0.00 H new ATOM 0 HD3 LYS B 45 13.858 -6.073 -17.433 1.00 0.00 H new ATOM 0 HE2 LYS B 45 11.028 -6.132 -16.672 1.00 0.00 H new ATOM 0 HE3 LYS B 45 11.182 -6.061 -18.417 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 11.253 -8.347 -17.623 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 12.741 -7.930 -18.328 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 12.592 -7.999 -16.638 1.00 0.00 H new ATOM 1793 N ASN B 46 13.102 -0.884 -15.297 1.00 0.00 N ATOM 1794 CA ASN B 46 12.039 0.001 -14.795 1.00 0.00 C ATOM 1795 C ASN B 46 11.103 -0.738 -13.882 1.00 0.00 C ATOM 1796 O ASN B 46 10.070 -0.217 -13.508 1.00 0.00 O ATOM 1797 CB ASN B 46 11.270 0.637 -15.948 1.00 0.00 C ATOM 1798 CG ASN B 46 11.601 2.131 -16.017 1.00 0.00 C ATOM 1799 OD1 ASN B 46 12.755 2.510 -15.985 1.00 0.00 O ATOM 1800 ND2 ASN B 46 10.631 3.002 -16.092 1.00 0.00 N ATOM 0 H ASN B 46 14.019 -0.704 -14.888 1.00 0.00 H new ATOM 0 HA ASN B 46 12.515 0.796 -14.220 1.00 0.00 H new ATOM 0 HB2 ASN B 46 11.534 0.151 -16.887 1.00 0.00 H new ATOM 0 HB3 ASN B 46 10.198 0.497 -15.806 1.00 0.00 H new ATOM 0 HD21 ASN B 46 10.842 3.999 -16.124 1.00 0.00 H new ATOM 0 HD22 ASN B 46 9.662 2.685 -16.119 1.00 0.00 H new ATOM 1807 N ARG B 47 11.489 -1.896 -13.410 1.00 0.00 N ATOM 1808 CA ARG B 47 10.630 -2.550 -12.389 1.00 0.00 C ATOM 1809 C ARG B 47 10.614 -1.515 -11.280 1.00 0.00 C ATOM 1810 O ARG B 47 11.489 -0.669 -11.255 1.00 0.00 O ATOM 1811 CB ARG B 47 11.252 -3.855 -11.883 1.00 0.00 C ATOM 1812 CG ARG B 47 11.312 -4.880 -13.016 1.00 0.00 C ATOM 1813 CD ARG B 47 10.246 -5.954 -12.789 1.00 0.00 C ATOM 1814 NE ARG B 47 10.905 -7.248 -12.450 1.00 0.00 N ATOM 1815 CZ ARG B 47 10.298 -8.109 -11.678 1.00 0.00 C ATOM 1816 NH1 ARG B 47 10.153 -7.856 -10.406 1.00 0.00 N ATOM 1817 NH2 ARG B 47 9.841 -9.224 -12.177 1.00 0.00 N ATOM 0 H ARG B 47 12.334 -2.400 -13.679 1.00 0.00 H new ATOM 0 HA ARG B 47 9.645 -2.823 -12.768 1.00 0.00 H new ATOM 0 HB2 ARG B 47 12.255 -3.665 -11.500 1.00 0.00 H new ATOM 0 HB3 ARG B 47 10.664 -4.250 -11.055 1.00 0.00 H new ATOM 0 HG2 ARG B 47 11.149 -4.388 -13.975 1.00 0.00 H new ATOM 0 HG3 ARG B 47 12.301 -5.337 -13.056 1.00 0.00 H new ATOM 0 HD2 ARG B 47 9.577 -5.653 -11.983 1.00 0.00 H new ATOM 0 HD3 ARG B 47 9.635 -6.069 -13.684 1.00 0.00 H new ATOM 0 HE ARG B 47 11.831 -7.461 -12.821 1.00 0.00 H new ATOM 0 HH11 ARG B 47 10.514 -6.986 -10.015 1.00 0.00 H new ATOM 0 HH12 ARG B 47 9.679 -8.528 -9.803 1.00 0.00 H new ATOM 0 HH21 ARG B 47 9.958 -9.424 -13.170 1.00 0.00 H new ATOM 0 HH22 ARG B 47 9.367 -9.896 -11.574 1.00 0.00 H new ATOM 1831 N GLN B 48 9.656 -1.487 -10.423 1.00 0.00 N ATOM 1832 CA GLN B 48 9.690 -0.408 -9.422 1.00 0.00 C ATOM 1833 C GLN B 48 10.533 -0.855 -8.248 1.00 0.00 C ATOM 1834 O GLN B 48 10.063 -1.141 -7.174 1.00 0.00 O ATOM 1835 CB GLN B 48 8.280 -0.017 -9.048 1.00 0.00 C ATOM 1836 CG GLN B 48 7.920 1.203 -9.892 1.00 0.00 C ATOM 1837 CD GLN B 48 6.495 1.659 -9.566 1.00 0.00 C ATOM 1838 OE1 GLN B 48 5.605 0.845 -9.415 1.00 0.00 O ATOM 1839 NE2 GLN B 48 6.242 2.933 -9.436 1.00 0.00 N ATOM 0 H GLN B 48 8.874 -2.139 -10.368 1.00 0.00 H new ATOM 0 HA GLN B 48 10.157 0.491 -9.824 1.00 0.00 H new ATOM 0 HB2 GLN B 48 7.588 -0.837 -9.240 1.00 0.00 H new ATOM 0 HB3 GLN B 48 8.213 0.215 -7.985 1.00 0.00 H new ATOM 0 HG2 GLN B 48 8.624 2.012 -9.697 1.00 0.00 H new ATOM 0 HG3 GLN B 48 8.000 0.960 -10.951 1.00 0.00 H new ATOM 0 HE21 GLN B 48 6.988 3.617 -9.563 1.00 0.00 H new ATOM 0 HE22 GLN B 48 5.298 3.245 -9.208 1.00 0.00 H new ATOM 1848 N VAL B 49 11.803 -0.902 -8.500 1.00 0.00 N ATOM 1849 CA VAL B 49 12.802 -1.327 -7.494 1.00 0.00 C ATOM 1850 C VAL B 49 12.716 -0.394 -6.285 1.00 0.00 C ATOM 1851 O VAL B 49 12.313 0.741 -6.401 1.00 0.00 O ATOM 1852 CB VAL B 49 14.225 -1.257 -8.097 1.00 0.00 C ATOM 1853 CG1 VAL B 49 15.025 -2.450 -7.577 1.00 0.00 C ATOM 1854 CG2 VAL B 49 14.214 -1.302 -9.654 1.00 0.00 C ATOM 0 H VAL B 49 12.206 -0.652 -9.403 1.00 0.00 H new ATOM 0 HA VAL B 49 12.597 -2.353 -7.190 1.00 0.00 H new ATOM 0 HB VAL B 49 14.672 -0.309 -7.798 1.00 0.00 H new ATOM 0 HG11 VAL B 49 16.033 -2.420 -7.990 1.00 0.00 H new ATOM 0 HG12 VAL B 49 15.078 -2.406 -6.489 1.00 0.00 H new ATOM 0 HG13 VAL B 49 14.536 -3.376 -7.880 1.00 0.00 H new ATOM 0 HG21 VAL B 49 15.237 -1.250 -10.027 1.00 0.00 H new ATOM 0 HG22 VAL B 49 13.753 -2.232 -9.988 1.00 0.00 H new ATOM 0 HG23 VAL B 49 13.644 -0.456 -10.038 1.00 0.00 H new ATOM 1864 N CYS B 50 13.097 -0.856 -5.128 1.00 0.00 N ATOM 1865 CA CYS B 50 13.045 0.021 -3.929 1.00 0.00 C ATOM 1866 C CYS B 50 14.475 0.344 -3.500 1.00 0.00 C ATOM 1867 O CYS B 50 15.419 0.050 -4.207 1.00 0.00 O ATOM 1868 CB CYS B 50 12.339 -0.699 -2.785 1.00 0.00 C ATOM 1869 SG CYS B 50 11.400 0.497 -1.811 1.00 0.00 S ATOM 0 H CYS B 50 13.442 -1.802 -4.962 1.00 0.00 H new ATOM 0 HA CYS B 50 12.500 0.934 -4.170 1.00 0.00 H new ATOM 0 HB2 CYS B 50 