USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1221 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 NoAdj-H: A 125 HIS HD1 : A 125 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 146 HIS HD1 : A 146 HIS ND1 : A 202 ZNZN :(H bumps) USER MOD Set 1.1: A 93 SER OG : rot 180:sc= 0.00943 USER MOD Set 1.2: A 97 ASN : amide:sc= -0.0304 X(o=-0.021,f=-0.47!) USER MOD Set 2.1: A 72 MET CE :methyl 159:sc= -0.0775 (180deg=-0.616) USER MOD Set 2.2: A 73 THR OG1 : rot 84:sc= 0.851 USER MOD Set 3.1: A 52 ASN : amide:sc= -1.76! C(o=-5.1!,f=-9!) USER MOD Set 3.2: A 55 CYS SG : rot -119:sc= -3.32! USER MOD Set 4.1: A 33 GLN : amide:sc= -0.345 K(o=0.4,f=-9.4!) USER MOD Set 4.2: A 39 LYS NZ :NH3+ 137:sc= 0.74 (180deg=-0.979) USER MOD Single : A 1 MET CE :methyl 158:sc= -0.185 (180deg=-0.757) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0 (180deg=-0.0229) USER MOD Single : A 2 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 43:sc= 0.0397 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0.477 K(o=0.48,f=-4.5!) USER MOD Single : A 15 LYS NZ :NH3+ 129:sc= -0.0597 (180deg=-0.417) USER MOD Single : A 21 TYR OH : rot 159:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.857 K(o=-0.86,f=0) USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 43 THR OG1 : rot -81:sc= 0.662 USER MOD Single : A 45 THR OG1 : rot -96:sc= 1.33 USER MOD Single : A 49 GLN : amide:sc= -0.0674 K(o=-0.067,f=-0.71) USER MOD Single : A 50 ASN : amide:sc= -0.0428 K(o=-0.043,f=-1.4!) USER MOD Single : A 56 LYS NZ :NH3+ 150:sc=-0.00906 (180deg=-0.266) USER MOD Single : A 57 THR OG1 : rot 77:sc= 1.14 USER MOD Single : A 60 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0264) USER MOD Single : A 67 THR OG1 : rot 86:sc= 1.25 USER MOD Single : A 71 MET CE :methyl -165:sc= -0.0612 (180deg=-0.372) USER MOD Single : A 75 CYS SG : rot 96:sc= -1.64! USER MOD Single : A 76 GLN : amide:sc= 0.599 K(o=0.6,f=-5.6!) USER MOD Single : A 83 HIS : no HD1:sc= -0.112 X(o=-0.11,f=-0.0071) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -0.142 K(o=-0.14,f=-0.79) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0082 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0428 USER MOD Single : A 102 MET CE :methyl 157:sc= -0.15 (180deg=-0.712) USER MOD Single : A 104 GLN : amide:sc= 0.00113 X(o=0.0011,f=-0.45) USER MOD Single : A 105 LYS NZ :NH3+ 171:sc= -0.0148 (180deg=-0.14) USER MOD Single : A 107 ASN : amide:sc= -0.804 X(o=-0.8,f=-0.93) USER MOD Single : A 110 ASN : amide:sc= -0.0256 X(o=-0.026,f=-0.026) USER MOD Single : A 111 GLN : amide:sc= -1.02 K(o=-1,f=-1.7) USER MOD Single : A 113 LYS NZ :NH3+ -159:sc= -0.0688 (180deg=-0.48) USER MOD Single : A 114 THR OG1 : rot -9:sc= 0.532 USER MOD Single : A 116 LYS NZ :NH3+ -167:sc= -0.0185 (180deg=-0.188) USER MOD Single : A 119 ASN : amide:sc= -0.103 K(o=-0.1,f=-2.4) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 ASN : amide:sc= -1.65! C(o=-1.7!,f=-1.4!) USER MOD Single : A 135 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0797) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 GLN : amide:sc= -1.01 K(o=-1,f=-5.4!) USER MOD Single : A 148 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 ASN : amide:sc= 0 X(o=0,f=0.049) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.410 -4.181 -23.483 1.00 20.39 N ATOM 2 CA MET A 1 20.403 -3.778 -22.058 1.00 19.96 C ATOM 3 C MET A 1 21.006 -2.391 -21.884 1.00 19.35 C ATOM 4 O MET A 1 20.357 -1.492 -21.344 1.00 19.23 O ATOM 5 CB MET A 1 21.190 -4.775 -21.203 1.00 20.24 C ATOM 6 CG MET A 1 20.557 -6.151 -21.108 1.00 20.56 C ATOM 7 SD MET A 1 21.498 -7.281 -20.062 1.00 20.81 S ATOM 8 CE MET A 1 21.420 -6.436 -18.483 1.00 20.97 C ATOM 0 H1 MET A 1 19.919 -5.091 -23.589 1.00 20.39 H new ATOM 0 H2 MET A 1 19.924 -3.457 -24.051 1.00 20.39 H new ATOM 0 H3 MET A 1 21.392 -4.278 -23.812 1.00 20.39 H new ATOM 0 HA MET A 1 19.364 -3.764 -21.729 1.00 19.96 H new ATOM 0 HB2 MET A 1 22.194 -4.877 -21.616 1.00 20.24 H new ATOM 0 HB3 MET A 1 21.299 -4.368 -20.198 1.00 20.24 H new ATOM 0 HG2 MET A 1 19.546 -6.054 -20.713 1.00 20.56 H new ATOM 0 HG3 MET A 1 20.470 -6.576 -22.108 1.00 20.56 H new ATOM 0 HE1 MET A 1 21.595 -7.151 -17.679 1.00 20.97 H new ATOM 0 HE2 MET A 1 22.182 -5.658 -18.449 1.00 20.97 H new ATOM 0 HE3 MET A 1 20.435 -5.985 -18.360 1.00 20.97 H new ATOM 20 N TYR A 2 22.249 -2.231 -22.339 1.00 19.08 N ATOM 21 CA TYR A 2 22.992 -0.986 -22.167 1.00 18.61 C ATOM 22 C TYR A 2 23.058 -0.628 -20.685 1.00 17.62 C ATOM 23 O TYR A 2 22.372 0.286 -20.217 1.00 17.34 O ATOM 24 CB TYR A 2 22.365 0.154 -22.980 1.00 19.12 C ATOM 25 CG TYR A 2 23.213 1.410 -23.025 1.00 19.80 C ATOM 26 CD1 TYR A 2 22.864 2.537 -22.291 1.00 19.93 C ATOM 27 CD2 TYR A 2 24.364 1.462 -23.799 1.00 20.43 C ATOM 28 CE1 TYR A 2 23.638 3.681 -22.329 1.00 20.67 C ATOM 29 CE2 TYR A 2 25.144 2.603 -23.842 1.00 21.16 C ATOM 30 CZ TYR A 2 24.776 3.709 -23.105 1.00 21.27 C ATOM 31 OH TYR A 2 25.550 4.848 -23.145 1.00 22.10 O ATOM 0 H TYR A 2 22.765 -2.958 -22.834 1.00 19.08 H new ATOM 0 HA TYR A 2 24.005 -1.131 -22.542 1.00 18.61 H new ATOM 0 HB2 TYR A 2 22.190 -0.192 -23.999 1.00 19.12 H new ATOM 0 HB3 TYR A 2 21.392 0.399 -22.555 1.00 19.12 H new ATOM 0 HD1 TYR A 2 21.973 2.519 -21.681 1.00 19.93 H new ATOM 0 HD2 TYR A 2 24.655 0.597 -24.377 1.00 20.43 H new ATOM 0 HE1 TYR A 2 23.352 4.549 -21.753 1.00 20.67 H new ATOM 0 HE2 TYR A 2 26.037 2.628 -24.449 1.00 21.16 H new ATOM 0 HH TYR A 2 26.316 4.702 -23.738 1.00 22.10 H new ATOM 41 N SER A 3 23.859 -1.385 -19.955 1.00 17.23 N ATOM 42 CA SER A 3 24.032 -1.181 -18.529 1.00 16.40 C ATOM 43 C SER A 3 24.591 0.211 -18.234 1.00 15.74 C ATOM 44 O SER A 3 25.638 0.599 -18.757 1.00 15.62 O ATOM 45 CB SER A 3 24.959 -2.264 -17.976 1.00 16.48 C ATOM 46 OG SER A 3 26.096 -2.438 -18.810 1.00 16.86 O ATOM 0 H SER A 3 24.407 -2.157 -20.335 1.00 17.23 H new ATOM 0 HA SER A 3 23.060 -1.251 -18.041 1.00 16.40 H new ATOM 0 HB2 SER A 3 25.280 -1.994 -16.970 1.00 16.48 H new ATOM 0 HB3 SER A 3 24.416 -3.206 -17.895 1.00 16.48 H new ATOM 0 HG SER A 3 26.435 -1.562 -19.088 1.00 16.86 H new ATOM 52 N PRO A 4 23.882 0.989 -17.403 1.00 15.46 N ATOM 53 CA PRO A 4 24.324 2.323 -17.012 1.00 15.00 C ATOM 54 C PRO A 4 25.468 2.264 -16.005 1.00 14.24 C ATOM 55 O PRO A 4 25.695 1.240 -15.353 1.00 13.43 O ATOM 56 CB PRO A 4 23.076 2.931 -16.373 1.00 15.20 C ATOM 57 CG PRO A 4 22.338 1.763 -15.826 1.00 15.47 C ATOM 58 CD PRO A 4 22.593 0.629 -16.782 1.00 15.76 C ATOM 0 HA PRO A 4 24.708 2.900 -17.854 1.00 15.00 H new ATOM 0 HB2 PRO A 4 23.337 3.640 -15.588 1.00 15.20 H new ATOM 0 HB3 PRO A 4 22.477 3.472 -17.106 1.00 15.20 H new ATOM 0 HG2 PRO A 4 22.687 1.515 -14.824 1.00 15.47 H new ATOM 0 HG3 PRO A 4 21.272 1.976 -15.748 1.00 15.47 H new ATOM 0 HD2 PRO A 4 22.650 -0.328 -16.264 1.00 15.76 H new ATOM 0 HD3 PRO A 4 21.799 0.543 -17.524 1.00 15.76 H new ATOM 66 N THR A 5 26.179 3.370 -15.880 1.00 14.65 N ATOM 67 CA THR A 5 27.343 3.447 -15.015 1.00 14.22 C ATOM 68 C THR A 5 26.917 3.511 -13.551 1.00 13.17 C ATOM 69 O THR A 5 27.700 3.229 -12.645 1.00 12.56 O ATOM 70 CB THR A 5 28.194 4.680 -15.368 1.00 15.22 C ATOM 71 OG1 THR A 5 28.448 4.697 -16.780 1.00 15.79 O ATOM 72 CG2 THR A 5 29.512 4.669 -14.613 1.00 15.33 C ATOM 0 H THR A 5 25.967 4.237 -16.373 1.00 14.65 H new ATOM 0 HA THR A 5 27.943 2.550 -15.168 1.00 14.22 H new ATOM 0 HB THR A 5 27.642 5.574 -15.079 1.00 15.22 H new ATOM 0 HG1 THR A 5 28.988 5.483 -17.006 1.00 15.79 H new ATOM 0 HG21 THR A 5 30.093 5.551 -14.882 1.00 15.33 H new ATOM 0 HG22 THR A 5 29.317 4.676 -13.541 1.00 15.33 H new ATOM 0 HG23 THR A 5 30.073 3.772 -14.874 1.00 15.33 H new ATOM 80 N SER A 6 25.654 3.853 -13.340 1.00 13.06 N ATOM 81 CA SER A 6 25.075 3.938 -12.007 1.00 12.17 C ATOM 82 C SER A 6 25.135 2.593 -11.278 1.00 11.07 C ATOM 83 O SER A 6 24.968 2.540 -10.064 1.00 10.23 O ATOM 84 CB SER A 6 23.632 4.425 -12.105 1.00 12.55 C ATOM 85 OG SER A 6 23.556 5.647 -12.823 1.00 13.32 O ATOM 0 H SER A 6 25.001 4.080 -14.090 1.00 13.06 H new ATOM 0 HA SER A 6 25.661 4.650 -11.426 1.00 12.17 H new ATOM 0 HB2 SER A 6 23.022 3.669 -12.600 1.00 12.55 H new ATOM 0 HB3 SER A 6 23.221 4.561 -11.104 1.00 12.55 H new ATOM 0 HG SER A 6 22.622 5.939 -12.874 1.00 13.32 H new ATOM 91 N ILE A 7 25.365 1.513 -12.023 1.00 11.18 N ATOM 92 CA ILE A 7 25.465 0.185 -11.423 1.00 10.37 C ATOM 93 C ILE A 7 26.741 0.065 -10.592 1.00 9.98 C ATOM 94 O ILE A 7 26.721 -0.452 -9.478 1.00 9.20 O ATOM 95 CB ILE A 7 25.435 -0.930 -12.494 1.00 10.88 C ATOM 96 CG1 ILE A 7 24.100 -0.905 -13.244 1.00 11.65 C ATOM 97 CG2 ILE A 7 25.664 -2.296 -11.856 1.00 10.56 C ATOM 98 CD1 ILE A 7 23.973 -1.979 -14.305 1.00 12.15 C ATOM 0 H ILE A 7 25.485 1.531 -13.036 1.00 11.18 H new ATOM 0 HA ILE A 7 24.598 0.058 -10.774 1.00 10.37 H new ATOM 0 HB ILE A 7 26.240 -0.748 -13.206 1.00 10.88 H new ATOM 0 HG12 ILE A 7 23.288 -1.020 -12.526 1.00 11.65 H new ATOM 0 HG13 ILE A 7 23.975 0.071 -13.712 1.00 11.65 H new ATOM 0 HG21 ILE A 7 25.639 -3.066 -12.627 1.00 10.56 H new ATOM 0 HG22 ILE A 7 26.635 -2.308 -11.362 1.00 10.56 H new ATOM 0 HG23 ILE A 7 24.881 -2.491 -11.123 1.00 10.56 H new ATOM 0 HD11 ILE A 7 23.001 -1.896 -14.792 1.00 12.15 H new ATOM 0 HD12 ILE A 7 24.762 -1.853 -15.046 1.00 12.15 H new ATOM 0 HD13 ILE A 7 24.064 -2.961 -13.841 1.00 12.15 H new ATOM 110 N LEU A 8 27.854 0.535 -11.140 1.00 10.74 N ATOM 111 CA LEU A 8 29.115 0.533 -10.410 1.00 10.77 C ATOM 112 C LEU A 8 29.221 1.778 -9.532 1.00 10.46 C ATOM 113 O LEU A 8 29.841 1.757 -8.473 1.00 10.30 O ATOM 114 CB LEU A 8 30.300 0.432 -11.382 1.00 11.94 C ATOM 115 CG LEU A 8 30.422 1.550 -12.423 1.00 12.47 C ATOM 116 CD1 LEU A 8 31.236 2.718 -11.883 1.00 12.44 C ATOM 117 CD2 LEU A 8 31.039 1.014 -13.701 1.00 13.09 C ATOM 0 H LEU A 8 27.910 0.921 -12.083 1.00 10.74 H new ATOM 0 HA LEU A 8 29.144 -0.341 -9.759 1.00 10.77 H new ATOM 0 HB2 LEU A 8 31.220 0.406 -10.798 1.00 11.94 H new ATOM 0 HB3 LEU A 8 30.230 -0.520 -11.909 1.00 11.94 H new ATOM 0 HG LEU A 8 29.420 1.917 -12.646 1.00 12.47 H new ATOM 0 HD11 LEU A 8 31.305 3.496 -12.644 1.00 12.44 H new ATOM 0 HD12 LEU A 8 30.749 3.121 -10.995 1.00 12.44 H new ATOM 0 HD13 LEU A 8 32.237 2.374 -11.623 1.00 12.44 H new ATOM 0 HD21 LEU A 8 31.120 1.819 -14.432 1.00 13.09 H new ATOM 0 HD22 LEU A 8 32.031 0.617 -13.487 1.00 13.09 H new ATOM 0 HD23 LEU A 8 30.410 0.220 -14.104 1.00 13.09 H new ATOM 129 N ASP A 9 28.584 2.853 -9.980 1.00 10.57 N ATOM 130 CA ASP A 9 28.599 4.130 -9.272 1.00 10.51 C ATOM 131 C ASP A 9 27.393 4.223 -8.340 1.00 9.48 C ATOM 132 O ASP A 9 26.843 5.298 -8.121 1.00 9.50 O ATOM 133 CB ASP A 9 28.611 5.298 -10.267 1.00 11.48 C ATOM 134 CG ASP A 9 28.928 6.631 -9.611 1.00 12.16 C ATOM 135 OD1 ASP A 9 28.117 7.573 -9.747 1.00 12.46 O ATOM 136 OD2 ASP A 9 29.973 6.733 -8.928 1.00 12.54 O ATOM 0 H ASP A 9 28.042 2.866 -10.844 1.00 10.57 H new ATOM 0 HA ASP A 9 29.507 4.190 -8.672 1.00 10.51 H new ATOM 0 HB2 ASP A 9 29.347 5.098 -11.045 1.00 11.48 H new ATOM 0 HB3 ASP A 9 27.639 5.362 -10.756 1.00 11.48 H new ATOM 141 N ILE A 10 26.955 3.061 -7.868 1.00 8.74 N ATOM 142 CA ILE A 10 25.779 2.928 -7.003 1.00 7.86 C ATOM 143 C ILE A 10 25.818 3.831 -5.759 1.00 7.43 C ATOM 144 O ILE A 10 26.227 3.416 -4.678 1.00 6.73 O ATOM 145 CB ILE A 10 25.559 1.448 -6.578 1.00 7.25 C ATOM 146 CG1 ILE A 10 26.876 0.641 -6.569 1.00 7.42 C ATOM 147 CG2 ILE A 10 24.560 0.790 -7.506 1.00 7.55 C ATOM 148 CD1 ILE A 10 27.925 1.127 -5.589 1.00 7.84 C ATOM 0 H ILE A 10 27.409 2.172 -8.075 1.00 8.74 H new ATOM 0 HA ILE A 10 24.936 3.264 -7.607 1.00 7.86 H new ATOM 0 HB ILE A 10 25.172 1.454 -5.559 1.00 7.25 H new ATOM 0 HG12 ILE A 10 26.644 -0.399 -6.342 1.00 7.42 H new ATOM 0 HG13 ILE A 10 27.302 0.661 -7.572 1.00 7.42 H new ATOM 0 HG21 ILE A 10 24.410 -0.246 -7.203 1.00 7.55 H new ATOM 0 HG22 ILE A 10 23.611 1.324 -7.456 1.00 7.55 H new ATOM 0 HG23 ILE A 10 24.939 0.818 -8.528 1.00 7.55 H new ATOM 0 HD11 ILE A 10 28.810 0.495 -5.660 1.00 7.84 H new ATOM 0 HD12 ILE A 10 28.194 2.156 -5.825 1.00 7.84 H new ATOM 0 HD13 ILE A 10 27.526 1.080 -4.576 1.00 7.84 H new ATOM 160 N ARG A 11 25.373 5.071 -5.925 1.00 8.07 N ATOM 161 CA ARG A 11 25.210 5.991 -4.809 1.00 7.96 C ATOM 162 C ARG A 11 23.879 6.725 -4.925 1.00 7.79 C ATOM 163 O ARG A 11 23.529 7.236 -5.988 1.00 8.29 O ATOM 164 CB ARG A 11 26.398 6.970 -4.705 1.00 9.08 C ATOM 165 CG ARG A 11 26.948 7.476 -6.035 1.00 9.98 C ATOM 166 CD ARG A 11 26.087 8.568 -6.651 1.00 10.66 C ATOM 167 NE ARG A 11 26.618 9.024 -7.937 1.00 11.50 N ATOM 168 CZ ARG A 11 26.311 10.193 -8.499 1.00 12.34 C ATOM 169 NH1 ARG A 11 25.488 11.033 -7.884 1.00 12.46 N ATOM 170 NH2 ARG A 11 26.835 10.525 -9.672 1.00 13.19 N ATOM 0 H ARG A 11 25.117 5.464 -6.831 1.00 8.07 H new ATOM 0 HA ARG A 11 25.199 5.414 -3.884 1.00 7.96 H new ATOM 0 HB2 ARG A 11 26.088 7.829 -4.109 1.00 9.08 H new ATOM 0 HB3 ARG A 11 27.205 6.479 -4.161 1.00 9.08 H new ATOM 0 HG2 ARG A 11 27.958 7.858 -5.884 1.00 9.98 H new ATOM 0 HG3 ARG A 11 27.023 6.642 -6.733 1.00 9.98 H new ATOM 0 HD2 ARG A 11 25.072 8.195 -6.789 1.00 10.66 H new ATOM 0 HD3 ARG A 11 26.025 9.412 -5.964 1.00 10.66 H new ATOM 0 HE ARG A 11 27.263 8.409 -8.434 1.00 11.50 H new ATOM 0 HH11 ARG A 11 25.089 10.785 -6.979 1.00 12.46 H new ATOM 0 HH12 ARG A 11 25.255 11.927 -8.316 1.00 12.46 H new ATOM 0 HH21 ARG A 11 27.474 9.885 -10.145 1.00 13.19 H new ATOM 0 HH22 ARG A 11 26.599 11.420 -10.101 1.00 13.19 H new ATOM 184 N GLN A 12 23.135 6.754 -3.828 1.00 7.29 N ATOM 185 CA GLN A 12 21.772 7.268 -3.831 1.00 7.16 C ATOM 186 C GLN A 12 21.735 8.790 -3.893 1.00 7.82 C ATOM 187 O GLN A 12 22.472 9.475 -3.182 1.00 8.10 O ATOM 188 CB GLN A 12 21.017 6.799 -2.584 1.00 6.33 C ATOM 189 CG GLN A 12 19.602 7.352 -2.503 1.00 6.44 C ATOM 190 CD GLN A 12 18.950 7.139 -1.155 1.00 6.33 C ATOM 191 OE1 GLN A 12 19.625 7.063 -0.128 1.00 6.37 O ATOM 192 NE2 GLN A 12 17.628 7.071 -1.148 1.00 6.60 N ATOM 0 H GLN A 12 23.456 6.425 -2.917 1.00 7.29 H new ATOM 0 HA GLN A 12 21.289 6.876 -4.726 1.00 7.16 H new ATOM 0 HB2 GLN A 12 20.976 5.710 -2.579 1.00 6.33 H new ATOM 0 HB3 GLN A 12 21.571 7.102 -1.695 1.00 6.33 H new ATOM 0 HG2 GLN A 12 19.624 8.419 -2.723 1.00 6.44 H new ATOM 0 HG3 GLN A 12 18.991 6.880 -3.272 1.00 6.44 H new ATOM 0 HE21 GLN A 12 17.109 7.139 -2.024 1.00 6.60 H new ATOM 0 HE22 GLN A 12 17.128 6.951 -0.267 1.00 6.60 H new ATOM 201 N GLY A 13 20.862 9.308 -4.749 1.00 8.30 N ATOM 202 CA GLY A 13 20.608 10.731 -4.787 1.00 9.01 C ATOM 203 C GLY A 13 19.327 11.076 -4.048 1.00 8.63 C ATOM 204 O GLY A 13 18.725 10.206 -3.423 1.00 7.84 O ATOM 0 H GLY A 13 20.323 8.761 -5.421 1.00 8.30 H new ATOM 0 HA2 GLY A 13 21.446 11.265 -4.339 1.00 9.01 H new ATOM 0 HA3 GLY A 13 20.535 11.063 -5.823 1.00 9.01 H new ATOM 208 N PRO A 14 18.871 12.332 -4.111 1.00 9.33 N ATOM 209 CA PRO A 14 17.690 12.785 -3.373 1.00 9.17 C ATOM 210 C PRO A 14 16.371 12.313 -3.989 1.00 8.90 C ATOM 211 O PRO A 14 15.317 12.404 -3.359 1.00 8.50 O ATOM 212 CB PRO A 14 17.781 14.320 -3.437 1.00 10.25 C ATOM 213 CG PRO A 14 19.096 14.632 -4.080 1.00 10.91 C ATOM 214 CD PRO A 14 19.468 13.422 -4.887 1.00 10.46 C ATOM 0 HA PRO A 14 17.686 12.380 -2.361 1.00 9.17 H new ATOM 0 HB2 PRO A 14 16.956 14.735 -4.016 1.00 10.25 H new ATOM 0 HB3 PRO A 14 17.722 14.756 -2.440 1.00 10.25 H new ATOM 0 HG2 PRO A 14 19.019 15.514 -4.715 1.00 10.91 H new ATOM 0 HG3 PRO A 14 19.855 14.846 -3.328 1.00 10.91 H new ATOM 0 HD2 PRO A 14 19.065 13.469 -5.899 1.00 10.46 H new ATOM 0 HD3 PRO A 14 20.548 13.311 -4.979 1.00 10.46 H new ATOM 222 N LYS A 15 16.425 11.815 -5.220 1.00 9.36 N ATOM 223 CA LYS A 15 15.207 11.441 -5.933 1.00 9.53 C ATOM 224 C LYS A 15 15.059 9.929 -6.032 1.00 9.20 C ATOM 225 O LYS A 15 13.946 9.401 -6.001 1.00 9.66 O ATOM 226 CB LYS A 15 15.217 12.037 -7.338 1.00 10.67 C ATOM 227 CG LYS A 15 15.625 13.496 -7.375 1.00 11.41 C ATOM 228 CD LYS A 15 15.640 14.034 -8.794 1.00 12.05 C ATOM 229 CE LYS A 15 14.231 14.225 -9.342 1.00 12.96 C ATOM 230 NZ LYS A 15 13.453 15.220 -8.555 1.00 13.55 N ATOM 0 H LYS A 15 17.289 11.662 -5.741 1.00 9.36 H new ATOM 0 HA LYS A 15 14.362 11.835 -5.368 1.00 9.53 H new ATOM 0 HB2 LYS A 15 15.900 11.461 -7.963 1.00 10.67 H new ATOM 0 HB3 LYS A 15 14.223 11.935 -7.774 1.00 10.67 H new ATOM 0 HG2 LYS A 15 14.935 14.083 -6.769 1.00 11.41 H new ATOM 0 HG3 LYS A 15 16.614 13.610 -6.931 1.00 11.41 H new ATOM 0 HD2 LYS A 15 16.171 14.986 -8.816 1.00 12.05 H new ATOM 0 HD3 LYS A 15 16.190 13.347 -9.437 1.00 12.05 H new ATOM 0 HE2 LYS A 15 14.288 14.550 -10.381 1.00 12.96 H new ATOM 0 HE3 LYS A 15 13.707 13.269 -9.335 1.00 12.96 H new ATOM 0 HZ1 LYS A 15 13.039 15.925 -9.198 1.00 13.55 H new ATOM 0 HZ2 LYS A 15 12.693 14.735 -8.037 1.00 13.55 H new ATOM 0 HZ3 LYS A 15 14.083 15.697 -7.879 1.00 13.55 H new ATOM 244 N GLU A 16 16.182 9.240 -6.162 1.00 8.57 N ATOM 245 CA GLU A 16 16.169 7.790 -6.325 1.00 8.39 C ATOM 246 C GLU A 16 15.841 7.097 -5.003 1.00 7.72 C ATOM 247 O GLU A 16 16.489 7.348 -3.984 1.00 6.94 O ATOM 248 CB GLU A 16 17.522 7.295 -6.838 1.00 8.10 C ATOM 249 CG GLU A 16 17.463 5.898 -7.441 1.00 8.26 C ATOM 250 CD GLU A 16 16.901 5.895 -8.848 1.00 9.36 C ATOM 251 OE1 GLU A 16 15.720 6.245 -9.026 1.00 9.85 O ATOM 252 OE2 GLU A 16 17.648 5.543 -9.786 1.00 9.91 O ATOM 0 H GLU A 16 17.113 9.658 -6.158 1.00 8.57 H new ATOM 0 HA GLU A 16 15.397 7.544 -7.054 1.00 8.39 H new ATOM 0 HB2 GLU A 16 17.895 7.992 -7.589 1.00 8.10 H new ATOM 0 HB3 GLU A 16 18.238 7.298 -6.016 1.00 8.10 H new ATOM 0 HG2 GLU A 16 18.465 5.469 -7.453 1.00 8.26 H new ATOM 0 HG3 GLU A 16 16.849 5.258 -6.807 1.00 8.26 H new ATOM 259 N PRO