USER MOD reduce.3.24.130724 H: found=0, std=0, add=1458, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1458 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 127 TYR OH : rot 36:sc= 0.715 USER MOD Set 1.2: A 199 TYR OH : rot 30:sc= 0.631 USER MOD Set 2.1: A 113 MET CE :methyl -174:sc= -0.157 (180deg=-0.332) USER MOD Set 2.2: A 124 HIS : no HE2:sc= -0.795 X(o=-0.95,f=-1.1) USER MOD Set 3.1: A 109 THR OG1 : rot 86:sc= -2.1! USER MOD Set 3.2: A 176 HIS : no HE2:sc= -7.46! C(o=-9.6!,f=-13!) USER MOD Set 4.1: A 106 LYS NZ :NH3+ 169:sc= 0.252 (180deg=-0.505) USER MOD Set 4.2: A 111 MET CE :methyl -133:sc= -5.9! (180deg=-8.26!) USER MOD Set 5.1: A 83 LYS NZ :NH3+ -122:sc= -1.22 (180deg=-4.03!) USER MOD Set 5.2: A 85 GLN : amide:sc= -0.0828 K(o=-1.3,f=-5.4!) USER MOD Single : A 0 THR OG1 : rot 180:sc= -1.25 USER MOD Single : A 1 MET CE :methyl -128:sc= -1.15 (180deg=-3.35!) USER MOD Single : A 5 SER OG : rot 35:sc= 0.00973 USER MOD Single : A 7 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0366) USER MOD Single : A 9 SER OG : rot 180:sc= -0.139 USER MOD Single : A -5 GLY N :NH3+ 139:sc= 0.298 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -158:sc= -0.319 (180deg=-1.06) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 86:sc= -0.968! USER MOD Single : A 24 MET CE :methyl 166:sc= -0.0147 (180deg=-0.217) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot -4:sc= -2.28! USER MOD Single : A 31 MET CE :methyl 168:sc= -2.48 (180deg=-2.85) USER MOD Single : A 45 ASN :FLIP amide:sc= -0.988 F(o=-1.9!,f=-0.99) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 159:sc= 1.28 (180deg=1.16) USER MOD Single : A 58 LYS NZ :NH3+ 167:sc= -0.0123 (180deg=-0.218) USER MOD Single : A 66 LYS NZ :NH3+ 164:sc= -0.391! (180deg=-1.89!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 161:sc= -0.299 (180deg=-1.02) USER MOD Single : A 75 ASN :FLIP amide:sc= -1.69! C(o=-4.5!,f=-1.7!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 144:sc= -2.11 (180deg=-5.17!) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -140:sc= -0.612 (180deg=-2.39!) USER MOD Single : A 89 LYS NZ :NH3+ 151:sc= 1.03 (180deg=0.519) USER MOD Single : A 92 MET CE :methyl 158:sc= -3.37! (180deg=-3.79!) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -108:sc= -1.23 (180deg=-3.47!) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl -168:sc= -5.64! (180deg=-6.49!) USER MOD Single : A 105 SER OG : rot -39:sc= 0.838 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.131 USER MOD Single : A 114 THR OG1 : rot 78:sc= 0.991 USER MOD Single : A 116 CYS SG : rot 65:sc= -3.43! USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 1.53 K(o=1.5,f=-6.1!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl -158:sc= 0 (180deg=-0.909) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 143:sc= 0.656! (180deg=-0.689) USER MOD Single : A 172 ASN : amide:sc= 0.286 K(o=0.29,f=-0.26) USER MOD Single : A 179 THR OG1 : rot 180:sc= 0 USER MOD Single : A 183 GLN : amide:sc= -1.5 K(o=-1.5,f=-5.7!) USER MOD Single : A 188 HIS : no HD1:sc= -0.539 X(o=-0.54,f=-0.28) USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 196 LYS NZ :NH3+ 164:sc= -0.039 (180deg=-0.274) USER MOD Single : A 200 SER OG : rot 85:sc= 0.81 USER MOD Single : A 202 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -5 -27.443 -15.435 2.324 1.00 10.08 N ATOM 2 CA GLY A -5 -28.879 -15.707 2.072 1.00 9.65 C ATOM 3 C GLY A -5 -29.690 -14.431 2.054 1.00 8.52 C ATOM 4 O GLY A -5 -29.290 -13.446 1.430 1.00 8.35 O ATOM 0 H1 GLY A -5 -27.063 -16.151 2.976 1.00 10.08 H new ATOM 0 H2 GLY A -5 -26.920 -15.472 1.426 1.00 10.08 H new ATOM 0 H3 GLY A -5 -27.338 -14.491 2.747 1.00 10.08 H new ATOM 0 HA2 GLY A -5 -28.991 -16.224 1.119 1.00 9.65 H new ATOM 0 HA3 GLY A -5 -29.265 -16.374 2.843 1.00 9.65 H new ATOM 10 N ILE A -4 -30.826 -14.431 2.736 1.00 7.94 N ATOM 11 CA ILE A -4 -31.631 -13.226 2.848 1.00 6.97 C ATOM 12 C ILE A -4 -31.157 -12.421 4.050 1.00 6.09 C ATOM 13 O ILE A -4 -31.771 -12.440 5.119 1.00 5.96 O ATOM 14 CB ILE A -4 -33.139 -13.530 2.992 1.00 7.12 C ATOM 15 CG1 ILE A -4 -33.582 -14.561 1.951 1.00 7.77 C ATOM 16 CG2 ILE A -4 -33.949 -12.248 2.839 1.00 7.21 C ATOM 17 CD1 ILE A -4 -35.034 -14.970 2.078 1.00 8.21 C ATOM 0 H ILE A -4 -31.208 -15.246 3.216 1.00 7.94 H new ATOM 0 HA ILE A -4 -31.504 -12.658 1.927 1.00 6.97 H new ATOM 0 HB ILE A -4 -33.315 -13.944 3.985 1.00 7.12 H new ATOM 0 HG12 ILE A -4 -33.415 -14.153 0.954 1.00 7.77 H new ATOM 0 HG13 ILE A -4 -32.955 -15.448 2.041 1.00 7.77 H new ATOM 0 HG21 ILE A -4 -35.010 -12.474 2.942 1.00 7.21 H new ATOM 0 HG22 ILE A -4 -33.653 -11.536 3.610 1.00 7.21 H new ATOM 0 HG23 ILE A -4 -33.764 -11.816 1.856 1.00 7.21 H new ATOM 0 HD11 ILE A -4 -35.274 -15.702 1.307 1.00 8.21 H new ATOM 0 HD12 ILE A -4 -35.204 -15.409 3.061 1.00 8.21 H new ATOM 0 HD13 ILE A -4 -35.671 -14.094 1.957 1.00 8.21 H new ATOM 29 N ASP A -3 -30.030 -11.753 3.881 1.00 5.76 N ATOM 30 CA ASP A -3 -29.431 -10.985 4.957 1.00 5.11 C ATOM 31 C ASP A -3 -30.151 -9.658 5.127 1.00 4.13 C ATOM 32 O ASP A -3 -30.645 -9.084 4.152 1.00 4.11 O ATOM 33 CB ASP A -3 -27.944 -10.758 4.689 1.00 5.67 C ATOM 34 CG ASP A -3 -27.160 -12.054 4.686 1.00 6.72 C ATOM 35 OD1 ASP A -3 -26.781 -12.529 5.776 1.00 7.33 O ATOM 36 OD2 ASP A -3 -26.921 -12.610 3.594 1.00 7.08 O ATOM 0 H ASP A -3 -29.509 -11.727 3.004 1.00 5.76 H new ATOM 0 HA ASP A -3 -29.531 -11.552 5.883 1.00 5.11 H new ATOM 0 HB2 ASP A -3 -27.822 -10.259 3.728 1.00 5.67 H new ATOM 0 HB3 ASP A -3 -27.537 -10.091 5.449 1.00 5.67 H new ATOM 41 N PRO A -2 -30.240 -9.165 6.367 1.00 3.75 N ATOM 42 CA PRO A -2 -30.957 -7.934 6.676 1.00 3.21 C ATOM 43 C PRO A -2 -30.166 -6.688 6.297 1.00 2.50 C ATOM 44 O PRO A -2 -29.125 -6.386 6.889 1.00 2.81 O ATOM 45 CB PRO A -2 -31.152 -8.012 8.189 1.00 3.86 C ATOM 46 CG PRO A -2 -30.003 -8.822 8.682 1.00 4.50 C ATOM 47 CD PRO A -2 -29.640 -9.773 7.573 1.00 4.43 C ATOM 0 HA PRO A -2 -31.889 -7.852 6.117 1.00 3.21 H new ATOM 0 HB2 PRO A -2 -31.157 -7.019 8.638 1.00 3.86 H new ATOM 0 HB3 PRO A -2 -32.103 -8.481 8.441 1.00 3.86 H new ATOM 0 HG2 PRO A -2 -29.158 -8.182 8.935 1.00 4.50 H new ATOM 0 HG3 PRO A -2 -30.273 -9.367 9.587 1.00 4.50 H new ATOM 0 HD2 PRO A -2 -28.559 -9.875 7.473 1.00 4.43 H new ATOM 0 HD3 PRO A -2 -30.038 -10.771 7.757 1.00 4.43 H new ATOM 55 N PHE A -1 -30.658 -5.974 5.299 1.00 2.13 N ATOM 56 CA PHE A -1 -30.045 -4.740 4.868 1.00 1.78 C ATOM 57 C PHE A -1 -31.037 -3.598 4.983 1.00 1.73 C ATOM 58 O PHE A -1 -31.685 -3.216 4.008 1.00 2.21 O ATOM 59 CB PHE A -1 -29.542 -4.861 3.434 1.00 2.13 C ATOM 60 CG PHE A -1 -28.415 -5.838 3.280 1.00 2.45 C ATOM 61 CD1 PHE A -1 -27.170 -5.569 3.821 1.00 2.78 C ATOM 62 CD2 PHE A -1 -28.603 -7.020 2.588 1.00 2.89 C ATOM 63 CE1 PHE A -1 -26.130 -6.465 3.676 1.00 3.51 C ATOM 64 CE2 PHE A -1 -27.567 -7.922 2.439 1.00 3.47 C ATOM 65 CZ PHE A -1 -26.329 -7.648 3.011 1.00 3.78 C ATOM 0 H PHE A -1 -31.490 -6.236 4.770 1.00 2.13 H new ATOM 0 HA PHE A -1 -29.192 -4.533 5.514 1.00 1.78 H new ATOM 0 HB2 PHE A -1 -30.368 -5.166 2.791 1.00 2.13 H new ATOM 0 HB3 PHE A -1 -29.214 -3.881 3.088 1.00 2.13 H new ATOM 0 HD1 PHE A -1 -27.010 -4.648 4.362 1.00 2.78 H new ATOM 0 HD2 PHE A -1 -29.570 -7.241 2.160 1.00 2.89 H new ATOM 0 HE1 PHE A -1 -25.158 -6.234 4.087 1.00 3.51 H new ATOM 0 HE2 PHE A -1 -27.718 -8.835 1.882 1.00 3.47 H new ATOM 0 HZ PHE A -1 -25.526 -8.366 2.932 1.00 3.78 H new ATOM 75 N THR A 0 -31.190 -3.094 6.192 1.00 1.54 N ATOM 76 CA THR A 0 -32.046 -1.952 6.433 1.00 1.59 C ATOM 77 C THR A 0 -31.300 -0.655 6.106 1.00 1.40 C ATOM 78 O THR A 0 -30.513 -0.614 5.158 1.00 1.49 O ATOM 79 CB THR A 0 -32.547 -1.937 7.893 1.00 1.75 C ATOM 80 OG1 THR A 0 -31.440 -1.988 8.801 1.00 1.70 O ATOM 81 CG2 THR A 0 -33.478 -3.111 8.160 1.00 2.11 C ATOM 0 H THR A 0 -30.730 -3.460 7.025 1.00 1.54 H new ATOM 0 HA THR A 0 -32.916 -2.030 5.780 1.00 1.59 H new ATOM 0 HB THR A 0 -33.098 -1.010 8.048 1.00 1.75 H new ATOM 0 HG1 THR A 0 -31.772 -1.976 9.723 1.00 1.70 H new ATOM 0 HG21 THR A 0 -33.817 -3.078 9.195 1.00 2.11 H new ATOM 0 HG22 THR A 0 -34.339 -3.052 7.494 1.00 2.11 H new ATOM 0 HG23 THR A 0 -32.946 -4.045 7.982 1.00 2.11 H new ATOM 89 N MET A 1 -31.536 0.399 6.873 1.00 1.38 N ATOM 90 CA MET A 1 -30.862 1.673 6.638 1.00 1.36 C ATOM 91 C MET A 1 -29.497 1.687 7.326 1.00 1.21 C ATOM 92 O MET A 1 -29.067 2.688 7.901 1.00 1.42 O ATOM 93 CB MET A 1 -31.747 2.831 7.123 1.00 1.66 C ATOM 94 CG MET A 1 -31.293 4.220 6.675 1.00 1.86 C ATOM 95 SD MET A 1 -31.332 4.451 4.882 1.00 2.09 S ATOM 96 CE MET A 1 -29.723 3.822 4.405 1.00 1.64 C ATOM 0 H MET A 1 -32.185 0.401 7.660 1.00 1.38 H new ATOM 0 HA MET A 1 -30.695 1.799 5.568 1.00 1.36 H new ATOM 0 HB2 MET A 1 -32.764 2.665 6.768 1.00 1.66 H new ATOM 0 HB3 MET A 1 -31.783 2.810 8.212 1.00 1.66 H new ATOM 0 HG2 MET A 1 -31.930 4.970 7.143 1.00 1.86 H new ATOM 0 HG3 MET A 1 -30.279 4.395 7.033 1.00 1.86 H new ATOM 0 HE1 MET A 1 -29.210 4.562 3.791 1.00 1.64 H new ATOM 0 HE2 MET A 1 -29.132 3.619 5.298 1.00 1.64 H new ATOM 0 HE3 MET A 1 -29.847 2.901 3.835 1.00 1.64 H new ATOM 106 N VAL A 2 -28.810 0.566 7.216 1.00 1.00 N ATOM 107 CA VAL A 2 -27.482 0.400 7.778 1.00 0.98 C ATOM 108 C VAL A 2 -26.568 -0.262 6.757 1.00 0.79 C ATOM 109 O VAL A 2 -26.107 -1.386 6.936 1.00 0.92 O ATOM 110 CB VAL A 2 -27.485 -0.417 9.092 1.00 1.21 C ATOM 111 CG1 VAL A 2 -28.032 0.416 10.237 1.00 1.56 C ATOM 112 CG2 VAL A 2 -28.287 -1.702 8.942 1.00 1.32 C ATOM 0 H VAL A 2 -29.159 -0.261 6.731 1.00 1.00 H new ATOM 0 HA VAL A 2 -27.111 1.395 8.023 1.00 0.98 H new ATOM 0 HB VAL A 2 -26.454 -0.688 9.317 1.00 1.21 H new ATOM 0 HG11 VAL A 2 -28.026 -0.176 11.152 1.00 1.56 H new ATOM 0 HG12 VAL A 2 -27.410 1.301 10.373 1.00 1.56 H new ATOM 0 HG13 VAL A 2 -29.053 0.722 10.009 1.00 1.56 H new ATOM 0 HG21 VAL A 2 -28.270 -2.253 9.882 1.00 1.32 H new ATOM 0 HG22 VAL A 2 -29.317 -1.460 8.682 1.00 1.32 H new ATOM 0 HG23 VAL A 2 -27.849 -2.315 8.154 1.00 1.32 H new ATOM 122 N ALA A 3 -26.348 0.438 5.664 1.00 0.66 N ATOM 123 CA ALA A 3 -25.453 -0.024 4.625 1.00 0.55 C ATOM 124 C ALA A 3 -24.807 1.162 3.955 1.00 0.60 C ATOM 125 O ALA A 3 -25.327 1.696 2.972 1.00 1.10 O ATOM 126 CB ALA A 3 -26.173 -0.876 3.598 1.00 0.63 C ATOM 0 H ALA A 3 -26.783 1.340 5.471 1.00 0.66 H new ATOM 0 HA ALA A 3 -24.690 -0.649 5.089 1.00 0.55 H new ATOM 0 HB1 ALA A 3 -25.466 -1.202 2.836 1.00 0.63 H new ATOM 0 HB2 ALA A 3 -26.606 -1.748 4.088 1.00 0.63 H new ATOM 0 HB3 ALA A 3 -26.965 -0.291 3.131 1.00 0.63 H new ATOM 132 N LEU A 4 -23.724 1.612 4.565 1.00 0.45 N ATOM 133 CA LEU A 4 -22.913 2.719 4.077 1.00 0.41 C ATOM 134 C LEU A 4 -22.805 2.746 2.560 1.00 0.39 C ATOM 135 O LEU A 4 -22.522 1.733 1.920 1.00 0.38 O ATOM 136 CB LEU A 4 -21.512 2.633 4.688 1.00 0.41 C ATOM 137 CG LEU A 4 -21.467 2.324 6.189 1.00 0.56 C ATOM 138 CD1 LEU A 4 -20.033 2.318 6.685 1.00 1.16 C ATOM 139 CD2 LEU A 4 -22.306 3.321 6.977 1.00 1.46 C ATOM 0 H LEU A 4 -23.374 1.209 5.434 1.00 0.45 H new ATOM 0 HA LEU A 4 -23.409 3.641 4.381 1.00 0.41 H new ATOM 0 HB2 LEU A 4 -20.950 1.863 4.159 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -20.999 3.579 4.513 1.00 0.41 H new ATOM 0 HG LEU A 4 -21.891 1.332 6.346 1.00 0.56 H new ATOM 0 HD11 LEU A 4 -20.018 2.097 7.752 1.00 1.16 H new ATOM 0 HD12 LEU A 4 -19.466 1.557 6.149 1.00 1.16 H new ATOM 0 HD13 LEU A 4 -19.584 3.296 6.510 1.00 1.16 H new ATOM 0 HD21 LEU A 4 -22.257 3.079 8.039 1.00 1.46 H new ATOM 0 HD22 LEU A 4 -21.921 4.328 6.816 1.00 1.46 H new ATOM 0 HD23 LEU A 4 -23.342 3.271 6.641 1.00 1.46 H new ATOM 151 N SER A 5 -23.003 3.925 2.006 1.00 0.41 N ATOM 152 CA SER A 5 -22.953 4.113 0.574 1.00 0.42 C ATOM 153 C SER A 5 -21.576 4.642 0.198 1.00 0.37 C ATOM 154 O SER A 5 -21.250 5.804 0.455 1.00 0.42 O ATOM 155 CB SER A 5 -24.071 5.059 0.130 1.00 0.51 C ATOM 156 OG SER A 5 -23.955 6.333 0.737 1.00 1.28 O ATOM 0 H SER A 5 -23.202 4.775 2.534 1.00 0.41 H new ATOM 0 HA SER A 5 -23.111 3.165 0.059 1.00 0.42 H new ATOM 0 HB2 SER A 5 -24.044 5.169 -0.954 1.00 0.51 H new ATOM 0 HB3 SER A 5 -25.038 4.623 0.382 1.00 0.51 H new ATOM 0 HG SER A 5 -23.008 6.562 0.838 1.00 1.28 H new ATOM 162 N LEU A 6 -20.752 3.780 -0.371 1.00 0.31 N ATOM 163 CA LEU A 6 -19.362 4.117 -0.602 1.00 0.28 C ATOM 164 C LEU A 6 -19.052 4.143 -2.090 1.00 0.28 C ATOM 165 O LEU A 6 -19.438 3.237 -2.833 1.00 0.31 O ATOM 166 CB LEU A 6 -18.453 3.101 0.101 1.00 0.26 C ATOM 167 CG LEU A 6 -18.789 2.825 1.571 1.00 0.33 C ATOM 168 CD1 LEU A 6 -17.800 1.835 2.169 1.00 0.61 C ATOM 169 CD2 LEU A 6 -18.807 4.117 2.373 1.00 0.62 C ATOM 0 H LEU A 6 -21.021 2.846 -0.680 1.00 0.31 H new ATOM 0 HA LEU A 6 -19.178 5.111 -0.193 1.00 0.28 H new ATOM 0 HB2 LEU A 6 -18.497 2.160 -0.447 1.00 0.26 H new ATOM 0 HB3 LEU A 6 -17.424 3.457 0.042 1.00 0.26 H new ATOM 0 HG LEU A 6 -19.785 2.385 1.616 1.00 0.33 H new ATOM 0 HD11 LEU A 6 -18.055 1.652 3.213 1.00 0.61 H new ATOM 0 HD12 LEU A 6 -17.844 0.897 1.615 1.00 0.61 H new ATOM 0 HD13 LEU A 6 -16.792 2.246 2.108 1.00 0.61 H new ATOM 0 HD21 LEU A 6 -19.048 3.896 3.413 1.00 0.62 H new ATOM 0 HD22 LEU A 6 -17.827 4.592 2.320 1.00 0.62 H new ATOM 0 HD23 LEU A 6 -19.559 4.790 1.962 1.00 0.62 H new ATOM 181 N LYS A 7 -18.373 5.190 -2.525 1.00 0.29 N ATOM 182 CA LYS A 7 -17.901 5.262 -3.895 1.00 0.31 C ATOM 183 C LYS A 7 -16.532 4.624 -4.005 1.00 0.29 C ATOM 184 O LYS A 7 -15.551 5.149 -3.491 1.00 0.31 O ATOM 185 CB LYS A 7 -17.835 6.702 -4.398 1.00 0.39 C ATOM 186 CG LYS A 7 -19.168 7.250 -4.866 1.00 0.52 C ATOM 187 CD LYS A 7 -18.985 8.569 -5.596 1.00 0.63 C ATOM 188 CE LYS A 7 -20.283 9.050 -6.220 1.00 0.94 C ATOM 189 NZ LYS A 7 -21.326 9.332 -5.197 1.00 1.72 N ATOM 0 H LYS A 7 -18.137 5.999 -1.951 1.00 0.29 H new ATOM 0 HA LYS A 7 -18.614 4.721 -4.517 1.00 0.31 H new ATOM 0 HB2 LYS A 7 -17.452 7.338 -3.600 1.00 0.39 H new ATOM 0 HB3 LYS A 7 -17.122 6.757 -5.220 1.00 0.39 H new ATOM 0 HG2 LYS A 7 -19.651 6.529 -5.525 1.00 0.52 H new ATOM 0 HG3 LYS A 7 -19.828 7.392 -4.010 1.00 0.52 H new ATOM 0 HD2 LYS A 7 -18.615 9.322 -4.900 1.00 0.63 H new ATOM 0 HD3 LYS A 7 -18.229 8.453 -6.372 1.00 0.63 H new ATOM 0 HE2 LYS A 7 -20.093 9.952 -6.801 1.00 0.94 H new ATOM 0 HE3 LYS A 7 -20.652 8.295 -6.915 1.00 0.94 H new ATOM 0 HZ1 LYS A 7 -22.165 9.737 -5.659 1.00 1.72 H new ATOM 0 HZ2 LYS A 7 -21.589 8.448 -4.716 1.00 1.72 H new ATOM 0 HZ3 LYS A 7 -20.954 10.008 -4.500 1.00 1.72 H new ATOM 203 N ILE A 8 -16.473 3.490 -4.663 1.00 0.28 N ATOM 204 CA ILE A 8 -15.223 2.784 -4.847 1.00 0.28 C ATOM 205 C ILE A 8 -14.548 3.258 -6.125 1.00 0.31 C ATOM 206 O ILE A 8 -15.069 3.073 -7.227 1.00 0.34 O ATOM 207 CB ILE A 8 -15.422 1.245 -4.878 1.00 0.33 C ATOM 208 CG1 ILE A 8 -15.518 0.672 -3.453 1.00 0.58 C ATOM 209 CG2 ILE A 8 -14.289 0.565 -5.633 1.00 0.32 C ATOM 210 CD1 ILE A 8 -16.682 1.195 -2.641 1.00 0.51 C ATOM 0 H ILE A 8 -17.282 3.032 -5.083 1.00 0.28 H new ATOM 0 HA ILE A 8 -14.584 3.008 -3.993 1.00 0.28 H new ATOM 0 HB ILE A 8 -16.359 1.046 -5.398 1.00 0.33 H new ATOM 0 HG12 ILE A 8 -15.595 -0.413 -3.516 1.00 0.58 H new ATOM 0 HG13 ILE A 8 -14.592 0.896 -2.923 1.00 0.58 H new ATOM 0 HG21 ILE A 8 -14.452 -0.513 -5.640 1.00 0.32 H new ATOM 0 HG22 ILE A 8 -14.261 0.935 -6.658 1.00 0.32 H new ATOM 0 HG23 ILE A 8 -13.341 0.785 -5.142 1.00 0.32 H new ATOM 0 HD11 ILE A 8 -16.670 0.737 -1.652 1.00 0.51 H new ATOM 0 HD12 ILE A 8 -16.599 2.277 -2.541 1.00 0.51 H new ATOM 0 HD13 ILE A 8 -17.617 0.948 -3.144 1.00 0.51 H new ATOM 222 N SER A 9 -13.407 3.895 -5.967 1.00 0.33 N ATOM 223 CA SER A 9 -12.645 4.372 -7.099 1.00 0.39 C ATOM 224 C SER A 9 -11.554 3.368 -7.444 1.00 0.37 C ATOM 225 O SER A 9 -10.659 3.115 -6.637 1.00 0.45 O ATOM 226 CB SER A 9 -12.044 5.743 -6.783 1.00 0.46 C ATOM 227 OG SER A 9 -11.304 5.708 -5.573 1.00 1.48 O ATOM 0 H SER A 9 -12.986 4.095 -5.060 1.00 0.33 H new ATOM 0 HA SER A 9 -13.303 4.478 -7.961 1.00 0.39 H new ATOM 0 HB2 SER A 9 -11.395 6.057 -7.601 1.00 0.46 H new ATOM 0 HB3 SER A 9 -12.840 6.484 -6.705 1.00 0.46 H new ATOM 0 HG SER A 9 -10.928 6.595 -5.393 1.00 1.48 H new ATOM 233 N ILE A 10 -11.650 2.778 -8.622 1.00 0.40 N ATOM 234 CA ILE A 10 -10.654 1.821 -9.076 1.00 0.42 C ATOM 235 C ILE A 10 -9.860 2.425 -10.224 1.00 0.50 C ATOM 236 O ILE A 10 -10.218 2.269 -11.392 1.00 0.53 O ATOM 237 CB ILE A 10 -11.296 0.488 -9.528 1.00 0.40 C ATOM 238 CG1 ILE A 10 -12.195 -0.069 -8.420 1.00 0.38 C ATOM 239 CG2 ILE A 10 -10.217 -0.524 -9.894 1.00 0.45 C ATOM 240 CD1 ILE A 10 -12.953 -1.318 -8.816 1.00 0.43 C ATOM 0 H ILE A 10 -12.408 2.944 -9.283 1.00 0.40 H new ATOM 0 HA ILE A 10 -9.994 1.600 -8.237 1.00 0.42 H new ATOM 0 HB ILE A 10 -11.906 0.677 -10.411 1.00 0.40 H new ATOM 0 HG12 ILE A 10 -11.583 -0.289 -7.545 1.00 0.38 H new ATOM 0 HG13 ILE A 10 -12.909 0.699 -8.124 1.00 0.38 H new ATOM 0 HG21 ILE A 10 -10.685 -1.456 -10.210 1.00 0.45 H new ATOM 0 HG22 ILE A 10 -9.609 -0.129 -10.708 1.00 0.45 H new ATOM 0 HG23 ILE A 10 -9.584 -0.711 -9.026 1.00 0.45 H new ATOM 0 HD11 ILE A 10 -13.567 -1.652 -7.979 1.00 0.43 H new ATOM 0 HD12 ILE A 10 -13.593 -1.100 -9.671 1.00 0.43 H new ATOM 0 HD13 ILE A 10 -12.246 -2.103 -9.083 1.00 0.43 H new ATOM 252 N GLY A 11 -8.797 3.134 -9.877 1.00 0.59 N ATOM 253 CA GLY A 11 -8.019 3.848 -10.868 1.00 0.68 C ATOM 254 C GLY A 11 -8.806 4.973 -11.511 1.00 0.75 C ATOM 255 O GLY A 11 -8.843 6.092 -10.999 1.00 0.96 O ATOM 0 H GLY A 11 -8.457 3.228 -8.920 1.00 0.59 H new ATOM 0 HA2 GLY A 11 -7.123 4.255 -10.400 1.00 0.68 H new ATOM 0 HA3 GLY A 11 -7.688 3.152 -11.638 1.00 0.68 H new ATOM 259 N ASN A 12 -9.453 4.666 -12.623 1.00 0.75 N ATOM 260 CA ASN A 12 -10.225 5.654 -13.364 1.00 0.90 C ATOM 261 C ASN A 12 -11.719 5.505 -13.088 1.00 0.84 C ATOM 262 O ASN A 12 -12.438 6.496 -12.949 1.00 1.09 O ATOM 263 CB ASN A 12 -9.960 5.508 -14.864 1.00 1.09 C ATOM 264 CG ASN A 12 -10.827 6.427 -15.702 1.00 1.77 C ATOM 265 OD1 ASN A 12 -11.142 7.548 -15.302 1.00 2.62 O ATOM 266 ND2 ASN A 12 -11.227 5.953 -16.869 1.00 2.17 N ATOM 0 H ASN A 12 -9.459 3.733 -13.036 1.00 0.75 H new ATOM 0 HA ASN A 12 -9.912 6.644 -13.034 1.00 0.90 H new ATOM 0 HB2 ASN A 12 -8.910 5.721 -15.066 1.00 1.09 H new ATOM 0 HB3 ASN A 12 -10.139 4.475 -15.162 1.00 1.09 H new ATOM 0 HD21 ASN A 12 -11.819 6.522 -17.475 1.00 2.17 H new ATOM 0 HD22 ASN A 12 -10.944 5.019 -17.164 1.00 2.17 H new ATOM 273 N VAL A 13 -12.178 4.266 -12.998 1.00 0.65 N ATOM 274 CA VAL A 13 -13.604 3.984 -12.875 1.00 0.61 C ATOM 275 C VAL A 13 -14.094 4.175 -11.434 1.00 0.53 C ATOM 276 O VAL A 13 -13.357 3.938 -10.476 1.00 0.50 O ATOM 277 CB VAL A 13 -13.927 2.551 -13.372 1.00 0.61 C ATOM 278 CG1 VAL A 13 -13.149 1.511 -12.584 1.00 0.55 C ATOM 279 CG2 VAL A 13 -15.422 2.263 -13.317 1.00 0.65 C ATOM 0 H VAL A 13 -11.584 3.437 -13.008 1.00 0.65 H new ATOM 0 HA VAL A 13 -14.134 4.698 -13.505 1.00 0.61 H new ATOM 0 HB VAL A 13 -13.616 2.491 -14.415 1.00 0.61 H new ATOM 0 HG11 VAL A 13 -13.395 0.516 -12.954 1.00 0.55 H new ATOM 0 HG12 VAL A 13 -12.080 1.689 -12.703 1.00 0.55 H new ATOM 0 HG13 VAL A 13 -13.413 1.582 -11.529 1.00 0.55 H new ATOM 0 HG21 VAL A 13 -15.611 1.250 -13.673 1.00 0.65 H new ATOM 0 HG22 VAL A 13 -15.773 2.358 -12.290 1.00 0.65 H new ATOM 0 HG23 VAL A 13 -15.953 2.974 -13.949 1.00 0.65 H new ATOM 289 N VAL A 14 -15.339 4.614 -11.300 1.00 0.51 N ATOM 290 CA VAL A 14 -15.952 4.817 -9.994 1.00 0.46 C ATOM 291 C VAL A 14 -17.223 3.977 -9.871 1.00 0.41 C ATOM 292 O VAL A 14 -18.163 4.116 -10.657 1.00 0.45 O ATOM 293 CB VAL A 14 -16.261 6.314 -9.719 1.00 0.53 C ATOM 294 CG1 VAL A 14 -17.033 6.943 -10.871 1.00 0.62 C ATOM 295 CG2 VAL A 14 -17.025 6.484 -8.407 1.00 0.50 C ATOM 0 H VAL A 14 -15.948 4.838 -12.087 1.00 0.51 H new ATOM 0 HA VAL A 14 -15.233 4.493 -9.241 1.00 0.46 H new ATOM 0 HB VAL A 14 -15.307 6.833 -9.631 1.00 0.53 H new ATOM 0 HG11 VAL A 14 -17.233 7.991 -10.646 1.00 0.62 H new ATOM 0 HG12 VAL A 14 -16.443 6.874 -11.785 1.00 0.62 H new ATOM 0 HG13 VAL A 14 -17.977 6.415 -11.008 1.00 0.62 H new ATOM 0 HG21 VAL A 14 -17.228 7.542 -8.239 1.00 0.50 H new ATOM 0 HG22 VAL A 14 -17.967 5.937 -8.461 