11.673 -1.466 -3.180 1.00 0.00 H new ATOM 0 HB3 CYS B 50 13.069 -1.205 -2.154 1.00 0.00 H new ATOM 1874 N ALA B 51 14.651 0.929 -2.339 1.00 0.00 N ATOM 1875 CA ALA B 51 16.031 1.248 -1.864 1.00 0.00 C ATOM 1876 C ALA B 51 15.988 2.158 -0.641 1.00 0.00 C ATOM 1877 O ALA B 51 16.884 2.941 -0.426 1.00 0.00 O ATOM 1878 CB ALA B 51 16.807 1.950 -2.978 1.00 0.00 C ATOM 0 H ALA B 51 13.900 1.198 -1.703 1.00 0.00 H new ATOM 0 HA ALA B 51 16.523 0.314 -1.593 1.00 0.00 H new ATOM 0 HB1 ALA B 51 17.814 2.182 -2.630 1.00 0.00 H new ATOM 0 HB2 ALA B 51 16.866 1.296 -3.848 1.00 0.00 H new ATOM 0 HB3 ALA B 51 16.296 2.873 -3.252 1.00 0.00 H new ATOM 1884 N ASN B 52 14.978 2.049 0.176 1.00 0.00 N ATOM 1885 CA ASN B 52 14.910 2.900 1.391 1.00 0.00 C ATOM 1886 C ASN B 52 14.770 4.368 0.981 1.00 0.00 C ATOM 1887 O ASN B 52 15.359 4.784 0.004 1.00 0.00 O ATOM 1888 CB ASN B 52 16.199 2.715 2.187 1.00 0.00 C ATOM 1889 CG ASN B 52 16.056 3.368 3.564 1.00 0.00 C ATOM 1890 OD1 ASN B 52 16.588 4.435 3.802 1.00 0.00 O ATOM 1891 ND2 ASN B 52 15.345 2.776 4.485 1.00 0.00 N ATOM 0 H ASN B 52 14.196 1.405 0.052 1.00 0.00 H new ATOM 0 HA ASN B 52 14.051 2.615 1.998 1.00 0.00 H new ATOM 0 HB2 ASN B 52 16.419 1.653 2.299 1.00 0.00 H new ATOM 0 HB3 ASN B 52 17.036 3.159 1.649 1.00 0.00 H new ATOM 0 HD21 ASN B 52 15.237 3.209 5.402 1.00 0.00 H new ATOM 0 HD22 ASN B 52 14.898 1.881 4.287 1.00 0.00 H new ATOM 1898 N PRO B 53 13.991 5.123 1.729 1.00 0.00 N ATOM 1899 CA PRO B 53 13.782 6.539 1.426 1.00 0.00 C ATOM 1900 C PRO B 53 14.888 7.381 2.074 1.00 0.00 C ATOM 1901 O PRO B 53 15.224 8.452 1.606 1.00 0.00 O ATOM 1902 CB PRO B 53 12.456 6.855 2.107 1.00 0.00 C ATOM 1903 CG PRO B 53 12.307 5.827 3.261 1.00 0.00 C ATOM 1904 CD PRO B 53 13.241 4.650 2.918 1.00 0.00 C ATOM 0 HA PRO B 53 13.788 6.749 0.356 1.00 0.00 H new ATOM 0 HB2 PRO B 53 12.449 7.875 2.491 1.00 0.00 H new ATOM 0 HB3 PRO B 53 11.628 6.773 1.403 1.00 0.00 H new ATOM 0 HG2 PRO B 53 12.580 6.274 4.217 1.00 0.00 H new ATOM 0 HG3 PRO B 53 11.274 5.490 3.350 1.00 0.00 H new ATOM 0 HD2 PRO B 53 13.911 4.417 3.746 1.00 0.00 H new ATOM 0 HD3 PRO B 53 12.677 3.743 2.700 1.00 0.00 H new ATOM 1912 N GLU B 54 15.432 6.915 3.176 1.00 0.00 N ATOM 1913 CA GLU B 54 16.487 7.701 3.885 1.00 0.00 C ATOM 1914 C GLU B 54 17.831 6.961 3.886 1.00 0.00 C ATOM 1915 O GLU B 54 18.585 7.043 4.836 1.00 0.00 O ATOM 1916 CB GLU B 54 16.051 7.931 5.335 1.00 0.00 C ATOM 1917 CG