A 17 14.818 6.229 -4.998 1.00 8.28 N ATOM 260 CA PRO A 17 14.463 5.440 -3.819 1.00 8.07 C ATOM 261 C PRO A 17 15.572 4.463 -3.434 1.00 7.31 C ATOM 262 O PRO A 17 16.109 3.762 -4.292 1.00 7.39 O ATOM 263 CB PRO A 17 13.204 4.676 -4.245 1.00 9.21 C ATOM 264 CG PRO A 17 12.704 5.382 -5.460 1.00 9.95 C ATOM 265 CD PRO A 17 13.917 5.960 -6.128 1.00 9.45 C ATOM 0 HA PRO A 17 14.308 6.070 -2.943 1.00 8.07 H new ATOM 0 HB2 PRO A 17 13.433 3.633 -4.463 1.00 9.21 H new ATOM 0 HB3 PRO A 17 12.455 4.679 -3.453 1.00 9.21 H new ATOM 0 HG2 PRO A 17 12.183 4.694 -6.125 1.00 9.95 H new ATOM 0 HG3 PRO A 17 11.995 6.165 -5.193 1.00 9.95 H new ATOM 0 HD2 PRO A 17 14.358 5.261 -6.839 1.00 9.45 H new ATOM 0 HD3 PRO A 17 13.679 6.869 -6.680 1.00 9.45 H new ATOM 273 N PHE A 18 15.921 4.450 -2.153 1.00 6.75 N ATOM 274 CA PHE A 18 17.053 3.673 -1.644 1.00 6.11 C ATOM 275 C PHE A 18 17.091 2.250 -2.203 1.00 6.56 C ATOM 276 O PHE A 18 18.050 1.881 -2.882 1.00 6.14 O ATOM 277 CB PHE A 18 17.003 3.633 -0.118 1.00 6.14 C ATOM 278 CG PHE A 18 18.197 2.981 0.525 1.00 5.98 C ATOM 279 CD1 PHE A 18 19.430 3.615 0.537 1.00 6.36 C ATOM 280 CD2 PHE A 18 18.081 1.742 1.132 1.00 5.83 C ATOM 281 CE1 PHE A 18 20.522 3.027 1.144 1.00 6.55 C ATOM 282 CE2 PHE A 18 19.171 1.147 1.737 1.00 6.04 C ATOM 283 CZ PHE A 18 20.392 1.791 1.744 1.00 6.38 C ATOM 0 H PHE A 18 15.428 4.978 -1.433 1.00 6.75 H new ATOM 0 HA PHE A 18 17.964 4.170 -1.978 1.00 6.11 H new ATOM 0 HB2 PHE A 18 16.915 4.652 0.258 1.00 6.14 H new ATOM 0 HB3 PHE A 18 16.103 3.101 0.190 1.00 6.14 H new ATOM 0 HD1 PHE A 18 19.538 4.581 0.066 1.00 6.36 H new ATOM 0 HD2 PHE A 18 17.127 1.235 1.132 1.00 5.83 H new ATOM 0 HE1 PHE A 18 21.476 3.533 1.149 1.00 6.55 H new ATOM 0 HE2 PHE A 18 19.068 0.179 2.204 1.00 6.04 H new ATOM 0 HZ PHE A 18 21.245 1.328 2.219 1.00 6.38 H new ATOM 293 N ARG A 19 16.036 1.471 -1.949 1.00 7.57 N ATOM 294 CA ARG A 19 16.012 0.059 -2.333 1.00 8.30 C ATOM 295 C ARG A 19 16.140 -0.117 -3.846 1.00 8.53 C ATOM 296 O ARG A 19 16.561 -1.171 -4.322 1.00 8.98 O ATOM 297 CB ARG A 19 14.728 -0.614 -1.838 1.00 9.53 C ATOM 298 CG ARG A 19 14.746 -2.128 -1.975 1.00 10.28 C ATOM 299 CD ARG A 19 13.432 -2.751 -1.535 1.00 11.35 C ATOM 300 NE ARG A 19 13.483 -4.212 -1.567 1.00 12.03 N ATOM 301 CZ ARG A 19 12.417 -5.004 -1.445 1.00 13.02 C ATOM 302 NH1 ARG A 19 11.206 -4.481 -1.302 1.00 13.43 N ATOM 303 NH2 ARG A 19 12.563 -6.322 -1.470 1.00 13.72 N ATOM 0 H ARG A 19 15.190 1.794 -1.480 1.00 7.57 H new ATOM 0 HA ARG A 19 16.871 -0.419 -1.862 1.00 8.30 H new ATOM 0 HB2 ARG A 19 14.571 -0.354 -0.791 1.00 9.53 H new ATOM 0 HB3 ARG A 19 13.880 -0.217 -2.396 1.00 9.53 H new ATOM 0 HG2 ARG A 19 14.946 -2.397 -3.012 1.00 10.28 H new ATOM 0 HG3 ARG A 19 15.560 -2.537 -1.377 1.00 10.28 H new ATOM 0 HD2 ARG A 19 13.193 -2.418 -0.525 1.00 11.35 H new ATOM 0 HD3 ARG A 19 12.629 -2.402 -2.184 1.00 11.35 H new ATOM 0 HE ARG A 19 14.394 -4.654 -1.691 1.00 12.03 H new ATOM 0 HH11 ARG A 19 11.087 -3.468 -1.285 1.00 13.43 H new ATOM 0 HH12 ARG A 19 10.394 -5.092 -1.209 1.00 13.43 H new ATOM 0 HH21 ARG A 19 13.491 -6.730 -1.583 1.00 13.72 H new ATOM 0 HH22 ARG A 19 11.747 -6.927 -1.377 1.00 13.72 H new ATOM 317 N ASP A 20 15.790 0.916 -4.599 1.00 8.44 N ATOM 318 CA ASP A 20 15.897 0.864 -6.049 1.00 9.01 C ATOM 319 C ASP A 20 17.359 0.919 -6.459 1.00 8.27 C ATOM 320 O ASP A 20 17.806 0.157 -7.314 1.00 8.68 O ATOM 321 CB ASP A 20 15.123 2.014 -6.697 1.00 9.59 C ATOM 322 CG ASP A 20 15.071 1.896 -8.208 1.00 10.55 C ATOM 323 OD1 ASP A 20 15.756 2.685 -8.892 1.00 11.24 O ATOM 324 OD2 ASP A 20 14.358 1.010 -8.720 1.00 10.78 O ATOM 0 H ASP A 20 15.431 1.797 -4.231 1.00 8.44 H new ATOM 0 HA ASP A 20 15.461 -0.073 -6.394 1.00 9.01 H new ATOM 0 HB2 ASP A 20 14.107 2.033 -6.302 1.00 9.59 H new ATOM 0 HB3 ASP A 20 15.589 2.961 -6.425 1.00 9.59 H new ATOM 329 N TYR A 21 18.110 1.810 -5.823 1.00 7.30 N ATOM 330 CA TYR A 21 19.538 1.918 -6.080 1.00 6.73 C ATOM 331 C TYR A 21 20.261 0.707 -5.505 1.00 6.19 C ATOM 332 O TYR A 21 21.190 0.171 -6.114 1.00 6.24 O ATOM 333 CB TYR A 21 20.106 3.202 -5.473 1.00 6.06 C ATOM 334 CG TYR A 21 20.874 4.040 -6.471 1.00 5.92 C ATOM 335 CD1 TYR A 21 20.588 5.388 -6.636 1.00 6.01 C ATOM 336 CD2 TYR A 21 21.886 3.487 -7.236 1.00 6.13 C ATOM 337 CE1 TYR A 21 21.294 6.160 -7.539 1.00 6.36 C ATOM 338 CE2 TYR A 21 22.598 4.250 -8.140 1.00 6.47 C ATOM 339 CZ TYR A 21 22.269 5.576 -8.318 1.00 6.60 C ATOM 340 OH TYR A 21 22.999 6.348 -9.189 1.00 7.29 O ATOM 0 H TYR A 21 17.754 2.466 -5.128 1.00 7.30 H new ATOM 0 HA TYR A 21 19.692 1.952 -7.159 1.00 6.73 H new ATOM 0 HB2 TYR A 21 19.289 3.795 -5.062 1.00 6.06 H new ATOM 0 HB3 TYR A 21 20.763 2.945 -4.642 1.00 6.06 H new ATOM 0 HD1 TYR A 21 19.802 5.841 -6.050 1.00 6.01 H new ATOM 0 HD2 TYR A 21 22.123 2.439 -7.124 1.00 6.13 H new ATOM 0 HE1 TYR A 21 21.083 7.215 -7.634 1.00 6.36 H new ATOM 0 HE2 TYR A 21 23.407 3.810 -8.704 1.00 6.47 H new ATOM 0 HH TYR A 21 23.837 5.890 -9.408 1.00 7.29 H new ATOM 350 N VAL A 22 19.808 0.271 -4.336 1.00 5.96 N ATOM 351 CA VAL A 22 20.377 -0.894 -3.672 1.00 5.81 C ATOM 352 C VAL A 22 20.153 -2.148 -4.506 1.00 6.77 C ATOM 353 O VAL A 22 20.917 -3.103 -4.418 1.00 6.77 O ATOM 354 CB VAL A 22 19.781 -1.088 -2.259 1.00 5.93 C ATOM 355 CG1 VAL A 22 20.335 -2.336 -1.587 1.00 6.61 C ATOM 356 CG2 VAL A 22 20.058 0.135 -1.407 1.00 5.41 C ATOM 0 H VAL A 22 19.042 0.711 -3.825 1.00 5.96 H new ATOM 0 HA VAL A 22 21.448 -0.721 -3.568 1.00 5.81 H new ATOM 0 HB VAL A 22 18.704 -1.218 -2.362 1.00 5.93 H new ATOM 0 HG11 VAL A 22 19.895 -2.441 -0.596 1.00 6.61 H new ATOM 0 HG12 VAL A 22 20.090 -3.212 -2.188 1.00 6.61 H new ATOM 0 HG13 VAL A 22 21.418 -2.250 -1.496 1.00 6.61 H new ATOM 0 HG21 VAL A 22 19.635 -0.010 -0.413 1.00 5.41 H new ATOM 0 HG22 VAL A 22 21.135 0.285 -1.324 1.00 5.41 H new ATOM 0 HG23 VAL A 22 19.604 1.011 -1.870 1.00 5.41 H new ATOM 366 N ASP A 23 19.116 -2.127 -5.333 1.00 7.71 N ATOM 367 CA ASP A 23 18.817 -3.249 -6.214 1.00 8.82 C ATOM 368 C ASP A 23 20.031 -3.613 -7.060 1.00 8.87 C ATOM 369 O ASP A 23 20.408 -4.782 -7.141 1.00 9.30 O ATOM 370 CB ASP A 23 17.627 -2.926 -7.118 1.00 9.88 C ATOM 371 CG ASP A 23 17.270 -4.078 -8.036 1.00 11.09 C ATOM 372 OD1 ASP A 23 16.877 -5.149 -7.527 1.00 11.57 O ATOM 373 OD2 ASP A 23 17.379 -3.917 -9.270 1.00 11.68 O ATOM 0 H ASP A 23 18.467 -1.344 -5.412 1.00 7.71 H new ATOM 0 HA ASP A 23 18.559 -4.104 -5.589 1.00 8.82 H new ATOM 0 HB2 ASP A 23 16.764 -2.675 -6.502 1.00 9.88 H new ATOM 0 HB3 ASP A 23 17.858 -2.045 -7.717 1.00 9.88 H new ATOM 378 N ARG A 24 20.666 -2.611 -7.662 1.00 8.57 N ATOM 379 CA ARG A 24 21.835 -2.867 -8.496 1.00 8.91 C ATOM 380 C ARG A 24 23.113 -2.885 -7.654 1.00 8.10 C ATOM 381 O ARG A 24 24.089 -3.546 -8.013 1.00 8.53 O ATOM 382 CB ARG A 24 21.952 -1.880 -9.673 1.00 9.20 C ATOM 383 CG ARG A 24 21.906 -0.401 -9.315 1.00 9.35 C ATOM 384 CD ARG A 24 20.498 0.171 -9.426 1.00 9.42 C ATOM 385 NE ARG A 24 20.517 1.612 -9.687 1.00 10.13 N ATOM 386 CZ ARG A 24 19.435 2.398 -9.674 1.00 10.62 C ATOM 387 NH1 ARG A 24 18.247 1.891 -9.380 1.00 10.53 N ATOM 388 NH2 ARG A 24 19.546 3.691 -9.952 1.00 11.36 N ATOM 0 H ARG A 24 20.396 -1.630 -7.590 1.00 8.57 H new ATOM 0 HA ARG A 24 21.700 -3.855 -8.936 1.00 8.91 H new ATOM 0 HB2 ARG A 24 22.889 -2.078 -10.194 1.00 9.20 H new ATOM 0 HB3 ARG A 24 21.146 -2.088 -10.376 1.00 9.20 H new ATOM 0 HG2 ARG A 24 22.274 -0.263 -8.298 1.00 9.35 H new ATOM 0 HG3 ARG A 24 22.575 0.152 -9.974 1.00 9.35 H new ATOM 0 HD2 ARG A 24 19.961 -0.337 -10.227 1.00 9.42 H new ATOM 0 HD3 ARG A 24 19.952 -0.024 -8.503 1.00 9.42 H new ATOM 0 HE ARG A 24 21.417 2.046 -9.893 1.00 10.13 H new ATOM 0 HH11 ARG A 24 18.156 0.899 -9.163 1.00 10.53 H new ATOM 0 HH12 ARG A 24 17.424 2.493 -9.371 1.00 10.53 H new ATOM 0 HH21 ARG A 24 20.458 4.088 -10.176 1.00 11.36 H new ATOM 0 HH22 ARG A 24 18.719 4.288 -9.941 1.00 11.36 H new ATOM 402 N PHE A 25 23.094 -2.169 -6.531 1.00 7.02 N ATOM 403 CA PHE A 25 24.181 -2.212 -5.565 1.00 6.32 C ATOM 404 C PHE A 25 24.368 -3.643 -5.056 1.00 6.59 C ATOM 405 O PHE A 25 25.483 -4.113 -4.856 1.00 6.62 O ATOM 406 CB PHE A 25 23.829 -1.278 -4.404 1.00 5.33 C ATOM 407 CG PHE A 25 25.000 -0.761 -3.615 1.00 4.98 C ATOM 408 CD1 PHE A 25 26.021 -1.624 -3.250 1.00 4.85 C ATOM 409 CD2 PHE A 25 25.090 0.570 -3.239 1.00 5.26 C ATOM 410 CE1 PHE A 25 27.105 -1.172 -2.529 1.00 4.99 C ATOM 411 CE2 PHE A 25 26.173 1.028 -2.515 1.00 5.43 C ATOM 412 CZ PHE A 25 27.144 0.235 -2.157 1.00 5.29 C ATOM 0 H PHE A 25 22.328 -1.548 -6.270 1.00 7.02 H new ATOM 0 HA PHE A 25 25.113 -1.890 -6.030 1.00 6.32 H new ATOM 0 HB2 PHE A 25 23.275 -0.427 -4.800 1.00 5.33 H new ATOM 0 HB3 PHE A 25 23.160 -1.806 -3.725 1.00 5.33 H new ATOM 0 HD1 PHE A 25 25.966 -2.664 -3.534 1.00 4.85 H new ATOM 0 HD2 PHE A 25 24.304 1.257 -3.516 1.00 5.26 H new ATOM 0 HE1 PHE A 25 27.903 -1.843 -2.248 1.00 4.99 H new ATOM 0 HE2 PHE A 25 26.217 2.071 -2.238 1.00 5.43 H new ATOM 0 HZ PHE A 25 27.975 0.621 -1.586 1.00 5.29 H new ATOM 422 N TYR A 26 23.254 -4.332 -4.877 1.00 7.06 N ATOM 423 CA TYR A 26 23.251 -5.691 -4.361 1.00 7.60 C ATOM 424 C TYR A 26 23.665 -6.667 -5.456 1.00 8.54 C ATOM 425 O TYR A 26 24.286 -7.692 -5.188 1.00 8.87 O ATOM 426 CB TYR A 26 21.854 -6.021 -3.829 1.00 8.10 C ATOM 427 CG TYR A 26 21.695 -7.418 -3.282 1.00 8.84 C ATOM 428 CD1 TYR A 26 22.370 -7.827 -2.139 1.00 9.57 C ATOM 429 CD2 TYR A 26 20.844 -8.323 -3.901 1.00 9.04 C ATOM 430 CE1 TYR A 26 22.201 -9.101 -1.630 1.00 10.37 C ATOM 431 CE2 TYR A 26 20.673 -9.595 -3.400 1.00 9.88 C ATOM 432 CZ TYR A 26 21.351 -9.981 -2.267 1.00 10.50 C ATOM 433 OH TYR A 26 21.171 -11.250 -1.766 1.00 11.44 O ATOM 0 H TYR A 26 22.325 -3.965 -5.085 1.00 7.06 H new ATOM 0 HA TYR A 26 23.969 -5.780 -3.545 1.00 7.60 H new ATOM 0 HB2 TYR A 26 21.603 -5.308 -3.043 1.00 8.10 H new ATOM 0 HB3 TYR A 26 21.132 -5.877 -4.633 1.00 8.10 H new ATOM 0 HD1 TYR A 26 23.037 -7.139 -1.640 1.00 9.57 H new ATOM 0 HD2 TYR A 26 20.307 -8.025 -4.790 1.00 9.04 H new ATOM 0 HE1 TYR A 26 22.731 -9.405 -0.740 1.00 10.37 H new ATOM 0 HE2 TYR A 26 20.008 -10.287 -3.895 1.00 9.88 H new ATOM 0 HH TYR A 26 20.540 -11.739 -2.334 1.00 11.44 H new ATOM 443 N LYS A 27 23.327 -6.319 -6.690 1.00 9.08 N ATOM 444 CA LYS A 27 23.679 -7.128 -7.850 1.00 10.12 C ATOM 445 C LYS A 27 25.193 -7.281 -7.984 1.00 10.01 C ATOM 446 O LYS A 27 25.697 -8.393 -8.129 1.00 10.69 O ATOM 447 CB LYS A 27 23.099 -6.499 -9.119 1.00 10.87 C ATOM 448 CG LYS A 27 21.604 -6.730 -9.299 1.00 11.19 C ATOM 449 CD LYS A 27 21.273 -8.200 -9.528 1.00 12.15 C ATOM 450 CE LYS A 27 21.868 -8.717 -10.830 1.00 12.87 C ATOM 451 NZ LYS A 27 21.524 -10.143 -11.074 1.00 13.47 N ATOM 0 H LYS A 27 22.804 -5.473 -6.915 1.00 9.08 H new ATOM 0 HA LYS A 27 23.254 -8.122 -7.711 1.00 10.12 H new ATOM 0 HB2 LYS A 27 23.291 -5.426 -9.100 1.00 10.87 H new ATOM 0 HB3 LYS A 27 23.625 -6.902 -9.985 1.00 10.87 H new ATOM 0 HG2 LYS A 27 21.074 -6.373 -8.416 1.00 11.19 H new ATOM 0 HG3 LYS A 27 21.246 -6.143 -10.145 1.00 11.19 H new ATOM 0 HD2 LYS A 27 21.652 -8.792 -8.695 1.00 12.15 H new ATOM 0 HD3 LYS A 27 20.191 -8.331 -9.546 1.00 12.15 H new ATOM 0 HE2 LYS A 27 21.506 -8.110 -11.660 1.00 12.87 H new ATOM 0 HE3 LYS A 27 22.952 -8.605 -10.802 1.00 12.87 H new ATOM 0 HZ1 LYS A 27 21.949 -10.454 -11.971 1.00 13.47 H new ATOM 0 HZ2 LYS A 27 21.891 -10.727 -10.296 1.00 13.47 H new ATOM 0 HZ3 LYS A 27 20.491 -10.247 -11.127 1.00 13.47 H new ATOM 465 N THR A 28 25.918 -6.168 -7.913 1.00 9.28 N ATOM 466 CA THR A 28 27.369 -6.205 -8.051 1.00 9.35 C ATOM 467 C THR A 28 28.004 -6.959 -6.875 1.00 8.90 C ATOM 468 O THR A 28 29.087 -7.534 -7.003 1.00 9.29 O ATOM 469 CB THR A 28 27.973 -4.780 -8.185 1.00 9.07 C ATOM 470 OG1 THR A 28 29.382 -4.852 -8.450 1.00 9.27 O ATOM 471 CG2 THR A 28 27.739 -3.953 -6.932 1.00 8.30 C ATOM 0 H THR A 28 25.528 -5.238 -7.762 1.00 9.28 H new ATOM 0 HA THR A 28 27.598 -6.741 -8.972 1.00 9.35 H new ATOM 0 HB THR A 28 27.469 -4.294 -9.020 1.00 9.07 H new ATOM 0 HG1 THR A 28 29.746 -3.946 -8.533 1.00 9.27 H new ATOM 0 HG21 THR A 28 28.175 -2.963 -7.063 1.00 8.30 H new ATOM 0 HG22 THR A 28 26.668 -3.857 -6.754 1.00 8.30 H new ATOM 0 HG23 THR A 28 28.206 -4.445 -6.079 1.00 8.30 H new ATOM 479 N LEU A 29 27.306 -6.988 -5.742 1.00 8.24 N ATOM 480 CA LEU A 29 27.765 -7.736 -4.575 1.00 8.03 C ATOM 481 C LEU A 29 27.604 -9.238 -4.795 1.00 8.87 C ATOM 482 O LEU A 29 28.321 -10.043 -4.205 1.00 9.09 O ATOM 483 CB LEU A 29 27.000 -7.303 -3.318 1.00 7.48 C ATOM 484 CG LEU A 29 27.704 -6.265 -2.432 1.00 7.10 C ATOM 485 CD1 LEU A 29 28.944 -6.863 -1.786 1.00 6.93 C ATOM 486 CD2 LEU A 29 28.074 -5.025 -3.230 1.00 6.99 C ATOM 0 H LEU A 29 26.420 -6.502 -5.608 1.00 8.24 H new ATOM 0 HA LEU A 29 28.823 -7.518 -4.432 1.00 8.03 H new ATOM 0 HB2 LEU A 29 26.036 -6.897 -3.624 1.00 7.48 H new ATOM 0 HB3 LEU A 29 26.797 -8.189 -2.716 1.00 7.48 H new ATOM 0 HG LEU A 29 27.008 -5.971 -1.647 1.00 7.10 H new ATOM 0 HD11 LEU A 29 29.428 -6.111 -1.163 1.00 6.93 H new ATOM 0 HD12 LEU A 29 28.658 -7.716 -1.170 1.00 6.93 H new ATOM 0 HD13 LEU A 29 29.636 -7.191 -2.562 1.00 6.93 H new ATOM 0 HD21 LEU A 29 28.571 -4.307 -2.577 1.00 6.99 H new ATOM 0 HD22 LEU A 29 28.746 -5.302 -4.043 1.00 6.99 H new ATOM 0 HD23 LEU A 29 27.171 -4.575 -3.643 1.00 6.99 H new ATOM 498 N ARG A 30 26.664 -9.606 -5.657 1.00 9.50 N ATOM 499 CA ARG A 30 26.424 -11.008 -5.978 1.00 10.45 C ATOM 500 C ARG A 30 27.521 -11.541 -6.886 1.00 10.98 C ATOM 501 O ARG A 30 27.726 -12.747 -6.992 1.00 11.61 O ATOM 502 CB ARG A 30 25.070 -11.185 -6.659 1.00 11.14 C ATOM 503 CG ARG A 30 23.900 -10.709 -5.820 1.00 11.16 C ATOM 504 CD ARG A 30 23.799 -11.468 -4.504 1.00 11.94 C ATOM 505 NE ARG A 30 23.650 -12.908 -4.707 1.00 12.66 N ATOM 506 CZ ARG A 30 23.446 -13.783 -3.725 1.00 13.44 C ATOM 507 NH1 ARG A 30 23.352 -13.369 -2.468 1.00 13.60 N ATOM 508 NH2 ARG A 30 23.336 -15.075 -4.001 1.00 14.19 N ATOM 0 H ARG A 30 26.054 -8.952 -6.147 1.00 9.50 H new ATOM 0 HA ARG A 30 26.425 -11.570 -5.044 1.00 10.45 H new ATOM 0 HB2 ARG A 30 25.074 -10.641 -7.603 1.00 11.14 H new ATOM 0 HB3 ARG A 30 24.929 -12.239 -6.899 1.00 11.14 H new ATOM 0 HG2 ARG A 30 24.008 -9.644 -5.617 1.00 11.16 H new ATOM 0 HG3 ARG A 30 22.975 -10.834 -6.383 1.00 11.16 H new ATOM 0 HD2 ARG A 30 24.691 -11.277 -3.907 1.00 11.94 H new ATOM 0 HD3 ARG A 30 22.948 -11.093 -3.935 1.00 11.94 H new ATOM 0 HE ARG A 30 23.706 -13.265 -5.661 1.00 12.66 H new ATOM 0 HH11 ARG A 30 23.436 -12.376 -2.250 1.00 13.60 H new ATOM 0 HH12 ARG A 30 23.196 -14.044 -1.719 1.00 13.60 H new ATOM 0 HH21 ARG A 30 23.408 -15.398 -4.966 1.00 14.19 H new ATOM 0 HH22 ARG A 30 23.180 -15.746 -3.249 1.00 14.19 H new ATOM 522 N ALA A 31 28.203 -10.638 -7.562 1.00 10.87 N ATOM 523 CA ALA A 31 29.336 -11.013 -8.395 1.00 11.56 C ATOM 524 C ALA A 31 30.523 -11.438 -7.530 1.00 11.34 C ATOM 525 O ALA A 31 31.137 -12.481 -7.761 1.00 11.93 O ATOM 526 CB ALA A 31 29.725 -9.861 -9.310 1.00 11.84 C ATOM 0 H ALA A 31 27.995 -9.639 -7.553 1.00 10.87 H new ATOM 0 HA ALA A 31 29.044 -11.862 -9.013 1.00 11.56 H new ATOM 0 HB1 ALA A 31 30.574 -10.157 -9.927 1.00 11.84 H new ATOM 0 HB2 ALA A 31 28.882 -9.605 -9.952 1.00 11.84 H new ATOM 0 HB3 ALA A 31 29.998 -8.995 -8.708 1.00 11.84 H new ATOM 532 N GLU A 32 30.819 -10.636 -6.514 1.00 10.61 N ATOM 533 CA GLU A 32 31.973 -10.869 -5.646 1.00 10.60 C ATOM 534 C GLU A 32 31.629 -11.803 -4.482 1.00 10.54 C ATOM 535 O GLU A 32 31.987 -11.541 -3.331 1.00 10.89 O ATOM 536 CB GLU A 32 32.498 -9.534 -5.118 1.00 10.22 C ATOM 537 CG GLU A 32 31.455 -8.739 -4.357 1.00 9.56 C ATOM 538 CD GLU A 32 31.935 -7.352 -3.983 1.00 9.48 C ATOM 539 OE1 GLU A 32 32.497 -7.185 -2.881 1.00 9.47 O ATOM 540 OE2 GLU A 32 31.756 -6.416 -4.795 1.00 9.62 O ATOM 0 H GLU A 32 30.272 -9.811 -6.268 1.00 10.61 H new ATOM 0 HA GLU A 32 32.747 -11.358 -6.238 1.00 10.60 H new ATOM 0 HB2 GLU A 32 33.351 -9.719 -4.465 1.00 10.22 H new ATOM 0 HB3 GLU A 32 32.861 -8.937 -5.955 1.00 10.22 H new ATOM 0 HG2 GLU A 32 30.554 -8.656 -4.964 1.00 9.56 H new ATOM 0 HG3 GLU A 32 31.181 -9.280 -3.452 1.00 9.56 H new ATOM 547 N GLN A 33 30.950 -12.902 -4.792 1.00 10.31 N ATOM 548 CA GLN A 33 30.568 -13.906 -3.789 1.00 10.45 C ATOM 549 C GLN A 33 31.774 -14.447 -3.023 1.00 10.39 C ATOM 550 O GLN A 33 31.628 -14.996 -1.932 1.00 10.09 O ATOM 551 CB GLN A 33 29.850 -15.089 -4.450 1.00 10.44 C ATOM 552 CG GLN A 33 28.484 -14.763 -5.022 1.00 10.76 C ATOM 553 CD GLN A 33 27.488 -14.336 -3.965 1.00 11.12 C ATOM 554 OE1 GLN A 33 27.340 -13.153 -3.678 1.00 11.23 O ATOM 555 NE2 GLN A 33 26.808 -15.302 -3.371 1.00 11.52 N ATOM 0 H GLN A 33 30.647 -13.127 -5.740 1.00 10.31 H new ATOM 0 HA GLN A 33 29.903 -13.400 -3.089 1.00 10.45 H new ATOM 0 HB2 GLN A 33 30.480 -15.478 -5.250 1.00 10.44 H new ATOM 0 HB3 GLN A 33 29.740 -15.886 -3.715 1.00 10.44 H new ATOM 0 HG2 GLN A 33 28.586 -13.968 -5.760 1.00 10.76 H new ATOM 0 HG3 GLN A 33 28.097 -15.637 -5.546 1.00 10.76 H new ATOM 0 HE21 GLN A 33 26.962 -16.274 -3.640 1.00 11.52 H new ATOM 0 HE22 GLN A 33 26.130 -15.075 -2.644 1.00 11.52 H new ATOM 564 N ALA A 34 32.958 -14.285 -3.593 1.00 10.90 N ATOM 565 CA ALA A 34 34.160 -14.896 -3.040 1.00 11.19 C ATOM 566 C ALA A 34 34.655 -14.166 -1.795 1.00 11.09 C ATOM 567 O ALA A 34 35.080 -14.798 -0.830 1.00 11.27 O ATOM 568 CB ALA A 34 35.257 -14.957 -4.091 1.00 11.97 C ATOM 0 H ALA A 34 33.114 -13.736 -4.438 1.00 10.90 H new ATOM 0 HA ALA A 34 33.898 -15.910 -2.739 1.00 11.19 H new ATOM 0 HB1 ALA A 34 36.147 -15.416 -3.661 1.00 11.97 H new ATOM 0 HB2 ALA A 34 34.916 -15.551 -4.939 1.00 11.97 H new ATOM 0 HB3 ALA A 34 35.495 -13.948 -4.427 