1.00 0.50 H new ATOM 0 HG23 VAL A 14 -16.426 6.094 -7.584 1.00 0.50 H new ATOM 305 N LYS A 15 -17.227 3.082 -8.899 1.00 0.39 N ATOM 306 CA LYS A 15 -18.358 2.198 -8.667 1.00 0.41 C ATOM 307 C LYS A 15 -19.026 2.543 -7.346 1.00 0.35 C ATOM 308 O LYS A 15 -18.360 2.944 -6.397 1.00 0.31 O ATOM 309 CB LYS A 15 -17.892 0.743 -8.649 1.00 0.50 C ATOM 310 CG LYS A 15 -17.416 0.227 -9.998 1.00 0.67 C ATOM 311 CD LYS A 15 -18.580 0.015 -10.950 1.00 0.80 C ATOM 312 CE LYS A 15 -18.118 -0.583 -12.268 1.00 1.02 C ATOM 313 NZ LYS A 15 -19.264 -0.930 -13.148 1.00 1.28 N ATOM 0 H LYS A 15 -16.451 2.947 -8.251 1.00 0.39 H new ATOM 0 HA LYS A 15 -19.078 2.329 -9.475 1.00 0.41 H new ATOM 0 HB2 LYS A 15 -17.082 0.641 -7.927 1.00 0.50 H new ATOM 0 HB3 LYS A 15 -18.711 0.115 -8.300 1.00 0.50 H new ATOM 0 HG2 LYS A 15 -16.712 0.936 -10.433 1.00 0.67 H new ATOM 0 HG3 LYS A 15 -16.879 -0.712 -9.862 1.00 0.67 H new ATOM 0 HD2 LYS A 15 -19.315 -0.644 -10.487 1.00 0.80 H new ATOM 0 HD3 LYS A 15 -19.078 0.967 -11.135 1.00 0.80 H new ATOM 0 HE2 LYS A 15 -17.468 0.126 -12.781 1.00 1.02 H new ATOM 0 HE3 LYS A 15 -17.525 -1.477 -12.074 1.00 1.02 H new ATOM 0 HZ1 LYS A 15 -18.908 -1.335 -14.037 1.00 1.28 H new ATOM 0 HZ2 LYS A 15 -19.871 -1.625 -12.669 1.00 1.28 H new ATOM 0 HZ3 LYS A 15 -19.815 -0.073 -13.354 1.00 1.28 H new ATOM 327 N THR A 16 -20.333 2.402 -7.282 1.00 0.38 N ATOM 328 CA THR A 16 -21.057 2.676 -6.057 1.00 0.37 C ATOM 329 C THR A 16 -21.439 1.369 -5.370 1.00 0.35 C ATOM 330 O THR A 16 -22.155 0.545 -5.941 1.00 0.39 O ATOM 331 CB THR A 16 -22.322 3.507 -6.340 1.00 0.45 C ATOM 332 OG1 THR A 16 -21.978 4.641 -7.147 1.00 0.50 O ATOM 333 CG2 THR A 16 -22.965 3.980 -5.044 1.00 0.45 C ATOM 0 H THR A 16 -20.916 2.100 -8.062 1.00 0.38 H new ATOM 0 HA THR A 16 -20.406 3.252 -5.399 1.00 0.37 H new ATOM 0 HB THR A 16 -23.038 2.878 -6.869 1.00 0.45 H new ATOM 0 HG1 THR A 16 -22.783 5.169 -7.329 1.00 0.50 H new ATOM 0 HG21 THR A 16 -23.856 4.565 -5.272 1.00 0.45 H new ATOM 0 HG22 THR A 16 -23.242 3.117 -4.439 1.00 0.45 H new ATOM 0 HG23 THR A 16 -22.258 4.598 -4.491 1.00 0.45 H new ATOM 341 N MET A 17 -20.952 1.175 -4.155 1.00 0.31 N ATOM 342 CA MET A 17 -21.210 -0.047 -3.410 1.00 0.32 C ATOM 343 C MET A 17 -21.678 0.291 -2.009 1.00 0.32 C ATOM 344 O MET A 17 -21.226 1.268 -1.415 1.00 0.31 O ATOM 345 CB MET A 17 -19.955 -0.921 -3.334 1.00 0.34 C ATOM 346 CG MET A 17 -19.770 -1.861 -4.513 1.00 0.44 C ATOM 347 SD MET A 17 -20.794 -3.345 -4.399 1.00 1.04 S ATOM 348 CE MET A 17 -20.151 -4.100 -2.904 1.00 0.40 C ATOM 0 H MET A 17 -20.372 1.853 -3.661 1.00 0.31 H new ATOM 0 HA MET A 17 -21.988 -0.604 -3.932 1.00 0.32 H new ATOM 0 HB2 MET A 17 -19.081 -0.274 -3.261 1.00 0.34 H new ATOM 0 HB3 MET A 17 -19.993 -1.510 -2.418 1.00 0.34 H new ATOM 0 HG2 MET A 17 -20.010 -1.331 -5.435 1.00 0.44 H new ATOM 0 HG3 MET A 17 -18.722 -2.153 -4.577 1.00 0.44 H new ATOM 0 HE1 MET A 17 -20.381 -5.166 -2.907 1.00 0.40 H new ATOM 0 HE2 MET A 17 -19.071 -3.962 -2.862 1.00 0.40 H new ATOM 0 HE3 MET A 17 -20.610 -3.632 -2.033 1.00 0.40 H new ATOM 358 N GLN A 18 -22.587 -0.501 -1.491 1.00 0.36 N ATOM 359 CA GLN A 18 -23.029 -0.342 -0.122 1.00 0.37 C ATOM 360 C GLN A 18 -22.544 -1.500 0.722 1.00 0.35 C ATOM 361 O GLN A 18 -22.560 -2.652 0.280 1.00 0.38 O ATOM 362 CB GLN A 18 -24.546 -0.220 -0.065 1.00 0.44 C ATOM 363 CG GLN A 18 -25.028 1.176 -0.388 1.00 0.49 C ATOM 364 CD GLN A 18 -26.472 1.204 -0.829 1.00 0.59 C ATOM 365 OE1 GLN A 18 -27.382 1.330 -0.016 1.00 0.92 O ATOM 366 NE2 GLN A 18 -26.691 1.090 -2.129 1.00 0.60 N ATOM 0 H GLN A 18 -23.037 -1.264 -1.997 1.00 0.36 H new ATOM 0 HA GLN A 18 -22.602 0.576 0.282 1.00 0.37 H new ATOM 0 HB2 GLN A 18 -24.990 -0.926 -0.767 1.00 0.44 H new ATOM 0 HB3 GLN A 18 -24.892 -0.499 0.930 1.00 0.44 H new ATOM 0 HG2 GLN A 18 -24.908 1.810 0.490 1.00 0.49 H new ATOM 0 HG3 GLN A 18 -24.403 1.599 -1.175 1.00 0.49 H new ATOM 0 HE21 GLN A 18 -25.905 0.987 -2.771 1.00 0.60 H new ATOM 0 HE22 GLN A 18 -27.645 1.105 -2.489 1.00 0.60 H new ATOM 375 N PHE A 19 -22.103 -1.191 1.928 1.00 0.34 N ATOM 376 CA PHE A 19 -21.554 -2.183 2.828 1.00 0.33 C ATOM 377 C PHE A 19 -22.189 -2.000 4.192 1.00 0.37 C ATOM 378 O PHE A 19 -22.637 -0.908 4.520 1.00 0.40 O ATOM 379 CB PHE A 19 -20.038 -2.016 2.963 1.00 0.29 C ATOM 380 CG PHE A 19 -19.264 -2.262 1.702 1.00 0.27 C ATOM 381 CD1 PHE A 19 -18.814 -3.531 1.382 1.00 0.33 C ATOM 382 CD2 PHE A 19 -19.000 -1.222 0.831 1.00 0.30 C ATOM 383 CE1 PHE A 19 -18.113 -3.758 0.214 1.00 0.36 C ATOM 384 CE2 PHE A 19 -18.300 -1.441 -0.340 1.00 0.31 C ATOM 385 CZ PHE A 19 -17.806 -2.722 -0.617 1.00 0.31 C ATOM 0 H PHE A 19 -22.116 -0.245 2.309 1.00 0.34 H new ATOM 0 HA PHE A 19 -21.762 -3.176 2.430 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.827 -1.005 3.311 1.00 0.29 H new ATOM 0 HB3 PHE A 19 -19.678 -2.699 3.733 1.00 0.29 H new ATOM 0 HD1 PHE A 19 -19.013 -4.353 2.053 1.00 0.33 H new ATOM 0 HD2 PHE A 19 -19.345 -0.226 1.068 1.00 0.30 H new ATOM 0 HE1 PHE A 19 -17.806 -4.761 -0.042 1.00 0.36 H new ATOM 0 HE2 PHE A 19 -18.135 -0.631 -1.036 1.00 0.31 H new ATOM 0 HZ PHE A 19 -17.185 -2.888 -1.485 1.00 0.31 H new ATOM 395 N GLU A 20 -22.227 -3.051 4.980 1.00 0.39 N ATOM 396 CA GLU A 20 -22.736 -2.952 6.340 1.00 0.43 C ATOM 397 C GLU A 20 -21.853 -2.011 7.166 1.00 0.44 C ATOM 398 O GLU A 20 -20.714 -1.734 6.789 1.00 0.47 O ATOM 399 CB GLU A 20 -22.772 -4.338 6.981 1.00 0.50 C ATOM 400 CG GLU A 20 -23.691 -5.311 6.264 1.00 0.61 C ATOM 401 CD GLU A 20 -23.475 -6.744 6.704 1.00 0.90 C ATOM 402 OE1 GLU A 20 -22.634 -7.441 6.099 1.00 1.06 O ATOM 403 OE2 GLU A 20 -24.153 -7.181 7.660 1.00 1.42 O ATOM 0 H GLU A 20 -21.914 -3.983 4.709 1.00 0.39 H new ATOM 0 HA GLU A 20 -23.748 -2.547 6.313 1.00 0.43 H new ATOM 0 HB2 GLU A 20 -21.762 -4.749 6.998 1.00 0.50 H new ATOM 0 HB3 GLU A 20 -23.094 -4.242 8.018 1.00 0.50 H new ATOM 0 HG2 GLU A 20 -24.728 -5.030 6.449 1.00 0.61 H new ATOM 0 HG3 GLU A 20 -23.527 -5.236 5.189 1.00 0.61 H new ATOM 410 N PRO A 21 -22.368 -1.484 8.289 1.00 0.50 N ATOM 411 CA PRO A 21 -21.574 -0.642 9.184 1.00 0.53 C ATOM 412 C PRO A 21 -20.278 -1.335 9.578 1.00 0.53 C ATOM 413 O PRO A 21 -19.200 -0.737 9.565 1.00 0.65 O ATOM 414 CB PRO A 21 -22.472 -0.446 10.406 1.00 0.57 C ATOM 415 CG PRO A 21 -23.861 -0.729 9.938 1.00 0.61 C ATOM 416 CD PRO A 21 -23.751 -1.651 8.755 1.00 0.62 C ATOM 0 HA PRO A 21 -21.284 0.300 8.718 1.00 0.53 H new ATOM 0 HB2 PRO A 21 -22.186 -1.120 11.214 1.00 0.57 H new ATOM 0 HB3 PRO A 21 -22.389 0.569 10.794 1.00 0.57 H new ATOM 0 HG2 PRO A 21 -24.448 -1.190 10.732 1.00 0.61 H new ATOM 0 HG3 PRO A 21 -24.369 0.194 9.660 1.00 0.61 H new ATOM 0 HD2 PRO A 21 -23.953 -2.684 9.036 1.00 0.62 H new ATOM 0 HD3 PRO A 21 -24.467 -1.386 7.977 1.00 0.62 H new ATOM 424 N SER A 22 -20.385 -2.608 9.910 1.00 0.50 N ATOM 425 CA SER A 22 -19.219 -3.396 10.225 1.00 0.61 C ATOM 426 C SER A 22 -18.478 -3.767 8.941 1.00 0.84 C ATOM 427 O SER A 22 -17.447 -3.162 8.622 1.00 1.64 O ATOM 428 CB SER A 22 -19.621 -4.653 10.996 1.00 0.68 C ATOM 429 OG SER A 22 -20.512 -4.334 12.053 1.00 1.32 O ATOM 0 H SER A 22 -21.269 -3.114 9.967 1.00 0.50 H new ATOM 0 HA SER A 22 -18.552 -2.807 10.855 1.00 0.61 H new ATOM 0 HB2 SER A 22 -20.093 -5.365 10.319 1.00 0.68 H new ATOM 0 HB3 SER A 22 -18.732 -5.138 11.398 1.00 0.68 H new ATOM 0 HG SER A 22 -20.758 -5.153 12.532 1.00 1.32 H new ATOM 435 N THR A 23 -19.068 -4.698 8.180 1.00 0.41 N ATOM 436 CA THR A 23 -18.445 -5.319 7.014 1.00 0.49 C ATOM 437 C THR A 23 -17.077 -5.913 7.327 1.00 0.63 C ATOM 438 O THR A 23 -16.920 -7.132 7.353 1.00 1.47 O ATOM 439 CB THR A 23 -18.319 -4.334 5.845 1.00 0.51 C ATOM 440 OG1 THR A 23 -19.613 -3.891 5.458 1.00 0.68 O ATOM 441 CG2 THR A 23 -17.650 -4.994 4.659 1.00 0.50 C ATOM 0 H THR A 23 -20.010 -5.044 8.365 1.00 0.41 H new ATOM 0 HA THR A 23 -19.110 -6.133 6.724 1.00 0.49 H new ATOM 0 HB THR A 23 -17.712 -3.489 6.169 1.00 0.51 H new ATOM 0 HG1 THR A 23 -19.876 -3.126 6.011 1.00 0.68 H new ATOM 0 HG21 THR A 23 -17.571 -4.278 3.841 1.00 0.50 H new ATOM 0 HG22 THR A 23 -16.653 -5.331 4.944 1.00 0.50 H new ATOM 0 HG23 THR A 23 -18.243 -5.849 4.336 1.00 0.50 H new ATOM 449 N MET A 24 -16.114 -5.031 7.580 1.00 0.54 N ATOM 450 CA MET A 24 -14.720 -5.388 7.772 1.00 0.48 C ATOM 451 C MET A 24 -14.071 -5.654 6.424 1.00 0.43 C ATOM 452 O MET A 24 -14.640 -6.331 5.571 1.00 0.47 O ATOM 453 CB MET A 24 -14.571 -6.580 8.717 1.00 0.60 C ATOM 454 CG MET A 24 -13.418 -6.440 9.682 1.00 0.57 C ATOM 455 SD MET A 24 -13.619 -7.474 11.138 1.00 0.83 S ATOM 456 CE MET A 24 -12.510 -6.638 12.260 1.00 0.71 C ATOM 0 H MET A 24 -16.289 -4.029 7.658 1.00 0.54 H new ATOM 0 HA MET A 24 -14.206 -4.551 8.245 1.00 0.48 H new ATOM 0 HB2 MET A 24 -15.495 -6.704 9.282 1.00 0.60 H new ATOM 0 HB3 MET A 24 -14.434 -7.487 8.128 1.00 0.60 H new ATOM 0 HG2 MET A 24 -12.489 -6.705 9.176 1.00 0.57 H new ATOM 0 HG3 MET A 24 -13.328 -5.398 9.989 1.00 0.57 H new ATOM 0 HE1 MET A 24 -12.691 -6.986 13.277 1.00 0.71 H new ATOM 0 HE2 MET A 24 -11.479 -6.854 11.981 1.00 0.71 H new ATOM 0 HE3 MET A 24 -12.682 -5.563 12.208 1.00 0.71 H new ATOM 466 N VAL A 25 -12.897 -5.069 6.245 1.00 0.40 N ATOM 467 CA VAL A 25 -12.182 -5.087 4.966 1.00 0.38 C ATOM 468 C VAL A 25 -12.232 -6.447 4.263 1.00 0.39 C ATOM 469 O VAL A 25 -12.492 -6.509 3.063 1.00 0.39 O ATOM 470 CB VAL A 25 -10.719 -4.649 5.148 1.00 0.41 C ATOM 471 CG1 VAL A 25 -9.916 -4.844 3.867 1.00 0.42 C ATOM 472 CG2 VAL A 25 -10.683 -3.197 5.577 1.00 0.40 C ATOM 0 H VAL A 25 -12.406 -4.564 6.983 1.00 0.40 H new ATOM 0 HA VAL A 25 -12.701 -4.375 4.325 1.00 0.38 H new ATOM 0 HB VAL A 25 -10.262 -5.271 5.918 1.00 0.41 H new ATOM 0 HG11 VAL A 25 -8.887 -4.525 4.031 1.00 0.42 H new ATOM 0 HG12 VAL A 25 -9.929 -5.897 3.586 1.00 0.42 H new ATOM 0 HG13 VAL A 25 -10.357 -4.250 3.067 1.00 0.42 H new ATOM 0 HG21 VAL A 25 -9.648 -2.882 5.707 1.00 0.40 H new ATOM 0 HG22 VAL A 25 -11.157 -2.580 4.813 1.00 0.40 H new ATOM 0 HG23 VAL A 25 -11.219 -3.083 6.519 1.00 0.40 H new ATOM 482 N TYR A 26 -12.015 -7.528 5.006 1.00 0.42 N ATOM 483 CA TYR A 26 -11.947 -8.852 4.394 1.00 0.45 C ATOM 484 C TYR A 26 -13.307 -9.307 3.839 1.00 0.43 C ATOM 485 O TYR A 26 -13.369 -10.046 2.854 1.00 0.42 O ATOM 486 CB TYR A 26 -11.350 -9.886 5.359 1.00 0.52 C ATOM 487 CG TYR A 26 -12.202 -10.251 6.553 1.00 0.56 C ATOM 488 CD1 TYR A 26 -12.247 -9.449 7.685 1.00 0.58 C ATOM 489 CD2 TYR A 26 -12.938 -11.426 6.553 1.00 0.70 C ATOM 490 CE1 TYR A 26 -13.007 -9.811 8.782 1.00 0.65 C ATOM 491 CE2 TYR A 26 -13.693 -11.794 7.645 1.00 0.78 C ATOM 492 CZ TYR A 26 -13.727 -10.986 8.756 1.00 0.72 C ATOM 493 OH TYR A 26 -14.473 -11.368 9.848 1.00 0.83 O ATOM 0 H TYR A 26 -11.885 -7.516 6.018 1.00 0.42 H new ATOM 0 HA TYR A 26 -11.273 -8.774 3.541 1.00 0.45 H new ATOM 0 HB2 TYR A 26 -11.138 -10.796 4.798 1.00 0.52 H new ATOM 0 HB3 TYR A 26 -10.395 -9.505 5.722 1.00 0.52 H new ATOM 0 HD1 TYR A 26 -11.681 -8.530 7.709 1.00 0.58 H new ATOM 0 HD2 TYR A 26 -12.919 -12.064 5.682 1.00 0.70 H new ATOM 0 HE1 TYR A 26 -13.036 -9.176 9.655 1.00 0.65 H new ATOM 0 HE2 TYR A 26 -14.257 -12.715 7.628 1.00 0.78 H new ATOM 0 HH TYR A 26 -14.917 -12.221 9.658 1.00 0.83 H new ATOM 503 N ASP A 27 -14.395 -8.858 4.453 1.00 0.43 N ATOM 504 CA ASP A 27 -15.730 -9.131 3.916 1.00 0.44 C ATOM 505 C ASP A 27 -16.018 -8.203 2.740 1.00 0.39 C ATOM 506 O ASP A 27 -16.675 -8.583 1.777 1.00 0.40 O ATOM 507 CB ASP A 27 -16.805 -8.979 4.999 1.00 0.50 C ATOM 508 CG ASP A 27 -18.226 -9.171 4.476 1.00 0.91 C ATOM 509 OD1 ASP A 27 -18.519 -10.253 3.912 1.00 1.24 O ATOM 510 OD2 ASP A 27 -19.047 -8.235 4.596 1.00 1.48 O ATOM 0 H ASP A 27 -14.385 -8.309 5.313 1.00 0.43 H new ATOM 0 HA ASP A 27 -15.755 -10.163 3.567 1.00 0.44 H new ATOM 0 HB2 ASP A 27 -16.617 -9.704 5.791 1.00 0.50 H new ATOM 0 HB3 ASP A 27 -16.722 -7.989 5.446 1.00 0.50 H new ATOM 515 N ALA A 28 -15.506 -6.984 2.813 1.00 0.37 N ATOM 516 CA ALA A 28 -15.710 -6.014 1.750 1.00 0.33 C ATOM 517 C ALA A 28 -15.028 -6.465 0.473 1.00 0.32 C ATOM 518 O ALA A 28 -15.642 -6.497 -0.595 1.00 0.31 O ATOM 519 CB ALA A 28 -15.188 -4.649 2.173 1.00 0.33 C ATOM 0 H ALA A 28 -14.947 -6.644 3.596 1.00 0.37 H new ATOM 0 HA ALA A 28 -16.780 -5.936 1.558 1.00 0.33 H new ATOM 0 HB1 ALA A 28 -15.347 -3.933 1.367 1.00 0.33 H new ATOM 0 HB2 ALA A 28 -15.720 -4.316 3.065 1.00 0.33 H new ATOM 0 HB3 ALA A 28 -14.122 -4.719 2.391 1.00 0.33 H new ATOM 525 N CYS A 29 -13.764 -6.834 0.600 1.00 0.35 N ATOM 526 CA CYS A 29 -12.957 -7.225 -0.542 1.00 0.37 C ATOM 527 C CYS A 29 -13.509 -8.468 -1.243 1.00 0.38 C ATOM 528 O CYS A 29 -13.285 -8.662 -2.438 1.00 0.40 O ATOM 529 CB CYS A 29 -11.504 -7.442 -0.117 1.00 0.45 C ATOM 530 SG CYS A 29 -11.259 -8.700 1.154 1.00 1.37 S ATOM 0 H CYS A 29 -13.272 -6.871 1.492 1.00 0.35 H new ATOM 0 HA CYS A 29 -12.997 -6.409 -1.264 1.00 0.37 H new ATOM 0 HB2 CYS A 29 -10.922 -7.717 -0.996 1.00 0.45 H new ATOM 0 HB3 CYS A 29 -11.103 -6.496 0.247 1.00 0.45 H new ATOM 0 HG CYS A 29 -12.413 -9.152 1.545 1.00 1.37 H new ATOM 536 N ARG A 30 -14.236 -9.307 -0.513 1.00 0.40 N ATOM 537 CA ARG A 30 -14.799 -10.508 -1.114 1.00 0.44 C ATOM 538 C ARG A 30 -16.012 -10.146 -1.972 1.00 0.42 C ATOM 539 O ARG A 30 -16.183 -10.667 -3.073 1.00 0.45 O ATOM 540 CB ARG A 30 -15.181 -11.550 -0.049 1.00 0.49 C ATOM 541 CG ARG A 30 -16.450 -11.225 0.725 1.00 0.53 C ATOM 542 CD ARG A 30 -16.783 -12.294 1.748 1.00 0.71 C ATOM 543 NE ARG A 30 -15.733 -12.467 2.751 1.00 1.12 N ATOM 544 CZ ARG A 30 -15.975 -12.769 4.023 1.00 1.68 C ATOM 545 NH1 ARG A 30 -17.218 -12.756 4.486 1.00 1.94 N ATOM 546 NH2 ARG A 30 -14.972 -13.037 4.843 1.00 2.41 N ATOM 0 H ARG A 30 -14.446 -9.181 0.477 1.00 0.40 H new ATOM 0 HA ARG A 30 -14.035 -10.956 -1.749 1.00 0.44 H new ATOM 0 HB2 ARG A 30 -15.304 -12.518 -0.534 1.00 0.49 H new ATOM 0 HB3 ARG A 30 -14.356 -11.650 0.656 1.00 0.49 H new ATOM 0 HG2 ARG A 30 -16.331 -10.266 1.229 1.00 0.53 H new ATOM 0 HG3 ARG A 30 -17.282 -11.118 0.029 1.00 0.53 H new ATOM 0 HD2 ARG A 30 -17.716 -12.034 2.247 1.00 0.71 H new ATOM 0 HD3 ARG A 30 -16.949 -13.242 1.235 1.00 0.71 H new ATOM 0 HE ARG A 30 -14.763 -12.350 2.459 1.00 1.12 H new ATOM 0 HH11 ARG A 30 -17.991 -12.514 3.866 1.00 1.94 H new ATOM 0 HH12 ARG A 30 -17.401 -12.988 5.462 1.00 1.94 H new ATOM 0 HH21 ARG A 30 -14.012 -13.012 4.500 1.00 2.41 H new ATOM 0 HH22 ARG A 30 -15.159 -13.269 5.819 1.00 2.41 H new ATOM 560 N MET A 31 -16.832 -9.224 -1.478 1.00 0.39 N ATOM 561 CA MET A 31 -18.061 -8.850 -2.162 1.00 0.40 C ATOM 562 C MET A 31 -17.790 -7.925 -3.334 1.00 0.38 C ATOM 563 O MET A 31 -18.378 -8.081 -4.398 1.00 0.44 O ATOM 564 CB MET A 31 -19.023 -8.173 -1.197 1.00 0.39 C ATOM 565 CG MET A 31 -19.332 -9.016 0.023 1.00 0.43 C ATOM 566 SD MET A 31 -20.433 -8.182 1.174 1.00 0.45 S ATOM 567 CE MET A 31 -19.370 -6.839 1.690 1.00 0.39 C ATOM 0 H MET A 31 -16.666 -8.723 -0.605 1.00 0.39 H new ATOM 0 HA MET A 31 -18.510 -9.767 -2.544 1.00 0.40 H new ATOM 0 HB2 MET A 31 -18.597 -7.222 -0.876 1.00 0.39 H new ATOM 0 HB3 MET A 31 -19.952 -7.946 -1.719 1.00 0.39 H new ATOM 0 HG2 MET A 31 -19.786 -9.955 -0.294 1.00 0.43 H new ATOM 0 HG3 MET A 31 -18.402 -9.267 0.532 1.00 0.43 H new ATOM 0 HE1 MET A 31 -19.956 -6.101 2.239 1.00 0.39 H new ATOM 0 HE2 MET A 31 -18.580 -7.227 2.333 1.00 0.39 H new ATOM 0 HE3 MET A 31 -18.925 -6.369 0.813 1.00 0.39 H new ATOM 577 N ILE A 32 -16.903 -6.963 -3.145 1.00 0.34 N ATOM 578 CA ILE A 32 -16.603 -6.010 -4.202 1.00 0.33 C ATOM 579 C ILE A 32 -16.004 -6.725 -5.414 1.00 0.36 C ATOM 580 O ILE A 32 -16.359 -6.439 -6.551 1.00 0.40 O ATOM 581 CB ILE A 32 -15.666 -4.886 -3.712 1.00 0.30 C ATOM 582 CG1 ILE A 32 -15.448 -3.864 -4.824 1.00 0.40 C ATOM 583 CG2 ILE A 32 -14.335 -5.448 -3.231 1.00 0.30 C ATOM 584 CD1 ILE A 32 -14.575 -2.709 -4.412 1.00 0.48 C ATOM 0 H ILE A 32 -16.382 -6.821 -2.279 1.00 0.34 H new ATOM 0 HA ILE A 32 -17.542 -5.543 -4.500 1.00 0.33 H new ATOM 0 HB ILE A 32 -16.141 -4.390 -2.865 1.00 0.30 H new ATOM 0 HG12 ILE A 32 -14.997 -4.362 -5.682 1.00 0.40 H new ATOM 0 HG13 ILE A 32 -16.415 -3.481 -5.150 1.00 0.40 H new ATOM 0 HG21 ILE A 32 -13.697 -4.632 -2.892 1.00 0.30 H new ATOM 0 HG22 ILE A 32 -14.509 -6.139 -2.406 1.00 0.30 H new ATOM 0 HG23 ILE A 32 -13.846 -5.976 -4.050 1.00 0.30 H new ATOM 0 HD11 ILE A 32 -14.462 -2.021 -5.250 1.00 0.48 H new ATOM 0 HD12 ILE A 32 -15.035 -2.186 -3.573 1.00 0.48 H new ATOM 0 HD13 ILE A 32 -13.595 -3.082 -4.114 1.00 0.48 H new ATOM 596 N ARG A 33 -15.125 -7.682 -5.149 1.00 0.36 N ATOM 597 CA ARG A 33 -14.560 -8.540 -6.187 1.00 0.41 C ATOM 598 C ARG A 33 -15.653 -9.372 -6.860 1.00 0.45 C ATOM 599 O ARG A 33 -15.551 -9.741 -8.033 1.00 0.49 O ATOM 600 CB ARG A 33 -13.482 -9.437 -5.562 1.00 0.45 C ATOM 601 CG ARG A 33 -13.296 -10.781 -6.245 1.00 1.01 C ATOM 602 CD ARG A 33 -12.125 -11.547 -5.651 1.00 0.94 C ATOM 603 NE ARG A 33 -12.173 -11.597 -4.187 1.00 0.64 N ATOM 604 CZ ARG A 33 -11.875 -12.683 -3.470 1.00 0.84 C ATOM 605 NH1 ARG A 33 -11.623 -13.835 -4.078 1.00 1.32 N ATOM 606 NH2 ARG A 33 -11.850 -12.617 -2.144 1.00 1.22 N ATOM 0 H ARG A 33 -14.783 -7.887 -4.210 1.00 0.36 H new ATOM 0 HA ARG A 33 -14.104 -7.923 -6.961 1.00 0.41 H new ATOM 0 HB2 ARG A 33 -12.532 -8.903 -5.577 1.00 0.45 H new ATOM 0 HB3 ARG A 33 -13.734 -9.609 -4.516 1.00 0.45 H new ATOM 0 HG2 ARG A 33 -14.207 -11.371 -6.145 1.00 1.01 H new ATOM 0 HG3 ARG A 33 -13.130 -10.629 -7.312 1.00 1.01 H new ATOM 0 HD2 ARG A 33 -12.121 -12.563 -6.046 1.00 0.94 H new ATOM 0 HD3 ARG A 33 -11.192 -11.079 -5.965 1.00 0.94 H new ATOM 0 HE ARG A 33 -12.450 -10.753 -3.687 1.00 0.64 H new ATOM 0 HH11 ARG A 33 -11.657 -13.893 -5.096 1.00 1.32 H new ATOM 0 HH12 ARG A 33 -11.396 -14.663 -3.528 1.00 1.32 H new ATOM 0 HH21 ARG A 33 -12.059 -11.737 -1.673 1.00 1.22 H new ATOM 0 HH22 ARG A 33 -11.622 -13.447 -1.596 1.00 1.22 H new ATOM 620 N GLU A 34 -16.699 -9.646 -6.106 1.00 0.46 N ATOM 621 CA GLU A 34 -17.781 -10.498 -6.575 1.00 0.51 C ATOM 622 C GLU A 34 -18.647 -9.780 -7.614 1.00 0.50 C ATOM 623 O GLU A 34 -18.739 -10.215 -8.764 1.00 0.54 O ATOM 624 CB GLU A 34 -18.640 -10.919 -5.386 1.00 0.55 C ATOM 625 CG GLU A 34 -19.899 -11.673 -5.760 1.00 0.90 C ATOM 626 CD GLU A 34 -20.866 -11.739 -4.605 1.00 1.51 C ATOM 627 OE1 GLU A 34 -21.636 -10.776 -4.419 1.00 2.40 O ATOM 628 OE2 GLU A 34 -20.849 -12.743 -3.866 1.00 1.50 O ATOM 0 H GLU A 34 -16.826 -9.289 -5.159 1.00 0.46 H new ATOM 0 HA GLU A 34 -17.347 -11.377 -7.052 1.00 0.51 H new ATOM 0 HB2 GLU A 34 -18.041 -11.543 -4.723 1.00 0.55 H new ATOM 0 HB3 GLU A 34 -18.918 -10.029 -4.821 1.00 0.55 H new ATOM 0 HG2 GLU A 34 -20.378 -11.186 -6.609 1.00 0.90 H new ATOM 0 HG3 GLU A 34 -19.639 -12.683 -6.077 1.00 0.90 H new ATOM 635 N ARG A 35 -19.269 -8.676 -7.214 1.00 0.51 N ATOM 636 CA ARG A 35 -20.169 -7.948 -8.111 1.00 0.55 C ATOM 637 C ARG A 35 -19.426 -6.997 -9.051 1.00 0.49 C ATOM 638 O ARG A 35 -19.923 -6.687 -10.134 1.00 0.54 O ATOM 639 CB ARG A 35 -21.267 -7.193 -7.340 1.00 0.72 C ATOM 640 CG ARG A 35 -20.840 -6.630 -5.995 1.00 0.77 C ATOM 641 CD ARG A 35 -21.229 -7.564 -4.858 1.00 0.79 C ATOM 642 NE ARG A 35 -22.194 -6.955 -3.949 1.00 1.02 N ATOM 643 CZ ARG A 35 -22.783 -7.596 -2.939 1.00 1.46 C ATOM 644 NH1 ARG A 35 -22.599 -8.902 -2.768 1.00 1.79 N ATOM 645 NH2 ARG A 35 -23.582 -6.930 -2.116 1.00 1.90 N ATOM 0 H ARG A 35 -19.170 -8.266 -6.285 1.00 0.51 H new ATOM 0 HA ARG A 35 -20.648 -8.709 -8.728 1.00 0.55 H new ATOM 0 HB2 ARG A 35 -21.627 -6.373 -7.962 1.00 0.72 H new ATOM 0 HB3 ARG A 35 -22.108 -7.868 -7.183 1.00 0.72 H new ATOM 0 HG2 ARG A 35 -19.761 -6.475 -5.989 1.00 0.77 H new ATOM 0 HG3 ARG A 35 -21.303 -5.655 -5.843 1.00 0.77 H new ATOM 0 HD2 ARG A 35 -21.650 -8.481 -5.271 1.00 0.79 H new ATOM 0 HD3 ARG A 35 -20.336 -7.847 -4.301 1.00 0.79 H new ATOM 0 HE ARG A 35 -22.434 -5.975 -4.096 1.00 1.02 H new ATOM 0 HH11 ARG A 35 -22.003 -9.422 -3.412 1.00 1.79 H new ATOM 0 HH12 ARG A 35 -23.054 -9.384 -1.992 1.00 1.79 H new ATOM 0 HH21 ARG A 35 -23.743 -5.933 -2.257 1.00 1.90 H new ATOM 0 HH22 ARG A 35 -24.035 -7.415 -1.342 1.00 1.90 H new ATOM 659 