GLU B 54 14.770 8.770 5.360 1.00 0.00 C ATOM 1918 CD GLU B 54 14.411 9.107 6.809 1.00 0.00 C ATOM 1919 OE1 GLU B 54 15.297 9.053 7.647 1.00 0.00 O ATOM 1920 OE2 GLU B 54 13.254 9.406 7.056 1.00 0.00 O ATOM 0 H GLU B 54 15.189 6.025 3.612 1.00 0.00 H new ATOM 0 HA GLU B 54 16.614 8.649 3.362 1.00 0.00 H new ATOM 0 HB2 GLU B 54 15.881 6.975 5.830 1.00 0.00 H new ATOM 0 HB3 GLU B 54 16.842 8.440 5.887 1.00 0.00 H new ATOM 0 HG2 GLU B 54 14.911 9.686 4.786 1.00 0.00 H new ATOM 0 HG3 GLU B 54 13.954 8.222 4.890 1.00 0.00 H new ATOM 1927 N LYS B 55 18.155 6.259 2.834 1.00 0.00 N ATOM 1928 CA LYS B 55 19.472 5.544 2.793 1.00 0.00 C ATOM 1929 C LYS B 55 20.548 6.474 2.201 1.00 0.00 C ATOM 1930 O LYS B 55 21.459 6.031 1.530 1.00 0.00 O ATOM 1931 CB LYS B 55 19.361 4.276 1.939 1.00 0.00 C ATOM 1932 CG LYS B 55 19.264 3.047 2.848 1.00 0.00 C ATOM 1933 CD LYS B 55 20.665 2.499 3.128 1.00 0.00 C ATOM 1934 CE LYS B 55 20.851 2.329 4.637 1.00 0.00 C ATOM 1935 NZ LYS B 55 21.480 3.556 5.202 1.00 0.00 N ATOM 0 H LYS B 55 17.572 6.147 2.004 1.00 0.00 H new ATOM 0 HA LYS B 55 19.752 5.263 3.808 1.00 0.00 H new ATOM 0 HB2 LYS B 55 18.483 4.335 1.296 1.00 0.00 H new ATOM 0 HB3 LYS B 55 20.229 4.189 1.286 1.00 0.00 H new ATOM 0 HG2 LYS B 55 18.774 3.313 3.784 1.00 0.00 H new ATOM 0 HG3 LYS B 55 18.651 2.280 2.374 1.00 0.00 H new ATOM 0 HD2 LYS B 55 20.801 1.542 2.623 1.00 0.00 H new ATOM 0 HD3 LYS B 55 21.419 3.179 2.732 1.00 0.00 H new ATOM 0 HE2 LYS B 55 19.888 2.148 5.115 1.00 0.00 H new ATOM 0 HE3 LYS B 55 21.476 1.460 4.841 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 22.423 3.323 5.573 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 21.569 4.275 4.456 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 20.887 3.927 5.972 1.00 0.00 H new ATOM 1949 N LYS B 56 20.454 7.754 2.462 1.00 0.00 N ATOM 1950 CA LYS B 56 21.466 8.725 1.944 1.00 0.00 C ATOM 1951 C LYS B 56 21.616 8.615 0.420 1.00 0.00 C ATOM 1952 O LYS B 56 20.967 9.319 -0.328 1.00 0.00 O ATOM 1953 CB LYS B 56 22.815 8.457 2.617 1.00 0.00 C ATOM 1954 CG LYS B 56 22.854 9.153 3.979 1.00 0.00 C ATOM 1955 CD LYS B 56 23.648 8.297 4.966 1.00 0.00 C ATOM 1956 CE LYS B 56 22.691 7.668 5.979 1.00 0.00 C ATOM 1957 NZ LYS B 56 23.137 6.281 6.287 1.00 0.00 N ATOM 0 H LYS B 56 19.709 8.172 3.019 1.00 0.00 H new ATOM 0 HA LYS B 56 21.126 9.734 2.177 1.00 0.00 H new ATOM 0 HB2 LYS B 56 22.965 7.384 2.741 1.00 0.00 H new ATOM 0 HB3 LYS