1.00 11.97 H new ATOM 574 N SER A 35 34.599 -12.842 -1.815 1.00 11.05 N ATOM 575 CA SER A 35 35.109 -12.033 -0.711 1.00 11.21 C ATOM 576 C SER A 35 34.087 -11.916 0.425 1.00 10.64 C ATOM 577 O SER A 35 33.758 -10.814 0.860 1.00 10.19 O ATOM 578 CB SER A 35 35.485 -10.644 -1.226 1.00 11.48 C ATOM 579 OG SER A 35 36.403 -10.730 -2.303 1.00 12.02 O ATOM 0 H SER A 35 34.205 -12.301 -2.585 1.00 11.05 H new ATOM 0 HA SER A 35 35.992 -12.528 -0.308 1.00 11.21 H new ATOM 0 HB2 SER A 35 34.587 -10.118 -1.550 1.00 11.48 H new ATOM 0 HB3 SER A 35 35.923 -10.059 -0.417 1.00 11.48 H new ATOM 0 HG SER A 35 36.626 -9.828 -2.615 1.00 12.02 H new ATOM 585 N GLN A 36 33.622 -13.060 0.924 1.00 10.85 N ATOM 586 CA GLN A 36 32.561 -13.102 1.932 1.00 10.51 C ATOM 587 C GLN A 36 32.909 -12.290 3.174 1.00 10.66 C ATOM 588 O GLN A 36 32.073 -11.539 3.683 1.00 10.26 O ATOM 589 CB GLN A 36 32.268 -14.543 2.337 1.00 11.11 C ATOM 590 CG GLN A 36 31.741 -15.398 1.199 1.00 11.25 C ATOM 591 CD GLN A 36 31.548 -16.850 1.588 1.00 11.80 C ATOM 592 OE1 GLN A 36 31.670 -17.747 0.754 1.00 12.14 O ATOM 593 NE2 GLN A 36 31.235 -17.095 2.852 1.00 12.09 N ATOM 0 H GLN A 36 33.966 -13.978 0.644 1.00 10.85 H new ATOM 0 HA GLN A 36 31.677 -12.656 1.476 1.00 10.51 H new ATOM 0 HB2 GLN A 36 33.180 -14.995 2.728 1.00 11.11 H new ATOM 0 HB3 GLN A 36 31.540 -14.543 3.148 1.00 11.11 H new ATOM 0 HG2 GLN A 36 30.790 -14.990 0.856 1.00 11.25 H new ATOM 0 HG3 GLN A 36 32.433 -15.342 0.359 1.00 11.25 H new ATOM 0 HE21 GLN A 36 31.143 -16.324 3.513 1.00 12.09 H new ATOM 0 HE22 GLN A 36 31.086 -18.055 3.164 1.00 12.09 H new ATOM 602 N GLU A 37 34.142 -12.433 3.655 1.00 11.37 N ATOM 603 CA GLU A 37 34.574 -11.732 4.860 1.00 11.85 C ATOM 604 C GLU A 37 34.536 -10.223 4.652 1.00 11.40 C ATOM 605 O GLU A 37 34.315 -9.459 5.590 1.00 11.56 O ATOM 606 CB GLU A 37 35.982 -12.169 5.276 1.00 12.76 C ATOM 607 CG GLU A 37 37.048 -11.938 4.215 1.00 12.82 C ATOM 608 CD GLU A 37 38.442 -12.252 4.716 1.00 13.79 C ATOM 609 OE1 GLU A 37 39.245 -11.310 4.886 1.00 14.44 O ATOM 610 OE2 GLU A 37 38.741 -13.440 4.955 1.00 13.98 O ATOM 0 H GLU A 37 34.856 -13.025 3.231 1.00 11.37 H new ATOM 0 HA GLU A 37 33.881 -11.992 5.660 1.00 11.85 H new ATOM 0 HB2 GLU A 37 36.264 -11.631 6.181 1.00 12.76 H new ATOM 0 HB3 GLU A 37 35.961 -13.229 5.529 1.00 12.76 H new ATOM 0 HG2 GLU A 37 36.830 -12.557 3.345 1.00 12.82 H new ATOM 0 HG3 GLU A 37 37.009 -10.900 3.885 1.00 12.82 H new ATOM 617 N VAL A 38 34.737 -9.806 3.415 1.00 11.01 N ATOM 618 CA VAL A 38 34.734 -8.396 3.075 1.00 10.78 C ATOM 619 C VAL A 38 33.304 -7.891 2.938 1.00 9.91 C ATOM 620 O VAL A 38 32.970 -6.813 3.422 1.00 9.82 O ATOM 621 CB VAL A 38 35.493 -8.136 1.756 1.00 10.99 C ATOM 622 CG1 VAL A 38 35.612 -6.644 1.483 1.00 11.05 C ATOM 623 CG2 VAL A 38 36.865 -8.785 1.792 1.00 11.61 C ATOM 0 H VAL A 38 34.905 -10.429 2.625 1.00 11.01 H new ATOM 0 HA VAL A 38 35.239 -7.861 3.879 1.00 10.78 H new ATOM 0 HB VAL A 38 34.922 -8.584 0.943 1.00 10.99 H new ATOM 0 HG11 VAL A 38 36.151 -6.487 0.548 1.00 11.05 H new ATOM 0 HG12 VAL A 38 34.616 -6.208 1.406 1.00 11.05 H new ATOM 0 HG13 VAL A 38 36.155 -6.167 2.299 1.00 11.05 H new ATOM 0 HG21 VAL A 38 37.384 -8.590 0.854 1.00 11.61 H new ATOM 0 HG22 VAL A 38 37.442 -8.371 2.619 1.00 11.61 H new ATOM 0 HG23 VAL A 38 36.755 -9.861 1.930 1.00 11.61 H new ATOM 633 N LYS A 39 32.463 -8.704 2.303 1.00 9.40 N ATOM 634 CA LYS A 39 31.082 -8.329 2.002 1.00 8.62 C ATOM 635 C LYS A 39 30.295 -8.007 3.266 1.00 8.49 C ATOM 636 O LYS A 39 29.518 -7.053 3.291 1.00 8.00 O ATOM 637 CB LYS A 39 30.379 -9.458 1.252 1.00 8.48 C ATOM 638 CG LYS A 39 31.082 -9.885 -0.026 1.00 8.87 C ATOM 639 CD LYS A 39 30.364 -11.048 -0.684 1.00 8.96 C ATOM 640 CE LYS A 39 29.020 -10.622 -1.241 1.00 9.53 C ATOM 641 NZ LYS A 39 28.169 -11.782 -1.589 1.00 9.78 N ATOM 0 H LYS A 39 32.718 -9.638 1.983 1.00 9.40 H new ATOM 0 HA LYS A 39 31.119 -7.434 1.381 1.00 8.62 H new ATOM 0 HB2 LYS A 39 30.293 -10.321 1.913 1.00 8.48 H new ATOM 0 HB3 LYS A 39 29.365 -9.142 1.008 1.00 8.48 H new ATOM 0 HG2 LYS A 39 31.127 -9.044 -0.718 1.00 8.87 H new ATOM 0 HG3 LYS A 39 32.110 -10.169 0.199 1.00 8.87 H new ATOM 0 HD2 LYS A 39 30.981 -11.452 -1.487 1.00 8.96 H new ATOM 0 HD3 LYS A 39 30.222 -11.848 0.042 1.00 8.96 H new ATOM 0 HE2 LYS A 39 28.504 -10.002 -0.508 1.00 9.53 H new ATOM 0 HE3 LYS A 39 29.174 -10.007 -2.128 1.00 9.53 H new ATOM 0 HZ1 LYS A 39 27.195 -11.607 -1.269 1.00 9.78 H new ATOM 0 HZ2 LYS A 39 28.175 -11.920 -2.620 1.00 9.78 H new ATOM 0 HZ3 LYS A 39 28.538 -12.636 -1.123 1.00 9.78 H new ATOM 655 N ASN A 40 30.504 -8.807 4.305 1.00 9.12 N ATOM 656 CA ASN A 40 29.799 -8.633 5.576 1.00 9.38 C ATOM 657 C ASN A 40 29.999 -7.225 6.123 1.00 9.55 C ATOM 658 O ASN A 40 29.041 -6.554 6.503 1.00 9.39 O ATOM 659 CB ASN A 40 30.290 -9.663 6.603 1.00 10.35 C ATOM 660 CG ASN A 40 29.588 -9.537 7.946 1.00 10.85 C ATOM 661 OD1 ASN A 40 28.423 -9.141 8.022 1.00 10.92 O ATOM 662 ND2 ASN A 40 30.291 -9.881 9.014 1.00 11.43 N ATOM 0 H ASN A 40 31.160 -9.588 4.295 1.00 9.12 H new ATOM 0 HA ASN A 40 28.735 -8.786 5.394 1.00 9.38 H new ATOM 0 HB2 ASN A 40 30.132 -10.667 6.208 1.00 10.35 H new ATOM 0 HB3 ASN A 40 31.364 -9.543 6.747 1.00 10.35 H new ATOM 0 HD21 ASN A 40 29.871 -9.823 9.942 1.00 11.43 H new ATOM 0 HD22 ASN A 40 31.253 -10.204 8.909 1.00 11.43 H new ATOM 669 N ALA A 41 31.245 -6.775 6.138 1.00 10.04 N ATOM 670 CA ALA A 41 31.574 -5.457 6.654 1.00 10.52 C ATOM 671 C ALA A 41 31.302 -4.378 5.613 1.00 9.85 C ATOM 672 O ALA A 41 31.027 -3.226 5.951 1.00 10.08 O ATOM 673 CB ALA A 41 33.030 -5.420 7.084 1.00 11.43 C ATOM 0 H ALA A 41 32.046 -7.306 5.797 1.00 10.04 H new ATOM 0 HA ALA A 41 30.940 -5.257 7.518 1.00 10.52 H new ATOM 0 HB1 ALA A 41 33.270 -4.429 7.470 1.00 11.43 H new ATOM 0 HB2 ALA A 41 33.198 -6.164 7.863 1.00 11.43 H new ATOM 0 HB3 ALA A 41 33.668 -5.641 6.228 1.00 11.43 H new ATOM 679 N ALA A 42 31.374 -4.762 4.345 1.00 9.19 N ATOM 680 CA ALA A 42 31.211 -3.824 3.246 1.00 8.71 C ATOM 681 C ALA A 42 29.769 -3.371 3.090 1.00 7.86 C ATOM 682 O ALA A 42 29.505 -2.183 2.999 1.00 7.82 O ATOM 683 CB ALA A 42 31.704 -4.436 1.947 1.00 8.58 C ATOM 0 H ALA A 42 31.546 -5.724 4.053 1.00 9.19 H new ATOM 0 HA ALA A 42 31.811 -2.945 3.483 1.00 8.71 H new ATOM 0 HB1 ALA A 42 31.574 -3.720 1.135 1.00 8.58 H new ATOM 0 HB2 ALA A 42 32.760 -4.690 2.042 1.00 8.58 H new ATOM 0 HB3 ALA A 42 31.132 -5.338 1.730 1.00 8.58 H new ATOM 689 N THR A 43 28.843 -4.313 3.086 1.00 7.35 N ATOM 690 CA THR A 43 27.449 -4.013 2.770 1.00 6.63 C ATOM 691 C THR A 43 26.869 -2.958 3.707 1.00 6.87 C ATOM 692 O THR A 43 26.288 -1.964 3.265 1.00 6.42 O ATOM 693 CB THR A 43 26.587 -5.282 2.838 1.00 6.60 C ATOM 694 OG1 THR A 43 26.935 -6.035 4.007 1.00 6.93 O ATOM 695 CG2 THR A 43 26.777 -6.136 1.594 1.00 6.92 C ATOM 0 H THR A 43 29.026 -5.294 3.297 1.00 7.35 H new ATOM 0 HA THR A 43 27.434 -3.618 1.754 1.00 6.63 H new ATOM 0 HB THR A 43 25.539 -4.988 2.891 1.00 6.60 H new ATOM 0 HG1 THR A 43 27.745 -6.557 3.831 1.00 6.93 H new ATOM 0 HG21 THR A 43 26.156 -7.029 1.667 1.00 6.92 H new ATOM 0 HG22 THR A 43 26.488 -5.564 0.712 1.00 6.92 H new ATOM 0 HG23 THR A 43 27.824 -6.428 1.510 1.00 6.92 H new ATOM 703 N GLU A 44 27.064 -3.172 4.997 1.00 7.76 N ATOM 704 CA GLU A 44 26.513 -2.301 6.026 1.00 8.32 C ATOM 705 C GLU A 44 27.093 -0.888 5.950 1.00 8.48 C ATOM 706 O GLU A 44 26.403 0.089 6.229 1.00 8.35 O ATOM 707 CB GLU A 44 26.782 -2.907 7.403 1.00 9.53 C ATOM 708 CG GLU A 44 28.254 -3.178 7.671 1.00 10.03 C ATOM 709 CD GLU A 44 28.511 -3.675 9.076 1.00 11.07 C ATOM 710 OE1 GLU A 44 29.158 -2.951 9.858 1.00 11.69 O ATOM 711 OE2 GLU A 44 28.064 -4.788 9.408 1.00 11.42 O ATOM 0 H GLU A 44 27.608 -3.954 5.362 1.00 7.76 H new ATOM 0 HA GLU A 44 25.439 -2.220 5.859 1.00 8.32 H new ATOM 0 HB2 GLU A 44 26.400 -2.232 8.169 1.00 9.53 H new ATOM 0 HB3 GLU A 44 26.227 -3.840 7.495 1.00 9.53 H new ATOM 0 HG2 GLU A 44 28.619 -3.916 6.957 1.00 10.03 H new ATOM 0 HG3 GLU A 44 28.824 -2.264 7.504 1.00 10.03 H new ATOM 718 N THR A 45 28.359 -0.785 5.579 1.00 8.95 N ATOM 719 CA THR A 45 29.036 0.497 5.531 1.00 9.49 C ATOM 720 C THR A 45 28.821 1.176 4.189 1.00 8.79 C ATOM 721 O THR A 45 28.599 2.377 4.122 1.00 9.04 O ATOM 722 CB THR A 45 30.543 0.340 5.801 1.00 10.61 C ATOM 723 OG1 THR A 45 31.072 -0.739 5.020 1.00 11.34 O ATOM 724 CG2 THR A 45 30.806 0.084 7.277 1.00 11.01 C ATOM 0 H THR A 45 28.939 -1.578 5.306 1.00 8.95 H new ATOM 0 HA THR A 45 28.606 1.122 6.314 1.00 9.49 H new ATOM 0 HB THR A 45 31.039 1.269 5.518 1.00 10.61 H new ATOM 0 HG1 THR A 45 31.092 -1.556 5.562 1.00 11.34 H new ATOM 0 HG21 THR A 45 31.878 -0.023 7.442 1.00 11.01 H new ATOM 0 HG22 THR A 45 30.430 0.922 7.864 1.00 11.01 H new ATOM 0 HG23 THR A 45 30.298 -0.830 7.584 1.00 11.01 H new ATOM 732 N LEU A 46 28.871 0.381 3.131 1.00 8.07 N ATOM 733 CA LEU A 46 28.810 0.880 1.765 1.00 7.71 C ATOM 734 C LEU A 46 27.440 1.438 1.412 1.00 6.77 C ATOM 735 O LEU A 46 27.345 2.532 0.859 1.00 6.93 O ATOM 736 CB LEU A 46 29.190 -0.238 0.796 1.00 7.55 C ATOM 737 CG LEU A 46 30.587 -0.123 0.179 1.00 7.70 C ATOM 738 CD1 LEU A 46 30.668 1.069 -0.762 1.00 7.76 C ATOM 739 CD2 LEU A 46 31.633 0.001 1.273 1.00 8.22 C ATOM 0 H LEU A 46 28.955 -0.633 3.196 1.00 8.07 H new ATOM 0 HA LEU A 46 29.520 1.703 1.681 1.00 7.71 H new ATOM 0 HB2 LEU A 46 29.120 -1.191 1.321 1.00 7.55 H new ATOM 0 HB3 LEU A 46 28.456 -0.263 -0.009 1.00 7.55 H new ATOM 0 HG LEU A 46 30.782 -1.027 -0.398 1.00 7.70 H new ATOM 0 HD11 LEU A 46 31.670 1.129 -1.187 1.00 7.76 H new ATOM 0 HD12 LEU A 46 29.940 0.950 -1.564 1.00 7.76 H new ATOM 0 HD13 LEU A 46 30.453 1.984 -0.210 1.00 7.76 H new ATOM 0 HD21 LEU A 46 32.622 0.082 0.823 1.00 8.22 H new ATOM 0 HD22 LEU A 46 31.432 0.891 1.870 1.00 8.22 H new ATOM 0 HD23 LEU A 46 31.597 -0.881 1.913 1.00 8.22 H new ATOM 751 N LEU A 47 26.384 0.697 1.732 1.00 5.99 N ATOM 752 CA LEU A 47 25.025 1.154 1.453 1.00 5.15 C ATOM 753 C LEU A 47 24.738 2.444 2.214 1.00 5.48 C ATOM 754 O LEU A 47 23.970 3.288 1.764 1.00 5.21 O ATOM 755 CB LEU A 47 24.002 0.078 1.832 1.00 4.73 C ATOM 756 CG LEU A 47 24.044 -1.202 0.990 1.00 4.22 C ATOM 757 CD1 LEU A 47 23.111 -2.251 1.577 1.00 4.20 C ATOM 758 CD2 LEU A 47 23.664 -0.910 -0.457 1.00 4.34 C ATOM 0 H LEU A 47 26.441 -0.217 2.182 1.00 5.99 H new ATOM 0 HA LEU A 47 24.940 1.347 0.384 1.00 5.15 H new ATOM 0 HB2 LEU A 47 24.155 -0.191 2.877 1.00 4.73 H new ATOM 0 HB3 LEU A 47 23.004 0.509 1.756 1.00 4.73 H new ATOM 0 HG LEU A 47 25.063 -1.588 1.006 1.00 4.22 H new ATOM 0 HD11 LEU A 47 23.151 -3.155 0.969 1.00 4.20 H new ATOM 0 HD12 LEU A 47 23.421 -2.485 2.595 1.00 4.20 H new ATOM 0 HD13 LEU A 47 22.091 -1.866 1.588 1.00 4.20 H new ATOM 0 HD21 LEU A 47 23.701 -1.833 -1.036 1.00 4.34 H new ATOM 0 HD22 LEU A 47 22.655 -0.499 -0.492 1.00 4.34 H new ATOM 0 HD23 LEU A 47 24.364 -0.189 -0.879 1.00 4.34 H new ATOM 770 N VAL A 48 25.374 2.580 3.369 1.00 6.32 N ATOM 771 CA VAL A 48 25.244 3.772 4.195 1.00 6.92 C ATOM 772 C VAL A 48 26.169 4.891 3.702 1.00 7.62 C ATOM 773 O VAL A 48 25.803 6.065 3.713 1.00 7.93 O ATOM 774 CB VAL A 48 25.547 3.428 5.674 1.00 7.91 C ATOM 775 CG1 VAL A 48 25.694 4.674 6.528 1.00 7.84 C ATOM 776 CG2 VAL A 48 24.451 2.536 6.234 1.00 8.67 C ATOM 0 H VAL A 48 25.993 1.869 3.759 1.00 6.32 H new ATOM 0 HA VAL A 48 24.218 4.131 4.118 1.00 6.92 H new ATOM 0 HB VAL A 48 26.499 2.898 5.702 1.00 7.91 H new ATOM 0 HG11 VAL A 48 25.906 4.386 7.558 1.00 7.84 H new ATOM 0 HG12 VAL A 48 26.513 5.283 6.145 1.00 7.84 H new ATOM 0 HG13 VAL A 48 24.769 5.249 6.495 1.00 7.84 H new ATOM 0 HG21 VAL A 48 24.671 2.298 7.275 1.00 8.67 H new ATOM 0 HG22 VAL A 48 23.494 3.055 6.175 1.00 8.67 H new ATOM 0 HG23 VAL A 48 24.400 1.614 5.654 1.00 8.67 H new ATOM 786 N GLN A 49 27.360 4.519 3.252 1.00 8.03 N ATOM 787 CA GLN A 49 28.341 5.481 2.783 1.00 8.97 C ATOM 788 C GLN A 49 27.902 6.093 1.462 1.00 8.65 C ATOM 789 O GLN A 49 27.950 7.312 1.285 1.00 9.36 O ATOM 790 CB GLN A 49 29.704 4.803 2.621 1.00 9.65 C ATOM 791 CG GLN A 49 30.812 5.756 2.222 1.00 10.72 C ATOM 792 CD GLN A 49 31.053 6.832 3.262 1.00 11.48 C ATOM 793 OE1 GLN A 49 30.842 6.619 4.454 1.00 11.55 O ATOM 794 NE2 GLN A 49 31.500 7.994 2.818 1.00 12.22 N ATOM 0 H GLN A 49 27.669 3.548 3.203 1.00 8.03 H new ATOM 0 HA GLN A 49 28.425 6.278 3.522 1.00 8.97 H new ATOM 0 HB2 GLN A 49 29.973 4.319 3.560 1.00 9.65 H new ATOM 0 HB3 GLN A 49 29.623 4.018 1.869 1.00 9.65 H new ATOM 0 HG2 GLN A 49 31.732 5.193 2.066 1.00 10.72 H new ATOM 0 HG3 GLN A 49 30.559 6.224 1.271 1.00 10.72 H new ATOM 0 HE21 GLN A 49 31.662 8.130 1.820 1.00 12.22 H new ATOM 0 HE22 GLN A 49 31.683 8.754 3.473 1.00 12.22 H new ATOM 803 N ASN A 50 27.463 5.243 0.544 1.00 7.73 N ATOM 804 CA ASN A 50 27.012 5.698 -0.767 1.00 7.72 C ATOM 805 C ASN A 50 25.533 6.071 -0.753 1.00 7.17 C ATOM 806 O ASN A 50 24.904 6.182 -1.802 1.00 7.27 O ATOM 807 CB ASN A 50 27.263 4.629 -1.833 1.00 7.34 C ATOM 808 CG ASN A 50 28.719 4.527 -2.237 1.00 7.66 C ATOM 809 OD1 ASN A 50 29.479 5.489 -2.124 1.00 8.30 O ATOM 810 ND2 ASN A 50 29.114 3.368 -2.740 1.00 7.49 N ATOM 0 H ASN A 50 27.409 4.234 0.682 1.00 7.73 H new ATOM 0 HA ASN A 50 27.590 6.589 -1.013 1.00 7.72 H new ATOM 0 HB2 ASN A 50 26.927 3.663 -1.457 1.00 7.34 H new ATOM 0 HB3 ASN A 50 26.662 4.854 -2.714 1.00 7.34 H new ATOM 0 HD21 ASN A 50 30.078 3.249 -3.050 1.00 7.49 H new ATOM 0 HD22 ASN A 50 28.454 2.594 -2.817 1.00 7.49 H new ATOM 817 N ALA A 51 24.975 6.256 0.429 1.00 6.83 N ATOM 818 CA ALA A 51 23.604 6.719 0.547 1.00 6.42 C ATOM 819 C ALA A 51 23.561 8.235 0.459 1.00 7.39 C ATOM 820 O ALA A 51 24.597 8.900 0.558 1.00 8.36 O ATOM 821 CB ALA A 51 22.984 6.252 1.855 1.00 5.86 C ATOM 0 H ALA A 51 25.448 6.094 1.318 1.00 6.83 H new ATOM 0 HA ALA A 51 23.025 6.295 -0.274 1.00 6.42 H new ATOM 0 HB1 ALA A 51 21.957 6.612 1.920 1.00 5.86 H new ATOM 0 HB2 ALA A 51 22.990 5.163 1.892 1.00 5.86 H new ATOM 0 HB3 ALA A 51 23.560 6.647 2.692 1.00 5.86 H new ATOM 827 N ASN A 52 22.369 8.774 0.264 1.00 7.23 N ATOM 828 CA ASN A 52 22.175 10.218 0.257 1.00 8.14 C ATOM 829 C ASN A 52 22.509 10.775 1.637 1.00 8.57 C ATOM 830 O ASN A 52 22.023 10.247 2.637 1.00 8.09 O ATOM 831 CB ASN A 52 20.724 10.548 -0.113 1.00 7.94 C ATOM 832 CG ASN A 52 20.437 12.038 -0.172 1.00 8.81 C ATOM 833 OD1 ASN A 52 21.276 12.835 -0.588 1.00 9.40 O ATOM 834 ND2 ASN A 52 19.246 12.427 0.257 1.00 9.07 N ATOM 0 H ASN A 52 21.518 8.234 0.108 1.00 7.23 H new ATOM 0 HA ASN A 52 22.833 10.673 -0.483 1.00 8.14 H new ATOM 0 HB2 ASN A 52 20.494 10.103 -1.081 1.00 7.94 H new ATOM 0 HB3 ASN A 52 20.058 10.086 0.616 1.00 7.94 H new ATOM 0 HD21 ASN A 52 18.999 13.417 0.249 1.00 9.07 H new ATOM 0 HD22 ASN A 52 18.575 11.737 0.595 1.00 9.07 H new ATOM 841 N PRO A 53 23.378 11.805 1.714 1.00 9.68 N ATOM 842 CA PRO A 53 23.827 12.396 2.980 1.00 10.41 C ATOM 843 C PRO A 53 22.734 12.470 4.044 1.00 10.13 C ATOM 844 O PRO A 53 22.903 11.948 5.147 1.00 10.29 O ATOM 845 CB PRO A 53 24.260 13.794 2.553 1.00 11.56 C ATOM 846 CG PRO A 53 24.804 13.602 1.178 1.00 11.66 C ATOM 847 CD PRO A 53 24.022 12.467 0.560 1.00 10.51 C ATOM 0 HA PRO A 53 24.608 11.800 3.452 1.00 10.41 H new ATOM 0 HB2 PRO A 53 23.421 14.490 2.556 1.00 11.56 H new ATOM 0 HB3 PRO A 53 25.014 14.201 3.227 1.00 11.56 H new ATOM 0 HG2 PRO A 53 24.697 14.512 0.588 1.00 11.66 H new ATOM 0 HG3 PRO A 53 25.868 13.367 1.211 1.00 11.66 H new ATOM 0 HD2 PRO A 53 23.283 12.833 -0.153 1.00 10.51 H new ATOM 0 HD3 PRO A 53 24.674 11.781 0.019 1.00 10.51 H new ATOM 855 N ASP A 54 21.606 13.078 3.689 1.00 9.86 N ATOM 856 CA ASP A 54 20.489 13.262 4.618 1.00 9.76 C ATOM 857 C ASP A 54 19.977 11.919 5.128 1.00 8.93 C ATOM 858 O ASP A 54 19.710 11.742 6.318 1.00 9.26 O ATOM 859 CB ASP A 54 19.352 13.991 3.907 1.00 9.71 C ATOM 860 CG ASP A 54 18.340 14.590 4.864 1.00 9.98 C ATOM 861 OD1 ASP A 54 17.339 13.907 5.183 1.00 10.64 O ATOM 862 OD2 ASP A 54 18.539 15.734 5.315 1.00 9.67 O ATOM 0 H ASP A 54 21.438 13.456 2.757 1.00 9.86 H new ATOM 0 HA ASP A 54 20.841 13.848 5.467 1.00 9.76 H new ATOM 0 HB2 ASP A 54 19.769 14.783 3.285 1.00 9.71 H new ATOM 0 HB3 ASP A 54 18.844 13.296 3.239 1.00 9.71 H new ATOM 867 N CYS A 55 19.885 10.976 4.209 1.00 8.04 N ATOM 868 CA CYS A 55 19.316 9.661 4.476 1.00 7.30 C ATOM 869 C CYS A 55 20.173 8.859 5.451 1.00 7.57 C ATOM 870 O CYS A 55 19.658 8.248 6.380 1.00 7.74 O ATOM 871 CB CYS A 55 19.152 8.891 3.167 1.00 6.46 C ATOM 872 SG CYS A 55 18.132 9.739 1.939 1.00 6.30 S ATOM 0 H CYS A 55 20.204 11.098 3.248 1.00 8.04 H new ATOM 0 HA CYS A 55 18.340 9.808 4.939 1.00 7.30 H new ATOM 0 HB2 CYS A 55 20.138 8.706 2.740 1.00 6.46 H new ATOM 0 HB3 CYS A 55 18.710 7.918 3.382 1.00 6.46 H new ATOM 0 HG CYS A 55 17.091 9.012 1.663 1.00 6.30 H new ATOM 878 N LYS A 56 21.484 8.862 5.251 1.00 7.87 N ATOM 879 CA LYS A 56 22.365 8.119 6.144 1.00 8.36 C ATOM 880 C LYS A 56 22.522 8.854 7.466 1.00 9.50 C ATOM 881 O LYS A 56 22.844 8.259 8.494 1.00 10.04 O ATOM 882 CB LYS A 56 23.723 7.850 5.492 1.00 8.58 C ATOM 883 CG LYS A 56 24.569 9.081 5.218 1.00 8.84 C ATOM 884 CD LYS A 56 25.057 9.092 3.779 1.00 8.68 C ATOM 885 CE LYS A 56 26.382 9.819 3.628 1.00 9.50 C ATOM 886 NZ LYS A 56 27.508 9.043 4.215 1.00 9.81 N ATOM 0 H LYS A 56 21.954 9.359 4.495 1.00 7.87 H new ATOM 0 HA LYS A 56 21.907 7.150 6.345 1.00 8.36 H new ATOM 0 HB2 LYS A 56 24.289 7.177 6.136 1.00 8.58 H new ATOM 0 HB3 LYS A 56 23.558 7.327 4.550 1.00 8.58 H new ATOM 0 HG2 LYS A 56 23.985 9.980 5.415 1.00 8.84 H new ATOM 0 HG3 LYS A 56 25.422 9.100 5.896 1.00 8.84 H new ATOM 0 HD2 LYS A 56 25.165 8.066 3.426 1.00 8.68 H new ATOM 