N ILE A 36 -18.261 -6.513 -8.640 1.00 0.45 N ATOM 660 CA ILE A 36 -17.480 -5.610 -9.482 1.00 0.43 C ATOM 661 C ILE A 36 -16.310 -6.340 -10.138 1.00 0.45 C ATOM 662 O ILE A 36 -15.307 -6.637 -9.489 1.00 0.44 O ATOM 663 CB ILE A 36 -16.954 -4.395 -8.689 1.00 0.43 C ATOM 664 CG1 ILE A 36 -18.115 -3.658 -8.016 1.00 0.43 C ATOM 665 CG2 ILE A 36 -16.187 -3.449 -9.605 1.00 0.44 C ATOM 666 CD1 ILE A 36 -17.681 -2.475 -7.182 1.00 0.44 C ATOM 0 H ILE A 36 -17.837 -6.727 -7.737 1.00 0.45 H new ATOM 0 HA ILE A 36 -18.153 -5.247 -10.259 1.00 0.43 H new ATOM 0 HB ILE A 36 -16.273 -4.755 -7.917 1.00 0.43 H new ATOM 0 HG12 ILE A 36 -18.810 -3.315 -8.783 1.00 0.43 H new ATOM 0 HG13 ILE A 36 -18.660 -4.358 -7.382 1.00 0.43 H new ATOM 0 HG21 ILE A 36 -15.824 -2.599 -9.028 1.00 0.44 H new ATOM 0 HG22 ILE A 36 -15.341 -3.976 -10.046 1.00 0.44 H new ATOM 0 HG23 ILE A 36 -16.847 -3.095 -10.397 1.00 0.44 H new ATOM 0 HD11 ILE A 36 -18.557 -2.003 -6.737 1.00 0.44 H new ATOM 0 HD12 ILE A 36 -17.010 -2.813 -6.392 1.00 0.44 H new ATOM 0 HD13 ILE A 36 -17.163 -1.754 -7.815 1.00 0.44 H new ATOM 678 N PRO A 37 -16.424 -6.643 -11.437 1.00 0.53 N ATOM 679 CA PRO A 37 -15.376 -7.335 -12.192 1.00 0.60 C ATOM 680 C PRO A 37 -14.146 -6.457 -12.432 1.00 0.61 C ATOM 681 O PRO A 37 -13.060 -6.956 -12.725 1.00 0.71 O ATOM 682 CB PRO A 37 -16.050 -7.682 -13.526 1.00 0.73 C ATOM 683 CG PRO A 37 -17.507 -7.429 -13.319 1.00 0.76 C ATOM 684 CD PRO A 37 -17.594 -6.361 -12.275 1.00 0.60 C ATOM 0 HA PRO A 37 -15.004 -8.205 -11.650 1.00 0.60 H new ATOM 0 HB2 PRO A 37 -15.657 -7.067 -14.335 1.00 0.73 H new ATOM 0 HB3 PRO A 37 -15.868 -8.722 -13.798 1.00 0.73 H new ATOM 0 HG2 PRO A 37 -17.983 -7.109 -14.246 1.00 0.76 H new ATOM 0 HG3 PRO A 37 -18.018 -8.335 -12.994 1.00 0.76 H new ATOM 0 HD2 PRO A 37 -17.550 -5.363 -12.711 1.00 0.60 H new ATOM 0 HD3 PRO A 37 -18.523 -6.421 -11.709 1.00 0.60 H new ATOM 692 N GLU A 38 -14.318 -5.148 -12.309 1.00 0.57 N ATOM 693 CA GLU A 38 -13.218 -4.207 -12.499 1.00 0.61 C ATOM 694 C GLU A 38 -12.302 -4.181 -11.278 1.00 0.54 C ATOM 695 O GLU A 38 -11.250 -3.542 -11.294 1.00 0.62 O ATOM 696 CB GLU A 38 -13.744 -2.790 -12.768 1.00 0.75 C ATOM 697 CG GLU A 38 -14.468 -2.621 -14.098 1.00 0.99 C ATOM 698 CD GLU A 38 -15.797 -3.348 -14.158 1.00 1.67 C ATOM 699 OE1 GLU A 38 -16.472 -3.452 -13.113 1.00 2.46 O ATOM 700 OE2 GLU A 38 -16.183 -3.795 -15.258 1.00 2.04 O ATOM 0 H GLU A 38 -15.210 -4.711 -12.078 1.00 0.57 H new ATOM 0 HA GLU A 38 -12.649 -4.546 -13.365 1.00 0.61 H new ATOM 0 HB2 GLU A 38 -14.423 -2.510 -11.962 1.00 0.75 H new ATOM 0 HB3 GLU A 38 -12.906 -2.094 -12.735 1.00 0.75 H new ATOM 0 HG2 GLU A 38 -14.635 -1.559 -14.280 1.00 0.99 H new ATOM 0 HG3 GLU A 38 -13.827 -2.985 -14.901 1.00 0.99 H new ATOM 707 N ALA A 39 -12.704 -4.873 -10.222 1.00 0.47 N ATOM 708 CA ALA A 39 -11.949 -4.872 -8.980 1.00 0.47 C ATOM 709 C ALA A 39 -10.724 -5.776 -9.063 1.00 0.49 C ATOM 710 O ALA A 39 -9.671 -5.462 -8.511 1.00 0.55 O ATOM 711 CB ALA A 39 -12.839 -5.294 -7.821 1.00 0.47 C ATOM 0 H ALA A 39 -13.550 -5.443 -10.202 1.00 0.47 H new ATOM 0 HA ALA A 39 -11.597 -3.855 -8.808 1.00 0.47 H new ATOM 0 HB1 ALA A 39 -12.260 -5.289 -6.897 1.00 0.47 H new ATOM 0 HB2 ALA A 39 -13.673 -4.598 -7.731 1.00 0.47 H new ATOM 0 HB3 ALA A 39 -13.222 -6.298 -8.003 1.00 0.47 H new ATOM 717 N LEU A 40 -10.848 -6.888 -9.768 1.00 0.50 N ATOM 718 CA LEU A 40 -9.770 -7.863 -9.813 1.00 0.59 C ATOM 719 C LEU A 40 -9.004 -7.812 -11.132 1.00 0.67 C ATOM 720 O LEU A 40 -9.109 -8.697 -11.976 1.00 0.99 O ATOM 721 CB LEU A 40 -10.252 -9.299 -9.478 1.00 0.65 C ATOM 722 CG LEU A 40 -11.643 -9.744 -9.978 1.00 0.62 C ATOM 723 CD1 LEU A 40 -12.748 -9.047 -9.210 1.00 1.29 C ATOM 724 CD2 LEU A 40 -11.807 -9.508 -11.467 1.00 1.19 C ATOM 0 H LEU A 40 -11.674 -7.137 -10.312 1.00 0.50 H new ATOM 0 HA LEU A 40 -9.070 -7.581 -9.027 1.00 0.59 H new ATOM 0 HB2 LEU A 40 -9.517 -9.997 -9.878 1.00 0.65 H new ATOM 0 HB3 LEU A 40 -10.239 -9.409 -8.394 1.00 0.65 H new ATOM 0 HG LEU A 40 -11.719 -10.816 -9.799 1.00 0.62 H new ATOM 0 HD11 LEU A 40 -13.716 -9.380 -9.584 1.00 1.29 H new ATOM 0 HD12 LEU A 40 -12.664 -9.290 -8.151 1.00 1.29 H new ATOM 0 HD13 LEU A 40 -12.659 -7.969 -9.343 1.00 1.29 H new ATOM 0 HD21 LEU A 40 -12.799 -9.834 -11.780 1.00 1.19 H new ATOM 0 HD22 LEU A 40 -11.690 -8.446 -11.682 1.00 1.19 H new ATOM 0 HD23 LEU A 40 -11.051 -10.074 -12.011 1.00 1.19 H new ATOM 736 N ALA A 41 -8.219 -6.756 -11.298 1.00 0.65 N ATOM 737 CA ALA A 41 -7.364 -6.615 -12.467 1.00 0.74 C ATOM 738 C ALA A 41 -6.155 -7.544 -12.356 1.00 0.81 C ATOM 739 O ALA A 41 -5.313 -7.618 -13.254 1.00 1.15 O ATOM 740 CB ALA A 41 -6.925 -5.167 -12.622 1.00 0.92 C ATOM 0 H ALA A 41 -8.157 -5.983 -10.635 1.00 0.65 H new ATOM 0 HA ALA A 41 -7.928 -6.899 -13.355 1.00 0.74 H new ATOM 0 HB1 ALA A 41 -6.286 -5.073 -13.500 1.00 0.92 H new ATOM 0 HB2 ALA A 41 -7.802 -4.532 -12.742 1.00 0.92 H new ATOM 0 HB3 ALA A 41 -6.372 -4.858 -11.735 1.00 0.92 H new ATOM 746 N GLY A 42 -6.086 -8.245 -11.236 1.00 0.75 N ATOM 747 CA GLY A 42 -5.037 -9.206 -10.992 1.00 0.86 C ATOM 748 C GLY A 42 -5.467 -10.193 -9.929 1.00 0.80 C ATOM 749 O GLY A 42 -6.619 -10.628 -9.927 1.00 0.82 O ATOM 0 H GLY A 42 -6.758 -8.160 -10.474 1.00 0.75 H new ATOM 0 HA2 GLY A 42 -4.798 -9.735 -11.914 1.00 0.86 H new ATOM 0 HA3 GLY A 42 -4.130 -8.692 -10.675 1.00 0.86 H new ATOM 753 N PRO A 43 -4.581 -10.559 -9.000 1.00 0.83 N ATOM 754 CA PRO A 43 -4.934 -11.428 -7.889 1.00 0.82 C ATOM 755 C PRO A 43 -5.598 -10.645 -6.760 1.00 0.72 C ATOM 756 O PRO A 43 -5.076 -9.624 -6.313 1.00 0.66 O ATOM 757 CB PRO A 43 -3.592 -12.009 -7.426 1.00 0.94 C ATOM 758 CG PRO A 43 -2.535 -11.353 -8.266 1.00 1.09 C ATOM 759 CD PRO A 43 -3.173 -10.172 -8.946 1.00 0.98 C ATOM 0 HA PRO A 43 -5.650 -12.196 -8.180 1.00 0.82 H new ATOM 0 HB2 PRO A 43 -3.427 -11.809 -6.367 1.00 0.94 H new ATOM 0 HB3 PRO A 43 -3.573 -13.091 -7.553 1.00 0.94 H new ATOM 0 HG2 PRO A 43 -1.696 -11.033 -7.648 1.00 1.09 H new ATOM 0 HG3 PRO A 43 -2.140 -12.053 -9.002 1.00 1.09 H new ATOM 0 HD2 PRO A 43 -3.027 -9.251 -8.381 1.00 0.98 H new ATOM 0 HD3 PRO A 43 -2.760 -10.005 -9.941 1.00 0.98 H new ATOM 767 N PRO A 44 -6.760 -11.120 -6.289 1.00 0.76 N ATOM 768 CA PRO A 44 -7.540 -10.458 -5.232 1.00 0.73 C ATOM 769 C PRO A 44 -6.728 -10.182 -3.969 1.00 0.69 C ATOM 770 O PRO A 44 -6.981 -9.207 -3.263 1.00 0.74 O ATOM 771 CB PRO A 44 -8.663 -11.460 -4.929 1.00 0.93 C ATOM 772 CG PRO A 44 -8.220 -12.742 -5.548 1.00 0.99 C ATOM 773 CD PRO A 44 -7.418 -12.349 -6.748 1.00 0.89 C ATOM 0 HA PRO A 44 -7.891 -9.479 -5.557 1.00 0.73 H new ATOM 0 HB2 PRO A 44 -8.812 -11.572 -3.855 1.00 0.93 H new ATOM 0 HB3 PRO A 44 -9.612 -11.127 -5.349 1.00 0.93 H new ATOM 0 HG2 PRO A 44 -7.622 -13.329 -4.851 1.00 0.99 H new ATOM 0 HG3 PRO A 44 -9.074 -13.357 -5.831 1.00 0.99 H new ATOM 0 HD2 PRO A 44 -6.697 -13.118 -7.026 1.00 0.89 H new ATOM 0 HD3 PRO A 44 -8.048 -12.173 -7.620 1.00 0.89 H new ATOM 781 N ASN A 45 -5.750 -11.039 -3.695 1.00 0.72 N ATOM 782 CA ASN A 45 -4.930 -10.912 -2.492 1.00 0.77 C ATOM 783 C ASN A 45 -4.047 -9.666 -2.557 1.00 0.71 C ATOM 784 O ASN A 45 -3.596 -9.155 -1.527 1.00 0.85 O ATOM 785 CB ASN A 45 -4.063 -12.164 -2.303 1.00 0.87 C ATOM 786 CG ASN A 45 -2.850 -12.198 -3.210 1.00 1.41 C ATOM 787 OD1 ASN A 45 -3.010 -12.782 -4.384 1.00 2.21 O flip ATOM 788 ND2 ASN A 45 -1.774 -11.722 -2.850 1.00 1.37 N flip ATOM 0 H ASN A 45 -5.504 -11.831 -4.290 1.00 0.72 H new ATOM 0 HA ASN A 45 -5.599 -10.811 -1.638 1.00 0.77 H new ATOM 0 HB2 ASN A 45 -3.733 -12.215 -1.265 1.00 0.87 H new ATOM 0 HB3 ASN A 45 -4.671 -13.049 -2.488 1.00 0.87 H new ATOM 0 HD21 ASN A 45 -1.693 -11.279 -1.935 1.00 1.37 H new ATOM 0 HD22 ASN A 45 -0.963 -11.770 -3.467 1.00 1.37 H new ATOM 795 N ASP A 46 -3.821 -9.170 -3.767 1.00 0.61 N ATOM 796 CA ASP A 46 -2.975 -8.003 -3.971 1.00 0.68 C ATOM 797 C ASP A 46 -3.793 -6.720 -3.957 1.00 0.57 C ATOM 798 O ASP A 46 -3.249 -5.633 -4.132 1.00 0.61 O ATOM 799 CB ASP A 46 -2.220 -8.103 -5.299 1.00 0.83 C ATOM 800 CG ASP A 46 -1.152 -9.179 -5.302 1.00 1.22 C ATOM 801 OD1 ASP A 46 -1.482 -10.345 -5.595 1.00 1.38 O ATOM 802 OD2 ASP A 46 0.013 -8.874 -4.992 1.00 1.90 O ATOM 0 H ASP A 46 -4.214 -9.560 -4.624 1.00 0.61 H new ATOM 0 HA ASP A 46 -2.259 -7.976 -3.149 1.00 0.68 H new ATOM 0 HB2 ASP A 46 -2.932 -8.305 -6.099 1.00 0.83 H new ATOM 0 HB3 ASP A 46 -1.757 -7.141 -5.519 1.00 0.83 H new ATOM 807 N PHE A 47 -5.096 -6.842 -3.753 1.00 0.53 N ATOM 808 CA PHE A 47 -5.977 -5.681 -3.751 1.00 0.47 C ATOM 809 C PHE A 47 -6.574 -5.447 -2.370 1.00 0.44 C ATOM 810 O PHE A 47 -7.092 -6.370 -1.740 1.00 0.48 O ATOM 811 CB PHE A 47 -7.096 -5.850 -4.777 1.00 0.49 C ATOM 812 CG PHE A 47 -6.629 -5.788 -6.203 1.00 0.51 C ATOM 813 CD1 PHE A 47 -6.323 -4.572 -6.791 1.00 0.78 C ATOM 814 CD2 PHE A 47 -6.500 -6.942 -6.955 1.00 0.79 C ATOM 815 CE1 PHE A 47 -5.898 -4.508 -8.104 1.00 0.80 C ATOM 816 CE2 PHE A 47 -6.074 -6.884 -8.268 1.00 0.85 C ATOM 817 CZ PHE A 47 -5.773 -5.667 -8.842 1.00 0.63 C ATOM 0 H PHE A 47 -5.567 -7.731 -3.587 1.00 0.53 H new ATOM 0 HA PHE A 47 -5.377 -4.812 -4.021 1.00 0.47 H new ATOM 0 HB2 PHE A 47 -7.589 -6.807 -4.608 1.00 0.49 H new ATOM 0 HB3 PHE A 47 -7.844 -5.073 -4.616 1.00 0.49 H new ATOM 0 HD1 PHE A 47 -6.418 -3.663 -6.216 1.00 0.78 H new ATOM 0 HD2 PHE A 47 -6.735 -7.898 -6.511 1.00 0.79 H new ATOM 0 HE1 PHE A 47 -5.664 -3.553 -8.552 1.00 0.80 H new ATOM 0 HE2 PHE A 47 -5.977 -7.792 -8.845 1.00 0.85 H new ATOM 0 HZ PHE A 47 -5.440 -5.621 -9.868 1.00 0.63 H new ATOM 827 N GLY A 48 -6.480 -4.214 -1.897 1.00 0.42 N ATOM 828 CA GLY A 48 -7.033 -3.875 -0.602 1.00 0.41 C ATOM 829 C GLY A 48 -7.784 -2.562 -0.613 1.00 0.35 C ATOM 830 O GLY A 48 -7.914 -1.919 -1.657 1.00 0.34 O ATOM 0 H GLY A 48 -6.030 -3.441 -2.387 1.00 0.42 H new ATOM 0 HA2 GLY A 48 -7.705 -4.670 -0.279 1.00 0.41 H new ATOM 0 HA3 GLY A 48 -6.227 -3.822 0.130 1.00 0.41 H new ATOM 834 N LEU A 49 -8.264 -2.157 0.552 1.00 0.31 N ATOM 835 CA LEU A 49 -9.088 -0.963 0.665 1.00 0.28 C ATOM 836 C LEU A 49 -8.274 0.230 1.155 1.00 0.29 C ATOM 837 O LEU A 49 -7.806 0.258 2.292 1.00 0.31 O ATOM 838 CB LEU A 49 -10.258 -1.214 1.617 1.00 0.26 C ATOM 839 CG LEU A 49 -11.161 -2.393 1.250 1.00 0.26 C ATOM 840 CD1 LEU A 49 -12.292 -2.526 2.256 1.00 0.27 C ATOM 841 CD2 LEU A 49 -11.713 -2.229 -0.157 1.00 0.25 C ATOM 0 H LEU A 49 -8.097 -2.639 1.435 1.00 0.31 H new ATOM 0 HA LEU A 49 -9.472 -0.731 -0.328 1.00 0.28 H new ATOM 0 HB2 LEU A 49 -9.860 -1.381 2.618 1.00 0.26 H new ATOM 0 HB3 LEU A 49 -10.868 -0.312 1.662 1.00 0.26 H new ATOM 0 HG LEU A 49 -10.565 -3.305 1.277 1.00 0.26 H new ATOM 0 HD11 LEU A 49 -12.926 -3.369 1.981 1.00 0.27 H new ATOM 0 HD12 LEU A 49 -11.877 -2.693 3.250 1.00 0.27 H new ATOM 0 HD13 LEU A 49 -12.886 -1.612 2.259 1.00 0.27 H new ATOM 0 HD21 LEU A 49 -12.353 -3.078 -0.398 1.00 0.25 H new ATOM 0 HD22 LEU A 49 -12.294 -1.309 -0.215 1.00 0.25 H new ATOM 0 HD23 LEU A 49 -10.888 -2.182 -0.868 1.00 0.25 H new ATOM 853 N PHE A 50 -8.087 1.194 0.277 1.00 0.29 N ATOM 854 CA PHE A 50 -7.441 2.444 0.640 1.00 0.30 C ATOM 855 C PHE A 50 -8.489 3.537 0.799 1.00 0.30 C ATOM 856 O PHE A 50 -9.295 3.773 -0.100 1.00 0.31 O ATOM 857 CB PHE A 50 -6.403 2.845 -0.415 1.00 0.34 C ATOM 858 CG PHE A 50 -5.668 4.123 -0.101 1.00 0.34 C ATOM 859 CD1 PHE A 50 -4.555 4.122 0.730 1.00 0.37 C ATOM 860 CD2 PHE A 50 -6.089 5.329 -0.644 1.00 0.36 C ATOM 861 CE1 PHE A 50 -3.883 5.295 1.011 1.00 0.38 C ATOM 862 CE2 PHE A 50 -5.420 6.504 -0.363 1.00 0.38 C ATOM 863 CZ PHE A 50 -4.316 6.487 0.465 1.00 0.37 C ATOM 0 H PHE A 50 -8.374 1.137 -0.700 1.00 0.29 H new ATOM 0 HA PHE A 50 -6.922 2.308 1.589 1.00 0.30 H new ATOM 0 HB2 PHE A 50 -5.678 2.038 -0.521 1.00 0.34 H new ATOM 0 HB3 PHE A 50 -6.902 2.953 -1.378 1.00 0.34 H new ATOM 0 HD1 PHE A 50 -4.211 3.193 1.161 1.00 0.37 H new ATOM 0 HD2 PHE A 50 -6.951 5.349 -1.295 1.00 0.36 H new ATOM 0 HE1 PHE A 50 -3.018 5.280 1.658 1.00 0.38 H new ATOM 0 HE2 PHE A 50 -5.760 7.435 -0.791 1.00 0.38 H new ATOM 0 HZ PHE A 50 -3.791 7.405 0.686 1.00 0.37 H new ATOM 873 N LEU A 51 -8.484 4.201 1.938 1.00 0.30 N ATOM 874 CA LEU A 51 -9.433 5.270 2.171 1.00 0.32 C ATOM 875 C LEU A 51 -8.788 6.579 1.759 1.00 0.36 C ATOM 876 O LEU A 51 -7.853 7.059 2.405 1.00 0.38 O ATOM 877 CB LEU A 51 -9.865 5.305 3.645 1.00 0.33 C ATOM 878 CG LEU A 51 -11.260 5.890 3.928 1.00 0.35 C ATOM 879 CD1 LEU A 51 -11.312 7.385 3.648 1.00 0.46 C ATOM 880 CD2 LEU A 51 -12.318 5.166 3.110 1.00 0.41 C ATOM 0 H LEU A 51 -7.841 4.022 2.709 1.00 0.30 H new ATOM 0 HA LEU A 51 -10.332 5.104 1.578 1.00 0.32 H new ATOM 0 HB2 LEU A 51 -9.834 4.288 4.036 1.00 0.33 H new ATOM 0 HB3 LEU A 51 -9.130 5.884 4.204 1.00 0.33 H new ATOM 0 HG LEU A 51 -11.467 5.742 4.988 1.00 0.35 H new ATOM 0 HD11 LEU A 51 -12.313 7.760 3.860 1.00 0.46 H new ATOM 0 HD12 LEU A 51 -10.590 7.899 4.282 1.00 0.46 H new ATOM 0 HD13 LEU A 51 -11.070 7.568 2.601 1.00 0.46 H new ATOM 0 HD21 LEU A 51 -13.298 5.593 3.323 1.00 0.41 H new ATOM 0 HD22 LEU A 51 -12.097 5.277 2.049 1.00 0.41 H new ATOM 0 HD23 LEU A 51 -12.319 4.108 3.371 1.00 0.41 H new ATOM 892 N SER A 52 -9.278 7.137 0.668 1.00 0.42 N ATOM 893 CA SER A 52 -8.696 8.337 0.107 1.00 0.53 C ATOM 894 C SER A 52 -9.364 9.570 0.680 1.00 0.61 C ATOM 895 O SER A 52 -10.558 9.801 0.480 1.00 0.93 O ATOM 896 CB SER A 52 -8.815 8.319 -1.417 1.00 0.67 C ATOM 897 OG SER A 52 -8.240 9.477 -2.000 1.00 1.28 O ATOM 0 H SER A 52 -10.081 6.775 0.153 1.00 0.42 H new ATOM 0 HA SER A 52 -7.639 8.368 0.372 1.00 0.53 H new ATOM 0 HB2 SER A 52 -8.322 7.430 -1.810 1.00 0.67 H new ATOM 0 HB3 SER A 52 -9.866 8.252 -1.700 1.00 0.67 H new ATOM 0 HG SER A 52 -8.332 9.432 -2.975 1.00 1.28 H new ATOM 903 N ASP A 53 -8.582 10.348 1.395 1.00 0.74 N ATOM 904 CA ASP A 53 -9.063 11.582 1.987 1.00 0.90 C ATOM 905 C ASP A 53 -8.728 12.750 1.075 1.00 1.04 C ATOM 906 O ASP A 53 -9.615 13.378 0.492 1.00 1.28 O ATOM 907 CB ASP A 53 -8.424 11.793 3.362 1.00 0.89 C ATOM 908 CG ASP A 53 -8.788 13.131 3.972 1.00 1.18 C ATOM 909 OD1 ASP A 53 -9.856 13.225 4.608 1.00 1.42 O ATOM 910 OD2 ASP A 53 -8.009 14.094 3.811 1.00 1.24 O ATOM 0 H ASP A 53 -7.600 10.147 1.583 1.00 0.74 H new ATOM 0 HA ASP A 53 -10.144 11.520 2.110 1.00 0.90 H new ATOM 0 HB2 ASP A 53 -8.740 10.994 4.032 1.00 0.89 H new ATOM 0 HB3 ASP A 53 -7.340 11.722 3.270 1.00 0.89 H new ATOM 915 N ASP A 54 -7.430 12.986 0.931 1.00 0.93 N ATOM 916 CA ASP A 54 -6.889 14.088 0.141 1.00 1.10 C ATOM 917 C ASP A 54 -5.403 14.202 0.419 1.00 1.02 C ATOM 918 O ASP A 54 -4.570 14.112 -0.485 1.00 1.22 O ATOM 919 CB ASP A 54 -7.565 15.421 0.484 1.00 1.26 C ATOM 920 CG ASP A 54 -6.940 16.586 -0.254 1.00 1.47 C ATOM 921 OD1 ASP A 54 -7.270 16.792 -1.439 1.00 1.73 O ATOM 922 OD2 ASP A 54 -6.110 17.302 0.348 1.00 1.45 O ATOM 0 H ASP A 54 -6.711 12.408 1.366 1.00 0.93 H new ATOM 0 HA ASP A 54 -7.076 13.877 -0.912 1.00 1.10 H new ATOM 0 HB2 ASP A 54 -8.625 15.363 0.237 1.00 1.26 H new ATOM 0 HB3 ASP A 54 -7.497 15.595 1.558 1.00 1.26 H new ATOM 927 N ASP A 55 -5.092 14.365 1.693 1.00 0.87 N ATOM 928 CA ASP A 55 -3.721 14.503 2.151 1.00 0.94 C ATOM 929 C ASP A 55 -3.076 13.128 2.325 1.00 0.87 C ATOM 930 O ASP A 55 -3.725 12.190 2.794 1.00 0.71 O ATOM 931 CB ASP A 55 -3.711 15.281 3.468 1.00 0.99 C ATOM 932 CG ASP A 55 -2.349 15.332 4.119 1.00 1.39 C ATOM 933 OD1 ASP A 55 -1.539 16.205 3.750 1.00 1.58 O ATOM 934 OD2 ASP A 55 -2.091 14.504 5.008 1.00 1.79 O ATOM 0 H ASP A 55 -5.785 14.405 2.441 1.00 0.87 H new ATOM 0 HA ASP A 55 -3.140 15.050 1.408 1.00 0.94 H new ATOM 0 HB2 ASP A 55 -4.057 16.298 3.284 1.00 0.99 H new ATOM 0 HB3 ASP A 55 -4.420 14.823 4.158 1.00 0.99 H new ATOM 939 N PRO A 56 -1.800 12.988 1.924 1.00 1.06 N ATOM 940 CA PRO A 56 -1.054 11.723 2.024 1.00 1.08 C ATOM 941 C PRO A 56 -0.979 11.171 3.450 1.00 0.98 C ATOM 942 O PRO A 56 -0.927 9.957 3.649 1.00 0.97 O ATOM 943 CB PRO A 56 0.352 12.087 1.523 1.00 1.35 C ATOM 944 CG PRO A 56 0.413 13.575 1.573 1.00 1.48 C ATOM 945 CD PRO A 56 -0.984 14.047 1.313 1.00 1.33 C ATOM 0 HA PRO A 56 -1.543 10.936 1.449 1.00 1.08 H new ATOM 0 HB2 PRO A 56 1.122 11.640 2.152 1.00 1.35 H new ATOM 0 HB3 PRO A 56 0.516 11.720 0.510 1.00 1.35 H new ATOM 0 HG2 PRO A 56 0.768 13.920 2.544 1.00 1.48 H new ATOM 0 HG3 PRO A 56 1.103 13.964 0.824 1.00 1.48 H new ATOM 0 HD2 PRO A 56 -1.175 15.019 1.768 1.00 1.33 H new ATOM 0 HD3 PRO A 56 -1.185 14.149 0.247 1.00 1.33 H new ATOM 953 N LYS A 57 -0.980 12.057 4.440 1.00 0.99 N ATOM 954 CA LYS A 57 -0.885 11.635 5.831 1.00 1.02 C ATOM 955 C LYS A 57 -2.250 11.198 6.343 1.00 0.82 C ATOM 956 O LYS A 57 -2.363 10.215 7.076 1.00 0.87 O ATOM 957 CB LYS A 57 -0.342 12.762 6.715 1.00 1.25 C ATOM 958 CG LYS A 57 0.981 13.332 6.264 1.00 1.51 C ATOM 959 CD LYS A 57 2.060 12.277 6.289 1.00 1.62 C ATOM 960 CE LYS A 57 3.429 12.909 6.299 1.00 2.08 C ATOM 961 NZ LYS A 57 3.790 13.416 7.648 1.00 2.93 N ATOM 0 H LYS A 57 -1.045 13.066 4.306 1.00 0.99 H new ATOM 0 HA LYS A 57 -0.193 10.794 5.878 1.00 1.02 H new ATOM 0 HB2 LYS A 57 -1.077 13.566 6.748 1.00 1.25 H new ATOM 0 HB3 LYS A 57 -0.233 12.387 7.733 1.00 1.25 H new ATOM 0 HG2 LYS A 57 0.883 13.734 5.255 1.00 1.51 H new ATOM 0 HG3 LYS A 57 1.263 14.162 6.912 1.00 1.51 H new ATOM 0 HD2 LYS A 57 1.939 11.648 7.171 1.00 1.62 H new ATOM 0 HD3 LYS A 57 1.961 11.628 5.419 1.00 1.62 H new ATOM 0 HE2 LYS A 57 4.170 12.178 5.975 1.00 2.08 H new ATOM 0 HE3 LYS A 57 3.456 13.730 5.582 1.00 2.08 H new ATOM 0 HZ1 LYS A 57 4.823 13.512 7.718 1.00 2.93 H new ATOM 0 HZ2 LYS A 57 3.345 14.343 7.801 1.00 2.93 H new ATOM 0 HZ3 LYS A 57 3.455 12.748 8.371 1.00 2.93 H new ATOM 975 N LYS A 58 -3.286 11.932 5.949 1.00 0.69 N ATOM 976 CA LYS A 58 -4.649 11.618 6.358 1.00 0.65 C ATOM 977 C LYS A 58 -5.152 10.358 5.664 1.00 0.56 C ATOM 978 O LYS A 58 -6.022 9.658 6.187 1.00 0.63 O ATOM 979 CB LYS A 58 -5.574 12.794 6.055 1.00 0.73 C ATOM 980 CG LYS A 58 -5.220 14.048 6.835 1.00 0.94 C ATOM 981 CD LYS A 58 -6.070 15.231 6.411 1.00 1.24 C ATOM 982 CE LYS A 58 -7.544 15.019 6.729 1.00 1.55 C ATOM 983 NZ LYS A 58 -7.786 14.829 8.184 1.00 2.16 N ATOM 0 H LYS A 58 -3.206 12.750 5.345 1.00 0.69 H new ATOM 0 HA LYS A 58 -4.648 11.435 7.433 1.00 0.65 H new ATOM 0 HB2 LYS A 58 -5.534 13.014 4.988 1.00 0.73 H new ATOM 0 HB3 LYS A 58 -6.601 12.509 6.284 1.00 0.73 H new ATOM 0 HG2 LYS A 58 -5.357 13.865 7.901 1.00 0.94 H new ATOM 0 HG3 LYS A 58 -4.167 14.284 6.685 1.00 0.94 H new ATOM 0 HD2 LYS A 58 -5.716 16.130 6.915 1.00 1.24 H new ATOM 0 HD3 LYS A 58 -5.951 15.398 5.340 1.00 1.24 H new ATOM 0 HE2 LYS A 58 -8.116 15.877 6.377 1.00 1.55 H new ATOM 0 HE3 LYS A 58 -7.909 14.148 6.185 1.00 1.55 H new ATOM 0 HZ1 LYS A 58 -8.804 14.909 8.380 1.00 2.16 H new ATOM 0 HZ2 LYS A 58 -7.451 13.888 8.472 1.00 2.16 H new ATOM 0 HZ3 LYS A 58 -7.272 15.558 8.719 1.00 2.16 H new ATOM 997 N GLY A 59 -4.604 10.076 4.490 1.00 0.54 N ATOM 998 CA GLY A 59 -4.950 8.860 3.785 1.00 0.59 C ATOM 999 C GLY A 59 -4.385 7.640 4.479 1.00 0.54 C ATOM 1000 O GLY A 59 -3.243 7.658 4.946 1.00 0.58 O ATOM 0 H GLY A 59 -3.925 10.669 4.013 1.00 0.54 H new ATOM 0 HA2 GLY A 59 -6.034 8.773 3.718 1.00 0.59 H new ATOM 0 HA3 GLY A 59 -4.570 8.909 2.764 1.00 0.59 H new ATOM 1004 N ILE A 60 -5.164 6.570 4.535 1.00 0.49 N ATOM 1005 CA ILE A 60 -4.764 5.383 5.273 1.00 0.47 C ATOM 1006 C ILE A 60 -5.227 4.122 4.571 1.00 0.42 C ATOM 1007 O ILE A 60 -6.123 4.158 3.722 1.00 0.41 O ATOM 1008 CB ILE A 60 -5.299 5.382 6.731 1.00 0.51 C ATOM 1009 CG1 ILE A 60 -6.750 5.876 6.805 1.00 0.55 C ATOM 1010 CG2 ILE A 60 -4.408 6.209 7.639 1.00 0.60 C ATOM 1011 CD1 ILE A 60 -7.781 4.821 6.470 1.00 0.65 C ATOM 0 H ILE A 60 -6.074 6.500 4.079 1.00 0.49 H new ATOM 0 HA ILE A 60 -3.675 5.402 5.311 1.00 0.47 H new ATOM 0 HB ILE A 60 -5.283 4.349 7.079 1.00 0.51 H new ATOM 0 HG12 ILE A 60 -6.944 6.251 7.810 1.00 0.55 H new ATOM 0 HG13 ILE A 60 -6.871 6.717 6.122 1.00 0.55 H new ATOM 0 HG21 ILE A 60 -4.806 6.191 8.654 1.00 0.60 H new ATOM 0 HG22 ILE A 60 -3.400 5.793 7.637 1.00 0.60 H new ATOM 0 HG23 ILE A 60 -4.377 7.238 7.280 1.00 0.60 H new ATOM 0 