B 56 23.626 8.822 1.987 1.00 0.00 H new ATOM 0 HG2 LYS B 56 23.313 10.137 3.883 1.00 0.00 H new ATOM 0 HG3 LYS B 56 21.841 9.308 4.349 1.00 0.00 H new ATOM 0 HD2 LYS B 56 24.193 7.518 4.432 1.00 0.00 H new ATOM 0 HD3 LYS B 56 24.389 8.909 5.481 1.00 0.00 H new ATOM 0 HE2 LYS B 56 22.666 8.265 6.891 1.00 0.00 H new ATOM 0 HE3 LYS B 56 21.677 7.655 5.579 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 22.487 5.852 6.976 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 23.139 5.715 5.414 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 24.097 6.306 6.686 1.00 0.00 H new ATOM 1971 N TRP B 57 22.488 7.757 -0.043 1.00 0.00 N ATOM 1972 CA TRP B 57 22.722 7.607 -1.512 1.00 0.00 C ATOM 1973 C TRP B 57 21.398 7.576 -2.293 1.00 0.00 C ATOM 1974 O TRP B 57 21.342 7.996 -3.433 1.00 0.00 O ATOM 1975 CB TRP B 57 23.525 6.329 -1.751 1.00 0.00 C ATOM 1976 CG TRP B 57 22.711 5.155 -1.386 1.00 0.00 C ATOM 1977 CD1 TRP B 57 22.845 4.389 -0.282 1.00 0.00 C ATOM 1978 CD2 TRP B 57 21.709 4.543 -2.199 1.00 0.00 C ATOM 1979 NE1 TRP B 57 21.937 3.347 -0.359 1.00 0.00 N ATOM 1980 CE2 TRP B 57 21.209 3.398 -1.530 1.00 0.00 C ATOM 1981 CE3 TRP B 57 21.185 4.884 -3.456 1.00 0.00 C ATOM 1982 CZ2 TRP B 57 20.210 2.602 -2.107 1.00 0.00 C ATOM 1983 CZ3 TRP B 57 20.209 4.087 -4.055 1.00 0.00 C ATOM 1984 CH2 TRP B 57 19.718 2.943 -3.387 1.00 0.00 C ATOM 0 H TRP B 57 23.056 7.145 0.543 1.00 0.00 H new ATOM 0 HA TRP B 57 23.283 8.469 -1.875 1.00 0.00 H new ATOM 0 HB2 TRP B 57 23.823 6.266 -2.798 1.00 0.00 H new ATOM 0 HB3 TRP B 57 24.440 6.347 -1.159 1.00 0.00 H new ATOM 0 HD1 TRP B 57 23.543 4.560 0.525 1.00 0.00 H new ATOM 0 HE1 TRP B 57 21.821 2.632 0.359 1.00 0.00 H new ATOM 0 HE3 TRP B 57 21.540 5.769 -3.963 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 19.822 1.742 -1.582 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 19.828 4.345 -5.032 1.00 0.00 H new ATOM 0 HH2 TRP B 57 18.965 2.327 -3.856 1.00 0.00 H new ATOM 1995 N VAL B 58 20.338 7.093 -1.708 1.00 0.00 N ATOM 1996 CA VAL B 58 19.039 7.062 -2.459 1.00 0.00 C ATOM 1997 C VAL B 58 18.643 8.480 -2.868 1.00 0.00 C ATOM 1998 O VAL B 58 18.382 8.743 -4.020 1.00 0.00 O ATOM 1999 CB VAL B 58 17.908 6.470 -1.612 1.00 0.00 C ATOM 2000 CG1 VAL B 58 17.859 4.966 -1.814 1.00 0.00 C ATOM 2001 CG2 VAL B 58 18.110 6.783 -0.140 1.00 0.00 C ATOM 0 H VAL B 58 20.307 6.722 -0.758 1.00 0.00 H new ATOM 0 HA VAL B 58 19.186 6.433 -3.337 1.00 0.00 