0 HD3 LYS A 56 24.308 9.570 3.147 1.00 8.68 H new ATOM 0 HE2 LYS A 56 26.578 10.001 2.571 1.00 9.50 H new ATOM 0 HE3 LYS A 56 26.320 10.793 4.113 1.00 9.50 H new ATOM 0 HZ1 LYS A 56 28.384 9.255 3.696 1.00 9.81 H new ATOM 0 HZ2 LYS A 56 27.626 9.305 5.215 1.00 9.81 H new ATOM 0 HZ3 LYS A 56 27.302 8.026 4.145 1.00 9.81 H new ATOM 900 N THR A 57 22.288 10.154 7.424 1.00 9.98 N ATOM 901 CA THR A 57 22.327 10.987 8.614 1.00 11.08 C ATOM 902 C THR A 57 21.210 10.615 9.597 1.00 11.16 C ATOM 903 O THR A 57 21.439 10.538 10.801 1.00 12.08 O ATOM 904 CB THR A 57 22.225 12.477 8.231 1.00 11.53 C ATOM 905 OG1 THR A 57 23.391 12.870 7.500 1.00 12.00 O ATOM 906 CG2 THR A 57 22.074 13.361 9.450 1.00 12.46 C ATOM 0 H THR A 57 22.066 10.661 6.567 1.00 9.98 H new ATOM 0 HA THR A 57 23.282 10.812 9.110 1.00 11.08 H new ATOM 0 HB THR A 57 21.336 12.600 7.613 1.00 11.53 H new ATOM 0 HG1 THR A 57 23.329 12.536 6.581 1.00 12.00 H new ATOM 0 HG21 THR A 57 22.005 14.403 9.138 1.00 12.46 H new ATOM 0 HG22 THR A 57 21.169 13.084 9.990 1.00 12.46 H new ATOM 0 HG23 THR A 57 22.939 13.234 10.101 1.00 12.46 H new ATOM 914 N ILE A 58 20.009 10.364 9.089 1.00 10.34 N ATOM 915 CA ILE A 58 18.885 10.016 9.956 1.00 10.60 C ATOM 916 C ILE A 58 18.999 8.582 10.470 1.00 10.65 C ATOM 917 O ILE A 58 18.482 8.257 11.537 1.00 11.46 O ATOM 918 CB ILE A 58 17.528 10.179 9.245 1.00 9.96 C ATOM 919 CG1 ILE A 58 17.490 9.311 7.992 1.00 8.86 C ATOM 920 CG2 ILE A 58 17.278 11.641 8.899 1.00 10.22 C ATOM 921 CD1 ILE A 58 16.106 9.070 7.454 1.00 8.44 C ATOM 0 H ILE A 58 19.788 10.394 8.094 1.00 10.34 H new ATOM 0 HA ILE A 58 18.928 10.711 10.795 1.00 10.60 H new ATOM 0 HB ILE A 58 16.735 9.853 9.918 1.00 9.96 H new ATOM 0 HG12 ILE A 58 18.092 9.784 7.217 1.00 8.86 H new ATOM 0 HG13 ILE A 58 17.954 8.350 8.214 1.00 8.86 H new ATOM 0 HG21 ILE A 58 16.315 11.737 8.397 1.00 10.22 H new ATOM 0 HG22 ILE A 58 17.272 12.235 9.813 1.00 10.22 H new ATOM 0 HG23 ILE A 58 18.068 11.999 8.239 1.00 10.22 H new ATOM 0 HD11 ILE A 58 16.166 8.445 6.563 1.00 8.44 H new ATOM 0 HD12 ILE A 58 15.504 8.567 8.211 1.00 8.44 H new ATOM 0 HD13 ILE A 58 15.644 10.023 7.198 1.00 8.44 H new ATOM 933 N LEU A 59 19.666 7.726 9.697 1.00 9.90 N ATOM 934 CA LEU A 59 19.884 6.328 10.085 1.00 9.98 C ATOM 935 C LEU A 59 20.500 6.211 11.478 1.00 11.20 C ATOM 936 O LEU A 59 20.072 5.387 12.289 1.00 11.84 O ATOM 937 CB LEU A 59 20.787 5.615 9.076 1.00 9.07 C ATOM 938 CG LEU A 59 20.233 5.502 7.655 1.00 7.91 C ATOM 939 CD1 LEU A 59 21.171 4.678 6.786 1.00 7.28 C ATOM 940 CD2 LEU A 59 18.841 4.893 7.669 1.00 7.92 C ATOM 0 H LEU A 59 20.068 7.975 8.793 1.00 9.90 H new ATOM 0 HA LEU A 59 18.904 5.852 10.099 1.00 9.98 H new ATOM 0 HB2 LEU A 59 21.740 6.142 9.034 1.00 9.07 H new ATOM 0 HB3 LEU A 59 20.993 4.611 9.447 1.00 9.07 H new ATOM 0 HG LEU A 59 20.161 6.504 7.232 1.00 7.91 H new ATOM 0 HD11 LEU A 59 20.764 4.606 5.778 1.00 7.28 H new ATOM 0 HD12 LEU A 59 22.149 5.158 6.749 1.00 7.28 H new ATOM 0 HD13 LEU A 59 21.274 3.678 7.208 1.00 7.28 H new ATOM 0 HD21 LEU A 59 18.465 4.821 6.648 1.00 7.92 H new ATOM 0 HD22 LEU A 59 18.884 3.897 8.111 1.00 7.92 H new ATOM 0 HD23 LEU A 59 18.174 5.523 8.258 1.00 7.92 H new ATOM 952 N LYS A 60 21.498 7.037 11.759 1.00 11.67 N ATOM 953 CA LYS A 60 22.181 6.990 13.048 1.00 12.90 C ATOM 954 C LYS A 60 21.302 7.584 14.144 1.00 13.86 C ATOM 955 O LYS A 60 21.470 7.285 15.324 1.00 14.91 O ATOM 956 CB LYS A 60 23.527 7.718 12.962 1.00 13.23 C ATOM 957 CG LYS A 60 23.409 9.193 12.611 1.00 13.20 C ATOM 958 CD LYS A 60 24.671 9.715 11.938 1.00 13.44 C ATOM 959 CE LYS A 60 25.891 9.607 12.842 1.00 14.35 C ATOM 960 NZ LYS A 60 25.808 10.519 14.012 1.00 14.91 N ATOM 0 H LYS A 60 21.853 7.745 11.116 1.00 11.67 H new ATOM 0 HA LYS A 60 22.374 5.948 13.304 1.00 12.90 H new ATOM 0 HB2 LYS A 60 24.042 7.622 13.918 1.00 13.23 H new ATOM 0 HB3 LYS A 60 24.148 7.225 12.214 1.00 13.23 H new ATOM 0 HG2 LYS A 60 22.556 9.342 11.950 1.00 13.20 H new ATOM 0 HG3 LYS A 60 23.215 9.768 13.516 1.00 13.20 H new ATOM 0 HD2 LYS A 60 24.850 9.154 11.020 1.00 13.44 H new ATOM 0 HD3 LYS A 60 24.524 10.756 11.652 1.00 13.44 H new ATOM 0 HE2 LYS A 60 25.992 8.579 13.191 1.00 14.35 H new ATOM 0 HE3 LYS A 60 26.788 9.838 12.267 1.00 14.35 H new ATOM 0 HZ1 LYS A 60 26.696 10.473 14.552 1.00 14.91 H new ATOM 0 HZ2 LYS A 60 25.653 11.493 13.682 1.00 14.91 H new ATOM 0 HZ3 LYS A 60 25.017 10.230 14.622 1.00 14.91 H new ATOM 974 N ALA A 61 20.336 8.400 13.739 1.00 13.54 N ATOM 975 CA ALA A 61 19.404 9.010 14.675 1.00 14.41 C ATOM 976 C ALA A 61 18.318 8.017 15.085 1.00 14.65 C ATOM 977 O ALA A 61 17.561 8.263 16.024 1.00 15.64 O ATOM 978 CB ALA A 61 18.781 10.260 14.069 1.00 14.06 C ATOM 0 H ALA A 61 20.179 8.654 12.764 1.00 13.54 H new ATOM 0 HA ALA A 61 19.958 9.297 15.569 1.00 14.41 H new ATOM 0 HB1 ALA A 61 18.087 10.703 14.783 1.00 14.06 H new ATOM 0 HB2 ALA A 61 19.565 10.979 13.831 1.00 14.06 H new ATOM 0 HB3 ALA A 61 18.244 9.994 13.158 1.00 14.06 H new ATOM 984 N LEU A 62 18.232 6.901 14.362 1.00 13.84 N ATOM 985 CA LEU A 62 17.292 5.841 14.705 1.00 14.21 C ATOM 986 C LEU A 62 17.763 5.089 15.944 1.00 14.97 C ATOM 987 O LEU A 62 16.956 4.531 16.686 1.00 15.72 O ATOM 988 CB LEU A 62 17.144 4.868 13.536 1.00 13.37 C ATOM 989 CG LEU A 62 16.657 5.493 12.230 1.00 12.15 C ATOM 990 CD1 LEU A 62 16.805 4.503 11.090 1.00 11.39 C ATOM 991 CD2 LEU A 62 15.209 5.948 12.358 1.00 12.25 C ATOM 0 H LEU A 62 18.801 6.710 13.538 1.00 13.84 H new ATOM 0 HA LEU A 62 16.324 6.296 14.916 1.00 14.21 H new ATOM 0 HB2 LEU A 62 18.108 4.392 13.356 1.00 13.37 H new ATOM 0 HB3 LEU A 62 16.448 4.080 13.825 1.00 13.37 H new ATOM 0 HG LEU A 62 17.270 6.368 12.015 1.00 12.15 H new ATOM 0 HD11 LEU A 62 16.455 4.959 10.164 1.00 11.39 H new ATOM 0 HD12 LEU A 62 17.854 4.225 10.984 1.00 11.39 H new ATOM 0 HD13 LEU A 62 16.213 3.613 11.302 1.00 11.39 H new ATOM 0 HD21 LEU A 62 14.882 6.390 11.417 1.00 12.25 H new ATOM 0 HD22 LEU A 62 14.578 5.091 12.595 1.00 12.25 H new ATOM 0 HD23 LEU A 62 15.129 6.689 13.154 1.00 12.25 H new ATOM 1003 N GLY A 63 19.074 5.075 16.160 1.00 14.89 N ATOM 1004 CA GLY A 63 19.621 4.403 17.323 1.00 15.66 C ATOM 1005 C GLY A 63 20.743 3.437 16.976 1.00 16.04 C ATOM 1006 O GLY A 63 21.915 3.767 17.130 1.00 16.17 O ATOM 0 H GLY A 63 19.765 5.515 15.553 1.00 14.89 H new ATOM 0 HA2 GLY A 63 19.995 5.149 18.025 1.00 15.66 H new ATOM 0 HA3 GLY A 63 18.824 3.859 17.830 1.00 15.66 H new ATOM 1010 N PRO A 64 20.410 2.232 16.485 1.00 16.36 N ATOM 1011 CA PRO A 64 21.401 1.192 16.179 1.00 16.89 C ATOM 1012 C PRO A 64 22.097 1.423 14.844 1.00 16.41 C ATOM 1013 O PRO A 64 22.833 0.568 14.352 1.00 16.65 O ATOM 1014 CB PRO A 64 20.551 -0.073 16.119 1.00 17.44 C ATOM 1015 CG PRO A 64 19.239 0.403 15.606 1.00 16.99 C ATOM 1016 CD PRO A 64 19.035 1.775 16.194 1.00 16.40 C ATOM 0 HA PRO A 64 22.206 1.160 16.914 1.00 16.89 H new ATOM 0 HB2 PRO A 64 20.992 -0.820 15.458 1.00 17.44 H new ATOM 0 HB3 PRO A 64 20.452 -0.535 17.101 1.00 17.44 H new ATOM 0 HG2 PRO A 64 19.237 0.441 14.517 1.00 16.99 H new ATOM 0 HG3 PRO A 64 18.436 -0.272 15.903 1.00 16.99 H new ATOM 0 HD2 PRO A 64 18.530 2.441 15.494 1.00 16.40 H new ATOM 0 HD3 PRO A 64 18.424 1.739 17.096 1.00 16.40 H new ATOM 1024 N GLY A 65 21.840 2.581 14.257 1.00 15.83 N ATOM 1025 CA GLY A 65 22.419 2.907 12.974 1.00 15.53 C ATOM 1026 C GLY A 65 21.689 2.218 11.847 1.00 14.59 C ATOM 1027 O GLY A 65 22.255 2.010 10.773 1.00 14.42 O ATOM 0 H GLY A 65 21.237 3.304 14.650 1.00 15.83 H new ATOM 0 HA2 GLY A 65 22.388 3.986 12.823 1.00 15.53 H new ATOM 0 HA3 GLY A 65 23.469 2.614 12.962 1.00 15.53 H new ATOM 1031 N ALA A 66 20.431 1.860 12.117 1.00 14.15 N ATOM 1032 CA ALA A 66 19.565 1.179 11.156 1.00 13.39 C ATOM 1033 C ALA A 66 20.038 -0.249 10.902 1.00 13.11 C ATOM 1034 O ALA A 66 21.092 -0.484 10.312 1.00 12.58 O ATOM 1035 CB ALA A 66 19.476 1.963 9.857 1.00 12.24 C ATOM 0 H ALA A 66 19.983 2.037 13.016 1.00 14.15 H new ATOM 0 HA ALA A 66 18.565 1.125 11.587 1.00 13.39 H new ATOM 0 HB1 ALA A 66 18.826 1.436 9.158 1.00 12.24 H new ATOM 0 HB2 ALA A 66 19.067 2.953 10.057 1.00 12.24 H new ATOM 0 HB3 ALA A 66 20.471 2.062 9.423 1.00 12.24 H new ATOM 1041 N THR A 67 19.240 -1.197 11.372 1.00 13.60 N ATOM 1042 CA THR A 67 19.575 -2.608 11.283 1.00 13.52 C ATOM 1043 C THR A 67 19.491 -3.125 9.845 1.00 12.33 C ATOM 1044 O THR A 67 20.512 -3.282 9.182 1.00 11.64 O ATOM 1045 CB THR A 67 18.651 -3.435 12.193 1.00 14.67 C ATOM 1046 OG1 THR A 67 18.551 -2.805 13.479 1.00 15.33 O ATOM 1047 CG2 THR A 67 19.173 -4.855 12.358 1.00 15.45 C ATOM 0 H THR A 67 18.345 -1.009 11.824 1.00 13.60 H new ATOM 0 HA THR A 67 20.607 -2.719 11.617 1.00 13.52 H new ATOM 0 HB THR A 67 17.666 -3.484 11.728 1.00 14.67 H new ATOM 0 HG1 THR A 67 17.841 -2.130 13.458 1.00 15.33 H new ATOM 0 HG21 THR A 67 18.500 -5.417 13.006 1.00 15.45 H new ATOM 0 HG22 THR A 67 19.226 -5.339 11.383 1.00 15.45 H new ATOM 0 HG23 THR A 67 20.167 -4.828 12.804 1.00 15.45 H new ATOM 1055 N LEU A 68 18.283 -3.389 9.356 1.00 12.22 N ATOM 1056 CA LEU A 68 18.124 -3.906 8.003 1.00 11.25 C ATOM 1057 C LEU A 68 16.957 -3.227 7.296 1.00 11.10 C ATOM 1058 O LEU A 68 17.155 -2.501 6.321 1.00 10.12 O ATOM 1059 CB LEU A 68 17.935 -5.435 8.039 1.00 11.69 C ATOM 1060 CG LEU A 68 18.096 -6.182 6.702 1.00 10.84 C ATOM 1061 CD1 LEU A 68 16.878 -5.999 5.808 1.00 10.70 C ATOM 1062 CD2 LEU A 68 19.354 -5.721 5.979 1.00 9.79 C ATOM 0 H LEU A 68 17.412 -3.255 9.869 1.00 12.22 H new ATOM 0 HA LEU A 68 19.028 -3.683 7.437 1.00 11.25 H new ATOM 0 HB2 LEU A 68 18.650 -5.850 8.749 1.00 11.69 H new ATOM 0 HB3 LEU A 68 16.939 -5.646 8.429 1.00 11.69 H new ATOM 0 HG LEU A 68 18.188 -7.244 6.929 1.00 10.84 H new ATOM 0 HD11 LEU A 68 17.028 -6.540 4.874 1.00 10.70 H new ATOM 0 HD12 LEU A 68 15.994 -6.386 6.314 1.00 10.70 H new ATOM 0 HD13 LEU A 68 16.739 -4.939 5.595 1.00 10.70 H new ATOM 0 HD21 LEU A 68 19.450 -6.260 5.037 1.00 9.79 H new ATOM 0 HD22 LEU A 68 19.288 -4.651 5.780 1.00 9.79 H new ATOM 0 HD23 LEU A 68 20.226 -5.921 6.602 1.00 9.79 H new ATOM 1074 N GLU A 69 15.745 -3.428 7.794 1.00 12.16 N ATOM 1075 CA GLU A 69 14.574 -2.864 7.135 1.00 12.26 C ATOM 1076 C GLU A 69 14.518 -1.372 7.385 1.00 11.96 C ATOM 1077 O GLU A 69 13.959 -0.613 6.593 1.00 11.57 O ATOM 1078 CB GLU A 69 13.286 -3.535 7.622 1.00 13.61 C ATOM 1079 CG GLU A 69 12.944 -3.237 9.073 1.00 14.60 C ATOM 1080 CD GLU A 69 11.586 -3.767 9.470 1.00 15.86 C ATOM 1081 OE1 GLU A 69 11.525 -4.855 10.079 1.00 16.53 O ATOM 1082 OE2 GLU A 69 10.571 -3.105 9.174 1.00 16.24 O ATOM 0 H GLU A 69 15.547 -3.967 8.637 1.00 12.16 H new ATOM 0 HA GLU A 69 14.659 -3.048 6.064 1.00 12.26 H new ATOM 0 HB2 GLU A 69 12.459 -3.211 6.991 1.00 13.61 H new ATOM 0 HB3 GLU A 69 13.380 -4.614 7.496 1.00 13.61 H new ATOM 0 HG2 GLU A 69 13.704 -3.676 9.719 1.00 14.60 H new ATOM 0 HG3 GLU A 69 12.971 -2.159 9.235 1.00 14.60 H new ATOM 1089 N GLU A 70 15.129 -0.963 8.482 1.00 12.26 N ATOM 1090 CA GLU A 70 15.185 0.433 8.854 1.00 12.19 C ATOM 1091 C GLU A 70 15.983 1.211 7.821 1.00 10.92 C ATOM 1092 O GLU A 70 15.491 2.162 7.238 1.00 10.57 O ATOM 1093 CB GLU A 70 15.833 0.579 10.229 1.00 13.06 C ATOM 1094 CG GLU A 70 15.365 -0.464 11.228 1.00 14.21 C ATOM 1095 CD GLU A 70 15.946 -0.245 12.606 1.00 15.02 C ATOM 1096 OE1 GLU A 70 15.238 0.323 13.463 1.00 15.56 O ATOM 1097 OE2 GLU A 70 17.107 -0.633 12.831 1.00 15.23 O ATOM 0 H GLU A 70 15.598 -1.589 9.136 1.00 12.26 H new ATOM 0 HA GLU A 70 14.171 0.831 8.895 1.00 12.19 H new ATOM 0 HB2 GLU A 70 16.915 0.509 10.122 1.00 13.06 H new ATOM 0 HB3 GLU A 70 15.615 1.572 10.622 1.00 13.06 H new ATOM 0 HG2 GLU A 70 14.277 -0.443 11.288 1.00 14.21 H new ATOM 0 HG3 GLU A 70 15.645 -1.455 10.872 1.00 14.21 H new ATOM 1104 N MET A 71 17.200 0.753 7.564 1.00 10.30 N ATOM 1105 CA MET A 71 18.108 1.436 6.641 1.00 9.14 C ATOM 1106 C MET A 71 17.534 1.441 5.233 1.00 8.31 C ATOM 1107 O MET A 71 17.767 2.367 4.460 1.00 7.58 O ATOM 1108 CB MET A 71 19.501 0.780 6.641 1.00 8.85 C ATOM 1109 CG MET A 71 19.522 -0.644 6.106 1.00 8.69 C ATOM 1110 SD MET A 71 21.146 -1.424 6.235 1.00 8.41 S ATOM 1111 CE MET A 71 22.124 -0.364 5.172 1.00 8.50 C ATOM 0 H MET A 71 17.587 -0.093 7.982 1.00 10.30 H new ATOM 0 HA MET A 71 18.216 2.465 6.983 1.00 9.14 H new ATOM 0 HB2 MET A 71 20.177 1.391 6.043 1.00 8.85 H new ATOM 0 HB3 MET A 71 19.889 0.779 7.659 1.00 8.85 H new ATOM 0 HG2 MET A 71 18.793 -1.242 6.653 1.00 8.69 H new ATOM 0 HG3 MET A 71 19.210 -0.638 5.062 1.00 8.69 H new ATOM 0 HE1 MET A 71 23.067 -0.856 4.936 1.00 8.50 H new ATOM 0 HE2 MET A 71 21.576 -0.168 4.250 1.00 8.50 H new ATOM 0 HE3 MET A 71 22.324 0.578 5.682 1.00 8.50 H new ATOM 1121 N MET A 72 16.768 0.410 4.921 1.00 8.67 N ATOM 1122 CA MET A 72 16.159 0.285 3.610 1.00 8.32 C ATOM 1123 C MET A 72 15.003 1.265 3.466 1.00 8.63 C ATOM 1124 O MET A 72 14.909 2.003 2.486 1.00 8.10 O ATOM 1125 CB MET A 72 15.656 -1.143 3.391 1.00 9.08 C ATOM 1126 CG MET A 72 15.082 -1.383 2.004 1.00 9.10 C ATOM 1127 SD MET A 72 14.303 -3.002 1.845 1.00 10.28 S ATOM 1128 CE MET A 72 12.885 -2.803 2.923 1.00 11.15 C ATOM 0 H MET A 72 16.553 -0.355 5.561 1.00 8.67 H new ATOM 0 HA MET A 72 16.914 0.515 2.858 1.00 8.32 H new ATOM 0 HB2 MET A 72 16.478 -1.838 3.559 1.00 9.08 H new ATOM 0 HB3 MET A 72 14.891 -1.367 4.135 1.00 9.08 H new ATOM 0 HG2 MET A 72 14.349 -0.608 1.779 1.00 9.10 H new ATOM 0 HG3 MET A 72 15.878 -1.293 1.265 1.00 9.10 H new ATOM 0 HE1 MET A 72 12.123 -3.536 2.660 1.00 11.15 H new ATOM 0 HE2 MET A 72 13.191 -2.953 3.958 1.00 11.15 H new ATOM 0 HE3 MET A 72 12.478 -1.799 2.807 1.00 11.15 H new ATOM 1138 N THR A 73 14.145 1.271 4.467 1.00 9.62 N ATOM 1139 CA THR A 73 12.921 2.053 4.441 1.00 10.09 C ATOM 1140 C THR A 73 13.176 3.532 4.745 1.00 9.53 C ATOM 1141 O THR A 73 12.574 4.416 4.136 1.00 9.49 O ATOM 1142 CB THR A 73 11.923 1.480 5.463 1.00 11.37 C ATOM 1143 OG1 THR A 73 11.674 0.097 5.171 1.00 12.02 O ATOM 1144 CG2 THR A 73 10.610 2.245 5.448 1.00 11.93 C ATOM 0 H THR A 73 14.276 0.733 5.324 1.00 9.62 H new ATOM 0 HA THR A 73 12.509 1.990 3.434 1.00 10.09 H new ATOM 0 HB THR A 73 12.363 1.579 6.455 1.00 11.37 H new ATOM 0 HG1 THR A 73 12.376 -0.454 5.575 1.00 12.02 H new ATOM 0 HG21 THR A 73 9.929 1.813 6.182 1.00 11.93 H new ATOM 0 HG22 THR A 73 10.795 3.290 5.696 1.00 11.93 H new ATOM 0 HG23 THR A 73 10.163 2.181 4.456 1.00 11.93 H new ATOM 1152 N ALA A 74 14.087 3.790 5.672 1.00 9.27 N ATOM 1153 CA ALA A 74 14.339 5.140 6.163 1.00 9.02 C ATOM 1154 C ALA A 74 14.932 6.046 5.087 1.00 8.01 C ATOM 1155 O ALA A 74 14.596 7.225 5.015 1.00 8.00 O ATOM 1156 CB ALA A 74 15.262 5.082 7.372 1.00 9.32 C ATOM 0 H ALA A 74 14.671 3.074 6.104 1.00 9.27 H new ATOM 0 HA ALA A 74 13.381 5.572 6.451 1.00 9.02 H new ATOM 0 HB1 ALA A 74 15.448 6.092 7.736 1.00 9.32 H new ATOM 0 HB2 ALA A 74 14.793 4.493 8.160 1.00 9.32 H new ATOM 0 HB3 ALA A 74 16.207 4.619 7.087 1.00 9.32 H new ATOM 1162 N CYS A 75 15.800 5.496 4.250 1.00 7.31 N ATOM 1163 CA CYS A 75 16.504 6.293 3.256 1.00 6.51 C ATOM 1164 C CYS A 75 15.612 6.640 2.067 1.00 6.63 C ATOM 1165 O CYS A 75 15.756 7.706 1.472 1.00 6.46 O ATOM 1166 CB CYS A 75 17.749 5.557 2.775 1.00 5.86 C ATOM 1167 SG CYS A 75 18.900 5.125 4.095 1.00 6.16 S ATOM 0 H CYS A 75 16.033 4.503 4.239 1.00 7.31 H new ATOM 0 HA CYS A 75 16.796 7.227 3.735 1.00 6.51 H new ATOM 0 HB2 CYS A 75 17.444 4.646 2.260 1.00 5.86 H new ATOM 0 HB3 CYS A 75 18.267 6.178 2.044 1.00 5.86 H new ATOM 0 HG CYS A 75 18.687 3.900 4.473 1.00 6.16 H new ATOM 1173 N GLN A 76 14.691 5.747 1.719 1.00 7.27 N ATOM 1174 CA GLN A 76 13.792 6.008 0.603 1.00 7.76 C ATOM 1175 C GLN A 76 12.574 6.787 1.075 1.00 8.19 C ATOM 1176 O GLN A 76 11.798 6.317 1.905 1.00 8.73 O ATOM 1177 CB GLN A 76 13.383 4.712 -0.104 1.00 8.60 C ATOM 1178 CG GLN A 76 12.820 3.635 0.804 1.00 9.19 C ATOM 1179 CD GLN A 76 12.625 2.327 0.065 1.00 10.10 C ATOM 1180 OE1 GLN A 76 13.352 2.030 -0.888 1.00 10.49 O ATOM 1181 NE2 GLN A 76 11.652 1.539 0.490 1.00 10.66 N ATOM 0 H GLN A 76 14.549 4.851 2.185 1.00 7.27 H new ATOM 0 HA GLN A 76 14.327 6.616 -0.126 1.00 7.76 H new ATOM 0 HB2 GLN A 76 12.639 4.950 -0.864 1.00 8.60 H new ATOM 0 HB3 GLN A 76 14.253 4.310 -0.624 1.00 8.60 H new ATOM 0 HG2 GLN A 76 13.494 3.480 1.647 1.00 9.19 H new ATOM 0 HG3 GLN A 76 11.867 3.967 1.215 1.00 9.19 H new ATOM 0 HE21 GLN A 76 11.075 1.823 1.281 1.00 10.66 H new ATOM 0 HE22 GLN A 76 11.479 0.647 0.026 1.00 10.66 H new ATOM 1190 N GLY A 77 12.434 7.997 0.563 1.00 8.13 N ATOM 1191 CA GLY A 77 11.382 8.878 1.022 1.00 8.58 C ATOM 1192 C GLY A 77 11.819 9.661 2.243 1.00 8.30 C ATOM 1193 O GLY A 77 11.183 10.646 2.617 1.00 8.85 O ATOM 0 H GLY A 77 13.032 8.387 -0.165 1.00 8.13 H new ATOM 0 HA2 GLY A 77 11.107 9.567 0.224 1.00 8.58 H new ATOM 0 HA3 GLY A 77 10.493 8.294 1.260 1.00 8.58 H new ATOM 1197 N VAL A 78 12.937 9.227 2.830 1.00 7.65 N ATOM 1198 CA VAL A 78 13.489 9.811 4.044 1.00 7.69 C ATOM 1199 C VAL A 78 12.461 9.824 5.174 1.00 8.18 C ATOM 1200 O VAL A 78 11.642 10.736 5.292 1.00 8.24 O ATOM 1201 CB VAL A 78 14.040 11.222 3.793 1.00 7.30 C ATOM 1202 CG1 VAL A 78 14.649 11.795 5.061 1.00 7.56 C ATOM 1203 CG2 VAL A 78 15.067 11.193 2.672 1.00 7.23 C ATOM 0 H VAL A 78 13.488 8.449 2.467 1.00 7.65 H new ATOM 0 HA VAL A 78 14.321 9.179 4.353 1.00 7.69 H new ATOM 0 HB VAL A 78 13.214 11.867 3.493 1.00 7.30 H new ATOM 0 HG11 VAL A 78 15.033 12.795 4.860 1.00 7.56 H new ATOM 0 HG12 VAL A 78 13.887 11.848 5.839 1.00 7.56 H new ATOM 0 HG13 VAL A 78 15.464 11.153 5.395 1.00 7.56 H new ATOM 0 HG21 VAL A 78 15.450 12.199 2.504 1.00 7.23 H new ATOM 0 HG22 VAL A 78 15.889 10.533 