HD11 ILE A 60 -8.780 5.251 6.546 1.00 0.65 H new ATOM 0 HD12 ILE A 60 -7.617 4.462 5.454 1.00 0.65 H new ATOM 0 HD13 ILE A 60 -7.690 3.989 7.168 1.00 0.65 H new ATOM 1023 N TRP A 61 -4.614 3.011 4.930 1.00 0.42 N ATOM 1024 CA TRP A 61 -5.034 1.723 4.425 1.00 0.40 C ATOM 1025 C TRP A 61 -5.994 1.085 5.400 1.00 0.40 C ATOM 1026 O TRP A 61 -5.794 1.134 6.616 1.00 0.48 O ATOM 1027 CB TRP A 61 -3.845 0.797 4.193 1.00 0.44 C ATOM 1028 CG TRP A 61 -3.099 1.088 2.932 1.00 0.43 C ATOM 1029 CD1 TRP A 61 -1.972 1.833 2.805 1.00 0.48 C ATOM 1030 CD2 TRP A 61 -3.428 0.628 1.619 1.00 0.41 C ATOM 1031 NE1 TRP A 61 -1.576 1.874 1.494 1.00 0.49 N ATOM 1032 CE2 TRP A 61 -2.453 1.139 0.744 1.00 0.45 C ATOM 1033 CE3 TRP A 61 -4.453 -0.167 1.099 1.00 0.41 C ATOM 1034 CZ2 TRP A 61 -2.473 0.881 -0.621 1.00 0.48 C ATOM 1035 CZ3 TRP A 61 -4.471 -0.424 -0.256 1.00 0.45 C ATOM 1036 CH2 TRP A 61 -3.486 0.099 -1.102 1.00 0.48 C ATOM 0 H TRP A 61 -3.822 2.977 5.571 1.00 0.42 H new ATOM 0 HA TRP A 61 -5.528 1.881 3.466 1.00 0.40 H new ATOM 0 HB2 TRP A 61 -3.161 0.879 5.038 1.00 0.44 H new ATOM 0 HB3 TRP A 61 -4.197 -0.234 4.167 1.00 0.44 H new ATOM 0 HD1 TRP A 61 -1.461 2.323 3.620 1.00 0.48 H new ATOM 0 HE1 TRP A 61 -0.761 2.371 1.136 1.00 0.49 H new ATOM 0 HE3 TRP A 61 -5.217 -0.573 1.746 1.00 0.41 H new ATOM 0 HZ2 TRP A 61 -1.716 1.283 -1.278 1.00 0.48 H new ATOM 0 HZ3 TRP A 61 -5.257 -1.038 -0.671 1.00 0.45 H new ATOM 0 HH2 TRP A 61 -3.527 -0.120 -2.159 1.00 0.48 H new ATOM 1047 N LEU A 62 -7.041 0.504 4.868 1.00 0.36 N ATOM 1048 CA LEU A 62 -8.033 -0.157 5.678 1.00 0.37 C ATOM 1049 C LEU A 62 -7.652 -1.621 5.839 1.00 0.42 C ATOM 1050 O LEU A 62 -7.677 -2.386 4.875 1.00 0.43 O ATOM 1051 CB LEU A 62 -9.406 -0.017 5.019 1.00 0.33 C ATOM 1052 CG LEU A 62 -9.815 1.424 4.704 1.00 0.31 C ATOM 1053 CD1 LEU A 62 -11.076 1.459 3.867 1.00 0.29 C ATOM 1054 CD2 LEU A 62 -10.024 2.205 5.983 1.00 0.35 C ATOM 0 H LEU A 62 -7.229 0.476 3.866 1.00 0.36 H new ATOM 0 HA LEU A 62 -8.079 0.302 6.666 1.00 0.37 H new ATOM 0 HB2 LEU A 62 -9.411 -0.593 4.094 1.00 0.33 H new ATOM 0 HB3 LEU A 62 -10.156 -0.459 5.674 1.00 0.33 H new ATOM 0 HG LEU A 62 -9.009 1.885 4.133 1.00 0.31 H new ATOM 0 HD11 LEU A 62 -11.345 2.494 3.657 1.00 0.29 H new ATOM 0 HD12 LEU A 62 -10.905 0.931 2.929 1.00 0.29 H new ATOM 0 HD13 LEU A 62 -11.888 0.977 4.412 1.00 0.29 H new ATOM 0 HD21 LEU A 62 -10.314 3.228 5.742 1.00 0.35 H new ATOM 0 HD22 LEU A 62 -10.811 1.734 6.573 1.00 0.35 H new ATOM 0 HD23 LEU A 62 -9.098 2.217 6.558 1.00 0.35 H new ATOM 1066 N GLU A 63 -7.252 -1.997 7.044 1.00 0.48 N ATOM 1067 CA GLU A 63 -6.823 -3.359 7.316 1.00 0.55 C ATOM 1068 C GLU A 63 -8.008 -4.258 7.651 1.00 0.52 C ATOM 1069 O GLU A 63 -9.058 -3.787 8.086 1.00 0.48 O ATOM 1070 CB GLU A 63 -5.823 -3.357 8.469 1.00 0.65 C ATOM 1071 CG GLU A 63 -6.399 -2.828 9.773 1.00 0.68 C ATOM 1072 CD GLU A 63 -5.353 -2.698 10.856 1.00 1.07 C ATOM 1073 OE1 GLU A 63 -4.905 -3.737 11.382 1.00 1.42 O ATOM 1074 OE2 GLU A 63 -4.972 -1.557 11.183 1.00 1.30 O ATOM 0 H GLU A 63 -7.216 -1.375 7.852 1.00 0.48 H new ATOM 0 HA GLU A 63 -6.348 -3.756 6.419 1.00 0.55 H new ATOM 0 HB2 GLU A 63 -5.461 -4.373 8.627 1.00 0.65 H new ATOM 0 HB3 GLU A 63 -4.961 -2.751 8.190 1.00 0.65 H new ATOM 0 HG2 GLU A 63 -6.857 -1.855 9.596 1.00 0.68 H new ATOM 0 HG3 GLU A 63 -7.190 -3.496 10.114 1.00 0.68 H new ATOM 1081 N ALA A 64 -7.827 -5.557 7.461 1.00 0.58 N ATOM 1082 CA ALA A 64 -8.875 -6.529 7.742 1.00 0.58 C ATOM 1083 C ALA A 64 -9.167 -6.616 9.239 1.00 0.60 C ATOM 1084 O ALA A 64 -10.196 -7.150 9.651 1.00 0.65 O ATOM 1085 CB ALA A 64 -8.485 -7.894 7.196 1.00 0.64 C ATOM 0 H ALA A 64 -6.960 -5.964 7.112 1.00 0.58 H new ATOM 0 HA ALA A 64 -9.786 -6.196 7.245 1.00 0.58 H new ATOM 0 HB1 ALA A 64 -9.276 -8.612 7.412 1.00 0.64 H new ATOM 0 HB2 ALA A 64 -8.341 -7.827 6.118 1.00 0.64 H new ATOM 0 HB3 ALA A 64 -7.558 -8.223 7.666 1.00 0.64 H new ATOM 1091 N GLY A 65 -8.263 -6.070 10.042 1.00 0.64 N ATOM 1092 CA GLY A 65 -8.415 -6.118 11.482 1.00 0.70 C ATOM 1093 C GLY A 65 -9.317 -5.026 12.032 1.00 0.70 C ATOM 1094 O GLY A 65 -9.387 -4.834 13.247 1.00 0.84 O ATOM 0 H GLY A 65 -7.422 -5.592 9.718 1.00 0.64 H new ATOM 0 HA2 GLY A 65 -8.820 -7.090 11.765 1.00 0.70 H new ATOM 0 HA3 GLY A 65 -7.432 -6.035 11.946 1.00 0.70 H new ATOM 1098 N LYS A 66 -10.016 -4.306 11.159 1.00 0.60 N ATOM 1099 CA LYS A 66 -10.947 -3.283 11.615 1.00 0.61 C ATOM 1100 C LYS A 66 -12.151 -3.191 10.678 1.00 0.54 C ATOM 1101 O LYS A 66 -12.100 -3.645 9.530 1.00 0.47 O ATOM 1102 CB LYS A 66 -10.256 -1.911 11.753 1.00 0.66 C ATOM 1103 CG LYS A 66 -10.585 -0.910 10.653 1.00 0.60 C ATOM 1104 CD LYS A 66 -9.908 -1.236 9.337 1.00 0.56 C ATOM 1105 CE LYS A 66 -10.841 -0.986 8.163 1.00 0.61 C ATOM 1106 NZ LYS A 66 -11.470 0.356 8.221 1.00 1.29 N ATOM 0 H LYS A 66 -9.956 -4.411 10.146 1.00 0.60 H new ATOM 0 HA LYS A 66 -11.301 -3.575 12.604 1.00 0.61 H new ATOM 0 HB2 LYS A 66 -10.533 -1.477 12.713 1.00 0.66 H new ATOM 0 HB3 LYS A 66 -9.177 -2.065 11.772 1.00 0.66 H new ATOM 0 HG2 LYS A 66 -11.664 -0.884 10.504 1.00 0.60 H new ATOM 0 HG3 LYS A 66 -10.283 0.087 10.974 1.00 0.60 H new ATOM 0 HD2 LYS A 66 -9.010 -0.629 9.227 1.00 0.56 H new ATOM 0 HD3 LYS A 66 -9.590 -2.279 9.337 1.00 0.56 H new ATOM 0 HE2 LYS A 66 -10.284 -1.084 7.231 1.00 0.61 H new ATOM 0 HE3 LYS A 66 -11.619 -1.749 8.151 1.00 0.61 H new ATOM 0 HZ1 LYS A 66 -11.873 0.591 7.291 1.00 1.29 H new ATOM 0 HZ2 LYS A 66 -12.226 0.355 8.935 1.00 1.29 H new ATOM 0 HZ3 LYS A 66 -10.753 1.065 8.477 1.00 1.29 H new ATOM 1120 N ALA A 67 -13.224 -2.592 11.169 1.00 0.57 N ATOM 1121 CA ALA A 67 -14.440 -2.441 10.393 1.00 0.52 C ATOM 1122 C ALA A 67 -14.446 -1.105 9.656 1.00 0.47 C ATOM 1123 O ALA A 67 -13.568 -0.263 9.868 1.00 0.47 O ATOM 1124 CB ALA A 67 -15.647 -2.574 11.305 1.00 0.59 C ATOM 0 H ALA A 67 -13.275 -2.200 12.109 1.00 0.57 H new ATOM 0 HA ALA A 67 -14.486 -3.229 9.641 1.00 0.52 H new ATOM 0 HB1 ALA A 67 -16.560 -2.460 10.720 1.00 0.59 H new ATOM 0 HB2 ALA A 67 -15.639 -3.556 11.778 1.00 0.59 H new ATOM 0 HB3 ALA A 67 -15.610 -1.801 12.073 1.00 0.59 H new ATOM 1130 N LEU A 68 -15.422 -0.912 8.785 1.00 0.45 N ATOM 1131 CA LEU A 68 -15.492 0.296 7.975 1.00 0.40 C ATOM 1132 C LEU A 68 -15.944 1.492 8.814 1.00 0.43 C ATOM 1133 O LEU A 68 -15.230 2.491 8.923 1.00 0.44 O ATOM 1134 CB LEU A 68 -16.438 0.077 6.794 1.00 0.37 C ATOM 1135 CG LEU A 68 -15.985 -0.994 5.798 1.00 0.36 C ATOM 1136 CD1 LEU A 68 -17.011 -1.155 4.689 1.00 0.36 C ATOM 1137 CD2 LEU A 68 -14.621 -0.645 5.217 1.00 0.37 C ATOM 0 H LEU A 68 -16.178 -1.576 8.619 1.00 0.45 H new ATOM 0 HA LEU A 68 -14.495 0.516 7.592 1.00 0.40 H new ATOM 0 HB2 LEU A 68 -17.420 -0.197 7.179 1.00 0.37 H new ATOM 0 HB3 LEU A 68 -16.557 1.021 6.262 1.00 0.37 H new ATOM 0 HG LEU A 68 -15.898 -1.942 6.329 1.00 0.36 H new ATOM 0 HD11 LEU A 68 -16.674 -1.920 3.990 1.00 0.36 H new ATOM 0 HD12 LEU A 68 -17.968 -1.453 5.119 1.00 0.36 H new ATOM 0 HD13 LEU A 68 -17.129 -0.208 4.162 1.00 0.36 H new ATOM 0 HD21 LEU A 68 -14.317 -1.419 4.512 1.00 0.37 H new ATOM 0 HD22 LEU A 68 -14.680 0.314 4.701 1.00 0.37 H new ATOM 0 HD23 LEU A 68 -13.889 -0.580 6.022 1.00 0.37 H new ATOM 1149 N ASP A 69 -17.104 1.351 9.445 1.00 0.47 N ATOM 1150 CA ASP A 69 -17.712 2.423 10.243 1.00 0.52 C ATOM 1151 C ASP A 69 -16.864 2.764 11.464 1.00 0.58 C ATOM 1152 O ASP A 69 -17.012 3.834 12.053 1.00 0.65 O ATOM 1153 CB ASP A 69 -19.125 2.004 10.677 1.00 0.58 C ATOM 1154 CG ASP A 69 -19.746 2.915 11.722 1.00 0.86 C ATOM 1155 OD1 ASP A 69 -20.254 3.997 11.351 1.00 1.14 O ATOM 1156 OD2 ASP A 69 -19.704 2.571 12.922 1.00 1.16 O ATOM 0 H ASP A 69 -17.654 0.492 9.421 1.00 0.47 H new ATOM 0 HA ASP A 69 -17.770 3.318 9.623 1.00 0.52 H new ATOM 0 HB2 ASP A 69 -19.772 1.981 9.800 1.00 0.58 H new ATOM 0 HB3 ASP A 69 -19.087 0.989 11.072 1.00 0.58 H new ATOM 1161 N TYR A 70 -15.970 1.853 11.834 1.00 0.59 N ATOM 1162 CA TYR A 70 -15.042 2.089 12.931 1.00 0.65 C ATOM 1163 C TYR A 70 -14.252 3.382 12.703 1.00 0.62 C ATOM 1164 O TYR A 70 -13.956 4.116 13.646 1.00 0.67 O ATOM 1165 CB TYR A 70 -14.112 0.877 13.090 1.00 0.69 C ATOM 1166 CG TYR A 70 -12.777 1.197 13.714 1.00 0.81 C ATOM 1167 CD1 TYR A 70 -12.653 1.425 15.077 1.00 1.02 C ATOM 1168 CD2 TYR A 70 -11.641 1.270 12.929 1.00 0.84 C ATOM 1169 CE1 TYR A 70 -11.427 1.720 15.636 1.00 1.21 C ATOM 1170 CE2 TYR A 70 -10.413 1.564 13.477 1.00 1.05 C ATOM 1171 CZ TYR A 70 -10.308 1.789 14.832 1.00 1.22 C ATOM 1172 OH TYR A 70 -9.079 2.085 15.383 1.00 1.45 O ATOM 0 H TYR A 70 -15.869 0.941 11.387 1.00 0.59 H new ATOM 0 HA TYR A 70 -15.603 2.213 13.857 1.00 0.65 H new ATOM 0 HB2 TYR A 70 -14.614 0.126 13.700 1.00 0.69 H new ATOM 0 HB3 TYR A 70 -13.944 0.431 12.109 1.00 0.69 H new ATOM 0 HD1 TYR A 70 -13.528 1.371 15.708 1.00 1.02 H new ATOM 0 HD2 TYR A 70 -11.719 1.093 11.866 1.00 0.84 H new ATOM 0 HE1 TYR A 70 -11.343 1.896 16.698 1.00 1.21 H new ATOM 0 HE2 TYR A 70 -9.537 1.618 12.848 1.00 1.05 H new ATOM 0 HH TYR A 70 -8.398 2.093 14.678 1.00 1.45 H new ATOM 1182 N TYR A 71 -13.921 3.654 11.443 1.00 0.57 N ATOM 1183 CA TYR A 71 -13.285 4.913 11.072 1.00 0.58 C ATOM 1184 C TYR A 71 -14.324 6.032 10.971 1.00 0.60 C ATOM 1185 O TYR A 71 -15.213 6.152 11.812 1.00 0.69 O ATOM 1186 CB TYR A 71 -12.531 4.766 9.745 1.00 0.56 C ATOM 1187 CG TYR A 71 -11.127 4.228 9.897 1.00 0.56 C ATOM 1188 CD1 TYR A 71 -10.890 2.861 9.951 1.00 0.62 C ATOM 1189 CD2 TYR A 71 -10.041 5.083 9.993 1.00 0.58 C ATOM 1190 CE1 TYR A 71 -9.608 2.361 10.094 1.00 0.66 C ATOM 1191 CE2 TYR A 71 -8.756 4.593 10.138 1.00 0.63 C ATOM 1192 CZ TYR A 71 -8.539 3.245 10.167 1.00 0.65 C ATOM 1193 OH TYR A 71 -7.267 2.747 10.335 1.00 0.72 O ATOM 0 H TYR A 71 -14.083 3.018 10.662 1.00 0.57 H new ATOM 0 HA TYR A 71 -12.568 5.175 11.850 1.00 0.58 H new ATOM 0 HB2 TYR A 71 -13.095 4.103 9.089 1.00 0.56 H new ATOM 0 HB3 TYR A 71 -12.486 5.738 9.254 1.00 0.56 H new ATOM 0 HD1 TYR A 71 -11.722 2.176 9.880 1.00 0.62 H new ATOM 0 HD2 TYR A 71 -10.201 6.150 9.954 1.00 0.58 H new ATOM 0 HE1 TYR A 71 -9.440 1.295 10.148 1.00 0.66 H new ATOM 0 HE2 TYR A 71 -7.924 5.276 10.228 1.00 0.63 H new ATOM 0 HH TYR A 71 -6.627 3.488 10.367 1.00 0.72 H new ATOM 1203 N MET A 72 -14.205 6.851 9.938 1.00 0.60 N ATOM 1204 CA MET A 72 -15.125 7.961 9.730 1.00 0.69 C ATOM 1205 C MET A 72 -16.048 7.695 8.550 1.00 0.63 C ATOM 1206 O MET A 72 -16.686 8.615 8.042 1.00 0.75 O ATOM 1207 CB MET A 72 -14.345 9.254 9.474 1.00 0.83 C ATOM 1208 CG MET A 72 -13.582 9.773 10.680 1.00 1.02 C ATOM 1209 SD MET A 72 -12.639 11.267 10.310 1.00 1.73 S ATOM 1210 CE MET A 72 -13.925 12.323 9.642 1.00 2.38 C ATOM 0 H MET A 72 -13.478 6.768 9.227 1.00 0.60 H new ATOM 0 HA MET A 72 -15.728 8.065 10.632 1.00 0.69 H new ATOM 0 HB2 MET A 72 -13.641 9.085 8.659 1.00 0.83 H new ATOM 0 HB3 MET A 72 -15.040 10.024 9.140 1.00 0.83 H new ATOM 0 HG2 MET A 72 -14.284 9.981 11.488 1.00 1.02 H new ATOM 0 HG3 MET A 72 -12.904 8.998 11.038 1.00 1.02 H new ATOM 0 HE1 MET A 72 -13.599 13.362 9.680 1.00 2.38 H new ATOM 0 HE2 MET A 72 -14.125 12.043 8.608 1.00 2.38 H new ATOM 0 HE3 MET A 72 -14.834 12.206 10.231 1.00 2.38 H new ATOM 1220 N LEU A 73 -16.143 6.438 8.126 1.00 0.56 N ATOM 1221 CA LEU A 73 -16.866 6.128 6.900 1.00 0.54 C ATOM 1222 C LEU A 73 -18.348 6.049 7.148 1.00 0.50 C ATOM 1223 O LEU A 73 -18.811 5.518 8.159 1.00 0.60 O ATOM 1224 CB LEU A 73 -16.413 4.823 6.242 1.00 0.71 C ATOM 1225 CG LEU A 73 -14.971 4.382 6.499 1.00 0.43 C ATOM 1226 CD1 LEU A 73 -14.629 3.208 5.603 1.00 0.88 C ATOM 1227 CD2 LEU A 73 -13.997 5.521 6.272 1.00 0.88 C ATOM 0 H LEU A 73 -15.737 5.633 8.603 1.00 0.56 H new ATOM 0 HA LEU A 73 -16.638 6.947 6.218 1.00 0.54 H new ATOM 0 HB2 LEU A 73 -17.076 4.026 6.578 1.00 0.71 H new ATOM 0 HB3 LEU A 73 -16.551 4.920 5.165 1.00 0.71 H new ATOM 0 HG LEU A 73 -14.885 4.078 7.542 1.00 0.43 H new ATOM 0 HD11 LEU A 73 -13.601 2.896 5.788 1.00 0.88 H new ATOM 0 HD12 LEU A 73 -15.304 2.379 5.816 1.00 0.88 H new ATOM 0 HD13 LEU A 73 -14.736 3.504 4.559 1.00 0.88 H new ATOM 0 HD21 LEU A 73 -12.981 5.175 6.463 1.00 0.88 H new ATOM 0 HD22 LEU A 73 -14.075 5.866 5.241 1.00 0.88 H new ATOM 0 HD23 LEU A 73 -14.234 6.342 6.949 1.00 0.88 H new ATOM 1239 N ARG A 74 -19.071 6.586 6.201 1.00 0.48 N ATOM 1240 CA ARG A 74 -20.510 6.592 6.223 1.00 0.52 C ATOM 1241 C ARG A 74 -21.044 6.792 4.818 1.00 0.46 C ATOM 1242 O ARG A 74 -20.292 6.718 3.845 1.00 0.45 O ATOM 1243 CB ARG A 74 -21.040 7.672 7.185 1.00 0.65 C ATOM 1244 CG ARG A 74 -20.263 8.985 7.176 1.00 1.17 C ATOM 1245 CD ARG A 74 -20.496 9.793 5.913 1.00 1.64 C ATOM 1246 NE ARG A 74 -19.236 10.217 5.317 1.00 2.05 N ATOM 1247 CZ ARG A 74 -19.006 11.428 4.820 1.00 2.72 C ATOM 1248 NH1 ARG A 74 -19.954 12.357 4.830 1.00 2.96 N ATOM 1249 NH2 ARG A 74 -17.815 11.712 4.309 1.00 3.29 N ATOM 0 H ARG A 74 -18.670 7.039 5.380 1.00 0.48 H new ATOM 0 HA ARG A 74 -20.863 5.629 6.592 1.00 0.52 H new ATOM 0 HB2 ARG A 74 -22.080 7.881 6.934 1.00 0.65 H new ATOM 0 HB3 ARG A 74 -21.032 7.270 8.198 1.00 0.65 H new ATOM 0 HG2 ARG A 74 -20.553 9.580 8.042 1.00 1.17 H new ATOM 0 HG3 ARG A 74 -19.198 8.773 7.276 1.00 1.17 H new ATOM 0 HD2 ARG A 74 -21.058 9.196 5.195 1.00 1.64 H new ATOM 0 HD3 ARG A 74 -21.104 10.668 6.145 1.00 1.64 H new ATOM 0 HE ARG A 74 -18.477 9.537 5.278 1.00 2.05 H new ATOM 0 HH11 ARG A 74 -20.871 12.145 5.222 1.00 2.96 H new ATOM 0 HH12 ARG A 74 -19.765 13.283 4.446 1.00 2.96 H new ATOM 0 HH21 ARG A 74 -17.082 11.003 4.299 1.00 3.29 H new ATOM 0 HH22 ARG A 74 -17.632 12.640 3.926 1.00 3.29 H new ATOM 1263 N ASN A 75 -22.338 7.030 4.722 1.00 0.49 N ATOM 1264 CA ASN A 75 -22.985 7.297 3.442 1.00 0.47 C ATOM 1265 C ASN A 75 -22.369 8.531 2.794 1.00 0.48 C ATOM 1266 O ASN A 75 -22.691 9.657 3.174 1.00 0.56 O ATOM 1267 CB ASN A 75 -24.494 7.524 3.628 1.00 0.52 C ATOM 1268 CG ASN A 75 -25.287 6.257 3.926 1.00 0.52 C ATOM 1269 OD1 ASN A 75 -24.692 5.316 4.641 1.00 0.72 O flip ATOM 1270 ND2 ASN A 75 -26.447 6.138 3.531 1.00 0.51 N flip ATOM 0 H ASN A 75 -22.971 7.045 5.521 1.00 0.49 H new ATOM 0 HA ASN A 75 -22.835 6.429 2.800 1.00 0.47 H new ATOM 0 HB2 ASN A 75 -24.645 8.233 4.442 1.00 0.52 H new ATOM 0 HB3 ASN A 75 -24.894 7.985 2.725 1.00 0.52 H new ATOM 0 HD21 ASN A 75 -26.877 6.882 2.982 1.00 0.51 H new ATOM 0 HD22 ASN A 75 -26.978 5.296 3.753 1.00 0.51 H new ATOM 1277 N GLY A 76 -21.460 8.328 1.848 1.00 0.45 N ATOM 1278 CA GLY A 76 -20.894 9.453 1.136 1.00 0.51 C ATOM 1279 C GLY A 76 -19.382 9.413 1.005 1.00 0.47 C ATOM 1280 O GLY A 76 -18.805 10.244 0.302 1.00 0.55 O ATOM 0 H GLY A 76 -21.109 7.413 1.565 1.00 0.45 H new ATOM 0 HA2 GLY A 76 -21.332 9.495 0.139 1.00 0.51 H new ATOM 0 HA3 GLY A 76 -21.178 10.372 1.648 1.00 0.51 H new ATOM 1284 N ASP A 77 -18.719 8.474 1.671 1.00 0.42 N ATOM 1285 CA ASP A 77 -17.263 8.408 1.588 1.00 0.42 C ATOM 1286 C ASP A 77 -16.803 7.681 0.338 1.00 0.38 C ATOM 1287 O ASP A 77 -17.413 6.699 -0.092 1.00 0.40 O ATOM 1288 CB ASP A 77 -16.657 7.740 2.819 1.00 0.44 C ATOM 1289 CG ASP A 77 -16.746 8.619 4.041 1.00 0.74 C ATOM 1290 OD1 ASP A 77 -16.055 9.659 4.089 1.00 1.05 O ATOM 1291 OD2 ASP A 77 -17.531 8.292 4.944 1.00 1.00 O ATOM 0 H ASP A 77 -19.152 7.764 2.261 1.00 0.42 H new ATOM 0 HA ASP A 77 -16.912 9.439 1.541 1.00 0.42 H new ATOM 0 HB2 ASP A 77 -17.172 6.799 3.011 1.00 0.44 H new ATOM 0 HB3 ASP A 77 -15.613 7.497 2.622 1.00 0.44 H new ATOM 1296 N THR A 78 -15.734 8.186 -0.250 1.00 0.36 N ATOM 1297 CA THR A 78 -15.104 7.536 -1.378 1.00 0.35 C ATOM 1298 C THR A 78 -14.013 6.593 -0.879 1.00 0.31 C ATOM 1299 O THR A 78 -13.095 7.006 -0.166 1.00 0.34 O ATOM 1300 CB THR A 78 -14.499 8.578 -2.341 1.00 0.42 C ATOM 1301 OG1 THR A 78 -15.507 9.528 -2.718 1.00 0.50 O ATOM 1302 CG2 THR A 78 -13.933 7.919 -3.590 1.00 0.42 C ATOM 0 H THR A 78 -15.282 9.053 0.041 1.00 0.36 H new ATOM 0 HA THR A 78 -15.859 6.966 -1.920 1.00 0.35 H new ATOM 0 HB THR A 78 -13.684 9.082 -1.823 1.00 0.42 H new ATOM 0 HG1 THR A 78 -15.121 10.190 -3.328 1.00 0.50 H new ATOM 0 HG21 THR A 78 -13.515 8.682 -4.246 1.00 0.42 H new ATOM 0 HG22 THR A 78 -13.150 7.215 -3.307 1.00 0.42 H new ATOM 0 HG23 THR A 78 -14.728 7.387 -4.113 1.00 0.42 H new ATOM 1310 N MET A 79 -14.111 5.330 -1.255 1.00 0.27 N ATOM 1311 CA MET A 79 -13.169 4.328 -0.797 1.00 0.27 C ATOM 1312 C MET A 79 -12.486 3.698 -1.996 1.00 0.28 C ATOM 1313 O MET A 79 -13.119 3.027 -2.806 1.00 0.27 O ATOM 1314 CB MET A 79 -13.868 3.255 0.039 1.00 0.23 C ATOM 1315 CG MET A 79 -12.899 2.374 0.811 1.00 0.27 C ATOM 1316 SD MET A 79 -13.725 1.103 1.787 1.00 0.65 S ATOM 1317 CE MET A 79 -14.307 0.017 0.492 1.00 0.24 C ATOM 0 H MET A 79 -14.836 4.975 -1.878 1.00 0.27 H new ATOM 0 HA MET A 79 -12.425 4.810 -0.163 1.00 0.27 H new ATOM 0 HB2 MET A 79 -14.550 3.736 0.740 1.00 0.23 H new ATOM 0 HB3 MET A 79 -14.474 2.630 -0.617 1.00 0.23 H new ATOM 0 HG2 MET A 79 -12.213 1.898 0.111 1.00 0.27 H new ATOM 0 HG3 MET A 79 -12.297 2.998 1.472 1.00 0.27 H new ATOM 0 HE1 MET A 79 -14.246 -1.018 0.830 1.00 0.24 H new ATOM 0 HE2 MET A 79 -15.342 0.260 0.251 1.00 0.24 H new ATOM 0 HE3 MET A 79 -13.688 0.146 -0.396 1.00 0.24 H new ATOM 1327 N GLU A 80 -11.200 3.936 -2.114 1.00 0.32 N ATOM 1328 CA GLU A 80 -10.448 3.475 -3.259 1.00 0.35 C ATOM 1329 C GLU A 80 -10.169 1.984 -3.137 1.00 0.33 C ATOM 1330 O GLU A 80 -9.617 1.531 -2.132 1.00 0.33 O ATOM 1331 CB GLU A 80 -9.130 4.250 -3.334 1.00 0.40 C ATOM 1332 CG GLU A 80 -8.454 4.203 -4.691 1.00 0.53 C ATOM 1333 CD GLU A 80 -7.254 5.123 -4.769 1.00 0.69 C ATOM 1334 OE1 GLU A 80 -7.450 6.347 -4.923 1.00 1.04 O ATOM 1335 OE2 GLU A 80 -6.109 4.632 -4.679 1.00 1.04 O ATOM 0 H GLU A 80 -10.649 4.450 -1.426 1.00 0.32 H new ATOM 0 HA GLU A 80 -11.026 3.645 -4.167 1.00 0.35 H new ATOM 0 HB2 GLU A 80 -9.319 5.291 -3.071 1.00 0.40 H new ATOM 0 HB3 GLU A 80 -8.445 3.851 -2.586 1.00 0.40 H new ATOM 0 HG2 GLU A 80 -8.139 3.181 -4.902 1.00 0.53 H new ATOM 0 HG3 GLU A 80 -9.173 4.481 -5.462 1.00 0.53 H new ATOM 1342 N TYR A 81 -10.541 1.212 -4.150 1.00 0.33 N ATOM 1343 CA TYR A 81 -10.147 -0.178 -4.202 1.00 0.33 C ATOM 1344 C TYR A 81 -8.970 -0.274 -5.135 1.00 0.36 C ATOM 1345 O TYR A 81 -9.106 -0.133 -6.352 1.00 0.39 O ATOM 1346 CB TYR A 81 -11.283 -1.076 -4.689 1.00 0.33 C ATOM 1347 CG TYR A 81 -10.989 -2.560 -4.553 1.00 0.33 C ATOM 1348 CD1 TYR A 81 -11.236 -3.222 -3.359 1.00 0.34 C ATOM 1349 CD2 TYR A 81 -10.480 -3.299 -5.617 1.00 0.37 C ATOM 1350 CE1 TYR A 81 -10.984 -4.573 -3.222 1.00 0.36 C ATOM 1351 CE2 TYR A 81 -10.230 -4.653 -5.488 1.00 0.39 C ATOM 1352 CZ TYR A 81 -10.484 -5.285 -4.289 1.00 0.38 C ATOM 1353 OH TYR A 81 -10.238 -6.634 -4.157 1.00 0.42 O ATOM 0 H TYR A 81 -11.109 1.526 -4.936 1.00 0.33 H new ATOM 0 HA TYR A 81 -9.887 -0.522 -3.201 1.00 0.33 H new ATOM 0 HB2 TYR A 81 -12.187 -0.841 -4.127 1.00 0.33 H new ATOM 0 HB3 TYR A 81 -11.490 -0.850 -5.735 1.00 0.33 H new ATOM 0 HD1 TYR A 81 -11.633 -2.670 -2.520 1.00 0.34 H new ATOM 0 HD2 TYR A 81 -10.277 -2.808 -6.557 1.00 0.37 H new ATOM 0 HE1 TYR A 81 -11.178 -5.069 -2.282 1.00 0.36 H new ATOM 0 HE2 TYR A 81 -9.837 -5.214 -6.323 1.00 0.39 H new ATOM 0 HH TYR A 81 -9.888 -6.987 -5.002 1.00 0.42 H new ATOM 1363 N ARG A 82 -7.816 -0.460 -4.558 1.00 0.37 N ATOM 1364 CA ARG A 82 -6.590 -0.404 -5.320 1.00 0.39 C ATOM 1365 C ARG A 82 -5.687 -1.563 -4.973 1.00 0.40 C ATOM 1366 O ARG A 82 -5.953 -2.314 -4.031 1.00 0.42 O ATOM 1367 CB ARG A 82 -5.861 0.913 -5.063 1.00 0.42 C ATOM 1368 CG ARG A 82 -5.592 1.177 -3.594 1.00 0.44 C ATOM 1369 CD ARG A 82 -4.631 2.334 -3.413 1.00 0.56 C ATOM 1370 NE ARG A 82 -3.320 2.061 -4.000 1.00 0.65 N ATOM 1371 CZ ARG A 82 -2.580 2.986 -4.605 1.00 0.88 C ATOM 1372 NH1 ARG A 82 -3.061 4.213 -4.770 1.00 1.08 N ATOM 1373 NH2 ARG A 82 -1.374 2.679 -5.073 1.00 1.03 N ATOM 0 H ARG A 82 -7.693 -0.652 -3.564 1.00 0.37 H new ATOM 0 HA ARG A 82 -6.849 -0.468 -6.377 1.00 0.39 H new ATOM 0 HB2 ARG A 82 -4.914 0.907 -5.603 1.00 0.42 H new ATOM 0 HB3 ARG A 82 -6.454 1.733 -5.469 1.00 0.42 H new ATOM 0 HG2 ARG A 82 -6.530 1.396 -3.083 1.00 0.44 H new ATOM 0 HG3 ARG A 82 -5.179 0.281 -3.130 1.00 0.44 H new ATOM 0 