H new ATOM 0 HB VAL B 58 16.966 6.917 -1.930 1.00 0.00 H new ATOM 0 HG11 VAL B 58 17.055 4.544 -1.212 1.00 0.00 H new ATOM 0 HG12 VAL B 58 17.678 4.746 -2.866 1.00 0.00 H new ATOM 0 HG13 VAL B 58 18.809 4.527 -1.509 1.00 0.00 H new ATOM 0 HG21 VAL B 58 17.294 6.352 0.439 1.00 0.00 H new ATOM 0 HG22 VAL B 58 19.056 6.359 0.196 1.00 0.00 H new ATOM 0 HG23 VAL B 58 18.125 7.863 0.003 1.00 0.00 H new ATOM 2011 N ARG B 59 18.586 9.393 -1.936 1.00 0.00 N ATOM 2012 CA ARG B 59 18.200 10.789 -2.282 1.00 0.00 C ATOM 2013 C ARG B 59 19.261 11.385 -3.201 1.00 0.00 C ATOM 2014 O ARG B 59 18.970 12.194 -4.059 1.00 0.00 O ATOM 2015 CB ARG B 59 18.104 11.628 -1.004 1.00 0.00 C ATOM 2016 CG ARG B 59 16.636 11.938 -0.701 1.00 0.00 C ATOM 2017 CD ARG B 59 16.476 13.437 -0.432 1.00 0.00 C ATOM 2018 NE ARG B 59 15.867 14.094 -1.624 1.00 0.00 N ATOM 2019 CZ ARG B 59 15.771 15.396 -1.675 1.00 0.00 C ATOM 2020 NH1 ARG B 59 16.752 16.140 -1.243 1.00 0.00 N ATOM 2021 NH2 ARG B 59 14.693 15.952 -2.157 1.00 0.00 N ATOM 0 H ARG B 59 18.790 9.231 -0.950 1.00 0.00 H new ATOM 0 HA ARG B 59 17.233 10.788 -2.785 1.00 0.00 H new ATOM 0 HB2 ARG B 59 18.552 11.089 -0.169 1.00 0.00 H new ATOM 0 HB3 ARG B 59 18.665 12.555 -1.123 1.00 0.00 H new ATOM 0 HG2 ARG B 59 16.009 11.639 -1.541 1.00 0.00 H new ATOM 0 HG3 ARG B 59 16.303 11.365 0.164 1.00 0.00 H new ATOM 0 HD2 ARG B 59 15.847 13.595 0.444 1.00 0.00 H new ATOM 0 HD3 ARG B 59 17.446 13.884 -0.213 1.00 0.00 H new ATOM 0 HE ARG B 59 15.525 13.527 -2.400 1.00 0.00 H new ATOM 0 HH11 ARG B 59 17.594 15.705 -0.865 1.00 0.00 H new ATOM 0 HH12 ARG B 59 16.677 17.156 -1.283 1.00 0.00 H new ATOM 0 HH21 ARG B 59 13.926 15.370 -2.494 1.00 0.00 H new ATOM 0 HH22 ARG B 59 14.618 16.968 -2.197 1.00 0.00 H new ATOM 2035 N GLU B 60 20.490 10.984 -3.036 1.00 0.00 N ATOM 2036 CA GLU B 60 21.567 11.522 -3.909 1.00 0.00 C ATOM 2037 C GLU B 60 21.256 11.149 -5.357 1.00 0.00 C ATOM 2038 O GLU B 60 21.653 11.824 -6.285 1.00 0.00 O ATOM 2039 CB GLU B 60 22.913 10.920 -3.501 1.00 0.00 C ATOM 2040 CG GLU B 60 23.626 11.876 -2.542 1.00 0.00 C ATOM 2041 CD GLU B 60 25.093 11.466 -2.406 1.00 0.00 C ATOM 2042 OE1 GLU B 60 25.347 10.433 -1.809 1.00 0.00 O ATOM 2043 OE2 GLU B 60 25.939 12.195 -2.899 1.00 0.00 O ATOM 0 H GLU B 60 20.794 10.308 -2.335 1.00 0.00 H new ATOM 0 HA GLU B 60 21.619 12.606 -3.807 1.00 0.00 H new ATOM 0 HB2 GLU B 60 22.761 9.953 -3.022 1.00 0.00 H new ATOM 0 HB3 GLU