2.949 1.00 7.23 H new ATOM 0 HG23 VAL A 78 14.599 10.826 1.759 1.00 7.23 H new ATOM 1213 N GLY A 79 12.515 8.794 5.998 1.00 8.79 N ATOM 1214 CA GLY A 79 11.559 8.647 7.073 1.00 9.46 C ATOM 1215 C GLY A 79 10.630 7.481 6.830 1.00 9.86 C ATOM 1216 O GLY A 79 9.934 7.026 7.736 1.00 10.49 O ATOM 0 H GLY A 79 13.210 8.050 5.942 1.00 8.79 H new ATOM 0 HA2 GLY A 79 12.088 8.502 8.015 1.00 9.46 H new ATOM 0 HA3 GLY A 79 10.977 9.563 7.172 1.00 9.46 H new ATOM 1220 N GLY A 80 10.625 6.996 5.598 1.00 9.69 N ATOM 1221 CA GLY A 80 9.803 5.859 5.251 1.00 10.31 C ATOM 1222 C GLY A 80 8.620 6.244 4.386 1.00 10.42 C ATOM 1223 O GLY A 80 7.871 7.159 4.732 1.00 10.24 O ATOM 0 H GLY A 80 11.179 7.373 4.829 1.00 9.69 H new ATOM 0 HA2 GLY A 80 10.410 5.122 4.725 1.00 10.31 H new ATOM 0 HA3 GLY A 80 9.443 5.382 6.163 1.00 10.31 H new ATOM 1227 N PRO A 81 8.420 5.552 3.251 1.00 10.92 N ATOM 1228 CA PRO A 81 7.301 5.823 2.341 1.00 11.29 C ATOM 1229 C PRO A 81 5.963 5.359 2.912 1.00 11.16 C ATOM 1230 O PRO A 81 4.928 5.452 2.251 1.00 11.39 O ATOM 1231 CB PRO A 81 7.660 5.021 1.090 1.00 12.10 C ATOM 1232 CG PRO A 81 8.512 3.906 1.585 1.00 12.10 C ATOM 1233 CD PRO A 81 9.277 4.456 2.757 1.00 11.39 C ATOM 0 HA PRO A 81 7.174 6.890 2.156 1.00 11.29 H new ATOM 0 HB2 PRO A 81 6.767 4.645 0.591 1.00 12.10 H new ATOM 0 HB3 PRO A 81 8.194 5.636 0.366 1.00 12.10 H new ATOM 0 HG2 PRO A 81 7.903 3.052 1.883 1.00 12.10 H new ATOM 0 HG3 PRO A 81 9.190 3.558 0.806 1.00 12.10 H new ATOM 0 HD2 PRO A 81 9.437 3.697 3.523 1.00 11.39 H new ATOM 0 HD3 PRO A 81 10.260 4.820 2.458 1.00 11.39 H new ATOM 1241 N GLY A 82 5.992 4.860 4.144 1.00 10.99 N ATOM 1242 CA GLY A 82 4.776 4.436 4.807 1.00 11.07 C ATOM 1243 C GLY A 82 4.012 5.605 5.391 1.00 10.54 C ATOM 1244 O GLY A 82 2.944 5.431 5.972 1.00 10.90 O ATOM 0 H GLY A 82 6.842 4.742 4.696 1.00 10.99 H new ATOM 0 HA2 GLY A 82 4.141 3.907 4.096 1.00 11.07 H new ATOM 0 HA3 GLY A 82 5.023 3.731 5.601 1.00 11.07 H new ATOM 1248 N HIS A 83 4.578 6.796 5.256 1.00 9.87 N ATOM 1249 CA HIS A 83 3.890 8.020 5.648 1.00 9.50 C ATOM 1250 C HIS A 83 2.844 8.349 4.596 1.00 9.01 C ATOM 1251 O HIS A 83 3.108 8.206 3.408 1.00 8.60 O ATOM 1252 CB HIS A 83 4.875 9.194 5.760 1.00 9.28 C ATOM 1253 CG HIS A 83 5.900 9.067 6.848 1.00 9.71 C ATOM 1254 ND1 HIS A 83 6.683 10.124 7.257 1.00 9.88 N ATOM 1255 CD2 HIS A 83 6.291 8.005 7.593 1.00 10.26 C ATOM 1256 CE1 HIS A 83 7.509 9.722 8.201 1.00 10.48 C ATOM 1257 NE2 HIS A 83 7.292 8.440 8.424 1.00 10.71 N ATOM 0 H HIS A 83 5.514 6.942 4.877 1.00 9.87 H new ATOM 0 HA HIS A 83 3.425 7.866 6.621 1.00 9.50 H new ATOM 0 HB2 HIS A 83 5.392 9.306 4.807 1.00 9.28 H new ATOM 0 HB3 HIS A 83 4.307 10.110 5.923 1.00 9.28 H new ATOM 0 HD2 HIS A 83 5.890 7.004 7.542 1.00 10.26 H new ATOM 0 HE1 HIS A 83 8.239 10.337 8.706 1.00 10.48 H new ATOM 0 HE2 HIS A 83 7.788 7.865 9.105 1.00 10.71 H new ATOM 1266 N LYS A 84 1.662 8.768 5.015 1.00 9.30 N ATOM 1267 CA LYS A 84 0.621 9.130 4.063 1.00 9.11 C ATOM 1268 C LYS A 84 0.340 10.629 4.109 1.00 8.52 C ATOM 1269 O LYS A 84 0.688 11.363 3.183 1.00 8.22 O ATOM 1270 CB LYS A 84 -0.666 8.343 4.331 1.00 9.97 C ATOM 1271 CG LYS A 84 -1.782 8.637 3.335 1.00 10.46 C ATOM 1272 CD LYS A 84 -1.394 8.250 1.915 1.00 11.30 C ATOM 1273 CE LYS A 84 -2.454 8.681 0.915 1.00 11.85 C ATOM 1274 NZ LYS A 84 -2.102 8.295 -0.477 1.00 12.21 N ATOM 0 H LYS A 84 1.399 8.866 5.996 1.00 9.30 H new ATOM 0 HA LYS A 84 0.980 8.874 3.066 1.00 9.11 H new ATOM 0 HB2 LYS A 84 -0.441 7.277 4.307 1.00 9.97 H new ATOM 0 HB3 LYS A 84 -1.019 8.572 5.337 1.00 9.97 H new ATOM 0 HG2 LYS A 84 -2.681 8.093 3.626 1.00 10.46 H new ATOM 0 HG3 LYS A 84 -2.027 9.699 3.368 1.00 10.46 H new ATOM 0 HD2 LYS A 84 -0.440 8.711 1.658 1.00 11.30 H new ATOM 0 HD3 LYS A 84 -1.253 7.171 1.856 1.00 11.30 H new ATOM 0 HE2 LYS A 84 -3.410 8.231 1.184 1.00 11.85 H new ATOM 0 HE3 LYS A 84 -2.584 9.762 0.969 1.00 11.85 H new ATOM 0 HZ1 LYS A 84 -2.853 8.609 -1.125 1.00 12.21 H new ATOM 0 HZ2 LYS A 84 -1.203 8.744 -0.745 1.00 12.21 H new ATOM 0 HZ3 LYS A 84 -2.003 7.261 -0.536 1.00 12.21 H new ATOM 1288 N ALA A 85 -0.262 11.085 5.197 1.00 8.58 N ATOM 1289 CA ALA A 85 -0.679 12.477 5.307 1.00 8.36 C ATOM 1290 C ALA A 85 0.514 13.423 5.299 1.00 7.63 C ATOM 1291 O ALA A 85 0.443 14.524 4.754 1.00 7.43 O ATOM 1292 CB ALA A 85 -1.505 12.681 6.563 1.00 8.99 C ATOM 0 H ALA A 85 -0.473 10.514 6.015 1.00 8.58 H new ATOM 0 HA ALA A 85 -1.291 12.710 4.436 1.00 8.36 H new ATOM 0 HB1 ALA A 85 -1.810 13.725 6.632 1.00 8.99 H new ATOM 0 HB2 ALA A 85 -2.390 12.046 6.523 1.00 8.99 H new ATOM 0 HB3 ALA A 85 -0.909 12.418 7.437 1.00 8.99 H new ATOM 1298 N ARG A 86 1.615 12.989 5.892 1.00 7.48 N ATOM 1299 CA ARG A 86 2.805 13.821 5.973 1.00 7.14 C ATOM 1300 C ARG A 86 3.618 13.781 4.683 1.00 6.68 C ATOM 1301 O ARG A 86 4.390 14.697 4.418 1.00 6.49 O ATOM 1302 CB ARG A 86 3.677 13.412 7.164 1.00 7.54 C ATOM 1303 CG ARG A 86 3.462 14.269 8.405 1.00 7.94 C ATOM 1304 CD ARG A 86 2.022 14.224 8.900 1.00 8.47 C ATOM 1305 NE ARG A 86 1.649 12.903 9.404 1.00 9.09 N ATOM 1306 CZ ARG A 86 0.408 12.568 9.762 1.00 9.85 C ATOM 1307 NH1 ARG A 86 -0.578 13.455 9.673 1.00 10.10 N ATOM 1308 NH2 ARG A 86 0.154 11.349 10.215 1.00 10.56 N ATOM 0 H ARG A 86 1.709 12.069 6.323 1.00 7.48 H new ATOM 0 HA ARG A 86 2.468 14.847 6.120 1.00 7.14 H new ATOM 0 HB2 ARG A 86 3.471 12.371 7.413 1.00 7.54 H new ATOM 0 HB3 ARG A 86 4.725 13.469 6.871 1.00 7.54 H new ATOM 0 HG2 ARG A 86 4.127 13.928 9.198 1.00 7.94 H new ATOM 0 HG3 ARG A 86 3.735 15.301 8.182 1.00 7.94 H new ATOM 0 HD2 ARG A 86 1.889 14.963 9.690 1.00 8.47 H new ATOM 0 HD3 ARG A 86 1.352 14.503 8.087 1.00 8.47 H new ATOM 0 HE ARG A 86 2.380 12.196 9.487 1.00 9.09 H new ATOM 0 HH11 ARG A 86 -0.388 14.396 9.330 1.00 10.10 H new ATOM 0 HH12 ARG A 86 -1.525 13.194 9.948 1.00 10.10 H new ATOM 0 HH21 ARG A 86 0.907 10.666 10.290 1.00 10.56 H new ATOM 0 HH22 ARG A 86 -0.795 11.094 10.488 1.00 10.56 H new ATOM 1322 N VAL A 87 3.443 12.741 3.874 1.00 6.80 N ATOM 1323 CA VAL A 87 4.213 12.634 2.639 1.00 6.75 C ATOM 1324 C VAL A 87 3.532 13.413 1.517 1.00 6.55 C ATOM 1325 O VAL A 87 4.196 14.029 0.687 1.00 6.49 O ATOM 1326 CB VAL A 87 4.443 11.167 2.199 1.00 7.42 C ATOM 1327 CG1 VAL A 87 3.191 10.554 1.593 1.00 7.80 C ATOM 1328 CG2 VAL A 87 5.601 11.084 1.221 1.00 7.90 C ATOM 0 H VAL A 87 2.790 11.976 4.045 1.00 6.80 H new ATOM 0 HA VAL A 87 5.193 13.065 2.844 1.00 6.75 H new ATOM 0 HB VAL A 87 4.689 10.592 3.091 1.00 7.42 H new ATOM 0 HG11 VAL A 87 3.396 9.525 1.298 1.00 7.80 H new ATOM 0 HG12 VAL A 87 2.387 10.567 2.329 1.00 7.80 H new ATOM 0 HG13 VAL A 87 2.891 11.130 0.717 1.00 7.80 H new ATOM 0 HG21 VAL A 87 5.750 10.047 0.921 1.00 7.90 H new ATOM 0 HG22 VAL A 87 5.378 11.688 0.341 1.00 7.90 H new ATOM 0 HG23 VAL A 87 6.507 11.458 1.698 1.00 7.90 H new ATOM 1338 N LEU A 88 2.205 13.408 1.515 1.00 6.74 N ATOM 1339 CA LEU A 88 1.450 14.110 0.489 1.00 6.96 C ATOM 1340 C LEU A 88 1.559 15.613 0.700 1.00 6.75 C ATOM 1341 O LEU A 88 1.705 16.377 -0.251 1.00 6.87 O ATOM 1342 CB LEU A 88 -0.012 13.628 0.467 1.00 7.72 C ATOM 1343 CG LEU A 88 -0.868 13.912 1.711 1.00 8.06 C ATOM 1344 CD1 LEU A 88 -1.517 15.287 1.635 1.00 8.65 C ATOM 1345 CD2 LEU A 88 -1.934 12.839 1.873 1.00 8.66 C ATOM 0 H LEU A 88 1.633 12.928 2.210 1.00 6.74 H new ATOM 0 HA LEU A 88 1.873 13.884 -0.490 1.00 6.96 H new ATOM 0 HB2 LEU A 88 -0.504 14.084 -0.392 1.00 7.72 H new ATOM 0 HB3 LEU A 88 -0.009 12.551 0.298 1.00 7.72 H new ATOM 0 HG LEU A 88 -0.210 13.897 2.580 1.00 8.06 H new ATOM 0 HD11 LEU A 88 -2.116 15.457 2.530 1.00 8.65 H new ATOM 0 HD12 LEU A 88 -0.743 16.051 1.566 1.00 8.65 H new ATOM 0 HD13 LEU A 88 -2.158 15.339 0.755 1.00 8.65 H new ATOM 0 HD21 LEU A 88 -2.533 13.052 2.758 1.00 8.66 H new ATOM 0 HD22 LEU A 88 -2.577 12.829 0.993 1.00 8.66 H new ATOM 0 HD23 LEU A 88 -1.456 11.866 1.984 1.00 8.66 H new ATOM 1357 N ALA A 89 1.526 16.023 1.960 1.00 6.75 N ATOM 1358 CA ALA A 89 1.719 17.421 2.305 1.00 6.99 C ATOM 1359 C ALA A 89 3.152 17.841 2.002 1.00 6.71 C ATOM 1360 O ALA A 89 3.411 18.984 1.617 1.00 7.11 O ATOM 1361 CB ALA A 89 1.391 17.656 3.772 1.00 7.41 C ATOM 0 H ALA A 89 1.368 15.407 2.758 1.00 6.75 H new ATOM 0 HA ALA A 89 1.043 18.028 1.703 1.00 6.99 H new ATOM 0 HB1 ALA A 89 1.541 18.708 4.014 1.00 7.41 H new ATOM 0 HB2 ALA A 89 0.352 17.384 3.961 1.00 7.41 H new ATOM 0 HB3 ALA A 89 2.045 17.044 4.394 1.00 7.41 H new ATOM 1367 N GLU A 90 4.072 16.896 2.153 1.00 6.35 N ATOM 1368 CA GLU A 90 5.481 17.146 1.898 1.00 6.46 C ATOM 1369 C GLU A 90 5.753 17.278 0.405 1.00 6.45 C ATOM 1370 O GLU A 90 6.464 18.179 -0.022 1.00 6.84 O ATOM 1371 CB GLU A 90 6.334 16.021 2.481 1.00 6.55 C ATOM 1372 CG GLU A 90 7.810 16.141 2.149 1.00 7.09 C ATOM 1373 CD GLU A 90 8.635 15.018 2.733 1.00 7.80 C ATOM 1374 OE1 GLU A 90 8.748 13.962 2.080 1.00 8.05 O ATOM 1375 OE2 GLU A 90 9.159 15.177 3.857 1.00 8.34 O ATOM 0 H GLU A 90 3.863 15.944 2.453 1.00 6.35 H new ATOM 0 HA GLU A 90 5.747 18.086 2.382 1.00 6.46 H new ATOM 0 HB2 GLU A 90 6.214 16.010 3.564 1.00 6.55 H new ATOM 0 HB3 GLU A 90 5.963 15.066 2.109 1.00 6.55 H new ATOM 0 HG2 GLU A 90 7.934 16.152 1.066 1.00 7.09 H new ATOM 0 HG3 GLU A 90 8.185 17.094 2.523 1.00 7.09 H new ATOM 1382 N ALA A 91 5.156 16.396 -0.387 1.00 6.32 N ATOM 1383 CA ALA A 91 5.413 16.359 -1.817 1.00 6.63 C ATOM 1384 C ALA A 91 4.813 17.583 -2.475 1.00 6.98 C ATOM 1385 O ALA A 91 5.364 18.142 -3.423 1.00 7.39 O ATOM 1386 CB ALA A 91 4.839 15.091 -2.426 1.00 6.88 C ATOM 0 H ALA A 91 4.490 15.696 -0.060 1.00 6.32 H new ATOM 0 HA ALA A 91 6.490 16.360 -1.985 1.00 6.63 H new ATOM 0 HB1 ALA A 91 5.040 15.079 -3.497 1.00 6.88 H new ATOM 0 HB2 ALA A 91 5.302 14.221 -1.960 1.00 6.88 H new ATOM 0 HB3 ALA A 91 3.762 15.062 -2.258 1.00 6.88 H new ATOM 1392 N MET A 92 3.687 18.003 -1.931 1.00 7.07 N ATOM 1393 CA MET A 92 2.994 19.186 -2.414 1.00 7.77 C ATOM 1394 C MET A 92 3.795 20.440 -2.077 1.00 8.07 C ATOM 1395 O MET A 92 3.972 21.326 -2.917 1.00 8.75 O ATOM 1396 CB MET A 92 1.595 19.264 -1.796 1.00 8.13 C ATOM 1397 CG MET A 92 0.761 20.441 -2.277 1.00 8.95 C ATOM 1398 SD MET A 92 0.431 20.380 -4.049 1.00 9.67 S ATOM 1399 CE MET A 92 -0.697 21.758 -4.225 1.00 10.32 C ATOM 0 H MET A 92 3.228 17.539 -1.147 1.00 7.07 H new ATOM 0 HA MET A 92 2.894 19.119 -3.497 1.00 7.77 H new ATOM 0 HB2 MET A 92 1.061 18.340 -2.019 1.00 8.13 H new ATOM 0 HB3 MET A 92 1.693 19.322 -0.712 1.00 8.13 H new ATOM 0 HG2 MET A 92 -0.185 20.457 -1.735 1.00 8.95 H new ATOM 0 HG3 MET A 92 1.280 21.370 -2.040 1.00 8.95 H new ATOM 0 HE1 MET A 92 -0.995 21.853 -5.269 1.00 10.32 H new ATOM 0 HE2 MET A 92 -1.580 21.586 -3.610 1.00 10.32 H new ATOM 0 HE3 MET A 92 -0.204 22.675 -3.904 1.00 10.32 H new ATOM 1409 N SER A 93 4.299 20.487 -0.851 1.00 7.80 N ATOM 1410 CA SER A 93 5.067 21.626 -0.369 1.00 8.38 C ATOM 1411 C SER A 93 6.449 21.672 -1.023 1.00 8.44 C ATOM 1412 O SER A 93 7.004 22.745 -1.249 1.00 9.14 O ATOM 1413 CB SER A 93 5.200 21.541 1.156 1.00 8.44 C ATOM 1414 OG SER A 93 5.917 22.641 1.686 1.00 8.68 O ATOM 0 H SER A 93 4.187 19.740 -0.166 1.00 7.80 H new ATOM 0 HA SER A 93 4.542 22.543 -0.637 1.00 8.38 H new ATOM 0 HB2 SER A 93 4.208 21.504 1.605 1.00 8.44 H new ATOM 0 HB3 SER A 93 5.706 20.614 1.425 1.00 8.44 H new ATOM 0 HG SER A 93 5.980 22.552 2.660 1.00 8.68 H new ATOM 1420 N GLN A 94 6.978 20.501 -1.361 1.00 7.90 N ATOM 1421 CA GLN A 94 8.345 20.384 -1.863 1.00 8.16 C ATOM 1422 C GLN A 94 8.501 21.090 -3.207 1.00 8.55 C ATOM 1423 O GLN A 94 9.592 21.526 -3.574 1.00 9.08 O ATOM 1424 CB GLN A 94 8.728 18.908 -2.003 1.00 7.85 C ATOM 1425 CG GLN A 94 10.226 18.669 -2.095 1.00 8.03 C ATOM 1426 CD GLN A 94 10.956 19.059 -0.822 1.00 8.38 C ATOM 1427 OE1 GLN A 94 10.403 18.975 0.275 1.00 8.64 O ATOM 1428 NE2 GLN A 94 12.200 19.486 -0.958 1.00 8.68 N ATOM 0 H GLN A 94 6.479 19.614 -1.296 1.00 7.90 H new ATOM 0 HA GLN A 94 9.011 20.865 -1.146 1.00 8.16 H new ATOM 0 HB2 GLN A 94 8.333 18.357 -1.149 1.00 7.85 H new ATOM 0 HB3 GLN A 94 8.249 18.501 -2.894 1.00 7.85 H new ATOM 0 HG2 GLN A 94 10.410 17.616 -2.308 1.00 8.03 H new ATOM 0 HG3 GLN A 94 10.631 19.239 -2.931 1.00 8.03 H new ATOM 0 HE21 GLN A 94 12.622 19.541 -1.885 1.00 8.68 H new ATOM 0 HE22 GLN A 94 12.738 19.760 -0.136 1.00 8.68 H new ATOM 1437 N VAL A 95 7.399 21.205 -3.930 1.00 8.52 N ATOM 1438 CA VAL A 95 7.406 21.828 -5.244 1.00 9.16 C ATOM 1439 C VAL A 95 7.358 23.351 -5.128 1.00 9.86 C ATOM 1440 O VAL A 95 7.872 24.071 -5.988 1.00 10.49 O ATOM 1441 CB VAL A 95 6.215 21.332 -6.095 1.00 9.36 C ATOM 1442 CG1 VAL A 95 6.218 21.975 -7.472 1.00 9.64 C ATOM 1443 CG2 VAL A 95 6.238 19.815 -6.214 1.00 9.49 C ATOM 0 H VAL A 95 6.483 20.873 -3.627 1.00 8.52 H new ATOM 0 HA VAL A 95 8.335 21.543 -5.738 1.00 9.16 H new ATOM 0 HB VAL A 95 5.296 21.627 -5.589 1.00 9.36 H new ATOM 0 HG11 VAL A 95 5.369 21.607 -8.047 1.00 9.64 H new ATOM 0 HG12 VAL A 95 6.144 23.058 -7.368 1.00 9.64 H new ATOM 0 HG13 VAL A 95 7.144 21.723 -7.989 1.00 9.64 H new ATOM 0 HG21 VAL A 95 5.392 19.484 -6.817 1.00 9.49 H new ATOM 0 HG22 VAL A 95 7.167 19.501 -6.690 1.00 9.49 H new ATOM 0 HG23 VAL A 95 6.171 19.371 -5.221 1.00 9.49 H new ATOM 1453 N THR A 96 6.755 23.843 -4.059 1.00 9.91 N ATOM 1454 CA THR A 96 6.605 25.276 -3.867 1.00 10.78 C ATOM 1455 C THR A 96 7.722 25.852 -2.999 1.00 11.00 C ATOM 1456 O THR A 96 7.935 27.065 -2.962 1.00 11.80 O ATOM 1457 CB THR A 96 5.234 25.604 -3.250 1.00 11.07 C ATOM 1458 OG1 THR A 96 4.947 24.690 -2.182 1.00 10.84 O ATOM 1459 CG2 THR A 96 4.140 25.526 -4.302 1.00 11.70 C ATOM 0 H THR A 96 6.361 23.272 -3.311 1.00 9.91 H new ATOM 0 HA THR A 96 6.671 25.741 -4.851 1.00 10.78 H new ATOM 0 HB THR A 96 5.267 26.620 -2.857 1.00 11.07 H new ATOM 0 HG1 THR A 96 4.074 24.905 -1.793 1.00 10.84 H new ATOM 0 HG21 THR A 96 3.179 25.761 -3.845 1.00 11.70 H new ATOM 0 HG22 THR A 96 4.349 26.241 -5.098 1.00 11.70 H new ATOM 0 HG23 THR A 96 4.107 24.519 -4.719 1.00 11.70 H new ATOM 1467 N ASN A 97 8.435 24.977 -2.300 1.00 10.45 N ATOM 1468 CA ASN A 97 9.577 25.395 -1.496 1.00 10.82 C ATOM 1469 C ASN A 97 10.768 25.691 -2.387 1.00 10.83 C ATOM 1470 O ASN A 97 10.896 25.108 -3.467 1.00 10.47 O ATOM 1471 CB ASN A 97 9.953 24.318 -0.469 1.00 10.70 C ATOM 1472 CG ASN A 97 8.959 24.219 0.671 1.00 11.05 C ATOM 1473 OD1 ASN A 97 8.299 25.196 1.024 1.00 11.34 O ATOM 1474 ND2 ASN A 97 8.860 23.045 1.271 1.00 11.26 N ATOM 0 H ASN A 97 8.243 23.976 -2.274 1.00 10.45 H new ATOM 0 HA ASN A 97 9.295 26.301 -0.959 1.00 10.82 H new ATOM 0 HB2 ASN A 97 10.021 23.353 -0.970 1.00 10.70 H new ATOM 0 HB3 ASN A 97 10.941 24.537 -0.065 1.00 10.70 H new ATOM 0 HD21 ASN A 97 8.219 22.926 2.056 1.00 11.26 H new ATOM 0 HD22 ASN A 97 9.424 22.259 0.949 1.00 11.26 H new ATOM 1481 N PRO A 98 11.654 26.607 -1.957 1.00 11.40 N ATOM 1482 CA PRO A 98 12.866 26.959 -2.701 1.00 11.59 C ATOM 1483 C PRO A 98 13.910 25.844 -2.662 1.00 11.38 C ATOM 1484 O PRO A 98 15.101 26.091 -2.476 1.00 11.57 O ATOM 1485 CB PRO A 98 13.401 28.207 -1.981 1.00 12.45 C ATOM 1486 CG PRO A 98 12.321 28.628 -1.040 1.00 12.70 C ATOM 1487 CD PRO A 98 11.547 27.387 -0.717 1.00 12.08 C ATOM 0 HA PRO A 98 12.651 27.125 -3.757 1.00 11.59 H new ATOM 0 HB2 PRO A 98 14.323 27.983 -1.444 1.00 12.45 H new ATOM 0 HB3 PRO A 98 13.631 29.000 -2.692 1.00 12.45 H new ATOM 0 HG2 PRO A 98 12.741 29.072 -0.137 1.00 12.70 H new ATOM 0 HG3 PRO A 98 11.678 29.381 -1.496 1.00 12.70 H new ATOM 0 HD2 PRO A 98 11.972 26.855 0.134 1.00 12.08 H new ATOM 0 HD3 PRO A 98 10.510 27.610 -0.467 1.00 12.08 H new ATOM 1495 N ALA A 99 13.451 24.615 -2.857 1.00 11.13 N ATOM 1496 CA ALA A 99 14.325 23.454 -2.855 1.00 11.14 C ATOM 1497 C ALA A 99 15.226 23.469 -4.078 1.00 10.78 C ATOM 1498 O ALA A 99 16.246 22.777 -4.127 1.00 10.91 O ATOM 1499 CB ALA A 99 13.502 22.176 -2.815 1.00 11.25 C ATOM 0 H ALA A 99 12.468 24.397 -3.020 1.00 11.13 H new ATOM 0 HA ALA A 99 14.952 23.490 -1.964 1.00 11.14 H new ATOM 0 HB1 ALA A 99 14.169 21.314 -2.814 1.00 11.25 H new ATOM 0 HB2 ALA A 99 12.892 22.164 -1.912 1.00 11.25 H new ATOM 0 HB3 ALA A 99 12.854 22.133 -3.691 1.00 11.25 H new ATOM 1505 N THR A 100 14.860 24.291 -5.052 1.00 10.51 N ATOM 1506 CA THR A 100 15.609 24.390 -6.288 1.00 10.39 C ATOM 1507 C THR A 100 16.937 25.088 -6.044 1.00 10.51 C ATOM 1508 O THR A 100 17.971 24.694 -6.580 1.00 10.58 O ATOM 1509 CB THR A 100 14.801 25.149 -7.354 1.00 10.40 C ATOM 1510 OG1 THR A 100 14.161 26.287 -6.757 1.00 10.60 O ATOM 1511 CG2 THR A 100 13.754 24.243 -7.985 1.00 10.63 C ATOM 0 H THR A 100 14.043 24.900 -5.005 1.00 10.51 H new ATOM 0 HA THR A 100 15.801 23.381 -6.654 1.00 10.39 H new ATOM 0 HB THR A 100 15.485 25.482 -8.134 1.00 10.40 H new ATOM 0 HG1 THR A 100 13.649 26.769 -7.439 1.00 10.60 H new ATOM 0 HG21 THR A 100 13.195 24.801 -8.736 1.00 10.63 H new ATOM 0 HG22 THR A 100 14.246 23.392 -8.457 1.00 10.63 H new ATOM 0 HG23 THR A 100 13.070 23.886 -7.215 1.00 10.63 H new ATOM 1519 N ILE A 101 16.904 26.118 -5.213 1.00 10.71 N ATOM 1520 CA ILE A 101 18.121 26.820 -4.833 1.00 11.06 C ATOM 1521 C ILE A 101 18.784 26.129 -3.645 1.00 11.17 C ATOM 1522 O ILE A 101 19.982 26.283 -3.409 1.00 11.41 O ATOM 1523 CB ILE A 101 17.871 28.308 -4.501 1.00 11.57 C ATOM 1524 CG1 ILE A 101 16.907 28.454 -3.321 1.00 11.88 C ATOM 1525 CG2 ILE A 101 17.331 29.032 -5.726 1.00 11.78 C ATOM 1526 CD1 ILE A 101 16.698 29.886 -2.877 1.00 12.53 C ATOM 0 H ILE A 101 16.052 26.486 -4.790 1.00 10.71 H new ATOM 0 HA ILE A 101 18.785 26.787 -5.696 1.00 11.06 H new ATOM 0 HB ILE A 101 18.820 28.760 -4.214 1.00 11.57 H new ATOM 0 HG12 ILE A 101 15.944 28.024 -3.595 1.00 11.88 H new ATOM 0 HG13 ILE A 