HD2 ARG A 82 -5.053 3.229 -3.870 1.00 0.56 H new ATOM 0 HD3 ARG A 82 -4.514 2.544 -2.350 1.00 0.56 H new ATOM 0 HE ARG A 82 -2.953 1.111 -3.943 1.00 0.65 H new ATOM 0 HH11 ARG A 82 -3.996 4.444 -4.433 1.00 1.08 H new ATOM 0 HH12 ARG A 82 -2.496 4.924 -5.234 1.00 1.08 H new ATOM 0 HH21 ARG A 82 -1.013 1.731 -4.969 1.00 1.03 H new ATOM 0 HH22 ARG A 82 -0.810 3.392 -5.536 1.00 1.03 H new ATOM 1387 N LYS A 83 -4.625 -1.703 -5.736 1.00 0.43 N ATOM 1388 CA LYS A 83 -3.605 -2.668 -5.420 1.00 0.45 C ATOM 1389 C LYS A 83 -2.932 -2.248 -4.119 1.00 0.42 C ATOM 1390 O LYS A 83 -2.529 -1.089 -3.969 1.00 0.42 O ATOM 1391 CB LYS A 83 -2.593 -2.764 -6.566 1.00 0.53 C ATOM 1392 CG LYS A 83 -1.655 -3.956 -6.467 1.00 0.60 C ATOM 1393 CD LYS A 83 -0.815 -4.099 -7.725 1.00 0.70 C ATOM 1394 CE LYS A 83 0.146 -5.276 -7.644 1.00 1.25 C ATOM 1395 NZ LYS A 83 -0.563 -6.575 -7.532 1.00 1.74 N ATOM 0 H LYS A 83 -4.449 -1.158 -6.580 1.00 0.43 H new ATOM 0 HA LYS A 83 -4.046 -3.657 -5.293 1.00 0.45 H new ATOM 0 HB2 LYS A 83 -3.134 -2.818 -7.511 1.00 0.53 H new ATOM 0 HB3 LYS A 83 -2.000 -1.850 -6.590 1.00 0.53 H new ATOM 0 HG2 LYS A 83 -1.002 -3.838 -5.602 1.00 0.60 H new ATOM 0 HG3 LYS A 83 -2.234 -4.866 -6.308 1.00 0.60 H new ATOM 0 HD2 LYS A 83 -1.472 -4.227 -8.586 1.00 0.70 H new ATOM 0 HD3 LYS A 83 -0.250 -3.181 -7.889 1.00 0.70 H new ATOM 0 HE2 LYS A 83 0.780 -5.286 -8.530 1.00 1.25 H new ATOM 0 HE3 LYS A 83 0.803 -5.148 -6.784 1.00 1.25 H new ATOM 0 HZ1 LYS A 83 -0.262 -7.061 -6.663 1.00 1.74 H new ATOM 0 HZ2 LYS A 83 -1.589 -6.409 -7.498 1.00 1.74 H new ATOM 0 HZ3 LYS A 83 -0.335 -7.167 -8.356 1.00 1.74 H new ATOM 1409 N LYS A 84 -2.860 -3.177 -3.175 1.00 0.44 N ATOM 1410 CA LYS A 84 -2.221 -2.940 -1.883 1.00 0.46 C ATOM 1411 C LYS A 84 -0.808 -2.429 -2.086 1.00 0.46 C ATOM 1412 O LYS A 84 -0.303 -1.603 -1.329 1.00 0.52 O ATOM 1413 CB LYS A 84 -2.188 -4.241 -1.077 1.00 0.54 C ATOM 1414 CG LYS A 84 -3.488 -4.553 -0.356 1.00 0.55 C ATOM 1415 CD LYS A 84 -3.610 -3.760 0.936 1.00 0.66 C ATOM 1416 CE LYS A 84 -3.488 -4.658 2.158 1.00 0.67 C ATOM 1417 NZ LYS A 84 -2.188 -5.377 2.203 1.00 1.32 N ATOM 0 H LYS A 84 -3.242 -4.117 -3.281 1.00 0.44 H new ATOM 0 HA LYS A 84 -2.794 -2.191 -1.337 1.00 0.46 H new ATOM 0 HB2 LYS A 84 -1.949 -5.066 -1.748 1.00 0.54 H new ATOM 0 HB3 LYS A 84 -1.383 -4.182 -0.344 1.00 0.54 H new ATOM 0 HG2 LYS A 84 -4.331 -4.323 -1.007 1.00 0.55 H new ATOM 0 HG3 LYS A 84 -3.537 -5.619 -0.136 1.00 0.55 H new ATOM 0 HD2 LYS A 84 -2.835 -2.994 0.968 1.00 0.66 H new ATOM 0 HD3 LYS A 84 -4.570 -3.244 0.957 1.00 0.66 H new ATOM 0 HE2 LYS A 84 -3.599 -4.057 3.060 1.00 0.67 H new ATOM 0 HE3 LYS A 84 -4.302 -5.383 2.156 1.00 0.67 H new ATOM 0 HZ1 LYS A 84 -2.342 -6.352 2.531 1.00 1.32 H new ATOM 0 HZ2 LYS A 84 -1.767 -5.394 1.252 1.00 1.32 H new ATOM 0 HZ3 LYS A 84 -1.544 -4.889 2.858 1.00 1.32 H new ATOM 1431 N GLN A 85 -0.198 -2.912 -3.145 1.00 0.44 N ATOM 1432 CA GLN A 85 1.179 -2.613 -3.456 1.00 0.47 C ATOM 1433 C GLN A 85 1.265 -1.501 -4.488 1.00 0.52 C ATOM 1434 O GLN A 85 0.317 -1.258 -5.233 1.00 0.83 O ATOM 1435 CB GLN A 85 1.857 -3.863 -4.009 1.00 0.53 C ATOM 1436 CG GLN A 85 1.089 -5.146 -3.738 1.00 0.50 C ATOM 1437 CD GLN A 85 1.878 -6.373 -4.122 1.00 0.64 C ATOM 1438 OE1 GLN A 85 1.851 -6.802 -5.273 1.00 1.10 O ATOM 1439 NE2 GLN A 85 2.572 -6.953 -3.158 1.00 0.72 N ATOM 0 H GLN A 85 -0.649 -3.529 -3.820 1.00 0.44 H new ATOM 0 HA GLN A 85 1.679 -2.288 -2.544 1.00 0.47 H new ATOM 0 HB2 GLN A 85 1.987 -3.749 -5.085 1.00 0.53 H new ATOM 0 HB3 GLN A 85 2.853 -3.948 -3.574 1.00 0.53 H new ATOM 0 HG2 GLN A 85 0.832 -5.197 -2.680 1.00 0.50 H new ATOM 0 HG3 GLN A 85 0.151 -5.130 -4.293 1.00 0.50 H new ATOM 0 HE21 GLN A 85 2.564 -6.560 -2.217 1.00 0.72 H new ATOM 0 HE22 GLN A 85 3.115 -7.793 -3.355 1.00 0.72 H new ATOM 1448 N ARG A 86 2.406 -0.835 -4.533 1.00 0.50 N ATOM 1449 CA ARG A 86 2.661 0.176 -5.548 1.00 0.52 C ATOM 1450 C ARG A 86 4.065 0.013 -6.123 1.00 0.50 C ATOM 1451 O ARG A 86 4.949 -0.528 -5.454 1.00 0.53 O ATOM 1452 CB ARG A 86 2.435 1.583 -4.989 1.00 0.67 C ATOM 1453 CG ARG A 86 2.681 1.730 -3.503 1.00 0.85 C ATOM 1454 CD ARG A 86 4.158 1.787 -3.164 1.00 0.98 C ATOM 1455 NE ARG A 86 4.340 2.396 -1.858 1.00 1.13 N ATOM 1456 CZ ARG A 86 4.869 3.603 -1.669 1.00 1.24 C ATOM 1457 NH1 ARG A 86 5.454 4.243 -2.676 1.00 1.62 N ATOM 1458 NH2 ARG A 86 4.811 4.163 -0.471 1.00 1.85 N ATOM 0 H ARG A 86 3.174 -0.976 -3.877 1.00 0.50 H new ATOM 0 HA ARG A 86 1.951 0.036 -6.363 1.00 0.52 H new ATOM 0 HB2 ARG A 86 3.086 2.277 -5.520 1.00 0.67 H new ATOM 0 HB3 ARG A 86 1.409 1.882 -5.203 1.00 0.67 H new ATOM 0 HG2 ARG A 86 2.194 2.637 -3.145 1.00 0.85 H new ATOM 0 HG3 ARG A 86 2.222 0.893 -2.977 1.00 0.85 H new ATOM 0 HD2 ARG A 86 4.581 0.782 -3.169 1.00 0.98 H new ATOM 0 HD3 ARG A 86 4.692 2.361 -3.921 1.00 0.98 H new ATOM 0 HE ARG A 86 4.045 1.868 -1.037 1.00 1.13 H new ATOM 0 HH11 ARG A 86 5.499 3.810 -3.598 1.00 1.62 H new ATOM 0 HH12 ARG A 86 5.858 5.168 -2.527 1.00 1.62 H new ATOM 0 HH21 ARG A 86 4.363 3.670 0.301 1.00 1.85 H new ATOM 0 HH22 ARG A 86 5.215 5.088 -0.320 1.00 1.85 H new ATOM 1472 N PRO A 87 4.277 0.465 -7.376 1.00 0.52 N ATOM 1473 CA PRO A 87 5.530 0.236 -8.108 1.00 0.52 C ATOM 1474 C PRO A 87 6.728 0.924 -7.470 1.00 0.53 C ATOM 1475 O PRO A 87 6.891 2.145 -7.556 1.00 0.62 O ATOM 1476 CB PRO A 87 5.255 0.820 -9.497 1.00 0.57 C ATOM 1477 CG PRO A 87 4.148 1.795 -9.290 1.00 0.86 C ATOM 1478 CD PRO A 87 3.307 1.230 -8.182 1.00 0.60 C ATOM 0 HA PRO A 87 5.792 -0.822 -8.119 1.00 0.52 H new ATOM 0 HB2 PRO A 87 6.141 1.308 -9.903 1.00 0.57 H new ATOM 0 HB3 PRO A 87 4.969 0.041 -10.204 1.00 0.57 H new ATOM 0 HG2 PRO A 87 4.537 2.778 -9.023 1.00 0.86 H new ATOM 0 HG3 PRO A 87 3.562 1.921 -10.201 1.00 0.86 H new ATOM 0 HD2 PRO A 87 2.830 2.017 -7.598 1.00 0.60 H new ATOM 0 HD3 PRO A 87 2.511 0.592 -8.566 1.00 0.60 H new ATOM 1486 N LEU A 88 7.567 0.129 -6.832 1.00 0.50 N ATOM 1487 CA LEU A 88 8.733 0.651 -6.150 1.00 0.53 C ATOM 1488 C LEU A 88 9.988 0.424 -6.973 1.00 0.44 C ATOM 1489 O LEU A 88 10.294 -0.703 -7.361 1.00 0.42 O ATOM 1490 CB LEU A 88 8.864 0.049 -4.753 1.00 0.63 C ATOM 1491 CG LEU A 88 8.012 0.750 -3.695 1.00 0.88 C ATOM 1492 CD1 LEU A 88 8.102 0.035 -2.361 1.00 1.19 C ATOM 1493 CD2 LEU A 88 8.453 2.197 -3.553 1.00 1.51 C ATOM 0 H LEU A 88 7.461 -0.884 -6.773 1.00 0.50 H new ATOM 0 HA LEU A 88 8.605 1.727 -6.033 1.00 0.53 H new ATOM 0 HB2 LEU A 88 8.583 -1.003 -4.793 1.00 0.63 H new ATOM 0 HB3 LEU A 88 9.910 0.088 -4.448 1.00 0.63 H new ATOM 0 HG LEU A 88 6.971 0.725 -4.018 1.00 0.88 H new ATOM 0 HD11 LEU A 88 7.486 0.555 -1.627 1.00 1.19 H new ATOM 0 HD12 LEU A 88 7.746 -0.989 -2.472 1.00 1.19 H new ATOM 0 HD13 LEU A 88 9.138 0.024 -2.023 1.00 1.19 H new ATOM 0 HD21 LEU A 88 7.842 2.691 -2.798 1.00 1.51 H new ATOM 0 HD22 LEU A 88 9.500 2.230 -3.252 1.00 1.51 H new ATOM 0 HD23 LEU A 88 8.334 2.709 -4.508 1.00 1.51 H new ATOM 1505 N LYS A 89 10.701 1.506 -7.244 1.00 0.44 N ATOM 1506 CA LYS A 89 11.940 1.435 -8.000 1.00 0.42 C ATOM 1507 C LYS A 89 13.104 1.229 -7.044 1.00 0.39 C ATOM 1508 O LYS A 89 13.428 2.107 -6.255 1.00 0.42 O ATOM 1509 CB LYS A 89 12.143 2.709 -8.833 1.00 0.51 C ATOM 1510 CG LYS A 89 11.453 2.679 -10.195 1.00 0.69 C ATOM 1511 CD LYS A 89 9.935 2.586 -10.089 1.00 0.93 C ATOM 1512 CE LYS A 89 9.308 3.901 -9.644 1.00 1.49 C ATOM 1513 NZ LYS A 89 7.820 3.815 -9.608 1.00 2.11 N ATOM 0 H LYS A 89 10.441 2.447 -6.950 1.00 0.44 H new ATOM 0 HA LYS A 89 11.889 0.592 -8.689 1.00 0.42 H new ATOM 0 HB2 LYS A 89 11.771 3.563 -8.268 1.00 0.51 H new ATOM 0 HB3 LYS A 89 13.211 2.867 -8.982 1.00 0.51 H new ATOM 0 HG2 LYS A 89 11.719 3.578 -10.751 1.00 0.69 H new ATOM 0 HG3 LYS A 89 11.825 1.829 -10.767 1.00 0.69 H new ATOM 0 HD2 LYS A 89 9.522 2.297 -11.055 1.00 0.93 H new ATOM 0 HD3 LYS A 89 9.669 1.801 -9.381 1.00 0.93 H new ATOM 0 HE2 LYS A 89 9.682 4.167 -8.655 1.00 1.49 H new ATOM 0 HE3 LYS A 89 9.611 4.698 -10.324 1.00 1.49 H new ATOM 0 HZ1 LYS A 89 7.452 4.467 -8.886 1.00 2.11 H new ATOM 0 HZ2 LYS A 89 7.435 4.076 -10.538 1.00 2.11 H new ATOM 0 HZ3 LYS A 89 7.534 2.843 -9.375 1.00 2.11 H new ATOM 1527 N ILE A 90 13.728 0.070 -7.128 1.00 0.36 N ATOM 1528 CA ILE A 90 14.748 -0.329 -6.165 1.00 0.33 C ATOM 1529 C ILE A 90 16.050 -0.682 -6.877 1.00 0.35 C ATOM 1530 O ILE A 90 16.035 -1.416 -7.864 1.00 0.36 O ATOM 1531 CB ILE A 90 14.285 -1.554 -5.339 1.00 0.32 C ATOM 1532 CG1 ILE A 90 12.960 -1.263 -4.623 1.00 0.35 C ATOM 1533 CG2 ILE A 90 15.354 -1.965 -4.336 1.00 0.33 C ATOM 1534 CD1 ILE A 90 13.042 -0.153 -3.595 1.00 0.36 C ATOM 0 H ILE A 90 13.548 -0.620 -7.858 1.00 0.36 H new ATOM 0 HA ILE A 90 14.911 0.516 -5.496 1.00 0.33 H new ATOM 0 HB ILE A 90 14.125 -2.382 -6.029 1.00 0.32 H new ATOM 0 HG12 ILE A 90 12.208 -1.000 -5.367 1.00 0.35 H new ATOM 0 HG13 ILE A 90 12.617 -2.174 -4.132 1.00 0.35 H new ATOM 0 HG21 ILE A 90 15.007 -2.827 -3.767 1.00 0.33 H new ATOM 0 HG22 ILE A 90 16.270 -2.225 -4.867 1.00 0.33 H new ATOM 0 HG23 ILE A 90 15.552 -1.137 -3.655 1.00 0.33 H new ATOM 0 HD11 ILE A 90 12.064 -0.010 -3.135 1.00 0.36 H new ATOM 0 HD12 ILE A 90 13.768 -0.421 -2.828 1.00 0.36 H new ATOM 0 HD13 ILE A 90 13.352 0.772 -4.082 1.00 0.36 H new ATOM 1546 N ARG A 91 17.173 -0.165 -6.386 1.00 0.38 N ATOM 1547 CA ARG A 91 18.476 -0.508 -6.940 1.00 0.43 C ATOM 1548 C ARG A 91 19.228 -1.414 -5.967 1.00 0.42 C ATOM 1549 O ARG A 91 19.419 -1.064 -4.801 1.00 0.44 O ATOM 1550 CB ARG A 91 19.290 0.755 -7.212 1.00 0.52 C ATOM 1551 CG ARG A 91 20.599 0.499 -7.938 1.00 0.57 C ATOM 1552 CD ARG A 91 21.354 1.792 -8.193 1.00 0.74 C ATOM 1553 NE ARG A 91 20.594 2.710 -9.038 1.00 0.72 N ATOM 1554 CZ ARG A 91 20.497 4.021 -8.818 1.00 1.09 C ATOM 1555 NH1 ARG A 91 21.164 4.586 -7.817 1.00 1.82 N ATOM 1556 NH2 ARG A 91 19.742 4.772 -9.609 1.00 1.12 N ATOM 0 H ARG A 91 17.205 0.492 -5.607 1.00 0.38 H new ATOM 0 HA ARG A 91 18.329 -1.035 -7.883 1.00 0.43 H new ATOM 0 HB2 ARG A 91 18.687 1.444 -7.803 1.00 0.52 H new ATOM 0 HB3 ARG A 91 19.502 1.250 -6.264 1.00 0.52 H new ATOM 0 HG2 ARG A 91 21.219 -0.175 -7.347 1.00 0.57 H new ATOM 0 HG3 ARG A 91 20.399 -0.000 -8.886 1.00 0.57 H new ATOM 0 HD2 ARG A 91 21.578 2.275 -7.242 1.00 0.74 H new ATOM 0 HD3 ARG A 91 22.309 1.567 -8.669 1.00 0.74 H new ATOM 0 HE ARG A 91 20.107 2.324 -9.847 1.00 0.72 H new ATOM 0 HH11 ARG A 91 21.755 4.016 -7.212 1.00 1.82 H new ATOM 0 HH12 ARG A 91 21.085 5.590 -7.654 1.00 1.82 H new ATOM 0 HH21 ARG A 91 19.236 4.346 -10.385 1.00 1.12 H new ATOM 0 HH22 ARG A 91 19.668 5.775 -9.441 1.00 1.12 H new ATOM 1570 N MET A 92 19.638 -2.574 -6.455 1.00 0.42 N ATOM 1571 CA MET A 92 20.311 -3.580 -5.640 1.00 0.44 C ATOM 1572 C MET A 92 21.805 -3.308 -5.505 1.00 0.48 C ATOM 1573 O MET A 92 22.323 -2.351 -6.081 1.00 0.51 O ATOM 1574 CB MET A 92 20.092 -4.955 -6.261 1.00 0.46 C ATOM 1575 CG MET A 92 18.984 -5.764 -5.616 1.00 0.57 C ATOM 1576 SD MET A 92 17.522 -4.794 -5.206 1.00 1.04 S ATOM 1577 CE MET A 92 16.933 -4.373 -6.837 1.00 0.34 C ATOM 0 H MET A 92 19.514 -2.848 -7.430 1.00 0.42 H new ATOM 0 HA MET A 92 19.883 -3.541 -4.638 1.00 0.44 H new ATOM 0 HB2 MET A 92 19.865 -4.830 -7.320 1.00 0.46 H new ATOM 0 HB3 MET A 92 21.022 -5.521 -6.199 1.00 0.46 H new ATOM 0 HG2 MET A 92 18.696 -6.571 -6.290 1.00 0.57 H new ATOM 0 HG3 MET A 92 19.367 -6.229 -4.707 1.00 0.57 H new ATOM 0 HE1 MET A 92 15.872 -4.128 -6.789 1.00 0.34 H new ATOM 0 HE2 MET A 92 17.487 -3.513 -7.213 1.00 0.34 H new ATOM 0 HE3 MET A 92 17.079 -5.220 -7.507 1.00 0.34 H new ATOM 1587 N LEU A 93 22.485 -4.206 -4.787 1.00 0.49 N ATOM 1588 CA LEU A 93 23.875 -4.016 -4.364 1.00 0.55 C ATOM 1589 C LEU A 93 24.817 -3.793 -5.545 1.00 0.61 C ATOM 1590 O LEU A 93 25.689 -2.926 -5.494 1.00 0.69 O ATOM 1591 CB LEU A 93 24.370 -5.221 -3.547 1.00 0.57 C ATOM 1592 CG LEU A 93 23.634 -5.510 -2.228 1.00 0.57 C ATOM 1593 CD1 LEU A 93 23.375 -4.227 -1.455 1.00 0.68 C ATOM 1594 CD2 LEU A 93 22.336 -6.270 -2.473 1.00 0.79 C ATOM 0 H LEU A 93 22.083 -5.092 -4.481 1.00 0.49 H new ATOM 0 HA LEU A 93 23.886 -3.120 -3.744 1.00 0.55 H new ATOM 0 HB2 LEU A 93 24.303 -6.109 -4.176 1.00 0.57 H new ATOM 0 HB3 LEU A 93 25.426 -5.069 -3.321 1.00 0.57 H new ATOM 0 HG LEU A 93 24.280 -6.144 -1.621 1.00 0.57 H new ATOM 0 HD11 LEU A 93 22.853 -4.460 -0.527 1.00 0.68 H new ATOM 0 HD12 LEU A 93 24.324 -3.742 -1.226 1.00 0.68 H new ATOM 0 HD13 LEU A 93 22.761 -3.557 -2.057 1.00 0.68 H new ATOM 0 HD21 LEU A 93 21.840 -6.459 -1.521 1.00 0.79 H new ATOM 0 HD22 LEU A 93 21.682 -5.677 -3.112 1.00 0.79 H new ATOM 0 HD23 LEU A 93 22.557 -7.219 -2.962 1.00 0.79 H new ATOM 1606 N ASP A 94 24.647 -4.576 -6.604 1.00 0.61 N ATOM 1607 CA ASP A 94 25.494 -4.445 -7.790 1.00 0.69 C ATOM 1608 C ASP A 94 25.107 -3.200 -8.581 1.00 0.66 C ATOM 1609 O ASP A 94 25.798 -2.794 -9.512 1.00 0.70 O ATOM 1610 CB ASP A 94 25.386 -5.692 -8.678 1.00 0.76 C ATOM 1611 CG ASP A 94 26.258 -5.610 -9.919 1.00 1.47 C ATOM 1612 OD1 ASP A 94 27.481 -5.849 -9.814 1.00 2.26 O ATOM 1613 OD2 ASP A 94 25.725 -5.307 -11.007 1.00 1.93 O ATOM 0 H ASP A 94 23.936 -5.305 -6.669 1.00 0.61 H new ATOM 0 HA ASP A 94 26.529 -4.347 -7.461 1.00 0.69 H new ATOM 0 HB2 ASP A 94 25.669 -6.571 -8.098 1.00 0.76 H new ATOM 0 HB3 ASP A 94 24.347 -5.829 -8.978 1.00 0.76 H new ATOM 1618 N GLY A 95 24.011 -2.577 -8.179 1.00 0.61 N ATOM 1619 CA GLY A 95 23.531 -1.408 -8.877 1.00 0.61 C ATOM 1620 C GLY A 95 22.424 -1.754 -9.835 1.00 0.58 C ATOM 1621 O GLY A 95 22.041 -0.946 -10.680 1.00 0.64 O ATOM 0 H GLY A 95 23.445 -2.862 -7.380 1.00 0.61 H new ATOM 0 HA2 GLY A 95 23.173 -0.674 -8.156 1.00 0.61 H new ATOM 0 HA3 GLY A 95 24.354 -0.945 -9.422 1.00 0.61 H new ATOM 1625 N THR A 96 21.897 -2.959 -9.694 1.00 0.54 N ATOM 1626 CA THR A 96 20.859 -3.439 -10.586 1.00 0.54 C ATOM 1627 C THR A 96 19.504 -2.964 -10.098 1.00 0.47 C ATOM 1628 O THR A 96 19.151 -3.176 -8.943 1.00 0.47 O ATOM 1629 CB THR A 96 20.869 -4.977 -10.665 1.00 0.62 C ATOM 1630 OG1 THR A 96 22.190 -5.438 -10.983 1.00 0.81 O ATOM 1631 CG2 THR A 96 19.888 -5.481 -11.713 1.00 0.61 C ATOM 0 H THR A 96 22.172 -3.622 -8.969 1.00 0.54 H new ATOM 0 HA THR A 96 21.052 -3.040 -11.582 1.00 0.54 H new ATOM 0 HB THR A 96 20.565 -5.368 -9.694 1.00 0.62 H new ATOM 0 HG1 THR A 96 22.192 -6.417 -11.031 1.00 0.81 H new ATOM 0 HG21 THR A 96 19.918 -6.570 -11.745 1.00 0.61 H new ATOM 0 HG22 THR A 96 18.881 -5.153 -11.456 1.00 0.61 H new ATOM 0 HG23 THR A 96 20.162 -5.081 -12.690 1.00 0.61 H new ATOM 1639 N VAL A 97 18.745 -2.335 -10.967 1.00 0.45 N ATOM 1640 CA VAL A 97 17.489 -1.747 -10.556 1.00 0.41 C ATOM 1641 C VAL A 97 16.313 -2.567 -11.073 1.00 0.38 C ATOM 1642 O VAL A 97 16.305 -3.030 -12.212 1.00 0.41 O ATOM 1643 CB VAL A 97 17.372 -0.268 -11.008 1.00 0.50 C ATOM 1644 CG1 VAL A 97 17.515 -0.137 -12.512 1.00 1.07 C ATOM 1645 CG2 VAL A 97 16.060 0.351 -10.540 1.00 1.11 C ATOM 0 H VAL A 97 18.972 -2.218 -11.954 1.00 0.45 H new ATOM 0 HA VAL A 97 17.464 -1.758 -9.466 1.00 0.41 H new ATOM 0 HB VAL A 97 18.191 0.279 -10.542 1.00 0.50 H new ATOM 0 HG11 VAL A 97 17.428 0.912 -12.796 1.00 1.07 H new ATOM 0 HG12 VAL A 97 18.489 -0.517 -12.819 1.00 1.07 H new ATOM 0 HG13 VAL A 97 16.730 -0.712 -13.004 1.00 1.07 H new ATOM 0 HG21 VAL A 97 16.008 1.388 -10.872 1.00 1.11 H new ATOM 0 HG22 VAL A 97 15.224 -0.207 -10.961 1.00 1.11 H new ATOM 0 HG23 VAL A 97 16.009 0.316 -9.452 1.00 1.11 H new ATOM 1655 N LYS A 98 15.335 -2.751 -10.209 1.00 0.35 N ATOM 1656 CA LYS A 98 14.112 -3.442 -10.574 1.00 0.35 C ATOM 1657 C LYS A 98 12.927 -2.714 -9.975 1.00 0.36 C ATOM 1658 O LYS A 98 13.075 -1.969 -9.004 1.00 0.37 O ATOM 1659 CB LYS A 98 14.111 -4.912 -10.121 1.00 0.38 C ATOM 1660 CG LYS A 98 13.980 -5.114 -8.616 1.00 0.41 C ATOM 1661 CD LYS A 98 13.630 -6.561 -8.261 1.00 0.43 C ATOM 1662 CE LYS A 98 12.191 -6.911 -8.622 1.00 0.43 C ATOM 1663 NZ LYS A 98 12.031 -7.310 -10.048 1.00 0.94 N ATOM 0 H LYS A 98 15.363 -2.429 -9.241 1.00 0.35 H new ATOM 0 HA LYS A 98 14.043 -3.443 -11.662 1.00 0.35 H new ATOM 0 HB2 LYS A 98 13.290 -5.430 -10.616 1.00 0.38 H new ATOM 0 HB3 LYS A 98 15.035 -5.383 -10.458 1.00 0.38 H new ATOM 0 HG2 LYS A 98 14.916 -4.838 -8.130 1.00 0.41 H new ATOM 0 HG3 LYS A 98 13.210 -4.448 -8.226 1.00 0.41 H new ATOM 0 HD2 LYS A 98 14.308 -7.236 -8.784 1.00 0.43 H new ATOM 0 HD3 LYS A 98 13.784 -6.719 -7.193 1.00 0.43 H new ATOM 0 HE2 LYS A 98 11.849 -7.724 -7.982 1.00 0.43 H new ATOM 0 HE3 LYS A 98 11.551 -6.053 -8.416 1.00 0.43 H new ATOM 0 HZ1 LYS A 98 11.539 -6.555 -10.567 1.00 0.94 H new ATOM 0 HZ2 LYS A 98 12.968 -7.467 -10.472 1.00 0.94 H new ATOM 0 HZ3 LYS A 98 11.475 -8.187 -10.103 1.00 0.94 H new ATOM 1677 N THR A 99 11.762 -2.904 -10.556 1.00 0.40 N ATOM 1678 CA THR A 99 10.552 -2.356 -9.995 1.00 0.44 C ATOM 1679 C THR A 99 9.684 -3.489 -9.479 1.00 0.47 C ATOM 1680 O THR A 99 9.249 -4.348 -10.248 1.00 0.58 O ATOM 1681 CB THR A 99 9.768 -1.537 -11.032 1.00 0.48 C ATOM 1682 OG1 THR A 99 10.608 -0.510 -11.579 1.00 0.50 O ATOM 1683 CG2 THR A 99 8.538 -0.916 -10.396 1.00 0.57 C ATOM 0 H THR A 99 11.630 -3.435 -11.417 1.00 0.40 H new ATOM 0 HA THR A 99 10.826 -1.687 -9.179 1.00 0.44 H new ATOM 0 HB THR A 99 9.447 -2.202 -11.834 1.00 0.48 H new ATOM 0 HG1 THR A 99 10.103 0.008 -12.241 1.00 0.50 H new ATOM 0 HG21 THR A 99 7.994 -0.339 -11.144 1.00 0.57 H new ATOM 0 HG22 THR A 99 7.894 -1.703 -10.005 1.00 0.57 H new ATOM 0 HG23 THR A 99 8.842 -0.259 -9.581 1.00 0.57 H new ATOM 1691 N ILE A 100 9.454 -3.511 -8.180 1.00 0.42 N ATOM 1692 CA ILE A 100 8.687 -4.571 -7.563 1.00 0.44 C ATOM 1693 C ILE A 100 7.489 -3.964 -6.844 1.00 0.45 C ATOM 1694 O ILE A 100 7.561 -2.834 -6.352 1.00 0.45 O ATOM 1695 CB ILE A 100 9.576 -5.404 -6.598 1.00 0.48 C ATOM 1696 CG1 ILE A 100 8.879 -6.711 -6.177 1.00 0.61 C ATOM 1697 CG2 ILE A 100 9.979 -4.584 -5.377 1.00 0.48 C ATOM 1698 CD1 ILE A 100 8.037 -6.610 -4.922 1.00 0.50 C ATOM 0 H ILE A 100 9.791 -2.801 -7.530 1.00 0.42 H new ATOM 0 HA ILE A 100 8.324 -5.256 -8.329 1.00 0.44 H new ATOM 0 HB ILE A 100 10.484 -5.672 -7.139 1.00 0.48 H new ATOM 0 HG12 ILE A 100 8.244 -7.047 -6.997 1.00 0.61 H new ATOM 0 HG13 ILE A 100 9.638 -7.478 -6.027 1.00 0.61 H new ATOM 0 HG21 ILE A 100 10.600 -5.192 -4.719 1.00 0.48 H new ATOM 0 HG22 ILE A 100 10.540 -3.706 -5.697 1.00 0.48 H new ATOM 0 HG23 ILE A 100 9.085 -4.267 -4.840 1.00 0.48 H new ATOM 0 HD11 ILE A 100 7.587 -7.579 -4.707 1.00 0.50 H new ATOM 0 HD12 ILE A 100 8.666 -6.308 -4.085 1.00 0.50 H new ATOM 0 HD13 ILE A 100 7.250 -5.870 -5.070 1.00 0.50 H new ATOM 1710 N MET A 101 6.381 -4.683 -6.820 1.00 0.47 N ATOM 1711 CA MET A 101 5.184 -4.179 -6.175 1.00 0.50 C ATOM 1712 C MET A 101 5.150 -4.608 -4.718 1.00 0.50 C ATOM 1713 O MET A 101 5.038 -5.792 -4.401 1.00 0.52 O ATOM 1714 CB MET A 101 3.940 -4.714 -6.887 1.00 0.56 C ATOM 1715 CG MET A 101 3.883 -4.382 -8.369 1.00 0.64 C ATOM 1716 SD MET A 101 3.684 -2.621 -8.687 1.00 0.98 S ATOM 1717 CE MET A 101 2.120 -2.309 -7.877 1.00 0.59 C ATOM 0 H MET A 101 6.286 -5.609 -7.236 1.00 0.47 H new ATOM 0 HA MET A 101 5.195 -3.090 -6.229 1.00 0.50 H new ATOM 0 HB2 MET A 101 3.903 -5.797 -6.766 1.00 0.56 H new ATOM 0 HB3 MET A 101 3.053 -4.308 -6.400 1.00 0.56 H new ATOM 0 HG2 MET A 101 4.797 -4.732 -8.850 1.00 0.64 H new ATOM 0 HG3 MET A 101 3.055 -4.924 -8.826 1.00 0.64 H new ATOM 0 HE1 MET A 101 1.753 -1.323 -8.162 1.00 0.59 H new ATOM 0 HE2 MET A 101 1.396 -3.066 -8.179 1.00 0.59 H new ATOM 0 HE3 MET A 101 2.256 -2.348 -6.796 1.00 0.59 H new ATOM 1727 N VAL A 102 5.270 -3.629 -3.836 1.00 0.50 N ATOM 1728 CA VAL A 102 5.232 -3.888 -2.406 1.00 0.53 C ATOM 1729 C VAL A 102 4.052 -3.184 -1.763 1.00 0.49 C ATOM 1730 O VAL A 102 3.808 -2.002 -2.022 1.00 0.50 O ATOM 1731 CB VAL A 102 6.519 -3.440 -1.695 1.00 0.61 C ATOM 1732 CG1 VAL A 102 6.874 -4.419 -0.591 1.00 0.73 C ATOM 1733 CG2 VAL A 102 7.664 -3.282 -2.680 1.00 0.90 C ATOM 0 H VAL A 102 5.395 -2.648 -4.085 1.00 0.50 H new ATOM 0 HA VAL A 102 5.133 -4.968 -2.294 1.00 0.53 H new ATOM 0 HB VAL A 102 6.342 -2.463 -1.245 1.00 0.61 H new ATOM 0 HG11 VAL A 102 7.787 -4.092 -0.094 1.00 0.73 H new ATOM 0 HG12 VAL