B 60 23.529 10.746 -4.383 1.00 0.00 H new ATOM 0 HG2 GLU B 60 23.557 12.898 -2.913 1.00 0.00 H new ATOM 0 HG3 GLU B 60 23.141 11.857 -1.566 1.00 0.00 H new ATOM 2050 N TYR B 61 20.539 10.076 -5.555 1.00 0.00 N ATOM 2051 CA TYR B 61 20.190 9.657 -6.939 1.00 0.00 C ATOM 2052 C TYR B 61 18.834 10.256 -7.320 1.00 0.00 C ATOM 2053 O TYR B 61 18.545 10.471 -8.479 1.00 0.00 O ATOM 2054 CB TYR B 61 20.117 8.125 -7.011 1.00 0.00 C ATOM 2055 CG TYR B 61 21.447 7.492 -6.625 1.00 0.00 C ATOM 2056 CD1 TYR B 61 22.627 8.275 -6.516 1.00 0.00 C ATOM 2057 CD2 TYR B 61 21.508 6.100 -6.393 1.00 0.00 C ATOM 2058 CE1 TYR B 61 23.853 7.662 -6.173 1.00 0.00 C ATOM 2059 CE2 TYR B 61 22.736 5.490 -6.054 1.00 0.00 C ATOM 2060 CZ TYR B 61 23.907 6.271 -5.943 1.00 0.00 C ATOM 2061 OH TYR B 61 25.106 5.672 -5.612 1.00 0.00 O ATOM 0 H TYR B 61 20.180 9.472 -4.816 1.00 0.00 H new ATOM 0 HA TYR B 61 20.953 10.012 -7.632 1.00 0.00 H new ATOM 0 HB2 TYR B 61 19.333 7.764 -6.346 1.00 0.00 H new ATOM 0 HB3 TYR B 61 19.845 7.818 -8.021 1.00 0.00 H new ATOM 0 HD1 TYR B 61 22.587 9.339 -6.695 1.00 0.00 H new ATOM 0 HD2 TYR B 61 20.613 5.501 -6.475 1.00 0.00 H new ATOM 0 HE1 TYR B 61 24.749 8.259 -6.087 1.00 0.00 H new ATOM 0 HE2 TYR B 61 22.779 4.425 -5.880 1.00 0.00 H new ATOM 0 HH TYR B 61 25.668 6.311 -5.126 1.00 0.00 H new ATOM 2071 N ILE B 62 18.000 10.533 -6.351 1.00 0.00 N ATOM 2072 CA ILE B 62 16.669 11.127 -6.668 1.00 0.00 C ATOM 2073 C ILE B 62 16.895 12.503 -7.317 1.00 0.00 C ATOM 2074 O ILE B 62 16.361 12.799 -8.368 1.00 0.00 O ATOM 2075 CB ILE B 62 15.840 11.233 -5.364 1.00 0.00 C ATOM 2076 CG1 ILE B 62 14.983 9.972 -5.212 1.00 0.00 C ATOM 2077 CG2 ILE B 62 14.908 12.455 -5.381 1.00 0.00 C ATOM 2078 CD1 ILE B 62 15.878 8.763 -4.933 1.00 0.00 C ATOM 0 H ILE B 62 18.182 10.374 -5.360 1.00 0.00 H new ATOM 0 HA ILE B 62 16.112 10.503 -7.367 1.00 0.00 H new ATOM 0 HB ILE B 62 16.536 11.339 -4.532 1.00 0.00 H new ATOM 0 HG12 ILE B 62 14.270 10.103 -4.398 1.00 0.00 H new ATOM 0 HG13 ILE B 62 14.403 9.804 -6.120 1.00 0.00 H new ATOM 0 HG21 ILE B 62 14.343 12.495 -4.450 1.00 0.00 H new ATOM 0 HG22 ILE B 62 15.501 13.364 -5.485 1.00 0.00 H new ATOM 0 HG23 ILE B 62 14.218 12.374 -6.221 1.00 0.00 H new ATOM 0 HD11 ILE B 62 15.261 7.871 -4.826 1.00 0.00 H new ATOM 0 HD12 ILE B 62 16.574 8.626 -5.761 1.00 0.00 H new ATOM 0 HD13 ILE B 62 16.438 8.929 -4.013 1.00 0.00 H new ATOM 2090 N ASN B 63 17.683 13.341 -6.700 1.00 