101 17.287 27.874 -2.480 1.00 11.88 H new ATOM 0 HG21 ILE A 101 17.158 30.080 -5.482 1.00 11.78 H new ATOM 0 HG22 ILE A 101 18.055 28.963 -6.538 1.00 11.78 H new ATOM 0 HG23 ILE A 101 16.393 28.572 -6.036 1.00 11.78 H new ATOM 0 HD11 ILE A 101 16.003 29.909 -2.038 1.00 12.53 H new ATOM 0 HD12 ILE A 101 17.652 30.315 -2.570 1.00 12.53 H new ATOM 0 HD13 ILE A 101 16.288 30.467 -3.703 1.00 12.53 H new ATOM 1538 N MET A 102 17.992 25.357 -2.905 1.00 11.16 N ATOM 1539 CA MET A 102 18.495 24.633 -1.743 1.00 11.48 C ATOM 1540 C MET A 102 19.494 23.561 -2.166 1.00 11.29 C ATOM 1541 O MET A 102 20.524 23.375 -1.524 1.00 11.61 O ATOM 1542 CB MET A 102 17.346 23.984 -0.969 1.00 11.78 C ATOM 1543 CG MET A 102 17.788 23.321 0.327 1.00 12.25 C ATOM 1544 SD MET A 102 16.461 22.399 1.125 1.00 12.74 S ATOM 1545 CE MET A 102 16.181 21.100 -0.079 1.00 13.25 C ATOM 0 H MET A 102 16.999 25.217 -3.090 1.00 11.16 H new ATOM 0 HA MET A 102 18.997 25.352 -1.096 1.00 11.48 H new ATOM 0 HB2 MET A 102 16.596 24.742 -0.743 1.00 11.78 H new ATOM 0 HB3 MET A 102 16.865 23.239 -1.604 1.00 11.78 H new ATOM 0 HG2 MET A 102 18.620 22.647 0.120 1.00 12.25 H new ATOM 0 HG3 MET A 102 18.158 24.083 1.012 1.00 12.25 H new ATOM 0 HE1 MET A 102 15.715 20.245 0.410 1.00 13.25 H new ATOM 0 HE2 MET A 102 15.525 21.469 -0.867 1.00 13.25 H new ATOM 0 HE3 MET A 102 17.133 20.795 -0.513 1.00 13.25 H new ATOM 1555 N ILE A 103 19.190 22.854 -3.249 1.00 10.93 N ATOM 1556 CA ILE A 103 20.094 21.825 -3.746 1.00 10.95 C ATOM 1557 C ILE A 103 21.368 22.462 -4.308 1.00 10.91 C ATOM 1558 O ILE A 103 22.446 21.876 -4.252 1.00 11.12 O ATOM 1559 CB ILE A 103 19.420 20.924 -4.810 1.00 10.89 C ATOM 1560 CG1 ILE A 103 20.361 19.786 -5.217 1.00 11.10 C ATOM 1561 CG2 ILE A 103 18.999 21.735 -6.027 1.00 11.06 C ATOM 1562 CD1 ILE A 103 19.721 18.764 -6.131 1.00 11.41 C ATOM 0 H ILE A 103 18.336 22.972 -3.793 1.00 10.93 H new ATOM 0 HA ILE A 103 20.358 21.186 -2.903 1.00 10.95 H new ATOM 0 HB ILE A 103 18.521 20.492 -4.370 1.00 10.89 H new ATOM 0 HG12 ILE A 103 21.234 20.209 -5.714 1.00 11.10 H new ATOM 0 HG13 ILE A 103 20.718 19.283 -4.318 1.00 11.10 H new ATOM 0 HG21 ILE A 103 18.529 21.077 -6.758 1.00 11.06 H new ATOM 0 HG22 ILE A 103 18.290 22.506 -5.723 1.00 11.06 H new ATOM 0 HG23 ILE A 103 19.876 22.204 -6.473 1.00 11.06 H new ATOM 0 HD11 ILE A 103 20.448 17.989 -6.376 1.00 11.41 H new ATOM 0 HD12 ILE A 103 18.865 18.313 -5.629 1.00 11.41 H new ATOM 0 HD13 ILE A 103 19.389 19.253 -7.047 1.00 11.41 H new ATOM 1574 N GLN A 104 21.238 23.687 -4.810 1.00 10.83 N ATOM 1575 CA GLN A 104 22.387 24.447 -5.288 1.00 11.03 C ATOM 1576 C GLN A 104 23.278 24.840 -4.115 1.00 11.28 C ATOM 1577 O GLN A 104 24.482 25.040 -4.267 1.00 11.50 O ATOM 1578 CB GLN A 104 21.925 25.690 -6.049 1.00 11.19 C ATOM 1579 CG GLN A 104 21.073 25.369 -7.267 1.00 11.48 C ATOM 1580 CD GLN A 104 20.572 26.608 -7.979 1.00 11.71 C ATOM 1581 OE1 GLN A 104 21.226 27.654 -7.976 1.00 11.93 O ATOM 1582 NE2 GLN A 104 19.405 26.500 -8.594 1.00 11.88 N ATOM 0 H GLN A 104 20.346 24.175 -4.896 1.00 10.83 H new ATOM 0 HA GLN A 104 22.963 23.821 -5.970 1.00 11.03 H new ATOM 0 HB2 GLN A 104 21.356 26.329 -5.374 1.00 11.19 H new ATOM 0 HB3 GLN A 104 22.799 26.259 -6.366 1.00 11.19 H new ATOM 0 HG2 GLN A 104 21.656 24.767 -7.964 1.00 11.48 H new ATOM 0 HG3 GLN A 104 20.221 24.764 -6.959 1.00 11.48 H new ATOM 0 HE21 GLN A 104 18.897 25.616 -8.572 1.00 11.88 H new ATOM 0 HE22 GLN A 104 19.014 27.301 -9.090 1.00 11.88 H new ATOM 1591 N LYS A 105 22.669 24.931 -2.939 1.00 11.41 N ATOM 1592 CA LYS A 105 23.398 25.190 -1.705 1.00 11.86 C ATOM 1593 C LYS A 105 24.197 23.948 -1.314 1.00 11.85 C ATOM 1594 O LYS A 105 25.232 24.038 -0.656 1.00 12.20 O ATOM 1595 CB LYS A 105 22.417 25.578 -0.590 1.00 12.25 C ATOM 1596 CG LYS A 105 23.078 25.971 0.722 1.00 12.76 C ATOM 1597 CD LYS A 105 23.901 27.241 0.581 1.00 13.39 C ATOM 1598 CE LYS A 105 24.448 27.697 1.923 1.00 14.09 C ATOM 1599 NZ LYS A 105 25.312 26.664 2.551 1.00 14.37 N ATOM 0 H LYS A 105 21.662 24.828 -2.815 1.00 11.41 H new ATOM 0 HA LYS A 105 24.090 26.018 -1.857 1.00 11.86 H new ATOM 0 HB2 LYS A 105 21.803 26.409 -0.936 1.00 12.25 H new ATOM 0 HB3 LYS A 105 21.745 24.740 -0.407 1.00 12.25 H new ATOM 0 HG2 LYS A 105 22.313 26.116 1.485 1.00 12.76 H new ATOM 0 HG3 LYS A 105 23.719 25.158 1.064 1.00 12.76 H new ATOM 0 HD2 LYS A 105 24.726 27.067 -0.110 1.00 13.39 H new ATOM 0 HD3 LYS A 105 23.285 28.030 0.150 1.00 13.39 H new ATOM 0 HE2 LYS A 105 25.020 28.615 1.789 1.00 14.09 H new ATOM 0 HE3 LYS A 105 23.620 27.932 2.591 1.00 14.09 H new ATOM 0 HZ1 LYS A 105 25.785 27.067 3.385 1.00 14.37 H new ATOM 0 HZ2 LYS A 105 24.729 25.854 2.842 1.00 14.37 H new ATOM 0 HZ3 LYS A 105 26.028 26.347 1.866 1.00 14.37 H new ATOM 1613 N GLY A 106 23.706 22.787 -1.731 1.00 11.60 N ATOM 1614 CA GLY A 106 24.442 21.551 -1.539 1.00 11.77 C ATOM 1615 C GLY A 106 25.527 21.394 -2.583 1.00 11.76 C ATOM 1616 O GLY A 106 26.577 20.800 -2.325 1.00 12.03 O ATOM 0 H GLY A 106 22.807 22.679 -2.201 1.00 11.60 H new ATOM 0 HA2 GLY A 106 24.886 21.540 -0.544 1.00 11.77 H new ATOM 0 HA3 GLY A 106 23.757 20.705 -1.592 1.00 11.77 H new ATOM 1620 N ASN A 107 25.276 21.944 -3.766 1.00 11.60 N ATOM 1621 CA ASN A 107 26.259 21.954 -4.847 1.00 11.78 C ATOM 1622 C ASN A 107 27.426 22.867 -4.496 1.00 12.07 C ATOM 1623 O ASN A 107 28.487 22.797 -5.115 1.00 12.33 O ATOM 1624 CB ASN A 107 25.629 22.415 -6.166 1.00 11.85 C ATOM 1625 CG ASN A 107 24.582 21.455 -6.697 1.00 11.96 C ATOM 1626 OD1 ASN A 107 24.638 20.250 -6.453 1.00 11.97 O ATOM 1627 ND2 ASN A 107 23.625 21.985 -7.445 1.00 12.28 N ATOM 0 H ASN A 107 24.392 22.393 -4.003 1.00 11.60 H new ATOM 0 HA ASN A 107 26.621 20.934 -4.972 1.00 11.78 H new ATOM 0 HB2 ASN A 107 25.174 23.395 -6.021 1.00 11.85 H new ATOM 0 HB3 ASN A 107 26.414 22.536 -6.913 1.00 11.85 H new ATOM 0 HD21 ASN A 107 22.899 21.389 -7.842 1.00 12.28 H new ATOM 0 HD22 ASN A 107 23.614 22.989 -7.624 1.00 12.28 H new ATOM 1634 N PHE A 108 27.214 23.730 -3.505 1.00 12.19 N ATOM 1635 CA PHE A 108 28.249 24.648 -3.039 1.00 12.69 C ATOM 1636 C PHE A 108 29.473 23.877 -2.548 1.00 12.92 C ATOM 1637 O PHE A 108 30.593 24.383 -2.581 1.00 13.36 O ATOM 1638 CB PHE A 108 27.699 25.543 -1.920 1.00 13.02 C ATOM 1639 CG PHE A 108 28.650 26.619 -1.475 1.00 13.41 C ATOM 1640 CD1 PHE A 108 29.472 26.428 -0.376 1.00 13.60 C ATOM 1641 CD2 PHE A 108 28.719 27.823 -2.155 1.00 13.76 C ATOM 1642 CE1 PHE A 108 30.345 27.416 0.034 1.00 14.16 C ATOM 1643 CE2 PHE A 108 29.590 28.816 -1.749 1.00 14.30 C ATOM 1644 CZ PHE A 108 30.405 28.611 -0.653 1.00 14.51 C ATOM 0 H PHE A 108 26.328 23.812 -3.007 1.00 12.19 H new ATOM 0 HA PHE A 108 28.553 25.277 -3.875 1.00 12.69 H new ATOM 0 HB2 PHE A 108 26.774 26.008 -2.262 1.00 13.02 H new ATOM 0 HB3 PHE A 108 27.444 24.920 -1.063 1.00 13.02 H new ATOM 0 HD1 PHE A 108 29.429 25.495 0.166 1.00 13.60 H new ATOM 0 HD2 PHE A 108 28.084 27.988 -3.013 1.00 13.76 H new ATOM 0 HE1 PHE A 108 30.981 27.253 0.892 1.00 14.16 H new ATOM 0 HE2 PHE A 108 29.633 29.751 -2.288 1.00 14.30 H new ATOM 0 HZ PHE A 108 31.088 29.385 -0.334 1.00 14.51 H new ATOM 1654 N ARG A 109 29.252 22.643 -2.114 1.00 12.75 N ATOM 1655 CA ARG A 109 30.335 21.782 -1.656 1.00 13.13 C ATOM 1656 C ARG A 109 31.283 21.457 -2.811 1.00 13.11 C ATOM 1657 O ARG A 109 32.461 21.164 -2.604 1.00 13.55 O ATOM 1658 CB ARG A 109 29.765 20.490 -1.064 1.00 13.21 C ATOM 1659 CG ARG A 109 30.795 19.633 -0.348 1.00 13.63 C ATOM 1660 CD ARG A 109 31.357 20.352 0.865 1.00 13.95 C ATOM 1661 NE ARG A 109 32.351 19.546 1.571 1.00 14.26 N ATOM 1662 CZ ARG A 109 32.731 19.777 2.824 1.00 14.71 C ATOM 1663 NH1 ARG A 109 32.198 20.781 3.505 1.00 14.89 N ATOM 1664 NH2 ARG A 109 33.643 19.002 3.397 1.00 15.12 N ATOM 0 H ARG A 109 28.328 22.214 -2.069 1.00 12.75 H new ATOM 0 HA ARG A 109 30.895 22.309 -0.883 1.00 13.13 H new ATOM 0 HB2 ARG A 109 28.968 20.743 -0.365 1.00 13.21 H new ATOM 0 HB3 ARG A 109 29.313 19.904 -1.864 1.00 13.21 H new ATOM 0 HG2 ARG A 109 30.338 18.693 -0.038 1.00 13.63 H new ATOM 0 HG3 ARG A 109 31.605 19.383 -1.034 1.00 13.63 H new ATOM 0 HD2 ARG A 109 31.810 21.292 0.551 1.00 13.95 H new ATOM 0 HD3 ARG A 109 30.544 20.602 1.546 1.00 13.95 H new ATOM 0 HE ARG A 109 32.777 18.763 1.075 1.00 14.26 H new ATOM 0 HH11 ARG A 109 31.495 21.378 3.068 1.00 14.89 H new ATOM 0 HH12 ARG A 109 32.490 20.957 4.466 1.00 14.89 H new ATOM 0 HH21 ARG A 109 34.054 18.227 2.876 1.00 15.12 H new ATOM 0 HH22 ARG A 109 33.933 19.181 4.358 1.00 15.12 H new ATOM 1678 N ASN A 110 30.757 21.518 -4.027 1.00 12.73 N ATOM 1679 CA ASN A 110 31.549 21.265 -5.224 1.00 12.86 C ATOM 1680 C ASN A 110 32.043 22.582 -5.819 1.00 12.47 C ATOM 1681 O ASN A 110 32.999 22.608 -6.595 1.00 12.44 O ATOM 1682 CB ASN A 110 30.718 20.489 -6.255 1.00 13.08 C ATOM 1683 CG ASN A 110 31.483 20.183 -7.530 1.00 13.55 C ATOM 1684 OD1 ASN A 110 31.430 20.943 -8.499 1.00 13.74 O ATOM 1685 ND2 ASN A 110 32.200 19.071 -7.542 1.00 13.93 N ATOM 0 H ASN A 110 29.779 21.742 -4.211 1.00 12.73 H new ATOM 0 HA ASN A 110 32.415 20.662 -4.951 1.00 12.86 H new ATOM 0 HB2 ASN A 110 30.378 19.554 -5.809 1.00 13.08 H new ATOM 0 HB3 ASN A 110 29.827 21.066 -6.503 1.00 13.08 H new ATOM 0 HD21 ASN A 110 32.734 18.817 -8.373 1.00 13.93 H new ATOM 0 HD22 ASN A 110 32.219 18.467 -6.720 1.00 13.93 H new ATOM 1692 N GLN A 111 31.392 23.675 -5.427 1.00 12.38 N ATOM 1693 CA GLN A 111 31.745 25.004 -5.913 1.00 12.20 C ATOM 1694 C GLN A 111 33.092 25.448 -5.355 1.00 11.61 C ATOM 1695 O GLN A 111 33.164 26.071 -4.297 1.00 11.50 O ATOM 1696 CB GLN A 111 30.671 26.027 -5.530 1.00 12.57 C ATOM 1697 CG GLN A 111 29.329 25.805 -6.208 1.00 13.05 C ATOM 1698 CD GLN A 111 28.295 26.841 -5.806 1.00 13.63 C ATOM 1699 OE1 GLN A 111 28.629 27.984 -5.496 1.00 13.90 O ATOM 1700 NE2 GLN A 111 27.030 26.450 -5.806 1.00 14.01 N ATOM 0 H GLN A 111 30.612 23.664 -4.770 1.00 12.38 H new ATOM 0 HA GLN A 111 31.813 24.949 -7.000 1.00 12.20 H new ATOM 0 HB2 GLN A 111 30.528 26.000 -4.450 1.00 12.57 H new ATOM 0 HB3 GLN A 111 31.031 27.025 -5.779 1.00 12.57 H new ATOM 0 HG2 GLN A 111 29.463 25.831 -7.289 1.00 13.05 H new ATOM 0 HG3 GLN A 111 28.959 24.811 -5.957 1.00 13.05 H new ATOM 0 HE21 GLN A 111 26.792 25.494 -6.069 1.00 14.01 H new ATOM 0 HE22 GLN A 111 26.294 27.105 -5.543 1.00 14.01 H new ATOM 1709 N ARG A 112 34.156 25.112 -6.064 1.00 11.45 N ATOM 1710 CA ARG A 112 35.495 25.495 -5.646 1.00 11.12 C ATOM 1711 C ARG A 112 36.087 26.496 -6.628 1.00 10.61 C ATOM 1712 O ARG A 112 36.504 27.582 -6.243 1.00 10.60 O ATOM 1713 CB ARG A 112 36.394 24.260 -5.529 1.00 11.41 C ATOM 1714 CG ARG A 112 35.836 23.186 -4.605 1.00 11.96 C ATOM 1715 CD ARG A 112 35.586 23.728 -3.207 1.00 12.50 C ATOM 1716 NE ARG A 112 35.005 22.726 -2.317 1.00 13.09 N ATOM 1717 CZ ARG A 112 34.867 22.893 -1.002 1.00 13.79 C ATOM 1718 NH1 ARG A 112 35.254 24.027 -0.430 1.00 14.01 N ATOM 1719 NH2 ARG A 112 34.336 21.930 -0.261 1.00 14.43 N ATOM 0 H ARG A 112 34.120 24.576 -6.931 1.00 11.45 H new ATOM 0 HA ARG A 112 35.432 25.967 -4.665 1.00 11.12 H new ATOM 0 HB2 ARG A 112 36.542 23.833 -6.521 1.00 11.41 H new ATOM 0 HB3 ARG A 112 37.374 24.568 -5.165 1.00 11.41 H new ATOM 0 HG2 ARG A 112 34.905 22.798 -5.018 1.00 11.96 H new ATOM 0 HG3 ARG A 112 36.534 22.351 -4.553 1.00 11.96 H new ATOM 0 HD2 ARG A 112 36.526 24.084 -2.785 1.00 12.50 H new ATOM 0 HD3 ARG A 112 34.918 24.587 -3.267 1.00 12.50 H new ATOM 0 HE ARG A 112 34.686 21.847 -2.726 1.00 13.09 H new ATOM 0 HH11 ARG A 112 35.658 24.772 -0.997 1.00 14.01 H new ATOM 0 HH12 ARG A 112 35.147 24.153 0.577 1.00 14.01 H new ATOM 0 HH21 ARG A 112 34.032 21.059 -0.697 1.00 14.43 H new ATOM 0 HH22 ARG A 112 34.231 22.060 0.745 1.00 14.43 H new ATOM 1733 N LYS A 113 36.135 26.117 -7.895 1.00 10.40 N ATOM 1734 CA LYS A 113 36.573 27.025 -8.945 1.00 10.14 C ATOM 1735 C LYS A 113 35.416 27.901 -9.410 1.00 9.74 C ATOM 1736 O LYS A 113 35.606 29.047 -9.811 1.00 9.59 O ATOM 1737 CB LYS A 113 37.152 26.244 -10.124 1.00 10.36 C ATOM 1738 CG LYS A 113 38.412 25.472 -9.779 1.00 10.98 C ATOM 1739 CD LYS A 113 39.019 24.813 -11.005 1.00 11.43 C ATOM 1740 CE LYS A 113 40.365 24.188 -10.684 1.00 11.95 C ATOM 1741 NZ LYS A 113 41.347 25.201 -10.210 1.00 12.41 N ATOM 0 H LYS A 113 35.876 25.186 -8.222 1.00 10.40 H new ATOM 0 HA LYS A 113 37.354 27.667 -8.538 1.00 10.14 H new ATOM 0 HB2 LYS A 113 36.399 25.548 -10.493 1.00 10.36 H new ATOM 0 HB3 LYS A 113 37.371 26.937 -10.936 1.00 10.36 H new ATOM 0 HG2 LYS A 113 39.141 26.147 -9.330 1.00 10.98 H new ATOM 0 HG3 LYS A 113 38.180 24.711 -9.034 1.00 10.98 H new ATOM 0 HD2 LYS A 113 38.341 24.048 -11.383 1.00 11.43 H new ATOM 0 HD3 LYS A 113 39.138 25.552 -11.797 1.00 11.43 H new ATOM 0 HE2 LYS A 113 40.237 23.421 -9.920 1.00 11.95 H new ATOM 0 HE3 LYS A 113 40.756 23.691 -11.572 1.00 11.95 H new ATOM 0 HZ1 LYS A 113 42.312 24.836 -10.339 1.00 12.41 H new ATOM 0 HZ2 LYS A 113 41.233 26.078 -10.757 1.00 12.41 H new ATOM 0 HZ3 LYS A 113 41.183 25.398 -9.202 1.00 12.41 H new ATOM 1755 N THR A 114 34.214 27.351 -9.340 1.00 9.83 N ATOM 1756 CA THR A 114 33.027 28.036 -9.822 1.00 9.78 C ATOM 1757 C THR A 114 32.432 28.963 -8.756 1.00 9.62 C ATOM 1758 O THR A 114 31.582 29.800 -9.068 1.00 9.64 O ATOM 1759 CB THR A 114 31.964 27.024 -10.311 1.00 10.31 C ATOM 1760 OG1 THR A 114 30.859 27.705 -10.909 1.00 10.49 O ATOM 1761 CG2 THR A 114 31.461 26.156 -9.173 1.00 10.80 C ATOM 0 H THR A 114 34.035 26.425 -8.951 1.00 9.83 H new ATOM 0 HA THR A 114 33.333 28.654 -10.666 1.00 9.78 H new ATOM 0 HB THR A 114 32.442 26.384 -11.053 1.00 10.31 H new ATOM 0 HG1 THR A 114 30.942 28.668 -10.748 1.00 10.49 H new ATOM 0 HG21 THR A 114 30.716 25.456 -9.551 1.00 10.80 H new ATOM 0 HG22 THR A 114 32.295 25.601 -8.743 1.00 10.80 H new ATOM 0 HG23 THR A 114 31.011 26.786 -8.406 1.00 10.80 H new ATOM 1769 N VAL A 115 32.882 28.814 -7.507 1.00 9.74 N ATOM 1770 CA VAL A 115 32.333 29.588 -6.390 1.00 9.92 C ATOM 1771 C VAL A 115 32.464 31.095 -6.635 1.00 9.30 C ATOM 1772 O VAL A 115 31.530 31.858 -6.392 1.00 9.52 O ATOM 1773 CB VAL A 115 33.004 29.212 -5.043 1.00 10.85 C ATOM 1774 CG1 VAL A 115 34.488 29.548 -5.050 1.00 11.22 C ATOM 1775 CG2 VAL A 115 32.303 29.900 -3.883 1.00 11.44 C ATOM 0 H VAL A 115 33.624 28.165 -7.244 1.00 9.74 H new ATOM 0 HA VAL A 115 31.275 29.336 -6.326 1.00 9.92 H new ATOM 0 HB VAL A 115 32.908 28.134 -4.914 1.00 10.85 H new ATOM 0 HG11 VAL A 115 34.928 29.272 -4.092 1.00 11.22 H new ATOM 0 HG12 VAL A 115 34.982 28.995 -5.849 1.00 11.22 H new ATOM 0 HG13 VAL A 115 34.618 30.618 -5.214 1.00 11.22 H new ATOM 0 HG21 VAL A 115 32.789 29.623 -2.948 1.00 11.44 H new ATOM 0 HG22 VAL A 115 32.358 30.981 -4.014 1.00 11.44 H new ATOM 0 HG23 VAL A 115 31.258 29.591 -3.854 1.00 11.44 H new ATOM 1785 N LYS A 116 33.617 31.527 -7.120 1.00 8.75 N ATOM 1786 CA LYS A 116 33.794 32.915 -7.484 1.00 8.35 C ATOM 1787 C LYS A 116 33.592 33.051 -8.979 1.00 7.64 C ATOM 1788 O LYS A 116 34.391 32.555 -9.733 1.00 7.40 O ATOM 1789 CB LYS A 116 35.199 33.408 -7.113 1.00 8.50 C ATOM 1790 CG LYS A 116 35.582 33.199 -5.657 1.00 9.04 C ATOM 1791 CD LYS A 116 36.955 33.783 -5.350 1.00 9.56 C ATOM 1792 CE LYS A 116 38.071 33.062 -6.100 1.00 10.24 C ATOM 1793 NZ LYS A 116 38.174 31.629 -5.706 1.00 10.72 N ATOM 0 H LYS A 116 34.436 30.938 -7.268 1.00 8.75 H new ATOM 0 HA LYS A 116 33.068 33.519 -6.941 1.00 8.35 H new ATOM 0 HB2 LYS A 116 35.927 32.896 -7.743 1.00 8.50 H new ATOM 0 HB3 LYS A 116 35.269 34.471 -7.344 1.00 8.50 H new ATOM 0 HG2 LYS A 116 34.836 33.664 -5.013 1.00 9.04 H new ATOM 0 HG3 LYS A 116 35.580 32.133 -5.429 1.00 9.04 H new ATOM 0 HD2 LYS A 116 36.966 34.840 -5.616 1.00 9.56 H new ATOM 0 HD3 LYS A 116 37.142 33.722 -4.278 1.00 9.56 H new ATOM 0 HE2 LYS A 116 37.890 33.131 -7.173 1.00 10.24 H new ATOM 0 HE3 LYS A 116 39.020 33.561 -5.904 1.00 10.24 H new ATOM 0 HZ1 LYS A 116 39.067 31.234 -6.063 1.00 10.72 H new ATOM 0 HZ2 LYS A 116 38.151 31.552 -4.669 1.00 10.72 H new ATOM 0 HZ3 LYS A 116 37.375 31.100 -6.110 1.00 10.72 H new ATOM 1807 N CYS A 117 32.493 33.664 -9.392 1.00 7.61 N ATOM 1808 CA CYS A 117 32.217 33.917 -10.803 1.00 7.28 C ATOM 1809 C CYS A 117 31.660 35.302 -11.022 1.00 6.81 C ATOM 1810 O CYS A 117 30.947 35.819 -10.170 1.00 6.94 O ATOM 1811 CB CYS A 117 31.199 32.937 -11.282 1.00 7.77 C ATOM 1812 SG CYS A 117 30.903 32.980 -13.056 1.00 8.16 S ATOM 0 H CYS A 117 31.766 34.001 -8.761 1.00 7.61 H new ATOM 0 HA CYS A 117 33.156 33.821 -11.348 1.00 7.28 H new ATOM 0 HB2 CYS A 117 31.520 31.933 -11.004 1.00 7.77 H new ATOM 0 HB3 CYS A 117 30.259 33.126 -10.764 1.00 7.77 H new ATOM 1817 N PHE A 118 31.899 35.869 -12.188 1.00 6.60 N ATOM 1818 CA PHE A 118 31.190 37.072 -12.556 1.00 6.49 C ATOM 1819 C PHE A 118 29.875 36.655 -13.211 1.00 6.66 C ATOM 1820 O PHE A 118 29.601 36.978 -14.369 1.00 6.96 O ATOM 1821 CB PHE A 118 32.041 37.922 -13.501 1.00 6.75 C ATOM 1822 CG PHE A 118 31.722 39.386 -13.432 1.00 6.84 C ATOM 1823 CD1 PHE A 118 32.313 40.199 -12.482 1.00 7.09 C ATOM 1824 CD2 PHE A 118 30.834 39.952 -14.333 1.00 7.05 C ATOM 1825 CE1 PHE A 118 32.027 41.550 -12.430 1.00 7.55 C ATOM 1826 CE2 PHE A 118 30.542 41.301 -14.286 1.00 7.50 C ATOM 1827 CZ PHE A 118 31.123 42.093 -13.277 1.00 7.76 C ATOM 0 H PHE A 118 32.563 35.524 -12.881 1.00 6.60 H new ATOM 0 HA PHE A 118 30.983 37.683 -11.677 1.00 6.49 H new ATOM 0 HB2 PHE A 118 33.094 37.775 -13.262 1.00 6.75 H new ATOM 0 HB3 PHE A 118 31.895 37.573 -14.523 1.00 6.75 H new ATOM 0 HD1 PHE A 118 33.006 39.773 -11.772 1.00 7.09 H new ATOM 0 HD2 PHE A 118 30.365 39.330 -15.081 1.00 7.05 H new ATOM 