A 102 6.061 -4.460 0.134 1.00 0.73 H new ATOM 0 HG13 VAL A 102 7.029 -5.409 -1.019 1.00 0.73 H new ATOM 0 HG21 VAL A 102 8.561 -2.964 -2.148 1.00 0.90 H new ATOM 0 HG22 VAL A 102 7.854 -4.235 -3.174 1.00 0.90 H new ATOM 0 HG23 VAL A 102 7.401 -2.533 -3.427 1.00 0.90 H new ATOM 1743 N ASP A 103 3.324 -3.929 -0.943 1.00 0.48 N ATOM 1744 CA ASP A 103 2.145 -3.423 -0.245 1.00 0.47 C ATOM 1745 C ASP A 103 2.484 -2.199 0.594 1.00 0.46 C ATOM 1746 O ASP A 103 3.453 -2.200 1.341 1.00 0.51 O ATOM 1747 CB ASP A 103 1.564 -4.529 0.638 1.00 0.51 C ATOM 1748 CG ASP A 103 0.479 -4.036 1.572 1.00 1.22 C ATOM 1749 OD1 ASP A 103 -0.343 -3.206 1.144 1.00 1.56 O ATOM 1750 OD2 ASP A 103 0.459 -4.444 2.744 1.00 1.96 O ATOM 0 H ASP A 103 3.534 -4.906 -0.741 1.00 0.48 H new ATOM 0 HA ASP A 103 1.405 -3.121 -0.986 1.00 0.47 H new ATOM 0 HB2 ASP A 103 1.158 -5.317 0.003 1.00 0.51 H new ATOM 0 HB3 ASP A 103 2.366 -4.975 1.226 1.00 0.51 H new ATOM 1755 N ASP A 104 1.686 -1.156 0.465 1.00 0.46 N ATOM 1756 CA ASP A 104 1.933 0.082 1.192 1.00 0.47 C ATOM 1757 C ASP A 104 1.206 0.063 2.536 1.00 0.46 C ATOM 1758 O ASP A 104 1.365 0.957 3.367 1.00 0.54 O ATOM 1759 CB ASP A 104 1.490 1.282 0.351 1.00 0.54 C ATOM 1760 CG ASP A 104 1.828 2.608 1.003 1.00 0.66 C ATOM 1761 OD1 ASP A 104 3.027 2.967 1.037 1.00 1.08 O ATOM 1762 OD2 ASP A 104 0.896 3.290 1.482 1.00 0.64 O ATOM 0 H ASP A 104 0.861 -1.138 -0.135 1.00 0.46 H new ATOM 0 HA ASP A 104 3.002 0.172 1.385 1.00 0.47 H new ATOM 0 HB2 ASP A 104 1.967 1.231 -0.628 1.00 0.54 H new ATOM 0 HB3 ASP A 104 0.414 1.227 0.185 1.00 0.54 H new ATOM 1767 N SER A 105 0.426 -0.986 2.757 1.00 0.43 N ATOM 1768 CA SER A 105 -0.326 -1.130 3.999 1.00 0.49 C ATOM 1769 C SER A 105 0.524 -1.792 5.094 1.00 0.57 C ATOM 1770 O SER A 105 -0.004 -2.250 6.112 1.00 0.96 O ATOM 1771 CB SER A 105 -1.598 -1.948 3.736 1.00 0.52 C ATOM 1772 OG SER A 105 -2.412 -2.059 4.895 1.00 1.27 O ATOM 0 H SER A 105 0.296 -1.750 2.094 1.00 0.43 H new ATOM 0 HA SER A 105 -0.602 -0.137 4.354 1.00 0.49 H new ATOM 0 HB2 SER A 105 -2.170 -1.480 2.935 1.00 0.52 H new ATOM 0 HB3 SER A 105 -1.323 -2.944 3.390 1.00 0.52 H new ATOM 0 HG SER A 105 -1.843 -2.178 5.684 1.00 1.27 H new ATOM 1778 N LYS A 106 1.839 -1.813 4.903 1.00 0.45 N ATOM 1779 CA LYS A 106 2.736 -2.462 5.850 1.00 0.49 C ATOM 1780 C LYS A 106 4.068 -1.710 5.952 1.00 0.52 C ATOM 1781 O LYS A 106 4.422 -0.929 5.063 1.00 0.65 O ATOM 1782 CB LYS A 106 2.948 -3.925 5.436 1.00 0.58 C ATOM 1783 CG LYS A 106 3.545 -4.086 4.048 1.00 0.69 C ATOM 1784 CD LYS A 106 5.058 -4.139 4.099 1.00 0.58 C ATOM 1785 CE LYS A 106 5.682 -3.739 2.783 1.00 1.00 C ATOM 1786 NZ LYS A 106 5.653 -2.265 2.604 1.00 2.02 N ATOM 0 H LYS A 106 2.306 -1.388 4.102 1.00 0.45 H new ATOM 0 HA LYS A 106 2.282 -2.442 6.841 1.00 0.49 H new ATOM 0 HB2 LYS A 106 3.603 -4.408 6.162 1.00 0.58 H new ATOM 0 HB3 LYS A 106 1.991 -4.446 5.473 1.00 0.58 H new ATOM 0 HG2 LYS A 106 3.163 -4.998 3.590 1.00 0.69 H new ATOM 0 HG3 LYS A 106 3.230 -3.256 3.416 1.00 0.69 H new ATOM 0 HD2 LYS A 106 5.418 -3.477 4.887 1.00 0.58 H new ATOM 0 HD3 LYS A 106 5.377 -5.148 4.360 1.00 0.58 H new ATOM 0 HE2 LYS A 106 6.712 -4.093 2.743 1.00 1.00 H new ATOM 0 HE3 LYS A 106 5.148 -4.219 1.963 1.00 1.00 H new ATOM 0 HZ1 LYS A 106 6.247 -2.002 1.791 1.00 2.02 H new ATOM 0 HZ2 LYS A 106 4.675 -1.955 2.433 1.00 2.02 H new ATOM 0 HZ3 LYS A 106 6.017 -1.804 3.462 1.00 2.02 H new ATOM 1800 N THR A 107 4.804 -1.972 7.028 1.00 0.53 N ATOM 1801 CA THR A 107 6.045 -1.264 7.338 1.00 0.57 C ATOM 1802 C THR A 107 7.196 -1.597 6.373 1.00 0.52 C ATOM 1803 O THR A 107 7.017 -2.302 5.378 1.00 0.54 O ATOM 1804 CB THR A 107 6.460 -1.579 8.782 1.00 0.69 C ATOM 1805 OG1 THR A 107 5.948 -2.865 9.150 1.00 0.76 O ATOM 1806 CG2 THR A 107 5.933 -0.524 9.743 1.00 0.74 C ATOM 0 H THR A 107 4.556 -2.685 7.714 1.00 0.53 H new ATOM 0 HA THR A 107 5.846 -0.199 7.219 1.00 0.57 H new ATOM 0 HB THR A 107 7.548 -1.580 8.840 1.00 0.69 H new ATOM 0 HG1 THR A 107 6.212 -3.071 10.071 1.00 0.76 H new ATOM 0 HG21 THR A 107 6.241 -0.771 10.759 1.00 0.74 H new ATOM 0 HG22 THR A 107 6.335 0.451 9.469 1.00 0.74 H new ATOM 0 HG23 THR A 107 4.845 -0.495 9.691 1.00 0.74 H new ATOM 1814 N VAL A 108 8.383 -1.072 6.667 1.00 0.49 N ATOM 1815 CA VAL A 108 9.515 -1.163 5.748 1.00 0.47 C ATOM 1816 C VAL A 108 10.223 -2.522 5.782 1.00 0.42 C ATOM 1817 O VAL A 108 10.578 -3.056 4.738 1.00 0.44 O ATOM 1818 CB VAL A 108 10.537 -0.050 6.034 1.00 0.55 C ATOM 1819 CG1 VAL A 108 11.725 -0.139 5.091 1.00 0.61 C ATOM 1820 CG2 VAL A 108 9.883 1.320 5.948 1.00 0.60 C ATOM 0 H VAL A 108 8.586 -0.578 7.536 1.00 0.49 H new ATOM 0 HA VAL A 108 9.096 -1.043 4.749 1.00 0.47 H new ATOM 0 HB VAL A 108 10.905 -0.190 7.050 1.00 0.55 H new ATOM 0 HG11 VAL A 108 12.430 0.661 5.318 1.00 0.61 H new ATOM 0 HG12 VAL A 108 12.217 -1.103 5.216 1.00 0.61 H new ATOM 0 HG13 VAL A 108 11.381 -0.038 4.062 1.00 0.61 H new ATOM 0 HG21 VAL A 108 10.625 2.091 6.154 1.00 0.60 H new ATOM 0 HG22 VAL A 108 9.476 1.467 4.948 1.00 0.60 H new ATOM 0 HG23 VAL A 108 9.079 1.386 6.681 1.00 0.60 H new ATOM 1830 N THR A 109 10.488 -3.047 6.968 1.00 0.43 N ATOM 1831 CA THR A 109 11.081 -4.383 7.110 1.00 0.43 C ATOM 1832 C THR A 109 10.391 -5.428 6.219 1.00 0.44 C ATOM 1833 O THR A 109 11.053 -6.123 5.444 1.00 0.45 O ATOM 1834 CB THR A 109 11.034 -4.849 8.574 1.00 0.51 C ATOM 1835 OG1 THR A 109 11.641 -3.855 9.409 1.00 0.56 O ATOM 1836 CG2 THR A 109 11.756 -6.176 8.748 1.00 0.56 C ATOM 0 H THR A 109 10.304 -2.573 7.852 1.00 0.43 H new ATOM 0 HA THR A 109 12.118 -4.297 6.786 1.00 0.43 H new ATOM 0 HB THR A 109 9.992 -4.988 8.861 1.00 0.51 H new ATOM 0 HG1 THR A 109 10.976 -3.176 9.645 1.00 0.56 H new ATOM 0 HG21 THR A 109 11.707 -6.482 9.793 1.00 0.56 H new ATOM 0 HG22 THR A 109 11.280 -6.934 8.125 1.00 0.56 H new ATOM 0 HG23 THR A 109 12.799 -6.065 8.451 1.00 0.56 H new ATOM 1844 N ASP A 110 9.067 -5.521 6.314 1.00 0.47 N ATOM 1845 CA ASP A 110 8.299 -6.464 5.499 1.00 0.51 C ATOM 1846 C ASP A 110 8.446 -6.128 4.015 1.00 0.49 C ATOM 1847 O ASP A 110 8.403 -7.010 3.153 1.00 0.54 O ATOM 1848 CB ASP A 110 6.823 -6.434 5.916 1.00 0.57 C ATOM 1849 CG ASP A 110 6.020 -7.588 5.339 1.00 0.65 C ATOM 1850 OD1 ASP A 110 5.530 -7.465 4.194 1.00 0.70 O ATOM 1851 OD2 ASP A 110 5.887 -8.629 6.018 1.00 0.76 O ATOM 0 H ASP A 110 8.502 -4.955 6.947 1.00 0.47 H new ATOM 0 HA ASP A 110 8.688 -7.469 5.661 1.00 0.51 H new ATOM 0 HB2 ASP A 110 6.758 -6.461 7.004 1.00 0.57 H new ATOM 0 HB3 ASP A 110 6.379 -5.492 5.593 1.00 0.57 H new ATOM 1856 N MET A 111 8.649 -4.845 3.727 1.00 0.46 N ATOM 1857 CA MET A 111 8.891 -4.385 2.363 1.00 0.46 C ATOM 1858 C MET A 111 10.201 -4.947 1.849 1.00 0.40 C ATOM 1859 O MET A 111 10.261 -5.518 0.765 1.00 0.43 O ATOM 1860 CB MET A 111 8.950 -2.855 2.313 1.00 0.51 C ATOM 1861 CG MET A 111 9.072 -2.287 0.907 1.00 0.50 C ATOM 1862 SD MET A 111 9.504 -0.535 0.895 1.00 0.75 S ATOM 1863 CE MET A 111 8.636 0.050 2.346 1.00 0.67 C ATOM 0 H MET A 111 8.651 -4.101 4.425 1.00 0.46 H new ATOM 0 HA MET A 111 8.070 -4.733 1.736 1.00 0.46 H new ATOM 0 HB2 MET A 111 8.052 -2.451 2.780 1.00 0.51 H new ATOM 0 HB3 MET A 111 9.799 -2.515 2.906 1.00 0.51 H new ATOM 0 HG2 MET A 111 9.829 -2.847 0.358 1.00 0.50 H new ATOM 0 HG3 MET A 111 8.128 -2.427 0.380 1.00 0.50 H new ATOM 0 HE1 MET A 111 8.093 0.963 2.102 1.00 0.67 H new ATOM 0 HE2 MET A 111 7.932 -0.712 2.681 1.00 0.67 H new ATOM 0 HE3 MET A 111 9.353 0.256 3.141 1.00 0.67 H new ATOM 1873 N LEU A 112 11.244 -4.790 2.650 1.00 0.36 N ATOM 1874 CA LEU A 112 12.576 -5.222 2.264 1.00 0.34 C ATOM 1875 C LEU A 112 12.611 -6.732 2.103 1.00 0.37 C ATOM 1876 O LEU A 112 13.243 -7.250 1.187 1.00 0.42 O ATOM 1877 CB LEU A 112 13.601 -4.789 3.303 1.00 0.35 C ATOM 1878 CG LEU A 112 14.984 -4.484 2.740 1.00 0.38 C ATOM 1879 CD1 LEU A 112 14.952 -3.186 1.954 1.00 0.39 C ATOM 1880 CD2 LEU A 112 16.009 -4.409 3.849 1.00 0.46 C ATOM 0 H LEU A 112 11.191 -4.364 3.575 1.00 0.36 H new ATOM 0 HA LEU A 112 12.826 -4.756 1.311 1.00 0.34 H new ATOM 0 HB2 LEU A 112 13.228 -3.902 3.815 1.00 0.35 H new ATOM 0 HB3 LEU A 112 13.693 -5.575 4.053 1.00 0.35 H new ATOM 0 HG LEU A 112 15.272 -5.293 2.068 1.00 0.38 H new ATOM 0 HD11 LEU A 112 15.945 -2.977 1.556 1.00 0.39 H new ATOM 0 HD12 LEU A 112 14.243 -3.276 1.131 1.00 0.39 H new ATOM 0 HD13 LEU A 112 14.645 -2.371 2.610 1.00 0.39 H new ATOM 0 HD21 LEU A 112 16.989 -4.190 3.425 1.00 0.46 H new ATOM 0 HD22 LEU A 112 15.732 -3.620 4.548 1.00 0.46 H new ATOM 0 HD23 LEU A 112 16.046 -5.363 4.375 1.00 0.46 H new ATOM 1892 N MET A 113 11.920 -7.430 3.001 1.00 0.39 N ATOM 1893 CA MET A 113 11.760 -8.878 2.895 1.00 0.46 C ATOM 1894 C MET A 113 11.239 -9.231 1.517 1.00 0.49 C ATOM 1895 O MET A 113 11.769 -10.104 0.836 1.00 0.56 O ATOM 1896 CB MET A 113 10.771 -9.385 3.943 1.00 0.55 C ATOM 1897 CG MET A 113 10.555 -10.890 3.890 1.00 0.61 C ATOM 1898 SD MET A 113 9.220 -11.443 4.968 1.00 0.98 S ATOM 1899 CE MET A 113 9.853 -10.957 6.570 1.00 1.34 C ATOM 0 H MET A 113 11.461 -7.015 3.812 1.00 0.39 H new ATOM 0 HA MET A 113 12.730 -9.347 3.061 1.00 0.46 H new ATOM 0 HB2 MET A 113 11.132 -9.112 4.935 1.00 0.55 H new ATOM 0 HB3 MET A 113 9.814 -8.883 3.802 1.00 0.55 H new ATOM 0 HG2 MET A 113 10.333 -11.185 2.864 1.00 0.61 H new ATOM 0 HG3 MET A 113 11.478 -11.395 4.174 1.00 0.61 H new ATOM 0 HE1 MET A 113 9.189 -11.327 7.351 1.00 1.34 H new ATOM 0 HE2 MET A 113 10.849 -11.378 6.711 1.00 1.34 H new ATOM 0 HE3 MET A 113 9.908 -9.870 6.625 1.00 1.34 H new ATOM 1909 N THR A 114 10.212 -8.505 1.117 1.00 0.47 N ATOM 1910 CA THR A 114 9.564 -8.710 -0.159 1.00 0.50 C ATOM 1911 C THR A 114 10.514 -8.404 -1.319 1.00 0.46 C ATOM 1912 O THR A 114 10.544 -9.134 -2.306 1.00 0.49 O ATOM 1913 CB THR A 114 8.307 -7.825 -0.258 1.00 0.54 C ATOM 1914 OG1 THR A 114 7.389 -8.174 0.787 1.00 0.62 O ATOM 1915 CG2 THR A 114 7.627 -7.968 -1.612 1.00 0.60 C ATOM 0 H THR A 114 9.804 -7.753 1.673 1.00 0.47 H new ATOM 0 HA THR A 114 9.274 -9.759 -0.228 1.00 0.50 H new ATOM 0 HB THR A 114 8.616 -6.786 -0.148 1.00 0.54 H new ATOM 0 HG1 THR A 114 7.690 -7.780 1.632 1.00 0.62 H new ATOM 0 HG21 THR A 114 6.744 -7.329 -1.645 1.00 0.60 H new ATOM 0 HG22 THR A 114 8.319 -7.672 -2.400 1.00 0.60 H new ATOM 0 HG23 THR A 114 7.330 -9.006 -1.762 1.00 0.60 H new ATOM 1923 N ILE A 115 11.315 -7.352 -1.183 1.00 0.43 N ATOM 1924 CA ILE A 115 12.199 -6.917 -2.259 1.00 0.41 C ATOM 1925 C ILE A 115 13.401 -7.849 -2.400 1.00 0.42 C ATOM 1926 O ILE A 115 13.712 -8.309 -3.500 1.00 0.43 O ATOM 1927 CB ILE A 115 12.701 -5.475 -2.026 1.00 0.40 C ATOM 1928 CG1 ILE A 115 11.514 -4.514 -1.909 1.00 0.42 C ATOM 1929 CG2 ILE A 115 13.627 -5.043 -3.156 1.00 0.42 C ATOM 1930 CD1 ILE A 115 11.906 -3.104 -1.528 1.00 0.44 C ATOM 0 H ILE A 115 11.370 -6.784 -0.337 1.00 0.43 H new ATOM 0 HA ILE A 115 11.615 -6.946 -3.179 1.00 0.41 H new ATOM 0 HB ILE A 115 13.264 -5.449 -1.093 1.00 0.40 H new ATOM 0 HG12 ILE A 115 10.983 -4.489 -2.861 1.00 0.42 H new ATOM 0 HG13 ILE A 115 10.817 -4.901 -1.166 1.00 0.42 H new ATOM 0 HG21 ILE A 115 13.971 -4.025 -2.975 1.00 0.42 H new ATOM 0 HG22 ILE A 115 14.485 -5.714 -3.200 1.00 0.42 H new ATOM 0 HG23 ILE A 115 13.088 -5.081 -4.103 1.00 0.42 H new ATOM 0 HD11 ILE A 115 11.013 -2.483 -1.465 1.00 0.44 H new ATOM 0 HD12 ILE A 115 12.410 -3.115 -0.561 1.00 0.44 H new ATOM 0 HD13 ILE A 115 12.579 -2.697 -2.283 1.00 0.44 H new ATOM 1942 N CYS A 116 14.059 -8.146 -1.283 1.00 0.43 N ATOM 1943 CA CYS A 116 15.245 -8.993 -1.305 1.00 0.47 C ATOM 1944 C CYS A 116 14.875 -10.414 -1.731 1.00 0.50 C ATOM 1945 O CYS A 116 15.682 -11.128 -2.328 1.00 0.53 O ATOM 1946 CB CYS A 116 15.934 -9.002 0.066 1.00 0.51 C ATOM 1947 SG CYS A 116 16.258 -7.357 0.745 1.00 1.56 S ATOM 0 H CYS A 116 13.792 -7.814 -0.356 1.00 0.43 H new ATOM 0 HA CYS A 116 15.946 -8.584 -2.033 1.00 0.47 H new ATOM 0 HB2 CYS A 116 15.312 -9.557 0.769 1.00 0.51 H new ATOM 0 HB3 CYS A 116 16.878 -9.540 -0.018 1.00 0.51 H new ATOM 0 HG CYS A 116 15.130 -6.758 0.989 1.00 1.56 H new ATOM 1953 N ALA A 117 13.634 -10.806 -1.452 1.00 0.50 N ATOM 1954 CA ALA A 117 13.140 -12.122 -1.833 1.00 0.54 C ATOM 1955 C ALA A 117 13.005 -12.247 -3.348 1.00 0.54 C ATOM 1956 O ALA A 117 13.069 -13.348 -3.891 1.00 0.58 O ATOM 1957 CB ALA A 117 11.805 -12.408 -1.162 1.00 0.57 C ATOM 0 H ALA A 117 12.952 -10.227 -0.962 1.00 0.50 H new ATOM 0 HA ALA A 117 13.869 -12.859 -1.496 1.00 0.54 H new ATOM 0 HB1 ALA A 117 11.453 -13.396 -1.459 1.00 0.57 H new ATOM 0 HB2 ALA A 117 11.928 -12.377 -0.079 1.00 0.57 H new ATOM 0 HB3 ALA A 117 11.077 -11.656 -1.466 1.00 0.57 H new ATOM 1963 N ARG A 118 12.823 -11.117 -4.029 1.00 0.50 N ATOM 1964 CA ARG A 118 12.685 -11.128 -5.484 1.00 0.51 C ATOM 1965 C ARG A 118 14.025 -11.454 -6.124 1.00 0.52 C ATOM 1966 O ARG A 118 14.090 -12.140 -7.144 1.00 0.55 O ATOM 1967 CB ARG A 118 12.179 -9.778 -6.016 1.00 0.49 C ATOM 1968 CG ARG A 118 11.018 -9.197 -5.226 1.00 0.49 C ATOM 1969 CD ARG A 118 9.824 -10.138 -5.147 1.00 0.58 C ATOM 1970 NE ARG A 118 9.102 -10.254 -6.414 1.00 0.84 N ATOM 1971 CZ ARG A 118 7.786 -10.474 -6.492 1.00 1.16 C ATOM 1972 NH1 ARG A 118 7.072 -10.658 -5.386 1.00 1.23 N ATOM 1973 NH2 ARG A 118 7.185 -10.527 -7.671 1.00 1.75 N ATOM 0 H ARG A 118 12.768 -10.192 -3.603 1.00 0.50 H new ATOM 0 HA ARG A 118 11.951 -11.891 -5.743 1.00 0.51 H new ATOM 0 HB2 ARG A 118 13.003 -9.065 -6.009 1.00 0.49 H new ATOM 0 HB3 ARG A 118 11.873 -9.900 -7.055 1.00 0.49 H new ATOM 0 HG2 ARG A 118 11.355 -8.960 -4.217 1.00 0.49 H new ATOM 0 HG3 ARG A 118 10.705 -8.260 -5.686 1.00 0.49 H new ATOM 0 HD2 ARG A 118 10.167 -11.126 -4.839 1.00 0.58 H new ATOM 0 HD3 ARG A 118 9.139 -9.783 -4.376 1.00 0.58 H new ATOM 0 HE ARG A 118 9.630 -10.162 -7.282 1.00 0.84 H new ATOM 0 HH11 ARG A 118 7.528 -10.632 -4.474 1.00 1.23 H new ATOM 0 HH12 ARG A 118 6.068 -10.826 -5.449 1.00 1.23 H new ATOM 0 HH21 ARG A 118 7.727 -10.400 -8.526 1.00 1.75 H new ATOM 0 HH22 ARG A 118 6.180 -10.695 -7.724 1.00 1.75 H new ATOM 1987 N ILE A 119 15.095 -10.962 -5.512 1.00 0.52 N ATOM 1988 CA ILE A 119 16.442 -11.185 -6.022 1.00 0.54 C ATOM 1989 C ILE A 119 16.937 -12.564 -5.612 1.00 0.58 C ATOM 1990 O ILE A 119 17.749 -13.183 -6.299 1.00 0.66 O ATOM 1991 CB ILE A 119 17.431 -10.132 -5.479 1.00 0.51 C ATOM 1992 CG1 ILE A 119 16.728 -8.792 -5.255 1.00 0.49 C ATOM 1993 CG2 ILE A 119 18.596 -9.960 -6.442 1.00 0.56 C ATOM 1994 CD1 ILE A 119 16.221 -8.141 -6.525 1.00 0.69 C ATOM 0 H ILE A 119 15.056 -10.404 -4.659 1.00 0.52 H new ATOM 0 HA ILE A 119 16.395 -11.106 -7.108 1.00 0.54 H new ATOM 0 HB ILE A 119 17.814 -10.483 -4.520 1.00 0.51 H new ATOM 0 HG12 ILE A 119 15.888 -8.943 -4.577 1.00 0.49 H new ATOM 0 HG13 ILE A 119 17.419 -8.109 -4.760 1.00 0.49 H new ATOM 0 HG21 ILE A 119 19.287 -9.215 -6.048 1.00 0.56 H new ATOM 0 HG22 ILE A 119 19.116 -10.911 -6.558 1.00 0.56 H new ATOM 0 HG23 ILE A 119 18.221 -9.631 -7.411 1.00 0.56 H new ATOM 0 HD11 ILE A 119 15.736 -7.196 -6.281 1.00 0.69 H new ATOM 0 HD12 ILE A 119 17.058 -7.956 -7.198 1.00 0.69 H new ATOM 0 HD13 ILE A 119 15.504 -8.802 -7.012 1.00 0.69 H new ATOM 2006 N GLY A 120 16.442 -13.037 -4.477 1.00 0.57 N ATOM 2007 CA GLY A 120 16.845 -14.332 -3.980 1.00 0.62 C ATOM 2008 C GLY A 120 17.733 -14.227 -2.757 1.00 0.64 C ATOM 2009 O GLY A 120 18.530 -15.123 -2.480 1.00 0.70 O ATOM 0 H GLY A 120 15.767 -12.544 -3.892 1.00 0.57 H new ATOM 0 HA2 GLY A 120 15.958 -14.916 -3.734 1.00 0.62 H new ATOM 0 HA3 GLY A 120 17.374 -14.872 -4.765 1.00 0.62 H new ATOM 2013 N ILE A 121 17.597 -13.132 -2.028 1.00 0.66 N ATOM 2014 CA ILE A 121 18.388 -12.910 -0.827 1.00 0.71 C ATOM 2015 C ILE A 121 17.621 -13.412 0.394 1.00 0.82 C ATOM 2016 O ILE A 121 16.436 -13.106 0.558 1.00 1.54 O ATOM 2017 CB ILE A 121 18.710 -11.414 -0.636 1.00 0.63 C ATOM 2018 CG1 ILE A 121 19.227 -10.796 -1.940 1.00 0.59 C ATOM 2019 CG2 ILE A 121 19.730 -11.234 0.477 1.00 0.67 C ATOM 2020 CD1 ILE A 121 19.421 -9.293 -1.870 1.00 0.56 C ATOM 0 H ILE A 121 16.944 -12.380 -2.247 1.00 0.66 H new ATOM 0 HA ILE A 121 19.325 -13.457 -0.937 1.00 0.71 H new ATOM 0 HB ILE A 121 17.791 -10.898 -0.357 1.00 0.63 H new ATOM 0 HG12 ILE A 121 20.176 -11.264 -2.202 1.00 0.59 H new ATOM 0 HG13 ILE A 121 18.526 -11.026 -2.743 1.00 0.59 H new ATOM 0 HG21 ILE A 121 19.949 -10.174 0.602 1.00 0.67 H new ATOM 0 HG22 ILE A 121 19.327 -11.634 1.408 1.00 0.67 H new ATOM 0 HG23 ILE A 121 20.646 -11.766 0.220 1.00 0.67 H new ATOM 0 HD11 ILE A 121 19.788 -8.928 -2.829 1.00 0.56 H new ATOM 0 HD12 ILE A 121 18.469 -8.814 -1.640 1.00 0.56 H new ATOM 0 HD13 ILE A 121 20.145 -9.055 -1.090 1.00 0.56 H new ATOM 2032 N THR A 122 18.280 -14.189 1.239 1.00 0.96 N ATOM 2033 CA THR A 122 17.629 -14.731 2.420 1.00 1.00 C ATOM 2034 C THR A 122 17.811 -13.801 3.624 1.00 0.90 C ATOM 2035 O THR A 122 16.879 -13.592 4.404 1.00 1.04 O ATOM 2036 CB THR A 122 18.138 -16.159 2.748 1.00 1.18 C ATOM 2037 OG1 THR A 122 17.341 -16.740 3.791 1.00 1.55 O ATOM 2038 CG2 THR A 122 19.603 -16.157 3.168 1.00 1.65 C ATOM 0 H THR A 122 19.258 -14.457 1.130 1.00 0.96 H new ATOM 0 HA THR A 122 16.564 -14.802 2.200 1.00 1.00 H new ATOM 0 HB THR A 122 18.048 -16.754 1.839 1.00 1.18 H new ATOM 0 HG1 THR A 122 17.669 -17.642 3.990 1.00 1.55 H new ATOM 0 HG21 THR A 122 19.920 -17.176 3.389 1.00 1.65 H new ATOM 0 HG22 THR A 122 20.213 -15.755 2.359 1.00 1.65 H new ATOM 0 HG23 THR A 122 19.726 -15.538 4.057 1.00 1.65 H new ATOM 2046 N ASN A 123 18.993 -13.211 3.753 1.00 0.91 N ATOM 2047 CA ASN A 123 19.290 -12.325 4.872 1.00 0.87 C ATOM 2048 C ASN A 123 18.930 -10.883 4.526 1.00 0.77 C ATOM 2049 O ASN A 123 19.787 -10.063 4.209 1.00 1.05 O ATOM 2050 CB ASN A 123 20.765 -12.437 5.302 1.00 1.10 C ATOM 2051 CG ASN A 123 21.754 -12.258 4.158 1.00 1.31 C ATOM 2052 OD1 ASN A 123 21.473 -12.607 3.010 1.00 2.13 O ATOM 2053 ND2 ASN A 123 22.924 -11.716 4.461 1.00 1.50 N ATOM 0 H ASN A 123 19.763 -13.330 3.095 1.00 0.91 H new ATOM 0 HA ASN A 123 18.678 -12.638 5.718 1.00 0.87 H new ATOM 0 HB2 ASN A 123 20.969 -11.687 6.067 1.00 1.10 H new ATOM 0 HB3 ASN A 123 20.927 -13.412 5.761 1.00 1.10 H new ATOM 0 HD21 ASN A 123 23.625 -11.576 3.733 1.00 1.50 H new ATOM 0 HD22 ASN A 123 23.124 -11.438 5.422 1.00 1.50 H new ATOM 2060 N HIS A 124 17.639 -10.586 4.584 1.00 0.61 N ATOM 2061 CA HIS A 124 17.136 -9.261 4.235 1.00 0.59 C ATOM 2062 C HIS A 124 17.244 -8.314 5.424 1.00 0.57 C ATOM 2063 O HIS A 124 17.112 -7.099 5.283 1.00 0.66 O ATOM 2064 CB HIS A 124 15.675 -9.340 3.771 1.00 0.63 C ATOM 2065 CG HIS A 124 14.706 -9.685 4.864 1.00 0.58 C ATOM 2066 ND1 HIS A 124 14.040 -8.735 5.607 1.00 0.55 N ATOM 2067 CD2 HIS A 124 14.296 -10.883 5.339 1.00 0.66 C ATOM 2068 CE1 HIS A 124 13.266 -9.334 6.490 1.00 0.57 C ATOM 2069 NE2 HIS A 124 13.403 -10.638 6.352 1.00 0.66 N ATOM 0 H HIS A 124 16.917 -11.247 4.871 1.00 0.61 H new ATOM 0 HA HIS A 124 17.747 -8.876 3.418 1.00 0.59 H new ATOM 0 HB2 HIS A 124 15.390 -8.382 3.336 1.00 0.63 H new ATOM 0 HB3 HIS A 124 15.595 -10.086 2.980 1.00 0.63 H new ATOM 0 HD1 HIS A 124 14.132 -7.726 5.492 1.00 0.55 H new ATOM 0 HD2 HIS A 124 14.613 -11.853 4.986 1.00 0.66 H new ATOM 0 HE1 HIS A 124 12.627 -8.839 7.206 1.00 0.57 H new ATOM 2078 N ASP A 125 17.476 -8.883 6.598 1.00 0.62 N ATOM 2079 CA ASP A 125 17.519 -8.111 7.830 1.00 0.72 C ATOM 2080 C ASP A 125 18.791 -7.283 7.903 1.00 0.64 C ATOM 2081 O ASP A 125 18.869 -6.316 8.660 1.00 0.66 O ATOM 2082 CB ASP A 125 17.432 -9.037 9.049 1.00 0.97 C ATOM 2083 CG ASP A 125 18.656 -9.921 9.211 1.00 1.54 C ATOM 2084 OD1 ASP A 125 18.827 -10.858 8.400 1.00 2.14 O ATOM 2085 OD2 ASP A 125 19.447 -9.690 10.154 1.00 2.11 O ATOM 0 H ASP A 125 17.638 -9.882 6.723 1.00 0.62 H new ATOM 0 HA ASP A 125 16.662 -7.438 7.835 1.00 0.72 H new ATOM 0 HB2 ASP A 125 17.305 -8.434 9.948 1.00 0.97 H new ATOM 0 HB3 ASP A 125 16.546 -9.666 8.958 1.00 0.97 H new ATOM 2090 N GLU A 126 19.772 -7.641 7.084 1.00 0.62 N ATOM 2091 CA GLU A 126 21.073 -6.994 7.136 1.00 0.62 C ATOM 2092 C GLU A 126 21.152 -5.861 6.133 1.00 0.52 C ATOM 2093 O GLU A 126 22.239 -5.404 5.776 1.00 0.61 O ATOM 2094 