0.00 N ATOM 2091 CA ASN B 63 17.940 14.688 -7.282 1.00 0.00 C ATOM 2092 C ASN B 63 18.879 14.551 -8.482 1.00 0.00 C ATOM 2093 O ASN B 63 18.717 15.212 -9.489 1.00 0.00 O ATOM 2094 CB ASN B 63 18.589 15.585 -6.226 1.00 0.00 C ATOM 2095 CG ASN B 63 17.526 16.490 -5.602 1.00 0.00 C ATOM 2096 OD1 ASN B 63 17.281 17.579 -6.081 1.00 0.00 O ATOM 2097 ND2 ASN B 63 16.879 16.082 -4.544 1.00 0.00 N ATOM 0 H ASN B 63 18.159 13.151 -5.818 1.00 0.00 H new ATOM 0 HA ASN B 63 16.998 15.132 -7.605 1.00 0.00 H new ATOM 0 HB2 ASN B 63 19.060 14.975 -5.455 1.00 0.00 H new ATOM 0 HB3 ASN B 63 19.375 16.189 -6.680 1.00 0.00 H new ATOM 0 HD21 ASN B 63 16.168 16.678 -4.120 1.00 0.00 H new ATOM 0 HD22 ASN B 63 17.085 15.168 -4.142 1.00 0.00 H new ATOM 2104 N SER B 64 19.861 13.697 -8.383 1.00 0.00 N ATOM 2105 CA SER B 64 20.810 13.515 -9.516 1.00 0.00 C ATOM 2106 C SER B 64 20.053 13.002 -10.745 1.00 0.00 C ATOM 2107 O SER B 64 20.507 13.135 -11.865 1.00 0.00 O ATOM 2108 CB SER B 64 21.884 12.500 -9.122 1.00 0.00 C ATOM 2109 OG SER B 64 22.730 13.064 -8.130 1.00 0.00 O ATOM 0 H SER B 64 20.047 13.117 -7.565 1.00 0.00 H new ATOM 0 HA SER B 64 21.278 14.471 -9.752 1.00 0.00 H new ATOM 0 HB2 SER B 64 21.418 11.591 -8.743 1.00 0.00 H new ATOM 0 HB3 SER B 64 22.470 12.217 -9.996 1.00 0.00 H new ATOM 0 HG SER B 64 22.667 12.535 -7.307 1.00 0.00 H new ATOM 2115 N LEU B 65 18.905 12.415 -10.547 1.00 0.00 N ATOM 2116 CA LEU B 65 18.125 11.894 -11.704 1.00 0.00 C ATOM 2117 C LEU B 65 17.344 13.041 -12.348 1.00 0.00 C ATOM 2118 O LEU B 65 16.792 13.886 -11.672 1.00 0.00 O ATOM 2119 CB LEU B 65 17.147 10.821 -11.220 1.00 0.00 C ATOM 2120 CG LEU B 65 17.869 9.475 -11.125 1.00 0.00 C ATOM 2121 CD1 LEU B 65 17.122 8.563 -10.150 1.00 0.00 C ATOM 2122 CD2 LEU B 65 17.907 8.819 -12.507 1.00 0.00 C ATOM 0 H LEU B 65 18.473 12.274 -9.634 1.00 0.00 H new ATOM 0 HA LEU B 65 18.806 11.460 -12.436 1.00 0.00 H new ATOM 0 HB2 LEU B 65 16.741 11.097 -10.247 1.00 0.00 H new ATOM 0 HB3 LEU B 65 16.304 10.746 -11.907 1.00 0.00 H new ATOM 0 HG LEU B 65 18.887 9.633 -10.768 1.00 0.00 H new ATOM 0 HD11 LEU B 65 17.636 7.604 -10.082 1.00 0.00 H new ATOM 0 HD12 LEU B 65 17.093 9.029 -9.165 1.00 0.00 H new ATOM 0 HD13 LEU B 65 16.104 8.405 -10.507 1.00 0.00 H new ATOM 0 HD21 LEU B 65 18.421 7.860 -12.441 1.00 0.00 H new ATOM 0 HD22 LEU B 65 16.889 8.661 -12.863 1.00 0.00 H new ATOM 0 HD23 LEU B 65 18.438 9.468 -13.203 1.00 0.00 H new