0 HE1 PHE A 118 32.529 42.177 -11.708 1.00 7.55 H new ATOM 0 HE2 PHE A 118 29.877 41.743 -15.013 1.00 7.50 H new ATOM 0 HZ PHE A 118 30.847 43.133 -13.180 1.00 7.76 H new ATOM 1837 N ASN A 119 29.062 35.948 -12.416 1.00 6.83 N ATOM 1838 CA ASN A 119 27.785 35.370 -12.857 1.00 7.37 C ATOM 1839 C ASN A 119 27.283 34.330 -11.856 1.00 7.84 C ATOM 1840 O ASN A 119 26.260 34.531 -11.205 1.00 8.35 O ATOM 1841 CB ASN A 119 27.902 34.702 -14.235 1.00 7.76 C ATOM 1842 CG ASN A 119 26.593 34.088 -14.701 1.00 8.38 C ATOM 1843 OD1 ASN A 119 25.511 34.548 -14.342 1.00 8.64 O ATOM 1844 ND2 ASN A 119 26.681 33.039 -15.506 1.00 8.90 N ATOM 0 H ASN A 119 29.275 35.759 -11.437 1.00 6.83 H new ATOM 0 HA ASN A 119 27.078 36.197 -12.923 1.00 7.37 H new ATOM 0 HB2 ASN A 119 28.233 35.440 -14.965 1.00 7.76 H new ATOM 0 HB3 ASN A 119 28.668 33.928 -14.195 1.00 7.76 H new ATOM 0 HD21 ASN A 119 25.833 32.586 -15.848 1.00 8.90 H new ATOM 0 HD22 ASN A 119 27.596 32.684 -15.783 1.00 8.90 H new ATOM 1851 N CYS A 120 28.027 33.232 -11.696 1.00 7.96 N ATOM 1852 CA CYS A 120 27.530 32.098 -10.919 1.00 8.71 C ATOM 1853 C CYS A 120 28.170 32.084 -9.536 1.00 8.75 C ATOM 1854 O CYS A 120 28.313 31.039 -8.909 1.00 9.54 O ATOM 1855 CB CYS A 120 27.723 30.747 -11.666 1.00 9.25 C ATOM 1856 SG CYS A 120 29.401 30.031 -11.692 1.00 9.45 S ATOM 0 H CYS A 120 28.960 33.106 -12.088 1.00 7.96 H new ATOM 0 HA CYS A 120 26.455 32.222 -10.792 1.00 8.71 H new ATOM 0 HB2 CYS A 120 27.052 30.015 -11.216 1.00 9.25 H new ATOM 0 HB3 CYS A 120 27.400 30.884 -12.698 1.00 9.25 H new ATOM 1861 N GLY A 121 28.535 33.271 -9.059 1.00 8.15 N ATOM 1862 CA GLY A 121 29.123 33.388 -7.746 1.00 8.48 C ATOM 1863 C GLY A 121 29.700 34.764 -7.474 1.00 8.66 C ATOM 1864 O GLY A 121 28.981 35.764 -7.475 1.00 9.05 O ATOM 0 H GLY A 121 28.432 34.152 -9.563 1.00 8.15 H new ATOM 0 HA2 GLY A 121 28.367 33.162 -6.994 1.00 8.48 H new ATOM 0 HA3 GLY A 121 29.911 32.642 -7.639 1.00 8.48 H new ATOM 1868 N LYS A 122 31.008 34.804 -7.270 1.00 8.64 N ATOM 1869 CA LYS A 122 31.690 36.015 -6.817 1.00 9.14 C ATOM 1870 C LYS A 122 32.426 36.756 -7.939 1.00 9.38 C ATOM 1871 O LYS A 122 32.041 37.865 -8.310 1.00 9.60 O ATOM 1872 CB LYS A 122 32.665 35.653 -5.703 1.00 10.04 C ATOM 1873 CG LYS A 122 32.601 36.577 -4.506 1.00 10.62 C ATOM 1874 CD LYS A 122 32.958 38.008 -4.876 1.00 11.49 C ATOM 1875 CE LYS A 122 32.865 38.935 -3.677 1.00 12.13 C ATOM 1876 NZ LYS A 122 33.103 40.352 -4.053 1.00 12.70 N ATOM 0 H LYS A 122 31.627 34.005 -7.412 1.00 8.64 H new ATOM 0 HA LYS A 122 30.923 36.699 -6.452 1.00 9.14 H new ATOM 0 HB2 LYS A 122 32.463 34.634 -5.374 1.00 10.04 H new ATOM 0 HB3 LYS A 122 33.679 35.663 -6.103 1.00 10.04 H new ATOM 0 HG2 LYS A 122 31.598 36.551 -4.081 1.00 10.62 H new ATOM 0 HG3 LYS A 122 33.284 36.220 -3.735 1.00 10.62 H new ATOM 0 HD2 LYS A 122 33.969 38.038 -5.282 1.00 11.49 H new ATOM 0 HD3 LYS A 122 32.288 38.359 -5.661 1.00 11.49 H new ATOM 0 HE2 LYS A 122 31.879 38.841 -3.221 1.00 12.13 H new ATOM 0 HE3 LYS A 122 33.594 38.631 -2.926 1.00 12.13 H new ATOM 0 HZ1 LYS A 122 33.031 40.952 -3.207 1.00 12.70 H new ATOM 0 HZ2 LYS A 122 34.053 40.447 -4.465 1.00 12.70 H new ATOM 0 HZ3 LYS A 122 32.392 40.650 -4.751 1.00 12.70 H new ATOM 1890 N GLU A 123 33.483 36.150 -8.465 1.00 9.61 N ATOM 1891 CA GLU A 123 34.317 36.815 -9.474 1.00 10.15 C ATOM 1892 C GLU A 123 35.091 35.853 -10.394 1.00 10.16 C ATOM 1893 O GLU A 123 34.869 35.834 -11.603 1.00 9.77 O ATOM 1894 CB GLU A 123 35.305 37.748 -8.783 1.00 10.72 C ATOM 1895 CG GLU A 123 36.252 38.446 -9.740 1.00 11.36 C ATOM 1896 CD GLU A 123 37.232 39.349 -9.030 1.00 12.15 C ATOM 1897 OE1 GLU A 123 37.109 40.584 -9.160 1.00 12.53 O ATOM 1898 OE2 GLU A 123 38.133 38.829 -8.337 1.00 12.54 O ATOM 0 H GLU A 123 33.786 35.208 -8.217 1.00 9.61 H new ATOM 0 HA GLU A 123 33.629 37.365 -10.115 1.00 10.15 H new ATOM 0 HB2 GLU A 123 34.750 38.500 -8.221 1.00 10.72 H new ATOM 0 HB3 GLU A 123 35.888 37.176 -8.061 1.00 10.72 H new ATOM 0 HG2 GLU A 123 36.801 37.698 -10.312 1.00 11.36 H new ATOM 0 HG3 GLU A 123 35.674 39.033 -10.454 1.00 11.36 H new ATOM 1905 N GLY A 124 35.979 35.050 -9.813 1.00 10.81 N ATOM 1906 CA GLY A 124 37.021 34.372 -10.590 1.00 11.18 C ATOM 1907 C GLY A 124 36.580 33.113 -11.329 1.00 11.06 C ATOM 1908 O GLY A 124 37.230 32.071 -11.234 1.00 11.83 O ATOM 0 H GLY A 124 36.001 34.852 -8.813 1.00 10.81 H new ATOM 0 HA2 GLY A 124 37.422 35.077 -11.318 1.00 11.18 H new ATOM 0 HA3 GLY A 124 37.837 34.109 -9.917 1.00 11.18 H new ATOM 1912 N HIS A 125 35.485 33.209 -12.062 1.00 10.27 N ATOM 1913 CA HIS A 125 35.022 32.114 -12.916 1.00 10.32 C ATOM 1914 C HIS A 125 34.746 32.677 -14.295 1.00 9.72 C ATOM 1915 O HIS A 125 34.976 33.861 -14.545 1.00 9.32 O ATOM 1916 CB HIS A 125 33.745 31.449 -12.352 1.00 10.21 C ATOM 1917 CG HIS A 125 33.413 30.097 -12.938 1.00 10.68 C ATOM 1918 ND1 HIS A 125 32.322 29.881 -13.775 1.00 10.37 N ATOM 1919 CD2 HIS A 125 34.075 28.925 -12.785 1.00 11.65 C ATOM 1920 CE1 HIS A 125 32.363 28.602 -14.098 1.00 11.18 C ATOM 1921 NE2 HIS A 125 33.404 27.986 -13.525 1.00 11.94 N ATOM 0 H HIS A 125 34.891 34.038 -12.087 1.00 10.27 H new ATOM 0 HA HIS A 125 35.793 31.345 -12.958 1.00 10.32 H new ATOM 0 HB2 HIS A 125 33.856 31.342 -11.273 1.00 10.21 H new ATOM 0 HB3 HIS A 125 32.901 32.118 -12.521 1.00 10.21 H new ATOM 0 HD2 HIS A 125 34.963 28.761 -12.192 1.00 11.65 H new ATOM 0 HE1 HIS A 125 31.647 28.114 -14.743 1.00 11.18 H new ATOM 0 HE2 HIS A 125 33.652 27.001 -13.621 1.00 11.94 H new ATOM 1929 N ILE A 126 34.234 31.849 -15.171 1.00 9.89 N ATOM 1930 CA ILE A 126 33.979 32.261 -16.527 1.00 9.58 C ATOM 1931 C ILE A 126 32.499 32.114 -16.840 1.00 9.30 C ATOM 1932 O ILE A 126 32.009 31.022 -17.140 1.00 9.89 O ATOM 1933 CB ILE A 126 34.839 31.497 -17.572 1.00 10.51 C ATOM 1934 CG1 ILE A 126 34.679 29.970 -17.457 1.00 11.44 C ATOM 1935 CG2 ILE A 126 36.304 31.891 -17.444 1.00 10.87 C ATOM 1936 CD1 ILE A 126 35.445 29.326 -16.316 1.00 12.22 C ATOM 0 H ILE A 126 33.985 30.881 -14.967 1.00 9.89 H new ATOM 0 HA ILE A 126 34.270 33.309 -16.603 1.00 9.58 H new ATOM 0 HB ILE A 126 34.477 31.784 -18.559 1.00 10.51 H new ATOM 0 HG12 ILE A 126 33.620 29.739 -17.339 1.00 11.44 H new ATOM 0 HG13 ILE A 126 35.002 29.515 -18.393 1.00 11.44 H new ATOM 0 HG21 ILE A 126 36.893 31.347 -18.183 1.00 10.87 H new ATOM 0 HG22 ILE A 126 36.409 32.963 -17.614 1.00 10.87 H new ATOM 0 HG23 ILE A 126 36.661 31.646 -16.444 1.00 10.87 H new ATOM 0 HD11 ILE A 126 35.268 28.251 -16.320 1.00 12.22 H new ATOM 0 HD12 ILE A 126 36.511 29.518 -16.439 1.00 12.22 H new ATOM 0 HD13 ILE A 126 35.108 29.746 -15.368 1.00 12.22 H new ATOM 1948 N ALA A 127 31.787 33.224 -16.712 1.00 8.62 N ATOM 1949 CA ALA A 127 30.363 33.296 -17.041 1.00 8.50 C ATOM 1950 C ALA A 127 30.045 32.717 -18.423 1.00 9.47 C ATOM 1951 O ALA A 127 28.906 32.337 -18.695 1.00 9.79 O ATOM 1952 CB ALA A 127 29.897 34.740 -16.972 1.00 7.91 C ATOM 0 H ALA A 127 32.177 34.105 -16.377 1.00 8.62 H new ATOM 0 HA ALA A 127 29.831 32.689 -16.308 1.00 8.50 H new ATOM 0 HB1 ALA A 127 28.836 34.792 -17.217 1.00 7.91 H new ATOM 0 HB2 ALA A 127 30.056 35.126 -15.965 1.00 7.91 H new ATOM 0 HB3 ALA A 127 30.464 35.340 -17.684 1.00 7.91 H new ATOM 1958 N LYS A 128 31.054 32.637 -19.284 1.00 10.12 N ATOM 1959 CA LYS A 128 30.853 32.175 -20.655 1.00 11.20 C ATOM 1960 C LYS A 128 30.705 30.656 -20.726 1.00 11.91 C ATOM 1961 O LYS A 128 30.211 30.124 -21.719 1.00 12.77 O ATOM 1962 CB LYS A 128 32.015 32.617 -21.553 1.00 11.83 C ATOM 1963 CG LYS A 128 33.344 31.967 -21.203 1.00 11.76 C ATOM 1964 CD LYS A 128 34.434 32.336 -22.198 1.00 12.45 C ATOM 1965 CE LYS A 128 34.720 33.828 -22.187 1.00 12.66 C ATOM 1966 NZ LYS A 128 35.834 34.193 -23.099 1.00 13.15 N ATOM 0 H LYS A 128 32.017 32.885 -19.059 1.00 10.12 H new ATOM 0 HA LYS A 128 29.927 32.627 -21.011 1.00 11.20 H new ATOM 0 HB2 LYS A 128 31.770 32.385 -22.589 1.00 11.83 H new ATOM 0 HB3 LYS A 128 32.122 33.700 -21.486 1.00 11.83 H new ATOM 0 HG2 LYS A 128 33.646 32.275 -20.202 1.00 11.76 H new ATOM 0 HG3 LYS A 128 33.224 30.884 -21.181 1.00 11.76 H new ATOM 0 HD2 LYS A 128 35.346 31.788 -21.959 1.00 12.45 H new ATOM 0 HD3 LYS A 128 34.132 32.030 -23.200 1.00 12.45 H new ATOM 0 HE2 LYS A 128 33.821 34.371 -22.479 1.00 12.66 H new ATOM 0 HE3 LYS A 128 34.966 34.142 -21.172 1.00 12.66 H new ATOM 0 HZ1 LYS A 128 35.993 35.220 -23.059 1.00 13.15 H new ATOM 0 HZ2 LYS A 128 36.700 33.696 -22.806 1.00 13.15 H new ATOM 0 HZ3 LYS A 128 35.590 33.919 -24.072 1.00 13.15 H new ATOM 1980 N ASN A 129 31.129 29.955 -19.679 1.00 11.70 N ATOM 1981 CA ASN A 129 31.114 28.495 -19.701 1.00 12.56 C ATOM 1982 C ASN A 129 30.148 27.911 -18.678 1.00 12.29 C ATOM 1983 O ASN A 129 29.952 26.698 -18.629 1.00 13.04 O ATOM 1984 CB ASN A 129 32.518 27.922 -19.475 1.00 13.04 C ATOM 1985 CG ASN A 129 33.425 28.115 -20.675 1.00 13.96 C ATOM 1986 OD1 ASN A 129 32.965 28.155 -21.815 1.00 14.48 O ATOM 1987 ND2 ASN A 129 34.722 28.220 -20.430 1.00 14.33 N ATOM 0 H ASN A 129 31.483 30.366 -18.815 1.00 11.70 H new ATOM 0 HA ASN A 129 30.767 28.206 -20.693 1.00 12.56 H new ATOM 0 HB2 ASN A 129 32.966 28.401 -18.604 1.00 13.04 H new ATOM 0 HB3 ASN A 129 32.441 26.858 -19.250 1.00 13.04 H new ATOM 0 HD21 ASN A 129 35.379 28.339 -21.201 1.00 14.33 H new ATOM 0 HD22 ASN A 129 35.064 28.182 -19.470 1.00 14.33 H new ATOM 1994 N CYS A 130 29.543 28.751 -17.855 1.00 11.34 N ATOM 1995 CA CYS A 130 28.552 28.265 -16.910 1.00 11.22 C ATOM 1996 C CYS A 130 27.150 28.626 -17.362 1.00 11.41 C ATOM 1997 O CYS A 130 26.929 29.687 -17.949 1.00 10.94 O ATOM 1998 CB CYS A 130 28.816 28.793 -15.502 1.00 10.26 C ATOM 1999 SG CYS A 130 29.264 30.541 -15.407 1.00 10.18 S ATOM 0 H CYS A 130 29.716 29.756 -17.821 1.00 11.34 H new ATOM 0 HA CYS A 130 28.634 27.179 -16.879 1.00 11.22 H new ATOM 0 HB2 CYS A 130 27.924 28.630 -14.897 1.00 10.26 H new ATOM 0 HB3 CYS A 130 29.617 28.204 -15.055 1.00 10.26 H new ATOM 2004 N ARG A 131 26.210 27.735 -17.091 1.00 12.28 N ATOM 2005 CA ARG A 131 24.832 27.938 -17.493 1.00 12.72 C ATOM 2006 C ARG A 131 24.026 28.435 -16.306 1.00 12.49 C ATOM 2007 O ARG A 131 23.614 27.653 -15.449 1.00 12.99 O ATOM 2008 CB ARG A 131 24.217 26.642 -18.035 1.00 13.93 C ATOM 2009 CG ARG A 131 24.843 26.133 -19.328 1.00 14.54 C ATOM 2010 CD ARG A 131 26.235 25.553 -19.109 1.00 15.39 C ATOM 2011 NE ARG A 131 26.221 24.446 -18.155 1.00 15.94 N ATOM 2012 CZ ARG A 131 27.302 23.972 -17.533 1.00 16.74 C ATOM 2013 NH1 ARG A 131 28.501 24.482 -17.778 1.00 17.08 N ATOM 2014 NH2 ARG A 131 27.181 22.982 -16.665 1.00 17.31 N ATOM 0 H ARG A 131 26.380 26.862 -16.592 1.00 12.28 H new ATOM 0 HA ARG A 131 24.811 28.681 -18.290 1.00 12.72 H new ATOM 0 HB2 ARG A 131 24.307 25.867 -17.274 1.00 13.93 H new ATOM 0 HB3 ARG A 131 23.152 26.803 -18.202 1.00 13.93 H new ATOM 0 HG2 ARG A 131 24.199 25.370 -19.765 1.00 14.54 H new ATOM 0 HG3 ARG A 131 24.902 26.950 -20.047 1.00 14.54 H new ATOM 0 HD2 ARG A 131 26.638 25.207 -20.061 1.00 15.39 H new ATOM 0 HD3 ARG A 131 26.901 26.336 -18.747 1.00 15.39 H new ATOM 0 HE ARG A 131 25.324 24.006 -17.951 1.00 15.94 H new ATOM 0 HH11 ARG A 131 28.604 25.244 -18.448 1.00 17.08 H new ATOM 0 HH12 ARG A 131 29.321 24.112 -17.297 1.00 17.08 H new ATOM 0 HH21 ARG A 131 26.263 22.582 -16.472 1.00 17.31 H new ATOM 0 HH22 ARG A 131 28.006 22.618 -16.188 1.00 17.31 H new ATOM 2028 N ALA A 132 23.807 29.737 -16.260 1.00 11.89 N ATOM 2029 CA ALA A 132 23.096 30.355 -15.156 1.00 11.80 C ATOM 2030 C ALA A 132 22.632 31.753 -15.537 1.00 11.49 C ATOM 2031 O ALA A 132 23.449 32.640 -15.789 1.00 10.98 O ATOM 2032 CB ALA A 132 23.977 30.414 -13.914 1.00 11.27 C ATOM 0 H ALA A 132 24.114 30.391 -16.980 1.00 11.89 H new ATOM 0 HA ALA A 132 22.221 29.745 -14.931 1.00 11.80 H new ATOM 0 HB1 ALA A 132 23.425 30.881 -13.098 1.00 11.27 H new ATOM 0 HB2 ALA A 132 24.266 29.404 -13.625 1.00 11.27 H new ATOM 0 HB3 ALA A 132 24.871 31.000 -14.129 1.00 11.27 H new ATOM 2038 N PRO A 133 21.312 31.974 -15.575 1.00 11.98 N ATOM 2039 CA PRO A 133 20.736 33.277 -15.904 1.00 11.96 C ATOM 2040 C PRO A 133 20.777 34.237 -14.716 1.00 11.21 C ATOM 2041 O PRO A 133 19.833 34.985 -14.471 1.00 11.39 O ATOM 2042 CB PRO A 133 19.295 32.928 -16.268 1.00 12.84 C ATOM 2043 CG PRO A 133 18.982 31.735 -15.433 1.00 13.32 C ATOM 2044 CD PRO A 133 20.270 30.965 -15.296 1.00 12.82 C ATOM 0 HA PRO A 133 21.280 33.788 -16.698 1.00 11.96 H new ATOM 0 HB2 PRO A 133 18.619 33.754 -16.050 1.00 12.84 H new ATOM 0 HB3 PRO A 133 19.196 32.707 -17.331 1.00 12.84 H new ATOM 0 HG2 PRO A 133 18.601 32.033 -14.456 1.00 13.32 H new ATOM 0 HG3 PRO A 133 18.211 31.123 -15.902 1.00 13.32 H new ATOM 0 HD2 PRO A 133 20.379 30.542 -14.297 1.00 12.82 H new ATOM 0 HD3 PRO A 133 20.317 30.135 -16.001 1.00 12.82 H new ATOM 2052 N ARG A 134 21.881 34.210 -13.983 1.00 10.58 N ATOM 2053 CA ARG A 134 22.011 35.013 -12.782 1.00 10.01 C ATOM 2054 C ARG A 134 22.608 36.375 -13.112 1.00 9.69 C ATOM 2055 O ARG A 134 22.390 37.354 -12.396 1.00 10.21 O ATOM 2056 CB ARG A 134 22.873 34.286 -11.751 1.00 10.03 C ATOM 2057 CG ARG A 134 22.773 34.883 -10.360 1.00 10.19 C ATOM 2058 CD ARG A 134 23.677 34.169 -9.375 1.00 10.81 C ATOM 2059 NE ARG A 134 23.483 34.663 -8.015 1.00 11.15 N ATOM 2060 CZ ARG A 134 24.470 34.955 -7.172 1.00 11.83 C ATOM 2061 NH1 ARG A 134 25.735 34.821 -7.546 1.00 12.25 N ATOM 2062 NH2 ARG A 134 24.189 35.390 -5.955 1.00 12.30 N ATOM 0 H ARG A 134 22.698 33.640 -14.201 1.00 10.58 H new ATOM 0 HA ARG A 134 21.019 35.168 -12.358 1.00 10.01 H new ATOM 0 HB2 ARG A 134 22.575 33.238 -11.712 1.00 10.03 H new ATOM 0 HB3 ARG A 134 23.913 34.310 -12.075 1.00 10.03 H new ATOM 0 HG2 ARG A 134 23.039 35.939 -10.398 1.00 10.19 H new ATOM 0 HG3 ARG A 134 21.741 34.826 -10.013 1.00 10.19 H new ATOM 0 HD2 ARG A 134 23.477 33.098 -9.406 1.00 10.81 H new ATOM 0 HD3 ARG A 134 24.718 34.307 -9.668 1.00 10.81 H new ATOM 0 HE ARG A 134 22.525 34.793 -7.689 1.00 11.15 H new ATOM 0 HH11 ARG A 134 25.957 34.492 -8.486 1.00 12.25 H new ATOM 0 HH12 ARG A 134 26.486 35.047 -6.894 1.00 12.25 H new ATOM 0 HH21 ARG A 134 23.217 35.501 -5.665 1.00 12.30 H new ATOM 0 HH22 ARG A 134 24.944 35.615 -5.307 1.00 12.30 H new ATOM 2076 N LYS A 135 23.366 36.434 -14.199 1.00 9.06 N ATOM 2077 CA LYS A 135 23.936 37.689 -14.658 1.00 9.00 C ATOM 2078 C LYS A 135 22.846 38.575 -15.240 1.00 9.08 C ATOM 2079 O LYS A 135 22.478 38.460 -16.408 1.00 9.30 O ATOM 2080 CB LYS A 135 25.032 37.445 -15.693 1.00 8.75 C ATOM 2081 CG LYS A 135 25.685 38.716 -16.228 1.00 8.95 C ATOM 2082 CD LYS A 135 26.163 39.632 -15.110 1.00 9.28 C ATOM 2083 CE LYS A 135 27.152 40.673 -15.616 1.00 9.72 C ATOM 2084 NZ LYS A 135 26.625 41.455 -16.769 1.00 10.11 N ATOM 0 H LYS A 135 23.599 35.627 -14.777 1.00 9.06 H new ATOM 0 HA LYS A 135 24.385 38.195 -13.803 1.00 9.00 H new ATOM 0 HB2 LYS A 135 25.802 36.815 -15.248 1.00 8.75 H new ATOM 0 HB3 LYS A 135 24.608 36.889 -16.529 1.00 8.75 H new ATOM 0 HG2 LYS A 135 26.530 38.449 -16.863 1.00 8.95 H new ATOM 0 HG3 LYS A 135 24.973 39.252 -16.855 1.00 8.95 H new ATOM 0 HD2 LYS A 135 25.306 40.133 -14.660 1.00 9.28 H new ATOM 0 HD3 LYS A 135 26.632 39.036 -14.327 1.00 9.28 H new ATOM 0 HE2 LYS A 135 27.402 41.355 -14.804 1.00 9.72 H new ATOM 0 HE3 LYS A 135 28.076 40.177 -15.911 1.00 9.72 H new ATOM 0 HZ1 LYS A 135 27.260 42.255 -16.965 1.00 10.11 H new ATOM 0 HZ2 LYS A 135 26.571 40.843 -17.608 1.00 10.11 H new ATOM 0 HZ3 LYS A 135 25.676 41.814 -16.540 1.00 10.11 H new ATOM 2098 N LYS A 136 22.325 39.435 -14.392 1.00 9.17 N ATOM 2099 CA LYS A 136 21.293 40.382 -14.777 1.00 9.54 C ATOM 2100 C LYS A 136 21.805 41.792 -14.553 1.00 9.54 C ATOM 2101 O LYS A 136 21.049 42.756 -14.591 1.00 9.99 O ATOM 2102 CB LYS A 136 20.017 40.154 -13.955 1.00 10.03 C ATOM 2103 CG LYS A 136 19.497 38.724 -14.009 1.00 10.42 C ATOM 2104 CD LYS A 136 19.198 38.280 -15.433 1.00 10.60 C ATOM 2105 CE LYS A 136 18.038 39.056 -16.037 1.00 11.32 C ATOM 2106 NZ LYS A 136 17.823 38.705 -17.465 1.00 11.69 N ATOM 0 H LYS A 136 22.604 39.500 -13.413 1.00 9.17 H new ATOM 0 HA LYS A 136 21.052 40.239 -15.830 1.00 9.54 H new ATOM 0 HB2 LYS A 136 20.213 40.420 -12.916 1.00 10.03 H new ATOM 0 HB3 LYS A 136 19.239 40.827 -14.315 1.00 10.03 H new ATOM 0 HG2 LYS A 136 20.234 38.053 -13.567 1.00 10.42 H new ATOM 0 HG3 LYS A 136 18.592 38.644 -13.407 1.00 10.42 H new ATOM 0 HD2 LYS A 136 20.086 38.416 -16.050 1.00 10.60 H new ATOM 0 HD3 LYS A 136 18.965 37.215 -15.440 1.00 10.60 H new ATOM 0 HE2 LYS A 136 17.129 38.850 -15.471 1.00 11.32 H new ATOM 0 HE3 LYS A 136 18.232 40.125 -15.951 1.00 11.32 H new ATOM 0 HZ1 LYS A 136 17.024 39.254 -17.841 1.00 11.69 H new ATOM 0 HZ2 LYS A 136 18.681 38.925 -18.010 1.00 11.69 H new ATOM 0 HZ3 LYS A 136 17.613 37.690 -17.545 1.00 11.69 H new ATOM 2120 N GLY A 137 23.108 41.891 -14.351 1.00 9.28 N ATOM 2121 CA GLY A 137 23.715 43.141 -13.957 1.00 9.53 C ATOM 2122 C GLY A 137 24.111 43.102 -12.503 1.00 9.53 C ATOM 2123 O GLY A 137 25.259 42.812 -12.176 1.00 9.44 O ATOM 0 H GLY A 137 23.763 41.116 -14.455 1.00 9.28 H new ATOM 0 HA2 GLY A 137 24.592 43.336 -14.574 1.00 9.53 H new ATOM 0 HA3 GLY A 137 23.017 43.961 -14.128 1.00 9.53 H new ATOM 2127 N CYS A 138 23.156 43.370 -11.628 1.00 9.89 N ATOM 2128 CA CYS A 138 23.386 43.245 -10.201 1.00 10.22 C ATOM 2129 C CYS A 138 23.018 41.844 -9.730 1.00 9.92 C ATOM 2130 O CYS A 138 22.062 41.243 -10.223 1.00 9.94 O ATOM 2131 CB CYS A 138 22.547 44.255 -9.426 1.00 11.12 C ATOM 2132 SG CYS A 138 22.923 45.989 -9.741 1.00 12.01 S ATOM 0 H CYS A 138 22.216 43.675 -11.881 1.00 9.89 H new ATOM 0 HA CYS A 138 24.443 