CB GLU A 126 22.178 -8.017 6.885 1.00 0.76 C ATOM 2095 CG GLU A 126 22.018 -9.255 7.755 1.00 1.19 C ATOM 2096 CD GLU A 126 23.267 -10.093 7.854 1.00 1.84 C ATOM 2097 OE1 GLU A 126 23.474 -10.962 6.986 1.00 2.30 O ATOM 2098 OE2 GLU A 126 24.035 -9.902 8.822 1.00 2.27 O ATOM 0 H GLU A 126 19.690 -8.373 6.379 1.00 0.62 H new ATOM 0 HA GLU A 126 21.210 -6.570 8.131 1.00 0.62 H new ATOM 0 HB2 GLU A 126 22.170 -8.309 5.835 1.00 0.76 H new ATOM 0 HB3 GLU A 126 23.147 -7.559 7.081 1.00 0.76 H new ATOM 0 HG2 GLU A 126 21.717 -8.948 8.757 1.00 1.19 H new ATOM 0 HG3 GLU A 126 21.211 -9.868 7.354 1.00 1.19 H new ATOM 2105 N TYR A 127 19.996 -5.394 5.702 1.00 0.43 N ATOM 2106 CA TYR A 127 19.925 -4.292 4.767 1.00 0.38 C ATOM 2107 C TYR A 127 19.072 -3.169 5.319 1.00 0.39 C ATOM 2108 O TYR A 127 18.106 -3.400 6.053 1.00 0.42 O ATOM 2109 CB TYR A 127 19.335 -4.747 3.438 1.00 0.36 C ATOM 2110 CG TYR A 127 20.135 -5.813 2.748 1.00 0.36 C ATOM 2111 CD1 TYR A 127 21.403 -5.545 2.265 1.00 0.38 C ATOM 2112 CD2 TYR A 127 19.616 -7.082 2.574 1.00 0.40 C ATOM 2113 CE1 TYR A 127 22.137 -6.515 1.624 1.00 0.41 C ATOM 2114 CE2 TYR A 127 20.339 -8.062 1.936 1.00 0.43 C ATOM 2115 CZ TYR A 127 21.604 -7.776 1.459 1.00 0.43 C ATOM 2116 OH TYR A 127 22.340 -8.745 0.819 1.00 0.49 O ATOM 0 H TYR A 127 19.089 -5.764 5.987 1.00 0.43 H new ATOM 0 HA TYR A 127 20.942 -3.932 4.611 1.00 0.38 H new ATOM 0 HB2 TYR A 127 18.325 -5.119 3.609 1.00 0.36 H new ATOM 0 HB3 TYR A 127 19.250 -3.885 2.776 1.00 0.36 H new ATOM 0 HD1 TYR A 127 21.823 -4.558 2.393 1.00 0.38 H new ATOM 0 HD2 TYR A 127 18.627 -7.307 2.945 1.00 0.40 H new ATOM 0 HE1 TYR A 127 23.126 -6.290 1.252 1.00 0.41 H new ATOM 0 HE2 TYR A 127 19.921 -9.050 1.808 1.00 0.43 H new ATOM 0 HH TYR A 127 23.288 -8.636 1.041 1.00 0.49 H new ATOM 2126 N SER A 128 19.431 -1.954 4.975 1.00 0.40 N ATOM 2127 CA SER A 128 18.607 -0.809 5.275 1.00 0.42 C ATOM 2128 C SER A 128 18.045 -0.256 3.978 1.00 0.41 C ATOM 2129 O SER A 128 18.509 -0.621 2.893 1.00 0.54 O ATOM 2130 CB SER A 128 19.424 0.251 6.010 1.00 0.47 C ATOM 2131 OG SER A 128 20.690 0.428 5.396 1.00 1.13 O ATOM 0 H SER A 128 20.297 -1.733 4.483 1.00 0.40 H new ATOM 0 HA SER A 128 17.784 -1.105 5.925 1.00 0.42 H new ATOM 0 HB2 SER A 128 18.882 1.196 6.014 1.00 0.47 H new ATOM 0 HB3 SER A 128 19.558 -0.044 7.051 1.00 0.47 H new ATOM 0 HG SER A 128 21.196 1.112 5.882 1.00 1.13 H new ATOM 2137 N LEU A 129 17.046 0.600 4.067 1.00 0.42 N ATOM 2138 CA LEU A 129 16.465 1.160 2.863 1.00 0.42 C ATOM 2139 C LEU A 129 16.822 2.632 2.799 1.00 0.43 C ATOM 2140 O LEU A 129 16.937 3.278 3.826 1.00 0.48 O ATOM 2141 CB LEU A 129 14.945 0.946 2.853 1.00 0.43 C ATOM 2142 CG LEU A 129 14.322 0.662 1.478 1.00 0.45 C ATOM 2143 CD1 LEU A 129 12.912 0.122 1.639 1.00 1.33 C ATOM 2144 CD2 LEU A 129 14.297 1.911 0.612 1.00 1.13 C ATOM 0 H LEU A 129 16.627 0.918 4.941 1.00 0.42 H new ATOM 0 HA LEU A 129 16.864 0.658 1.981 1.00 0.42 H new ATOM 0 HB2 LEU A 129 14.709 0.114 3.517 1.00 0.43 H new ATOM 0 HB3 LEU A 129 14.469 1.833 3.271 1.00 0.43 H new ATOM 0 HG LEU A 129 14.941 -0.086 0.982 1.00 0.45 H new ATOM 0 HD11 LEU A 129 12.483 -0.075 0.656 1.00 1.33 H new ATOM 0 HD12 LEU A 129 12.940 -0.803 2.214 1.00 1.33 H new ATOM 0 HD13 LEU A 129 12.299 0.856 2.162 1.00 1.33 H new ATOM 0 HD21 LEU A 129 13.850 1.675 -0.354 1.00 1.13 H new ATOM 0 HD22 LEU A 129 13.708 2.684 1.105 1.00 1.13 H new ATOM 0 HD23 LEU A 129 15.315 2.271 0.463 1.00 1.13 H new ATOM 2156 N VAL A 130 17.045 3.151 1.612 1.00 0.42 N ATOM 2157 CA VAL A 130 17.364 4.556 1.464 1.00 0.46 C ATOM 2158 C VAL A 130 16.623 5.135 0.257 1.00 0.46 C ATOM 2159 O VAL A 130 16.816 4.704 -0.882 1.00 0.45 O ATOM 2160 CB VAL A 130 18.898 4.765 1.368 1.00 0.48 C ATOM 2161 CG1 VAL A 130 19.487 4.017 0.200 1.00 0.49 C ATOM 2162 CG2 VAL A 130 19.266 6.227 1.280 1.00 0.60 C ATOM 0 H VAL A 130 17.012 2.626 0.738 1.00 0.42 H new ATOM 0 HA VAL A 130 17.028 5.096 2.349 1.00 0.46 H new ATOM 0 HB VAL A 130 19.321 4.363 2.289 1.00 0.48 H new ATOM 0 HG11 VAL A 130 20.563 4.187 0.164 1.00 0.49 H new ATOM 0 HG12 VAL A 130 19.292 2.951 0.315 1.00 0.49 H new ATOM 0 HG13 VAL A 130 19.033 4.371 -0.725 1.00 0.49 H new ATOM 0 HG21 VAL A 130 20.349 6.326 1.214 1.00 0.60 H new ATOM 0 HG22 VAL A 130 18.807 6.665 0.394 1.00 0.60 H new ATOM 0 HG23 VAL A 130 18.907 6.747 2.168 1.00 0.60 H new ATOM 2172 N ARG A 131 15.729 6.077 0.523 1.00 0.48 N ATOM 2173 CA ARG A 131 14.896 6.646 -0.522 1.00 0.50 C ATOM 2174 C ARG A 131 15.461 7.960 -1.030 1.00 0.57 C ATOM 2175 O ARG A 131 15.303 9.009 -0.395 1.00 0.64 O ATOM 2176 CB ARG A 131 13.492 6.922 0.000 1.00 0.54 C ATOM 2177 CG ARG A 131 12.838 5.768 0.728 1.00 0.51 C ATOM 2178 CD ARG A 131 11.344 6.000 0.803 1.00 0.62 C ATOM 2179 NE ARG A 131 10.721 5.810 -0.510 1.00 0.96 N ATOM 2180 CZ ARG A 131 10.112 6.772 -1.206 1.00 1.65 C ATOM 2181 NH1 ARG A 131 9.990 7.988 -0.705 1.00 2.18 N ATOM 2182 NH2 ARG A 131 9.633 6.520 -2.417 1.00 2.01 N ATOM 0 H ARG A 131 15.564 6.462 1.453 1.00 0.48 H new ATOM 0 HA ARG A 131 14.869 5.917 -1.332 1.00 0.50 H new ATOM 0 HB2 ARG A 131 13.533 7.779 0.673 1.00 0.54 H new ATOM 0 HB3 ARG A 131 12.859 7.207 -0.840 1.00 0.54 H new ATOM 0 HG2 ARG A 131 13.046 4.832 0.209 1.00 0.51 H new ATOM 0 HG3 ARG A 131 13.253 5.675 1.732 1.00 0.51 H new ATOM 0 HD2 ARG A 131 10.901 5.313 1.524 1.00 0.62 H new ATOM 0 HD3 ARG A 131 11.146 7.010 1.162 1.00 0.62 H new ATOM 0 HE ARG A 131 10.755 4.877 -0.921 1.00 0.96 H new ATOM 0 HH11 ARG A 131 10.363 8.198 0.221 1.00 2.18 H new ATOM 0 HH12 ARG A 131 9.523 8.717 -1.244 1.00 2.18 H new ATOM 0 HH21 ARG A 131 9.729 5.588 -2.820 1.00 2.01 H new ATOM 0 HH22 ARG A 131 9.168 7.258 -2.945 1.00 2.01 H new ATOM 2196 N GLU A 132 16.082 7.913 -2.186 1.00 0.58 N ATOM 2197 CA GLU A 132 16.539 9.131 -2.823 1.00 0.66 C ATOM 2198 C GLU A 132 15.385 9.776 -3.564 1.00 0.73 C ATOM 2199 O GLU A 132 14.868 9.214 -4.541 1.00 0.74 O ATOM 2200 CB GLU A 132 17.701 8.870 -3.779 1.00 0.68 C ATOM 2201 CG GLU A 132 18.957 8.362 -3.099 1.00 0.64 C ATOM 2202 CD GLU A 132 20.142 8.340 -4.040 1.00 0.72 C ATOM 2203 OE1 GLU A 132 19.983 7.888 -5.189 1.00 0.90 O ATOM 2204 OE2 GLU A 132 21.241 8.775 -3.630 1.00 1.05 O ATOM 0 H GLU A 132 16.282 7.056 -2.702 1.00 0.58 H new ATOM 0 HA GLU A 132 16.902 9.805 -2.047 1.00 0.66 H new ATOM 0 HB2 GLU A 132 17.386 8.143 -4.527 1.00 0.68 H new ATOM 0 HB3 GLU A 132 17.935 9.793 -4.310 1.00 0.68 H new ATOM 0 HG2 GLU A 132 19.186 8.995 -2.242 1.00 0.64 H new ATOM 0 HG3 GLU A 132 18.780 7.357 -2.715 1.00 0.64 H new ATOM 2211 N LEU A 133 14.964 10.942 -3.091 1.00 0.80 N ATOM 2212 CA LEU A 133 13.777 11.575 -3.643 1.00 0.87 C ATOM 2213 C LEU A 133 14.089 12.922 -4.272 1.00 0.97 C ATOM 2214 O LEU A 133 15.239 13.350 -4.356 1.00 1.02 O ATOM 2215 CB LEU A 133 12.720 11.768 -2.554 1.00 0.92 C ATOM 2216 CG LEU A 133 12.532 10.579 -1.614 1.00 0.87 C ATOM 2217 CD1 LEU A 133 11.451 10.873 -0.583 1.00 0.97 C ATOM 2218 CD2 LEU A 133 12.192 9.327 -2.402 1.00 0.80 C ATOM 0 H LEU A 133 15.419 11.460 -2.339 1.00 0.80 H new ATOM 0 HA LEU A 133 13.397 10.912 -4.420 1.00 0.87 H new ATOM 0 HB2 LEU A 133 12.988 12.642 -1.960 1.00 0.92 H new ATOM 0 HB3 LEU A 133 11.765 11.988 -3.031 1.00 0.92 H new ATOM 0 HG LEU A 133 13.470 10.409 -1.085 1.00 0.87 H new ATOM 0 HD11 LEU A 133 11.333 10.013 0.076 1.00 0.97 H new ATOM 0 HD12 LEU A 133 11.737 11.745 0.005 1.00 0.97 H new ATOM 0 HD13 LEU A 133 10.508 11.072 -1.092 1.00 0.97 H new ATOM 0 HD21 LEU A 133 12.062 8.490 -1.716 1.00 0.80 H new ATOM 0 HD22 LEU A 133 11.269 9.487 -2.959 1.00 0.80 H new ATOM 0 HD23 LEU A 133 13.001 9.104 -3.097 1.00 0.80 H new ATOM 2230 N MET A 134 13.029 13.583 -4.695 1.00 1.04 N ATOM 2231 CA MET A 134 13.096 14.922 -5.255 1.00 1.15 C ATOM 2232 C MET A 134 12.614 15.926 -4.220 1.00 1.22 C ATOM 2233 O MET A 134 12.211 17.040 -4.554 1.00 1.29 O ATOM 2234 CB MET A 134 12.218 15.005 -6.505 1.00 1.27 C ATOM 2235 CG MET A 134 10.934 14.198 -6.389 1.00 1.36 C ATOM 2236 SD MET A 134 9.471 15.093 -6.942 1.00 1.80 S ATOM 2237 CE MET A 134 9.307 16.309 -5.635 1.00 2.03 C ATOM 0 H MET A 134 12.084 13.201 -4.660 1.00 1.04 H new ATOM 0 HA MET A 134 14.126 15.150 -5.529 1.00 1.15 H new ATOM 0 HB2 MET A 134 11.968 16.048 -6.697 1.00 1.27 H new ATOM 0 HB3 MET A 134 12.786 14.650 -7.365 1.00 1.27 H new ATOM 0 HG2 MET A 134 11.034 13.284 -6.975 1.00 1.36 H new ATOM 0 HG3 MET A 134 10.796 13.897 -5.350 1.00 1.36 H new ATOM 0 HE1 MET A 134 8.279 16.671 -5.602 1.00 2.03 H new ATOM 0 HE2 MET A 134 9.562 15.852 -4.679 1.00 2.03 H new ATOM 0 HE3 MET A 134 9.980 17.144 -5.829 1.00 2.03 H new ATOM 2247 N GLU A 135 12.672 15.504 -2.962 1.00 1.27 N ATOM 2248 CA GLU A 135 12.157 16.271 -1.837 1.00 1.39 C ATOM 2249 C GLU A 135 12.653 17.709 -1.836 1.00 1.41 C ATOM 2250 O GLU A 135 13.846 17.969 -1.682 1.00 1.45 O ATOM 2251 CB GLU A 135 12.564 15.592 -0.537 1.00 1.48 C ATOM 2252 CG GLU A 135 11.656 14.452 -0.130 1.00 1.58 C ATOM 2253 CD GLU A 135 10.372 14.953 0.489 1.00 1.83 C ATOM 2254 OE1 GLU A 135 10.394 16.044 1.091 1.00 2.04 O ATOM 2255 OE2 GLU A 135 9.346 14.253 0.404 1.00 2.29 O ATOM 0 H GLU A 135 13.083 14.610 -2.693 1.00 1.27 H new ATOM 0 HA GLU A 135 11.072 16.303 -1.931 1.00 1.39 H new ATOM 0 HB2 GLU A 135 13.581 15.214 -0.639 1.00 1.48 H new ATOM 0 HB3 GLU A 135 12.578 16.335 0.261 1.00 1.48 H new ATOM 0 HG2 GLU A 135 11.425 13.841 -1.003 1.00 1.58 H new ATOM 0 HG3 GLU A 135 12.176 13.809 0.580 1.00 1.58 H new ATOM 2262 N GLU A 136 11.723 18.633 -2.002 1.00 1.46 N ATOM 2263 CA GLU A 136 12.018 20.048 -1.944 1.00 1.52 C ATOM 2264 C GLU A 136 12.164 20.485 -0.491 1.00 1.52 C ATOM 2265 O GLU A 136 12.877 21.436 -0.181 1.00 1.59 O ATOM 2266 CB GLU A 136 10.896 20.832 -2.625 1.00 1.67 C ATOM 2267 CG GLU A 136 9.543 20.663 -1.948 1.00 1.73 C ATOM 2268 CD GLU A 136 8.432 21.410 -2.648 1.00 1.93 C ATOM 2269 OE1 GLU A 136 7.803 20.834 -3.559 1.00 1.99 O ATOM 2270 OE2 GLU A 136 8.172 22.575 -2.291 1.00 2.12 O ATOM 0 H GLU A 136 10.742 18.420 -2.181 1.00 1.46 H new ATOM 0 HA GLU A 136 12.955 20.247 -2.464 1.00 1.52 H new ATOM 0 HB2 GLU A 136 11.158 21.890 -2.638 1.00 1.67 H new ATOM 0 HB3 GLU A 136 10.817 20.511 -3.664 1.00 1.67 H new ATOM 0 HG2 GLU A 136 9.292 19.603 -1.910 1.00 1.73 H new ATOM 0 HG3 GLU A 136 9.613 21.011 -0.917 1.00 1.73 H new ATOM 2277 N LYS A 137 11.487 19.764 0.394 1.00 1.53 N ATOM 2278 CA LYS A 137 11.499 20.082 1.814 1.00 1.61 C ATOM 2279 C LYS A 137 12.678 19.417 2.505 1.00 1.55 C ATOM 2280 O LYS A 137 13.605 20.086 2.963 1.00 1.63 O ATOM 2281 CB LYS A 137 10.202 19.617 2.472 1.00 1.72 C ATOM 2282 CG LYS A 137 8.950 20.185 1.831 1.00 1.83 C ATOM 2283 CD LYS A 137 7.701 19.640 2.494 1.00 2.14 C ATOM 2284 CE LYS A 137 6.446 20.175 1.832 1.00 2.31 C ATOM 2285 NZ LYS A 137 5.214 19.712 2.520 1.00 2.98 N ATOM 0 H LYS A 137 10.921 18.951 0.150 1.00 1.53 H new ATOM 0 HA LYS A 137 11.591 21.163 1.916 1.00 1.61 H new ATOM 0 HB2 LYS A 137 10.156 18.529 2.434 1.00 1.72 H new ATOM 0 HB3 LYS A 137 10.219 19.898 3.525 1.00 1.72 H new ATOM 0 HG2 LYS A 137 8.960 21.272 1.907 1.00 1.83 H new ATOM 0 HG3 LYS A 137 8.938 19.939 0.769 1.00 1.83 H new ATOM 0 HD2 LYS A 137 7.705 18.551 2.443 1.00 2.14 H new ATOM 0 HD3 LYS A 137 7.700 19.910 3.550 1.00 2.14 H new ATOM 0 HE2 LYS A 137 6.473 21.265 1.831 1.00 2.31 H new ATOM 0 HE3 LYS A 137 6.421 19.856 0.790 1.00 2.31 H new ATOM 0 HZ1 LYS A 137 4.379 20.100 2.036 1.00 2.98 H new ATOM 0 HZ2 LYS A 137 5.174 18.673 2.499 1.00 2.98 H new ATOM 0 HZ3 LYS A 137 5.224 20.038 3.507 1.00 2.98 H new ATOM 2299 N LYS A 138 12.634 18.090 2.571 1.00 1.47 N ATOM 2300 CA LYS A 138 13.661 17.323 3.260 1.00 1.45 C ATOM 2301 C LYS A 138 14.985 17.399 2.521 1.00 1.34 C ATOM 2302 O LYS A 138 15.997 17.821 3.079 1.00 1.43 O ATOM 2303 CB LYS A 138 13.248 15.854 3.381 1.00 1.48 C ATOM 2304 CG LYS A 138 11.935 15.639 4.107 1.00 1.52 C ATOM 2305 CD LYS A 138 11.717 14.166 4.423 1.00 1.58 C ATOM 2306 CE LYS A 138 10.963 13.439 3.319 1.00 1.42 C ATOM 2307 NZ LYS A 138 9.546 13.889 3.202 1.00 1.76 N ATOM 0 H LYS A 138 11.895 17.524 2.154 1.00 1.47 H new ATOM 0 HA LYS A 138 13.778 17.755 4.254 1.00 1.45 H new ATOM 0 HB2 LYS A 138 13.173 15.425 2.382 1.00 1.48 H new ATOM 0 HB3 LYS A 138 14.034 15.309 3.904 1.00 1.48 H new ATOM 0 HG2 LYS A 138 11.928 16.217 5.031 1.00 1.52 H new ATOM 0 HG3 LYS A 138 11.113 16.008 3.494 1.00 1.52 H new ATOM 0 HD2 LYS A 138 12.682 13.684 4.578 1.00 1.58 H new ATOM 0 HD3 LYS A 138 11.163 14.076 5.357 1.00 1.58 H new ATOM 0 HE2 LYS A 138 11.472 13.601 2.369 1.00 1.42 H new ATOM 0 HE3 LYS A 138 10.985 12.367 3.514 1.00 1.42 H new ATOM 0 HZ1 LYS A 138 9.269 13.906 2.200 1.00 1.76 H new ATOM 0 HZ2 LYS A 138 8.929 13.232 3.721 1.00 1.76 H new ATOM 0 HZ3 LYS A 138 9.451 14.843 3.604 1.00 1.76 H new ATOM 2321 N ASP A 169 14.945 16.995 1.256 1.00 1.23 N ATOM 2322 CA ASP A 169 16.137 16.818 0.443 1.00 1.18 C ATOM 2323 C ASP A 169 17.070 15.861 1.143 1.00 1.11 C ATOM 2324 O ASP A 169 18.032 16.250 1.812 1.00 1.30 O ATOM 2325 CB ASP A 169 16.822 18.157 0.130 1.00 1.35 C ATOM 2326 CG ASP A 169 18.021 18.013 -0.790 1.00 1.44 C ATOM 2327 OD1 ASP A 169 17.828 17.764 -2.001 1.00 1.48 O ATOM 2328 OD2 ASP A 169 19.167 18.125 -0.304 1.00 1.59 O ATOM 0 H ASP A 169 14.077 16.780 0.765 1.00 1.23 H new ATOM 0 HA ASP A 169 15.850 16.396 -0.520 1.00 1.18 H new ATOM 0 HB2 ASP A 169 16.098 18.830 -0.330 1.00 1.35 H new ATOM 0 HB3 ASP A 169 17.141 18.622 1.063 1.00 1.35 H new ATOM 2333 N GLU A 170 16.738 14.595 1.008 1.00 0.96 N ATOM 2334 CA GLU A 170 17.354 13.564 1.805 1.00 0.90 C ATOM 2335 C GLU A 170 17.516 12.266 1.030 1.00 0.78 C ATOM 2336 O GLU A 170 16.839 12.024 0.011 1.00 0.77 O ATOM 2337 CB GLU A 170 16.500 13.310 3.047 1.00 0.98 C ATOM 2338 CG GLU A 170 17.149 13.759 4.339 1.00 1.24 C ATOM 2339 CD GLU A 170 18.509 13.136 4.546 1.00 1.90 C ATOM 2340 OE1 GLU A 170 18.643 11.917 4.319 1.00 2.57 O ATOM 2341 OE2 GLU A 170 19.443 13.862 4.948 1.00 2.27 O ATOM 0 H GLU A 170 16.039 14.256 0.347 1.00 0.96 H new ATOM 0 HA GLU A 170 18.349 13.908 2.088 1.00 0.90 H new ATOM 0 HB2 GLU A 170 15.547 13.826 2.932 1.00 0.98 H new ATOM 0 HB3 GLU A 170 16.280 12.244 3.113 1.00 0.98 H new ATOM 0 HG2 GLU A 170 17.246 14.845 4.336 1.00 1.24 H new ATOM 0 HG3 GLU A 170 16.502 13.500 5.177 1.00 1.24 H new ATOM 2348 N LEU A 171 18.423 11.438 1.526 1.00 0.73 N ATOM 2349 CA LEU A 171 18.568 10.084 1.040 1.00 0.67 C ATOM 2350 C LEU A 171 17.492 9.243 1.673 1.00 0.62 C ATOM 2351 O LEU A 171 17.190 8.166 1.207 1.00 0.57 O ATOM 2352 CB LEU A 171 19.935 9.510 1.403 1.00 0.71 C ATOM 2353 CG LEU A 171 21.120 10.362 0.988 1.00 0.77 C ATOM 2354 CD1 LEU A 171 22.427 9.637 1.264 1.00 0.86 C ATOM 2355 CD2 LEU A 171 21.012 10.730 -0.481 1.00 0.74 C ATOM 0 H LEU A 171 19.073 11.688 2.271 1.00 0.73 H new ATOM 0 HA LEU A 171 18.480 10.082 -0.046 1.00 0.67 H new ATOM 0 HB2 LEU A 171 19.974 9.361 2.482 1.00 0.71 H new ATOM 0 HB3 LEU A 171 20.034 8.528 0.941 1.00 0.71 H new ATOM 0 HG LEU A 171 21.111 11.278 1.578 1.00 0.77 H new ATOM 0 HD11 LEU A 171 23.263 10.266 0.959 1.00 0.86 H new ATOM 0 HD12 LEU A 171 22.505 9.421 2.329 1.00 0.86 H new ATOM 0 HD13 LEU A 171 22.451 8.704 0.702 1.00 0.86 H new ATOM 0 HD21 LEU A 171 21.868 11.341 -0.767 1.00 0.74 H new ATOM 0 HD22 LEU A 171 20.997 9.822 -1.083 1.00 0.74 H new ATOM 0 HD23 LEU A 171 20.093 11.292 -0.649 1.00 0.74 H new ATOM 2367 N ASN A 172 16.944 9.752 2.765 1.00 0.65 N ATOM 2368 CA ASN A 172 15.848 9.108 3.470 1.00 0.63 C ATOM 2369 C ASN A 172 16.179 7.660 3.778 1.00 0.57 C ATOM 2370 O ASN A 172 15.683 6.745 3.120 1.00 0.53 O ATOM 2371 CB ASN A 172 14.543 9.185 2.669 1.00 0.65 C ATOM 2372 CG ASN A 172 14.068 10.605 2.454 1.00 0.75 C ATOM 2373 OD1 ASN A 172 13.551 11.251 3.365 1.00 0.90 O ATOM 2374 ND2 ASN A 172 14.190 11.081 1.229 1.00 0.80 N ATOM 0 H ASN A 172 17.249 10.628 3.189 1.00 0.65 H new ATOM 0 HA ASN A 172 15.707 9.646 4.408 1.00 0.63 H new ATOM 0 HB2 ASN A 172 14.688 8.705 1.701 1.00 0.65 H new ATOM 0 HB3 ASN A 172 13.768 8.623 3.191 1.00 0.65 H new ATOM 0 HD21 ASN A 172 13.849 12.017 1.009 1.00 0.80 H new ATOM 0 HD22 ASN A 172 14.625 10.513 0.502 1.00 0.80 H new ATOM 2381 N TRP A 173 17.001 7.446 4.787 1.00 0.58 N ATOM 2382 CA TRP A 173 17.381 6.099 5.168 1.00 0.55 C ATOM 2383 C TRP A 173 16.272 5.509 6.030 1.00 0.54 C ATOM 2384 O TRP A 173 16.099 5.907 7.183 1.00 0.61 O ATOM 2385 CB TRP A 173 18.696 6.107 5.953 1.00 0.60 C ATOM 2386 CG TRP A 173 19.884 6.556 5.163 1.00 0.63 C ATOM 2387 CD1 TRP A 173 20.261 7.844 4.913 1.00 0.72 C ATOM 2388 CD2 TRP A 173 20.864 5.722 4.536 1.00 0.64 C ATOM 2389 NE1 TRP A 173 21.410 7.861 4.168 1.00 0.78 N ATOM 2390 CE2 TRP A 173 21.801 6.572 3.920 1.00 0.73 C ATOM 2391 CE3 TRP A 173 21.039 4.339 4.435 1.00 0.65 C ATOM 2392 CZ2 TRP A 173 22.896 6.084 3.213 1.00 0.80 C ATOM 2393 CZ3 TRP A 173 22.126 3.856 3.732 1.00 0.73 C ATOM 2394 CH2 TRP A 173 23.043 4.726 3.131 1.00 0.79 C ATOM 0 H TRP A 173 17.417 8.184 5.356 1.00 0.58 H new ATOM 0 HA TRP A 173 17.525 5.498 4.270 1.00 0.55 H new ATOM 0 HB2 TRP A 173 18.584 6.759 6.820 1.00 0.60 H new ATOM 0 HB3 TRP A 173 18.885 5.103 6.332 1.00 0.60 H new ATOM 0 HD1 TRP A 173 19.731 8.721 5.253 1.00 0.72 H new ATOM 0 HE1 TRP A 173 21.896 8.699 3.849 1.00 0.78 H new ATOM 0 HE3 TRP A 173 20.338 3.661 4.898 1.00 0.65 H new ATOM 0 HZ2 TRP A 173 23.604 6.753 2.746 1.00 0.80 H new ATOM 0 HZ3 TRP A 173 22.270 2.789 3.645 1.00 0.73 H new ATOM 0 HH2 TRP A 173 23.884 4.317 2.591 1.00 0.79 H new ATOM 2405 N LEU A 174 15.510 4.587 5.463 1.00 0.49 N ATOM 2406 CA LEU A 174 14.377 4.005 6.156 1.00 0.49 C ATOM 2407 C LEU A 174 14.822 3.160 7.334 1.00 0.53 C ATOM 2408 O LEU A 174 15.584 2.189 7.182 1.00 0.56 O ATOM 2409 CB LEU A 174 13.511 3.159 5.225 1.00 0.48 C ATOM 2410 CG LEU A 174 12.764 3.917 4.128 1.00 0.50 C ATOM 2411 CD1 LEU A 174 11.649 3.046 3.580 1.00 0.52 C ATOM 2412 CD2 LEU A 174 12.204 5.226 4.658 1.00 0.54 C ATOM 0 H LEU A 174 15.659 4.226 4.521 1.00 0.49 H new ATOM 0 HA LEU A 174 13.780 4.840 6.522 1.00 0.49 H new ATOM 0 HB2 LEU A 174 14.146 2.409 4.753 1.00 0.48 H new ATOM 0 HB3 LEU A 174 12.780 2.622 5.830 1.00 0.48 H new ATOM 0 HG LEU A 174 13.463 4.154 3.326 1.00 0.50 H new ATOM 0 HD11 LEU A 174 11.116 3.586 2.798 1.00 0.52 H new ATOM 0 HD12 LEU A 174 12.072 2.131 3.165 1.00 0.52 H new ATOM 0 HD13 LEU A 174 10.956 2.794 4.383 1.00 0.52 H new ATOM 0 HD21 LEU A 174 11.677 5.747 3.858 1.00 0.54 H new ATOM 0 HD22 LEU A 174 11.512 5.021 5.475 1.00 0.54 H new ATOM 0 HD23 LEU A 174 13.020 5.850 5.021 1.00 0.54 H new ATOM 2424 N ASP A 175 14.281 3.537 8.486 1.00 0.61 N ATOM 2425 CA ASP A 175 14.586 2.943 9.784 1.00 0.72 C ATOM 2426 C ASP A 175 13.988 1.548 9.948 1.00 0.68 C ATOM 2427 O ASP A 175 14.334 0.832 10.888 1.00 0.75 O ATOM 2428 CB ASP A 175 14.032 3.856 10.878 1.00 0.93 C ATOM 2429 CG ASP A 175 12.641 4.375 10.538 1.00 1.83 C ATOM 2430 OD1 ASP A 175 11.726 3.544 10.355 1.00 2.37 O ATOM 2431 OD2 ASP A 175 12.443 5.609 10.502 1.00 2.56 O ATOM 0 H ASP A 175 13.595 4.290 8.546 1.00 0.61 H new ATOM 0 HA ASP A 175 15.669 2.841 9.858 1.00 0.72 H new ATOM 0 HB2 ASP A 175 13.995 3.311 11.821 1.00 0.93 H new ATOM 0 HB3 ASP A 175 14.708 4.699 11.024 1.00 0.93 H new ATOM 2436 N HIS A 176 13.084 1.184 9.041 1.00 0.66 N ATOM 2437 CA HIS A 176 12.383 -0.104 9.089 1.00 0.71 C ATOM 2438 C HIS A 176 11.306 -0.119 10.168 1.00 0.83 C ATOM 2439 O HIS A 176 10.874 -1.185 10.606 1.00 1.10 O ATOM 2440 CB HIS A 176 13.347 -1.277 9.301 1.00 0.71 C ATOM 2441 CG HIS A 176 14.154 -1.615 8.094 1.00 0.69 C ATOM 2442 ND1 HIS A 176 13.631 -2.262 7.001 1.00 0.77 N ATOM 2443 CD2 HIS A 176 15.449 -1.379 7.805 1.00 0.67 C ATOM 2444 CE1 HIS A 176 14.569 -2.406 6.089 1.00 0.76 C ATOM 2445 NE2 HIS A 176 15.691 -1.883 6.549 1.00 0.69 N ATOM 0 H HIS A 176 12.815 1.771 8.251 1.00 0.66 H new ATOM 0 HA HIS A 176 11.905 -0.227 8.117 1.00 0.71 H new ATOM 0 HB2 HIS A 176 14.022 -1.037 10.123 1.00 0.71 H new ATOM 0 HB3 HIS A 176 12.776 -2.155 9.603 1.00 0.71 H new ATOM 0 HD1 HIS A 176 12.666 -2.581 6.910 1.00 0.77 H new ATOM 0 HD2 HIS A 176 16.166 -0.884 8.444 1.00 