43.435 -10.016 1.00 10.22 H new ATOM 0 HB2 CYS A 138 21.496 44.082 -9.659 1.00 11.12 H new ATOM 0 HB3 CYS A 138 22.673 44.063 -8.360 1.00 11.12 H new ATOM 2137 N TRP A 139 23.776 41.330 -8.775 1.00 9.89 N ATOM 2138 CA TRP A 139 23.474 40.036 -8.179 1.00 9.90 C ATOM 2139 C TRP A 139 22.837 40.211 -6.804 1.00 10.86 C ATOM 2140 O TRP A 139 22.483 39.231 -6.145 1.00 11.32 O ATOM 2141 CB TRP A 139 24.740 39.184 -8.061 1.00 9.65 C ATOM 2142 CG TRP A 139 25.394 38.907 -9.379 1.00 9.03 C ATOM 2143 CD1 TRP A 139 24.912 38.120 -10.382 1.00 8.51 C ATOM 2144 CD2 TRP A 139 26.656 39.407 -9.832 1.00 9.20 C ATOM 2145 NE1 TRP A 139 25.793 38.103 -11.434 1.00 8.35 N ATOM 2146 CE2 TRP A 139 26.873 38.886 -11.120 1.00 8.78 C ATOM 2147 CE3 TRP A 139 27.622 40.247 -9.273 1.00 9.91 C ATOM 2148 CZ2 TRP A 139 28.016 39.179 -11.856 1.00 9.11 C ATOM 2149 CZ3 TRP A 139 28.756 40.535 -10.004 1.00 10.19 C ATOM 2150 CH2 TRP A 139 28.944 40.003 -11.283 1.00 9.81 C ATOM 0 H TRP A 139 24.605 41.788 -8.395 1.00 9.89 H new ATOM 0 HA TRP A 139 22.767 39.524 -8.832 1.00 9.90 H new ATOM 0 HB2 TRP A 139 25.452 39.692 -7.410 1.00 9.65 H new ATOM 0 HB3 TRP A 139 24.489 38.238 -7.582 1.00 9.65 H new ATOM 0 HD1 TRP A 139 23.973 37.587 -10.353 1.00 8.51 H new ATOM 0 HE1 TRP A 139 25.665 37.591 -12.307 1.00 8.35 H new ATOM 0 HE3 TRP A 139 27.484 40.664 -8.286 1.00 9.91 H new ATOM 0 HZ2 TRP A 139 28.165 38.770 -12.845 1.00 9.11 H new ATOM 0 HZ3 TRP A 139 29.511 41.182 -9.581 1.00 10.19 H new ATOM 0 HH2 TRP A 139 29.842 40.248 -11.830 1.00 9.81 H new ATOM 2161 N LYS A 140 22.692 41.461 -6.373 1.00 11.35 N ATOM 2162 CA LYS A 140 22.105 41.756 -5.074 1.00 12.41 C ATOM 2163 C LYS A 140 20.758 42.455 -5.229 1.00 12.91 C ATOM 2164 O LYS A 140 19.737 41.980 -4.728 1.00 13.52 O ATOM 2165 CB LYS A 140 23.053 42.641 -4.268 1.00 13.04 C ATOM 2166 CG LYS A 140 22.625 42.856 -2.826 1.00 14.05 C ATOM 2167 CD LYS A 140 22.559 41.544 -2.066 1.00 14.34 C ATOM 2168 CE LYS A 140 22.231 41.768 -0.600 1.00 15.50 C ATOM 2169 NZ LYS A 140 22.148 40.491 0.155 1.00 16.11 N ATOM 0 H LYS A 140 22.973 42.284 -6.906 1.00 11.35 H new ATOM 0 HA LYS A 140 21.946 40.814 -4.548 1.00 12.41 H new ATOM 0 HB2 LYS A 140 24.047 42.194 -4.278 1.00 13.04 H new ATOM 0 HB3 LYS A 140 23.135 43.610 -4.760 1.00 13.04 H new ATOM 0 HG2 LYS A 140 23.327 43.529 -2.333 1.00 14.05 H new ATOM 0 HG3 LYS A 140 21.649 43.341 -2.803 1.00 14.05 H new ATOM 0 HD2 LYS A 140 21.803 40.899 -2.515 1.00 14.34 H new ATOM 0 HD3 LYS A 140 23.513 41.024 -2.151 1.00 14.34 H new ATOM 0 HE2 LYS A 140 22.993 42.405 -0.152 1.00 15.50 H new ATOM 0 HE3 LYS A 140 21.283 42.300 -0.518 1.00 15.50 H new ATOM 0 HZ1 LYS A 140 21.922 40.690 1.150 1.00 16.11 H new ATOM 0 HZ2 LYS A 140 21.403 39.893 -0.256 1.00 16.11 H new ATOM 0 HZ3 LYS A 140 23.060 39.995 0.099 1.00 16.11 H new ATOM 2183 N CYS A 141 20.761 43.576 -5.934 1.00 12.82 N ATOM 2184 CA CYS A 141 19.546 44.348 -6.146 1.00 13.44 C ATOM 2185 C CYS A 141 19.023 44.194 -7.565 1.00 13.01 C ATOM 2186 O CYS A 141 17.990 44.755 -7.916 1.00 13.56 O ATOM 2187 CB CYS A 141 19.808 45.821 -5.856 1.00 13.82 C ATOM 2188 SG CYS A 141 21.481 46.372 -6.279 1.00 13.97 S ATOM 0 H CYS A 141 21.594 43.972 -6.370 1.00 12.82 H new ATOM 0 HA CYS A 141 18.788 43.965 -5.463 1.00 13.44 H new ATOM 0 HB2 CYS A 141 19.088 46.423 -6.410 1.00 13.82 H new ATOM 0 HB3 CYS A 141 19.632 46.009 -4.797 1.00 13.82 H new ATOM 2193 N GLY A 142 19.737 43.427 -8.370 1.00 12.16 N ATOM 2194 CA GLY A 142 19.398 43.322 -9.773 1.00 11.86 C ATOM 2195 C GLY A 142 18.082 42.628 -9.992 1.00 11.95 C ATOM 2196 O GLY A 142 17.131 43.230 -10.494 1.00 12.26 O ATOM 0 H GLY A 142 20.544 42.875 -8.079 1.00 12.16 H new ATOM 0 HA2 GLY A 142 19.357 44.320 -10.210 1.00 11.86 H new ATOM 0 HA3 GLY A 142 20.185 42.777 -10.295 1.00 11.86 H new ATOM 2200 N LYS A 143 18.035 41.371 -9.571 1.00 11.90 N ATOM 2201 CA LYS A 143 16.873 40.500 -9.756 1.00 12.23 C ATOM 2202 C LYS A 143 16.564 40.297 -11.242 1.00 11.90 C ATOM 2203 O LYS A 143 16.821 39.230 -11.799 1.00 11.44 O ATOM 2204 CB LYS A 143 15.653 41.064 -9.017 1.00 13.11 C ATOM 2205 CG LYS A 143 14.428 40.161 -9.071 1.00 13.82 C ATOM 2206 CD LYS A 143 13.249 40.774 -8.328 1.00 14.46 C ATOM 2207 CE LYS A 143 13.530 40.904 -6.839 1.00 15.30 C ATOM 2208 NZ LYS A 143 12.407 41.553 -6.113 1.00 15.88 N ATOM 0 H LYS A 143 18.810 40.919 -9.085 1.00 11.90 H new ATOM 0 HA LYS A 143 17.112 39.525 -9.331 1.00 12.23 H new ATOM 0 HB2 LYS A 143 15.920 41.236 -7.974 1.00 13.11 H new ATOM 0 HB3 LYS A 143 15.397 42.033 -9.445 1.00 13.11 H new ATOM 0 HG2 LYS A 143 14.152 39.983 -10.110 1.00 13.82 H new ATOM 0 HG3 LYS A 143 14.670 39.192 -8.635 1.00 13.82 H new ATOM 0 HD2 LYS A 143 13.028 41.757 -8.744 1.00 14.46 H new ATOM 0 HD3 LYS A 143 12.363 40.157 -8.479 1.00 14.46 H new ATOM 0 HE2 LYS A 143 13.711 39.915 -6.417 1.00 15.30 H new ATOM 0 HE3 LYS A 143 14.440 41.485 -6.692 1.00 15.30 H new ATOM 0 HZ1 LYS A 143 12.641 41.621 -5.102 1.00 15.88 H new ATOM 0 HZ2 LYS A 143 12.250 42.507 -6.497 1.00 15.88 H new ATOM 0 HZ3 LYS A 143 11.543 40.986 -6.231 1.00 15.88 H new ATOM 2222 N GLU A 144 16.024 41.327 -11.875 1.00 12.31 N ATOM 2223 CA GLU A 144 15.683 41.275 -13.285 1.00 12.29 C ATOM 2224 C GLU A 144 16.541 42.267 -14.070 1.00 12.31 C ATOM 2225 O GLU A 144 16.952 41.992 -15.200 1.00 12.33 O ATOM 2226 CB GLU A 144 14.185 41.590 -13.451 1.00 13.02 C ATOM 2227 CG GLU A 144 13.630 41.414 -14.861 1.00 13.41 C ATOM 2228 CD GLU A 144 13.991 42.548 -15.801 1.00 13.89 C ATOM 2229 OE1 GLU A 144 14.592 42.278 -16.863 1.00 14.11 O ATOM 2230 OE2 GLU A 144 13.685 43.718 -15.482 1.00 14.20 O ATOM 0 H GLU A 144 15.811 42.218 -11.427 1.00 12.31 H new ATOM 0 HA GLU A 144 15.881 40.278 -13.677 1.00 12.29 H new ATOM 0 HB2 GLU A 144 13.620 40.950 -12.774 1.00 13.02 H new ATOM 0 HB3 GLU A 144 14.011 42.619 -13.136 1.00 13.02 H new ATOM 0 HG2 GLU A 144 14.003 40.477 -15.275 1.00 13.41 H new ATOM 0 HG3 GLU A 144 12.545 41.329 -14.807 1.00 13.41 H new ATOM 2237 N GLY A 145 16.852 43.399 -13.451 1.00 12.50 N ATOM 2238 CA GLY A 145 17.541 44.457 -14.161 1.00 12.76 C ATOM 2239 C GLY A 145 18.756 44.981 -13.426 1.00 12.89 C ATOM 2240 O GLY A 145 19.461 44.218 -12.762 1.00 13.35 O ATOM 0 H GLY A 145 16.640 43.602 -12.474 1.00 12.50 H new ATOM 0 HA2 GLY A 145 17.849 44.088 -15.139 1.00 12.76 H new ATOM 0 HA3 GLY A 145 16.847 45.280 -14.334 1.00 12.76 H new ATOM 2244 N HIS A 146 18.969 46.296 -13.538 1.00 12.67 N ATOM 2245 CA HIS A 146 20.151 46.975 -12.995 1.00 12.99 C ATOM 2246 C HIS A 146 21.389 46.664 -13.824 1.00 12.58 C ATOM 2247 O HIS A 146 21.703 45.512 -14.106 1.00 11.92 O ATOM 2248 CB HIS A 146 20.412 46.621 -11.529 1.00 13.11 C ATOM 2249 CG HIS A 146 19.470 47.262 -10.554 1.00 13.73 C ATOM 2250 ND1 HIS A 146 19.667 47.165 -9.195 1.00 13.78 N ATOM 2251 CD2 HIS A 146 18.357 47.997 -10.789 1.00 14.46 C ATOM 2252 CE1 HIS A 146 18.678 47.841 -8.640 1.00 14.54 C ATOM 2253 NE2 HIS A 146 17.858 48.363 -9.567 1.00 14.96 N ATOM 0 H HIS A 146 18.321 46.925 -14.012 1.00 12.67 H new ATOM 0 HA HIS A 146 19.939 48.043 -13.046 1.00 12.99 H new ATOM 0 HB2 HIS A 146 20.352 45.539 -11.414 1.00 13.11 H new ATOM 0 HB3 HIS A 146 21.431 46.912 -11.275 1.00 13.11 H new ATOM 0 HD2 HIS A 146 17.942 48.247 -11.755 1.00 14.46 H new ATOM 0 HE1 HIS A 146 18.545 47.959 -7.575 1.00 14.54 H new ATOM 0 HE2 HIS A 146 17.024 48.924 -9.394 1.00 14.96 H new ATOM 2261 N GLN A 147 22.095 47.711 -14.209 1.00 13.15 N ATOM 2262 CA GLN A 147 23.289 47.569 -15.033 1.00 13.06 C ATOM 2263 C GLN A 147 24.507 47.308 -14.162 1.00 12.82 C ATOM 2264 O GLN A 147 25.591 47.020 -14.671 1.00 13.08 O ATOM 2265 CB GLN A 147 23.524 48.828 -15.873 1.00 14.01 C ATOM 2266 CG GLN A 147 22.360 49.195 -16.780 1.00 14.38 C ATOM 2267 CD GLN A 147 21.187 49.786 -16.024 1.00 14.79 C ATOM 2268 OE1 GLN A 147 21.361 50.421 -14.983 1.00 14.85 O ATOM 2269 NE2 GLN A 147 19.987 49.575 -16.535 1.00 15.24 N ATOM 0 H GLN A 147 21.864 48.674 -13.965 1.00 13.15 H new ATOM 0 HA GLN A 147 23.135 46.722 -15.701 1.00 13.06 H new ATOM 0 HB2 GLN A 147 23.728 49.665 -15.205 1.00 14.01 H new ATOM 0 HB3 GLN A 147 24.415 48.683 -16.484 1.00 14.01 H new ATOM 0 HG2 GLN A 147 22.701 49.910 -17.529 1.00 14.38 H new ATOM 0 HG3 GLN A 147 22.029 48.306 -17.316 1.00 14.38 H new ATOM 0 HE21 GLN A 147 19.887 49.043 -17.400 1.00 15.24 H new ATOM 0 HE22 GLN A 147 19.160 49.944 -16.065 1.00 15.24 H new ATOM 2278 N MET A 148 24.308 47.426 -12.849 1.00 12.52 N ATOM 2279 CA MET A 148 25.372 47.273 -11.846 1.00 12.47 C ATOM 2280 C MET A 148 26.341 48.455 -11.890 1.00 13.37 C ATOM 2281 O MET A 148 26.554 49.129 -10.884 1.00 13.85 O ATOM 2282 CB MET A 148 26.127 45.950 -12.040 1.00 11.69 C ATOM 2283 CG MET A 148 27.273 45.739 -11.066 1.00 11.72 C ATOM 2284 SD MET A 148 28.243 44.271 -11.463 1.00 11.68 S ATOM 2285 CE MET A 148 29.443 44.292 -10.135 1.00 11.96 C ATOM 0 H MET A 148 23.395 47.633 -12.444 1.00 12.52 H new ATOM 0 HA MET A 148 24.901 47.255 -10.863 1.00 12.47 H new ATOM 0 HB2 MET A 148 25.423 45.124 -11.939 1.00 11.69 H new ATOM 0 HB3 MET A 148 26.518 45.913 -13.057 1.00 11.69 H new ATOM 0 HG2 MET A 148 27.922 46.615 -11.076 1.00 11.72 H new ATOM 0 HG3 MET A 148 26.876 45.648 -10.055 1.00 11.72 H new ATOM 0 HE1 MET A 148 30.118 43.443 -10.241 1.00 11.96 H new ATOM 0 HE2 MET A 148 30.016 45.218 -10.177 1.00 11.96 H new ATOM 0 HE3 MET A 148 28.927 44.228 -9.177 1.00 11.96 H new ATOM 2295 N LYS A 149 26.893 48.718 -13.066 1.00 13.75 N ATOM 2296 CA LYS A 149 27.831 49.820 -13.270 1.00 14.74 C ATOM 2297 C LYS A 149 27.154 51.174 -13.046 1.00 15.59 C ATOM 2298 O LYS A 149 27.776 52.123 -12.572 1.00 16.38 O ATOM 2299 CB LYS A 149 28.404 49.746 -14.689 1.00 15.07 C ATOM 2300 CG LYS A 149 27.335 49.764 -15.774 1.00 14.89 C ATOM 2301 CD LYS A 149 27.905 49.458 -17.146 1.00 14.96 C ATOM 2302 CE LYS A 149 28.833 50.556 -17.640 1.00 15.59 C ATOM 2303 NZ LYS A 149 29.318 50.279 -19.018 1.00 15.96 N ATOM 0 H LYS A 149 26.705 48.174 -13.908 1.00 13.75 H new ATOM 0 HA LYS A 149 28.638 49.726 -12.543 1.00 14.74 H new ATOM 0 HB2 LYS A 149 29.082 50.585 -14.843 1.00 15.07 H new ATOM 0 HB3 LYS A 149 28.996 48.836 -14.787 1.00 15.07 H new ATOM 0 HG2 LYS A 149 26.562 49.034 -15.532 1.00 14.89 H new ATOM 0 HG3 LYS A 149 26.855 50.742 -15.792 1.00 14.89 H new ATOM 0 HD2 LYS A 149 28.449 48.514 -17.109 1.00 14.96 H new ATOM 0 HD3 LYS A 149 27.088 49.328 -17.856 1.00 14.96 H new ATOM 0 HE2 LYS A 149 28.309 51.512 -17.622 1.00 15.59 H new ATOM 0 HE3 LYS A 149 29.684 50.646 -16.965 1.00 15.59 H new ATOM 0 HZ1 LYS A 149 29.949 51.047 -19.325 1.00 15.96 H new ATOM 0 HZ2 LYS A 149 29.838 49.379 -19.028 1.00 15.96 H new ATOM 0 HZ3 LYS A 149 28.507 50.217 -19.666 1.00 15.96 H new ATOM 2317 N ASP A 150 25.875 51.256 -13.391 1.00 15.52 N ATOM 2318 CA ASP A 150 25.116 52.495 -13.242 1.00 16.41 C ATOM 2319 C ASP A 150 24.390 52.506 -11.903 1.00 16.34 C ATOM 2320 O ASP A 150 23.847 53.523 -11.478 1.00 17.13 O ATOM 2321 CB ASP A 150 24.113 52.640 -14.395 1.00 16.67 C ATOM 2322 CG ASP A 150 23.346 53.952 -14.361 1.00 17.24 C ATOM 2323 OD1 ASP A 150 23.943 55.008 -14.663 1.00 17.41 O ATOM 2324 OD2 ASP A 150 22.144 53.936 -14.026 1.00 17.63 O ATOM 0 H ASP A 150 25.339 50.479 -13.777 1.00 15.52 H new ATOM 0 HA ASP A 150 25.806 53.339 -13.271 1.00 16.41 H new ATOM 0 HB2 ASP A 150 24.645 52.563 -15.343 1.00 16.67 H new ATOM 0 HB3 ASP A 150 23.405 51.812 -14.358 1.00 16.67 H new ATOM 2329 N CYS A 151 24.421 51.371 -11.222 1.00 15.51 N ATOM 2330 CA CYS A 151 23.675 51.206 -9.991 1.00 15.54 C ATOM 2331 C CYS A 151 24.477 51.709 -8.797 1.00 15.97 C ATOM 2332 O CYS A 151 25.497 51.128 -8.424 1.00 15.64 O ATOM 2333 CB CYS A 151 23.299 49.737 -9.792 1.00 14.63 C ATOM 2334 SG CYS A 151 22.195 49.440 -8.392 1.00 14.46 S ATOM 0 H CYS A 151 24.957 50.550 -11.504 1.00 15.51 H new ATOM 0 HA CYS A 151 22.763 51.798 -10.064 1.00 15.54 H new ATOM 0 HB2 CYS A 151 22.823 49.369 -10.701 1.00 14.63 H new ATOM 0 HB3 CYS A 151 24.210 49.156 -9.652 1.00 14.63 H new ATOM 2339 N THR A 152 24.022 52.807 -8.218 1.00 16.85 N ATOM 2340 CA THR A 152 24.603 53.319 -6.994 1.00 17.48 C ATOM 2341 C THR A 152 23.687 52.978 -5.822 1.00 17.79 C ATOM 2342 O THR A 152 22.555 53.454 -5.756 1.00 18.21 O ATOM 2343 CB THR A 152 24.811 54.842 -7.071 1.00 18.43 C ATOM 2344 OG1 THR A 152 25.529 55.173 -8.268 1.00 18.64 O ATOM 2345 CG2 THR A 152 25.579 55.351 -5.860 1.00 18.95 C ATOM 0 H THR A 152 23.247 53.362 -8.581 1.00 16.85 H new ATOM 0 HA THR A 152 25.579 52.854 -6.851 1.00 17.48 H new ATOM 0 HB THR A 152 23.831 55.320 -7.084 1.00 18.43 H new ATOM 0 HG1 THR A 152 25.658 56.143 -8.314 1.00 18.64 H new ATOM 0 HG21 THR A 152 25.712 56.430 -5.940 1.00 18.95 H new ATOM 0 HG22 THR A 152 25.021 55.121 -4.952 1.00 18.95 H new ATOM 0 HG23 THR A 152 26.555 54.867 -5.819 1.00 18.95 H new ATOM 2353 N GLU A 153 24.171 52.127 -4.924 1.00 17.71 N ATOM 2354 CA GLU A 153 23.377 51.664 -3.793 1.00 18.13 C ATOM 2355 C GLU A 153 23.066 52.819 -2.843 1.00 19.12 C ATOM 2356 O GLU A 153 23.951 53.335 -2.158 1.00 19.35 O ATOM 2357 CB GLU A 153 24.121 50.552 -3.053 1.00 17.70 C ATOM 2358 CG GLU A 153 23.290 49.858 -1.987 1.00 17.60 C ATOM 2359 CD GLU A 153 24.079 48.810 -1.234 1.00 17.59 C ATOM 2360 OE1 GLU A 153 24.602 49.116 -0.139 1.00 17.64 O ATOM 2361 OE2 GLU A 153 24.173 47.668 -1.727 1.00 17.65 O ATOM 0 H GLU A 153 25.115 51.742 -4.959 1.00 17.71 H new ATOM 0 HA GLU A 153 22.433 51.269 -4.169 1.00 18.13 H new ATOM 0 HB2 GLU A 153 24.458 49.810 -3.777 1.00 17.70 H new ATOM 0 HB3 GLU A 153 25.013 50.972 -2.588 1.00 17.70 H new ATOM 0 HG2 GLU A 153 22.913 50.600 -1.284 1.00 17.60 H new ATOM 0 HG3 GLU A 153 22.422 49.391 -2.453 1.00 17.60 H new ATOM 2368 N ARG A 154 21.805 53.222 -2.815 1.00 19.80 N ATOM 2369 CA ARG A 154 21.372 54.332 -1.983 1.00 20.84 C ATOM 2370 C ARG A 154 20.814 53.811 -0.665 1.00 21.28 C ATOM 2371 O ARG A 154 19.697 53.289 -0.612 1.00 21.68 O ATOM 2372 CB ARG A 154 20.314 55.156 -2.718 1.00 21.38 C ATOM 2373 CG ARG A 154 20.758 55.602 -4.101 1.00 21.89 C ATOM 2374 CD ARG A 154 19.641 56.304 -4.851 1.00 22.33 C ATOM 2375 NE ARG A 154 19.409 57.662 -4.371 1.00 22.67 N ATOM 2376 CZ ARG A 154 18.310 58.365 -4.645 1.00 23.08 C ATOM 2377 NH1 ARG A 154 17.314 57.802 -5.322 1.00 23.21 N ATOM 2378 NH2 ARG A 154 18.205 59.622 -4.241 1.00 23.48 N ATOM 0 H ARG A 154 21.060 52.793 -3.363 1.00 19.80 H new ATOM 0 HA ARG A 154 22.229 54.971 -1.771 1.00 20.84 H new ATOM 0 HB2 ARG A 154 19.402 54.566 -2.809 1.00 21.38 H new ATOM 0 HB3 ARG A 154 20.068 56.034 -2.122 1.00 21.38 H new ATOM 0 HG2 ARG A 154 21.612 56.273 -4.010 1.00 21.89 H new ATOM 0 HG3 ARG A 154 21.092 54.736 -4.673 1.00 21.89 H new ATOM 0 HD2 ARG A 154 19.885 56.335 -5.913 1.00 22.33 H new ATOM 0 HD3 ARG A 154 18.722 55.726 -4.752 1.00 22.33 H new ATOM 0 HE ARG A 154 20.128 58.098 -3.793 1.00 22.67 H new ATOM 0 HH11 ARG A 154 17.391 56.833 -5.631 1.00 23.21 H new ATOM 0 HH12 ARG A 154 16.473 58.339 -5.532 1.00 23.21 H new ATOM 0 HH21 ARG A 154 18.966 60.055 -3.718 1.00 23.48 H new ATOM 0 HH22 ARG A 154 17.363 60.157 -4.452 1.00 23.48 H new ATOM 2392 N GLN A 155 21.605 53.940 0.389 1.00 21.32 N ATOM 2393 CA GLN A 155 21.216 53.447 1.701 1.00 21.85 C ATOM 2394 C GLN A 155 20.169 54.359 2.327 1.00 22.14 C ATOM 2395 O GLN A 155 20.315 55.581 2.329 1.00 22.34 O ATOM 2396 CB GLN A 155 22.440 53.349 2.612 1.00 21.93 C ATOM 2397 CG GLN A 155 22.150 52.705 3.957 1.00 22.12 C ATOM 2398 CD GLN A 155 23.380 52.612 4.837 1.00 22.30 C ATOM 2399 OE1 GLN A 155 23.663 53.513 5.628 1.00 22.37 O ATOM 2400 NE2 GLN A 155 24.130 51.533 4.689 1.00 22.51 N ATOM 0 H GLN A 155 22.523 54.383 0.361 1.00 21.32 H new ATOM 0 HA GLN A 155 20.783 52.454 1.582 1.00 21.85 H new ATOM 0 HB2 GLN A 155 23.215 52.775 2.104 1.00 21.93 H new ATOM 0 HB3 GLN A 155 22.840 54.349 2.777 1.00 21.93 H new ATOM 0 HG2 GLN A 155 21.382 53.281 4.473 1.00 22.12 H new ATOM 0 HG3 GLN A 155 21.746 51.705 3.797 1.00 22.12 H new ATOM 0 HE21 GLN A 155 23.858 50.811 4.022 1.00 22.51 H new ATOM 0 HE22 GLN A 155 24.980 51.423 5.242 1.00 22.51 H new ATOM 2409 N ALA A 156 19.113 53.759 2.849 1.00 22.27 N ATOM 2410 CA ALA A 156 18.051 54.509 3.493 1.00 22.67 C ATOM 2411 C ALA A 156 18.327 54.639 4.982 1.00 23.02 C ATOM 2412 O ALA A 156 18.245 53.663 5.727 1.00 23.30 O ATOM 2413 CB ALA A 156 16.713 53.835 3.253 1.00 22.74 C ATOM 0 H ALA A 156 18.969 52.749 2.839 1.00 22.27 H new ATOM 0 HA ALA A 156 18.015 55.509 3.062 1.00 22.67 H new ATOM 0 HB1 ALA A 156 15.924 54.407 3.741 1.00 22.74 H new ATOM 0 HB2 ALA A 156 16.517 53.787 2.182 1.00 22.74 H new ATOM 0 HB3 ALA A 156 16.735 52.825 3.663 1.00 22.74 H new ATOM 2419 N ASN A 157 18.674 55.841 5.412 1.00 23.11 N ATOM 2420 CA ASN A 157 19.003 56.081 6.808 1.00 23.57 C ATOM 2421 C ASN A 157 17.977 57.011 7.440 1.00 23.76 C ATOM 2422 O ASN A 157 18.210 58.236 7.459 1.00 23.91 O ATOM 2423 CB ASN A 157 20.407 56.676 6.931 1.00 23.80 C ATOM 2424 CG ASN A 157 20.851 56.822 8.372 1.00 23.98 C ATOM 2425 OD1 ASN A 157 20.622 57.849 9.006 1.00 23.92 O ATOM 2426 ND2 ASN A 157 21.498 55.796 8.898 1.00 24.30 N ATOM 2427 OXT ASN A 157 16.926 56.514 7.894 1.00 23.85 O ATOM 0 H ASN A 157 18.735 56.666 4.815 1.00 23.11 H new ATOM 0 HA ASN A 157 18.983 55.129 7.338 1.00 23.57 H new ATOM 0 HB2 ASN A 157 21.115 56.041 6.399 1.00 23.80 H new ATOM 0 HB3 ASN A 157 20.428 57.652 6.447 1.00 23.80 H new ATOM 0 HD21 ASN A 157 21.826 55.840 9.863 1.00 24.30 H new ATOM 0 HD22 ASN A 157 21.669 54.960 8.339 1.00 24.30 H new TER 2434 ASN A 157 HETATM 2435 ZN ZN A 201 30.547 30.795 -13.525 1.00 9.38 ZN HETATM 2436 ZN ZN A 202 21.512 47.242 -8.418 1.00 13.43 ZN