0.67 H new ATOM 0 HE1 HIS A 176 14.442 -2.874 5.124 1.00 0.76 H new ATOM 2454 N GLY A 177 10.845 1.056 10.561 1.00 0.82 N ATOM 2455 CA GLY A 177 9.857 1.140 11.622 1.00 0.96 C ATOM 2456 C GLY A 177 8.689 2.042 11.276 1.00 1.00 C ATOM 2457 O GLY A 177 7.560 1.791 11.697 1.00 1.34 O ATOM 0 H GLY A 177 11.134 1.952 10.168 1.00 0.82 H new ATOM 0 HA2 GLY A 177 9.483 0.140 11.843 1.00 0.96 H new ATOM 0 HA3 GLY A 177 10.337 1.508 12.529 1.00 0.96 H new ATOM 2461 N ARG A 178 8.953 3.091 10.516 1.00 0.90 N ATOM 2462 CA ARG A 178 7.919 4.049 10.149 1.00 0.99 C ATOM 2463 C ARG A 178 7.241 3.666 8.836 1.00 0.87 C ATOM 2464 O ARG A 178 7.881 3.139 7.922 1.00 0.86 O ATOM 2465 CB ARG A 178 8.526 5.452 10.058 1.00 1.22 C ATOM 2466 CG ARG A 178 7.635 6.473 9.369 1.00 1.27 C ATOM 2467 CD ARG A 178 8.113 7.890 9.625 1.00 1.18 C ATOM 2468 NE ARG A 178 9.550 8.039 9.407 1.00 1.23 N ATOM 2469 CZ ARG A 178 10.225 9.158 9.659 1.00 1.74 C ATOM 2470 NH1 ARG A 178 9.586 10.247 10.075 1.00 2.16 N ATOM 2471 NH2 ARG A 178 11.540 9.193 9.492 1.00 2.18 N ATOM 0 H ARG A 178 9.877 3.303 10.139 1.00 0.90 H new ATOM 0 HA ARG A 178 7.151 4.040 10.923 1.00 0.99 H new ATOM 0 HB2 ARG A 178 8.752 5.804 11.065 1.00 1.22 H new ATOM 0 HB3 ARG A 178 9.473 5.392 9.521 1.00 1.22 H new ATOM 0 HG2 ARG A 178 7.621 6.281 8.296 1.00 1.27 H new ATOM 0 HG3 ARG A 178 6.611 6.363 9.726 1.00 1.27 H new ATOM 0 HD2 ARG A 178 7.576 8.576 8.970 1.00 1.18 H new ATOM 0 HD3 ARG A 178 7.872 8.173 10.650 1.00 1.18 H new ATOM 0 HE ARG A 178 10.066 7.239 9.040 1.00 1.23 H new ATOM 0 HH11 ARG A 178 8.574 10.227 10.202 1.00 2.16 H new ATOM 0 HH12 ARG A 178 10.108 11.102 10.267 1.00 2.16 H new ATOM 0 HH21 ARG A 178 12.036 8.362 9.170 1.00 2.18 H new ATOM 0 HH22 ARG A 178 12.056 10.051 9.686 1.00 2.18 H new ATOM 2485 N THR A 179 5.940 3.933 8.753 1.00 0.91 N ATOM 2486 CA THR A 179 5.177 3.658 7.549 1.00 0.89 C ATOM 2487 C THR A 179 5.496 4.705 6.479 1.00 0.86 C ATOM 2488 O THR A 179 5.996 5.790 6.784 1.00 0.91 O ATOM 2489 CB THR A 179 3.656 3.617 7.831 1.00 1.05 C ATOM 2490 OG1 THR A 179 2.961 3.051 6.713 1.00 1.20 O ATOM 2491 CG2 THR A 179 3.103 5.005 8.114 1.00 1.11 C ATOM 0 H THR A 179 5.394 4.341 9.512 1.00 0.91 H new ATOM 0 HA THR A 179 5.467 2.672 7.185 1.00 0.89 H new ATOM 0 HB THR A 179 3.503 2.997 8.715 1.00 1.05 H new ATOM 0 HG1 THR A 179 2.000 3.028 6.903 1.00 1.20 H new ATOM 0 HG21 THR A 179 2.032 4.938 8.308 1.00 1.11 H new ATOM 0 HG22 THR A 179 3.604 5.425 8.986 1.00 1.11 H new ATOM 0 HG23 THR A 179 3.276 5.648 7.251 1.00 1.11 H new ATOM 2499 N LEU A 180 5.213 4.376 5.233 1.00 0.84 N ATOM 2500 CA LEU A 180 5.639 5.174 4.108 1.00 0.84 C ATOM 2501 C LEU A 180 4.876 6.491 3.996 1.00 0.93 C ATOM 2502 O LEU A 180 5.483 7.552 3.845 1.00 0.97 O ATOM 2503 CB LEU A 180 5.476 4.344 2.842 1.00 0.85 C ATOM 2504 CG LEU A 180 6.232 3.010 2.837 1.00 0.83 C ATOM 2505 CD1 LEU A 180 7.612 3.172 3.455 1.00 1.08 C ATOM 2506 CD2 LEU A 180 5.454 1.897 3.532 1.00 0.90 C ATOM 0 H LEU A 180 4.680 3.545 4.976 1.00 0.84 H new ATOM 0 HA LEU A 180 6.684 5.446 4.253 1.00 0.84 H new ATOM 0 HB2 LEU A 180 4.415 4.143 2.692 1.00 0.85 H new ATOM 0 HB3 LEU A 180 5.812 4.937 1.991 1.00 0.85 H new ATOM 0 HG LEU A 180 6.347 2.713 1.795 1.00 0.83 H new ATOM 0 HD11 LEU A 180 8.131 2.214 3.442 1.00 1.08 H new ATOM 0 HD12 LEU A 180 8.183 3.903 2.883 1.00 1.08 H new ATOM 0 HD13 LEU A 180 7.512 3.516 4.484 1.00 1.08 H new ATOM 0 HD21 LEU A 180 6.033 0.974 3.501 1.00 0.90 H new ATOM 0 HD22 LEU A 180 5.270 2.175 4.570 1.00 0.90 H new ATOM 0 HD23 LEU A 180 4.502 1.746 3.023 1.00 0.90 H new ATOM 2518 N ARG A 181 3.555 6.425 4.079 1.00 1.02 N ATOM 2519 CA ARG A 181 2.720 7.619 3.952 1.00 1.13 C ATOM 2520 C ARG A 181 3.078 8.674 4.994 1.00 1.18 C ATOM 2521 O ARG A 181 3.013 9.870 4.719 1.00 1.36 O ATOM 2522 CB ARG A 181 1.243 7.250 4.068 1.00 1.22 C ATOM 2523 CG ARG A 181 0.596 6.893 2.741 1.00 1.15 C ATOM 2524 CD ARG A 181 -0.663 6.069 2.947 1.00 0.69 C ATOM 2525 NE ARG A 181 -0.339 4.711 3.373 1.00 1.10 N ATOM 2526 CZ ARG A 181 -0.493 4.254 4.615 1.00 2.02 C ATOM 2527 NH1 ARG A 181 -1.046 5.020 5.550 1.00 2.54 N ATOM 2528 NH2 ARG A 181 -0.101 3.025 4.920 1.00 2.64 N ATOM 0 H ARG A 181 3.036 5.561 4.233 1.00 1.02 H new ATOM 0 HA ARG A 181 2.908 8.046 2.967 1.00 1.13 H new ATOM 0 HB2 ARG A 181 1.141 6.406 4.750 1.00 1.22 H new ATOM 0 HB3 ARG A 181 0.703 8.086 4.512 1.00 1.22 H new ATOM 0 HG2 ARG A 181 0.352 7.805 2.196 1.00 1.15 H new ATOM 0 HG3 ARG A 181 1.303 6.334 2.128 1.00 1.15 H new ATOM 0 HD2 ARG A 181 -1.296 6.547 3.695 1.00 0.69 H new ATOM 0 HD3 ARG A 181 -1.235 6.036 2.020 1.00 0.69 H new ATOM 0 HE ARG A 181 0.030 4.068 2.672 1.00 1.10 H new ATOM 0 HH11 ARG A 181 -1.355 5.964 5.319 1.00 2.54 H new ATOM 0 HH12 ARG A 181 -1.161 4.664 6.499 1.00 2.54 H new ATOM 0 HH21 ARG A 181 0.318 2.431 4.204 1.00 2.64 H new ATOM 0 HH22 ARG A 181 -0.218 2.673 5.870 1.00 2.64 H new ATOM 2542 N GLU A 182 3.502 8.231 6.171 1.00 1.11 N ATOM 2543 CA GLU A 182 3.815 9.144 7.265 1.00 1.18 C ATOM 2544 C GLU A 182 5.136 9.868 7.007 1.00 1.16 C ATOM 2545 O GLU A 182 5.464 10.850 7.665 1.00 1.25 O ATOM 2546 CB GLU A 182 3.868 8.384 8.591 1.00 1.25 C ATOM 2547 CG GLU A 182 4.032 9.278 9.807 1.00 1.34 C ATOM 2548 CD GLU A 182 2.955 10.341 9.906 1.00 1.89 C ATOM 2549 OE1 GLU A 182 1.857 10.043 10.429 1.00 2.30 O ATOM 2550 OE2 GLU A 182 3.192 11.473 9.450 1.00 2.31 O ATOM 0 H GLU A 182 3.637 7.245 6.393 1.00 1.11 H new ATOM 0 HA GLU A 182 3.025 9.893 7.325 1.00 1.18 H new ATOM 0 HB2 GLU A 182 2.953 7.802 8.701 1.00 1.25 H new ATOM 0 HB3 GLU A 182 4.695 7.675 8.559 1.00 1.25 H new ATOM 0 HG2 GLU A 182 4.014 8.665 10.708 1.00 1.34 H new ATOM 0 HG3 GLU A 182 5.009 9.760 9.769 1.00 1.34 H new ATOM 2557 N GLN A 183 5.889 9.385 6.034 1.00 1.07 N ATOM 2558 CA GLN A 183 7.127 10.042 5.645 1.00 1.06 C ATOM 2559 C GLN A 183 6.838 11.119 4.612 1.00 1.13 C ATOM 2560 O GLN A 183 7.639 12.032 4.399 1.00 1.22 O ATOM 2561 CB GLN A 183 8.093 9.043 5.041 1.00 1.00 C ATOM 2562 CG GLN A 183 8.332 7.817 5.888 1.00 1.00 C ATOM 2563 CD GLN A 183 9.154 6.799 5.145 1.00 1.04 C ATOM 2564 OE1 GLN A 183 9.982 7.153 4.310 1.00 1.65 O ATOM 2565 NE2 GLN A 183 8.920 5.529 5.412 1.00 0.81 N ATOM 0 H GLN A 183 5.667 8.544 5.500 1.00 1.07 H new ATOM 0 HA GLN A 183 7.571 10.485 6.537 1.00 1.06 H new ATOM 0 HB2 GLN A 183 7.712 8.730 4.069 1.00 1.00 H new ATOM 0 HB3 GLN A 183 9.047 9.540 4.865 1.00 1.00 H new ATOM 0 HG2 GLN A 183 8.843 8.100 6.808 1.00 1.00 H new ATOM 0 HG3 GLN A 183 7.377 7.378 6.176 1.00 1.00 H new ATOM 0 HE21 GLN A 183 8.224 5.275 6.113 1.00 0.81 H new ATOM 0 HE22 GLN A 183 9.435 4.801 4.918 1.00 0.81 H new ATOM 2574 N GLY A 184 5.683 10.992 3.967 1.00 1.16 N ATOM 2575 CA GLY A 184 5.346 11.865 2.867 1.00 1.28 C ATOM 2576 C GLY A 184 5.920 11.366 1.557 1.00 1.23 C ATOM 2577 O GLY A 184 6.105 12.143 0.621 1.00 1.38 O ATOM 0 H GLY A 184 4.973 10.295 4.191 1.00 1.16 H new ATOM 0 HA2 GLY A 184 4.262 11.942 2.783 1.00 1.28 H new ATOM 0 HA3 GLY A 184 5.722 12.868 3.070 1.00 1.28 H new ATOM 2581 N VAL A 185 6.222 10.067 1.500 1.00 1.10 N ATOM 2582 CA VAL A 185 6.772 9.460 0.293 1.00 1.08 C ATOM 2583 C VAL A 185 5.803 9.526 -0.885 1.00 1.02 C ATOM 2584 O VAL A 185 4.591 9.694 -0.722 1.00 1.15 O ATOM 2585 CB VAL A 185 7.151 7.980 0.511 1.00 1.13 C ATOM 2586 CG1 VAL A 185 7.980 7.809 1.767 1.00 1.31 C ATOM 2587 CG2 VAL A 185 5.913 7.101 0.558 1.00 1.14 C ATOM 0 H VAL A 185 6.094 9.418 2.277 1.00 1.10 H new ATOM 0 HA VAL A 185 7.664 10.042 0.063 1.00 1.08 H new ATOM 0 HB VAL A 185 7.757 7.664 -0.338 1.00 1.13 H new ATOM 0 HG11 VAL A 185 8.233 6.757 1.896 1.00 1.31 H new ATOM 0 HG12 VAL A 185 8.896 8.394 1.681 1.00 1.31 H new ATOM 0 HG13 VAL A 185 7.409 8.153 2.629 1.00 1.31 H new ATOM 0 HG21 VAL A 185 6.209 6.063 0.713 1.00 1.14 H new ATOM 0 HG22 VAL A 185 5.270 7.421 1.378 1.00 1.14 H new ATOM 0 HG23 VAL A 185 5.370 7.187 -0.383 1.00 1.14 H new ATOM 2597 N GLU A 186 6.367 9.375 -2.067 1.00 0.93 N ATOM 2598 CA GLU A 186 5.612 9.260 -3.299 1.00 0.92 C ATOM 2599 C GLU A 186 5.759 7.828 -3.840 1.00 0.83 C ATOM 2600 O GLU A 186 6.197 6.933 -3.108 1.00 0.82 O ATOM 2601 CB GLU A 186 6.113 10.311 -4.308 1.00 1.02 C ATOM 2602 CG GLU A 186 7.610 10.586 -4.225 1.00 1.46 C ATOM 2603 CD GLU A 186 8.426 9.319 -4.137 1.00 2.45 C ATOM 2604 OE1 GLU A 186 8.455 8.563 -5.122 1.00 2.97 O ATOM 2605 OE2 GLU A 186 8.990 9.051 -3.056 1.00 3.02 O ATOM 0 H GLU A 186 7.377 9.328 -2.200 1.00 0.93 H new ATOM 0 HA GLU A 186 4.553 9.451 -3.123 1.00 0.92 H new ATOM 0 HB2 GLU A 186 5.871 9.976 -5.317 1.00 1.02 H new ATOM 0 HB3 GLU A 186 5.573 11.244 -4.144 1.00 1.02 H new ATOM 0 HG2 GLU A 186 7.921 11.155 -5.101 1.00 1.46 H new ATOM 0 HG3 GLU A 186 7.814 11.207 -3.353 1.00 1.46 H new ATOM 2612 N GLU A 187 5.404 7.600 -5.100 1.00 0.89 N ATOM 2613 CA GLU A 187 5.498 6.269 -5.682 1.00 0.91 C ATOM 2614 C GLU A 187 6.355 6.257 -6.954 1.00 0.91 C ATOM 2615 O GLU A 187 6.249 5.332 -7.759 1.00 1.14 O ATOM 2616 CB GLU A 187 4.089 5.761 -6.006 1.00 1.05 C ATOM 2617 CG GLU A 187 3.209 5.568 -4.781 1.00 1.11 C ATOM 2618 CD GLU A 187 1.745 5.379 -5.129 1.00 1.36 C ATOM 2619 OE1 GLU A 187 1.446 4.561 -6.026 1.00 1.72 O ATOM 2620 OE2 GLU A 187 0.884 6.033 -4.502 1.00 1.86 O ATOM 0 H GLU A 187 5.050 8.317 -5.734 1.00 0.89 H new ATOM 0 HA GLU A 187 5.981 5.616 -4.955 1.00 0.91 H new ATOM 0 HB2 GLU A 187 3.605 6.466 -6.682 1.00 1.05 H new ATOM 0 HB3 GLU A 187 4.168 4.813 -6.538 1.00 1.05 H new ATOM 0 HG2 GLU A 187 3.559 4.700 -4.222 1.00 1.11 H new ATOM 0 HG3 GLU A 187 3.313 6.433 -4.126 1.00 1.11 H new ATOM 2627 N HIS A 188 7.236 7.244 -7.130 1.00 0.92 N ATOM 2628 CA HIS A 188 7.933 7.383 -8.413 1.00 0.95 C ATOM 2629 C HIS A 188 9.451 7.577 -8.287 1.00 0.92 C ATOM 2630 O HIS A 188 10.168 7.440 -9.275 1.00 1.01 O ATOM 2631 CB HIS A 188 7.315 8.518 -9.246 1.00 1.04 C ATOM 2632 CG HIS A 188 7.308 9.872 -8.591 1.00 1.03 C ATOM 2633 ND1 HIS A 188 6.197 10.402 -7.975 1.00 1.09 N ATOM 2634 CD2 HIS A 188 8.264 10.827 -8.515 1.00 1.08 C ATOM 2635 CE1 HIS A 188 6.467 11.624 -7.557 1.00 1.14 C ATOM 2636 NE2 HIS A 188 7.716 11.911 -7.870 1.00 1.15 N ATOM 0 H HIS A 188 7.480 7.940 -6.425 1.00 0.92 H new ATOM 0 HA HIS A 188 7.795 6.431 -8.926 1.00 0.95 H new ATOM 0 HB2 HIS A 188 7.859 8.592 -10.188 1.00 1.04 H new ATOM 0 HB3 HIS A 188 6.288 8.247 -9.492 1.00 1.04 H new ATOM 0 HD2 HIS A 188 9.273 10.752 -8.892 1.00 1.08 H new ATOM 0 HE1 HIS A 188 5.780 12.280 -7.044 1.00 1.14 H new ATOM 0 HE2 HIS A 188 8.195 12.789 -7.668 1.00 1.15 H new ATOM 2645 N GLU A 189 9.947 7.886 -7.099 1.00 0.89 N ATOM 2646 CA GLU A 189 11.383 8.103 -6.916 1.00 0.92 C ATOM 2647 C GLU A 189 12.124 6.787 -6.703 1.00 0.78 C ATOM 2648 O GLU A 189 11.523 5.779 -6.329 1.00 0.74 O ATOM 2649 CB GLU A 189 11.645 9.051 -5.752 1.00 1.10 C ATOM 2650 CG GLU A 189 11.233 10.481 -6.039 1.00 1.37 C ATOM 2651 CD GLU A 189 11.935 11.043 -7.256 1.00 1.82 C ATOM 2652 OE1 GLU A 189 13.099 11.470 -7.132 1.00 2.38 O ATOM 2653 OE2 GLU A 189 11.321 11.073 -8.340 1.00 2.34 O ATOM 0 H GLU A 189 9.388 7.992 -6.253 1.00 0.89 H new ATOM 0 HA GLU A 189 11.763 8.560 -7.830 1.00 0.92 H new ATOM 0 HB2 GLU A 189 11.107 8.694 -4.874 1.00 1.10 H new ATOM 0 HB3 GLU A 189 12.707 9.028 -5.506 1.00 1.10 H new ATOM 0 HG2 GLU A 189 10.155 10.523 -6.192 1.00 1.37 H new ATOM 0 HG3 GLU A 189 11.457 11.103 -5.172 1.00 1.37 H new ATOM 2660 N THR A 190 13.429 6.798 -6.962 1.00 0.74 N ATOM 2661 CA THR A 190 14.227 5.583 -6.884 1.00 0.66 C ATOM 2662 C THR A 190 14.783 5.359 -5.482 1.00 0.57 C ATOM 2663 O THR A 190 15.369 6.256 -4.872 1.00 0.61 O ATOM 2664 CB THR A 190 15.382 5.609 -7.904 1.00 0.70 C ATOM 2665 OG1 THR A 190 14.859 5.855 -9.217 1.00 0.81 O ATOM 2666 CG2 THR A 190 16.148 4.292 -7.902 1.00 0.66 C ATOM 0 H THR A 190 13.952 7.633 -7.226 1.00 0.74 H new ATOM 0 HA THR A 190 13.561 4.754 -7.124 1.00 0.66 H new ATOM 0 HB THR A 190 16.069 6.407 -7.621 1.00 0.70 H new ATOM 0 HG1 THR A 190 15.595 5.873 -9.864 1.00 0.81 H new ATOM 0 HG21 THR A 190 16.957 4.340 -8.631 1.00 0.66 H new ATOM 0 HG22 THR A 190 16.564 4.115 -6.910 1.00 0.66 H new ATOM 0 HG23 THR A 190 15.472 3.478 -8.163 1.00 0.66 H new ATOM 2674 N LEU A 191 14.610 4.139 -4.997 1.00 0.48 N ATOM 2675 CA LEU A 191 15.025 3.770 -3.657 1.00 0.42 C ATOM 2676 C LEU A 191 16.143 2.749 -3.767 1.00 0.39 C ATOM 2677 O LEU A 191 16.116 1.891 -4.648 1.00 0.38 O ATOM 2678 CB LEU A 191 13.855 3.182 -2.849 1.00 0.41 C ATOM 2679 CG LEU A 191 12.529 3.960 -2.889 1.00 0.51 C ATOM 2680 CD1 LEU A 191 12.770 5.459 -2.903 1.00 1.01 C ATOM 2681 CD2 LEU A 191 11.681 3.543 -4.080 1.00 0.82 C ATOM 0 H LEU A 191 14.178 3.379 -5.523 1.00 0.48 H new ATOM 0 HA LEU A 191 15.370 4.661 -3.132 1.00 0.42 H new ATOM 0 HB2 LEU A 191 13.667 2.170 -3.209 1.00 0.41 H new ATOM 0 HB3 LEU A 191 14.169 3.097 -1.809 1.00 0.41 H new ATOM 0 HG LEU A 191 11.980 3.714 -1.980 1.00 0.51 H new ATOM 0 HD11 LEU A 191 11.814 5.981 -2.931 1.00 1.01 H new ATOM 0 HD12 LEU A 191 13.315 5.748 -2.004 1.00 1.01 H new ATOM 0 HD13 LEU A 191 13.355 5.725 -3.783 1.00 1.01 H new ATOM 0 HD21 LEU A 191 10.750 4.111 -4.081 1.00 0.82 H new ATOM 0 HD22 LEU A 191 12.227 3.741 -5.002 1.00 0.82 H new ATOM 0 HD23 LEU A 191 11.457 2.478 -4.012 1.00 0.82 H new ATOM 2693 N LEU A 192 17.128 2.831 -2.899 1.00 0.39 N ATOM 2694 CA LEU A 192 18.297 1.983 -3.026 1.00 0.41 C ATOM 2695 C LEU A 192 18.363 0.996 -1.870 1.00 0.40 C ATOM 2696 O LEU A 192 18.138 1.364 -0.716 1.00 0.44 O ATOM 2697 CB LEU A 192 19.560 2.846 -3.038 1.00 0.44 C ATOM 2698 CG LEU A 192 19.401 4.223 -3.691 1.00 0.49 C ATOM 2699 CD1 LEU A 192 20.634 5.070 -3.444 1.00 0.56 C ATOM 2700 CD2 LEU A 192 19.136 4.091 -5.184 1.00 0.50 C ATOM 0 H LEU A 192 17.145 3.470 -2.104 1.00 0.39 H new ATOM 0 HA LEU A 192 18.227 1.426 -3.960 1.00 0.41 H new ATOM 0 HB2 LEU A 192 19.896 2.985 -2.010 1.00 0.44 H new ATOM 0 HB3 LEU A 192 20.348 2.302 -3.560 1.00 0.44 H new ATOM 0 HG LEU A 192 18.541 4.717 -3.238 1.00 0.49 H new ATOM 0 HD11 LEU A 192 20.506 6.045 -3.914 1.00 0.56 H new ATOM 0 HD12 LEU A 192 20.777 5.200 -2.371 1.00 0.56 H new ATOM 0 HD13 LEU A 192 21.507 4.574 -3.869 1.00 0.56 H new ATOM 0 HD21 LEU A 192 19.027 5.083 -5.623 1.00 0.50 H new ATOM 0 HD22 LEU A 192 19.971 3.574 -5.657 1.00 0.50 H new ATOM 0 HD23 LEU A 192 18.220 3.522 -5.342 1.00 0.50 H new ATOM 2712 N LEU A 193 18.638 -0.258 -2.182 1.00 0.43 N ATOM 2713 CA LEU A 193 18.862 -1.261 -1.159 1.00 0.50 C ATOM 2714 C LEU A 193 20.311 -1.182 -0.687 1.00 0.47 C ATOM 2715 O LEU A 193 21.241 -1.284 -1.490 1.00 0.49 O ATOM 2716 CB LEU A 193 18.530 -2.650 -1.720 1.00 0.68 C ATOM 2717 CG LEU A 193 18.539 -3.804 -0.713 1.00 0.44 C ATOM 2718 CD1 LEU A 193 17.584 -4.891 -1.163 1.00 1.09 C ATOM 2719 CD2 LEU A 193 19.933 -4.384 -0.564 1.00 1.03 C ATOM 0 H LEU A 193 18.711 -0.605 -3.138 1.00 0.43 H new ATOM 0 HA LEU A 193 18.212 -1.079 -0.303 1.00 0.50 H new ATOM 0 HB2 LEU A 193 17.544 -2.606 -2.183 1.00 0.68 H new ATOM 0 HB3 LEU A 193 19.244 -2.880 -2.511 1.00 0.68 H new ATOM 0 HG LEU A 193 18.220 -3.413 0.253 1.00 0.44 H new ATOM 0 HD11 LEU A 193 17.596 -5.708 -0.441 1.00 1.09 H new ATOM 0 HD12 LEU A 193 16.575 -4.483 -1.232 1.00 1.09 H new ATOM 0 HD13 LEU A 193 17.892 -5.265 -2.139 1.00 1.09 H new ATOM 0 HD21 LEU A 193 19.912 -5.202 0.157 1.00 1.03 H new ATOM 0 HD22 LEU A 193 20.276 -4.759 -1.528 1.00 1.03 H new ATOM 0 HD23 LEU A 193 20.614 -3.609 -0.213 1.00 1.03 H new ATOM 2731 N ARG A 194 20.500 -0.980 0.609 1.00 0.46 N ATOM 2732 CA ARG A 194 21.831 -0.787 1.164 1.00 0.46 C ATOM 2733 C ARG A 194 22.169 -1.881 2.159 1.00 0.44 C ATOM 2734 O ARG A 194 21.344 -2.249 2.990 1.00 0.49 O ATOM 2735 CB ARG A 194 21.933 0.566 1.870 1.00 0.53 C ATOM 2736 CG ARG A 194 21.778 1.766 0.955 1.00 0.60 C ATOM 2737 CD ARG A 194 22.846 1.804 -0.122 1.00 0.65 C ATOM 2738 NE ARG A 194 24.186 1.593 0.428 1.00 0.69 N ATOM 2739 CZ ARG A 194 25.216 1.122 -0.276 1.00 0.95 C ATOM 2740 NH1 ARG A 194 25.060 0.776 -1.548 1.00 1.25 N ATOM 2741 NH2 ARG A 194 26.402 0.978 0.300 1.00 1.06 N ATOM 0 H ARG A 194 19.747 -0.946 1.296 1.00 0.46 H new ATOM 0 HA ARG A 194 22.536 -0.822 0.334 1.00 0.46 H new ATOM 0 HB2 ARG A 194 21.169 0.615 2.646 1.00 0.53 H new ATOM 0 HB3 ARG A 194 22.899 0.629 2.370 1.00 0.53 H new ATOM 0 HG2 ARG A 194 20.793 1.740 0.488 1.00 0.60 H new ATOM 0 HG3 ARG A 194 21.827 2.681 1.546 1.00 0.60 H new ATOM 0 HD2 ARG A 194 22.636 1.038 -0.869 1.00 0.65 H new ATOM 0 HD3 ARG A 194 22.811 2.766 -0.634 1.00 0.65 H new ATOM 0 HE ARG A 194 24.341 1.820 1.410 1.00 0.69 H new ATOM 0 HH11 ARG A 194 24.147 0.870 -1.994 1.00 1.25 H new ATOM 0 HH12 ARG A 194 25.853 0.417 -2.080 1.00 1.25 H new ATOM 0 HH21 ARG A 194 26.526 1.227 1.281 1.00 1.06 H new ATOM 0 HH22 ARG A 194 27.190 0.618 -0.238 1.00 1.06 H new ATOM 2755 N ARG A 195 23.385 -2.392 2.073 1.00 0.45 N ATOM 2756 CA ARG A 195 23.876 -3.337 3.057 1.00 0.50 C ATOM 2757 C ARG A 195 24.109 -2.602 4.371 1.00 0.55 C ATOM 2758 O ARG A 195 24.891 -1.652 4.430 1.00 0.64 O ATOM 2759 CB ARG A 195 25.165 -3.987 2.550 1.00 0.59 C ATOM 2760 CG ARG A 195 25.642 -5.180 3.366 1.00 1.02 C ATOM 2761 CD ARG A 195 26.976 -4.909 4.042 1.00 1.07 C ATOM 2762 NE ARG A 195 26.842 -3.960 5.139 1.00 1.49 N ATOM 2763 CZ ARG A 195 27.606 -2.875 5.280 1.00 2.13 C ATOM 2764 NH1 ARG A 195 28.605 -2.646 4.437 1.00 2.34 N ATOM 2765 NH2 ARG A 195 27.387 -2.030 6.277 1.00 2.68 N ATOM 0 H ARG A 195 24.049 -2.168 1.332 1.00 0.45 H new ATOM 0 HA ARG A 195 23.144 -4.128 3.221 1.00 0.50 H new ATOM 0 HB2 ARG A 195 25.013 -4.307 1.519 1.00 0.59 H new ATOM 0 HB3 ARG A 195 25.954 -3.235 2.537 1.00 0.59 H new ATOM 0 HG2 ARG A 195 24.895 -5.424 4.122 1.00 1.02 H new ATOM 0 HG3 ARG A 195 25.735 -6.050 2.716 1.00 1.02 H new ATOM 0 HD2 ARG A 195 27.390 -5.844 4.419 1.00 1.07 H new ATOM 0 HD3 ARG A 195 27.683 -4.520 3.309 1.00 1.07 H new ATOM 0 HE ARG A 195 26.122 -4.135 5.840 1.00 1.49 H new ATOM 0 HH11 ARG A 195 28.792 -3.301 3.677 1.00 2.34 H new ATOM 0 HH12 ARG A 195 29.186 -1.815 4.549 1.00 2.34 H new ATOM 0 HH21 ARG A 195 26.632 -2.208 6.940 1.00 2.68 H new ATOM 0 HH22 ARG A 195 27.973 -1.202 6.382 1.00 2.68 H new ATOM 2779 N LYS A 196 23.407 -3.016 5.411 1.00 0.60 N ATOM 2780 CA LYS A 196 23.510 -2.354 6.699 1.00 0.69 C ATOM 2781 C LYS A 196 24.473 -3.101 7.611 1.00 0.76 C ATOM 2782 O LYS A 196 25.448 -2.529 8.089 1.00 0.88 O ATOM 2783 CB LYS A 196 22.139 -2.246 7.370 1.00 0.75 C ATOM 2784 CG LYS A 196 22.184 -1.496 8.692 1.00 0.88 C ATOM 2785 CD LYS A 196 20.818 -1.410 9.346 1.00 1.28 C ATOM 2786 CE LYS A 196 20.864 -0.568 10.613 1.00 1.65 C ATOM 2787 NZ LYS A 196 21.212 0.852 10.326 1.00 2.15 N ATOM 0 H LYS A 196 22.761 -3.805 5.389 1.00 0.60 H new ATOM 0 HA LYS A 196 23.894 -1.348 6.526 1.00 0.69 H new ATOM 0 HB2 LYS A 196 21.449 -1.741 6.695 1.00 0.75 H new ATOM 0 HB3 LYS A 196 21.743 -3.247 7.540 1.00 0.75 H new ATOM 0 HG2 LYS A 196 22.878 -1.995 9.368 1.00 0.88 H new ATOM 0 HG3 LYS A 196 22.569 -0.490 8.525 1.00 0.88 H new ATOM 0 HD2 LYS A 196 20.103 -0.978 8.645 1.00 1.28 H new ATOM 0 HD3 LYS A 196 20.463 -2.412 9.586 1.00 1.28 H new ATOM 0 HE2 LYS A 196 19.896 -0.610 11.112 1.00 1.65 H new ATOM 0 HE3 LYS A 196 21.596 -0.989 11.302 1.00 1.65 H new ATOM 0 HZ1 LYS A 196 20.973 1.441 11.149 1.00 2.15 H new ATOM 0 HZ2 LYS A 196 22.231 0.927 10.131 1.00 2.15 H new ATOM 0 HZ3 LYS A 196 20.676 1.180 9.498 1.00 2.15 H new ATOM 2801 N PHE A 197 24.214 -4.383 7.829 1.00 0.77 N ATOM 2802 CA PHE A 197 25.045 -5.175 8.730 1.00 0.89 C ATOM 2803 C PHE A 197 26.211 -5.781 7.973 1.00 0.96 C ATOM 2804 O PHE A 197 26.086 -6.125 6.798 1.00 0.92 O ATOM 2805 CB PHE A 197 24.234 -6.279 9.408 1.00 0.95 C ATOM 2806 CG PHE A 197 23.141 -5.769 10.307 1.00 0.94 C ATOM 2807 CD1 PHE A 197 23.381 -4.719 11.175 1.00 1.14 C ATOM 2808 CD2 PHE A 197 21.878 -6.337 10.284 1.00 0.92 C ATOM 2809 CE1 PHE A 197 22.387 -4.245 12.006 1.00 1.19 C ATOM 2810 CE2 PHE A 197 20.877 -5.869 11.114 1.00 0.95 C ATOM 2811 CZ PHE A 197 21.113 -4.830 11.958 1.00 1.03 C ATOM 0 H PHE A 197 23.443 -4.894 7.400 1.00 0.77 H new ATOM 0 HA PHE A 197 25.426 -4.509 9.504 1.00 0.89 H new ATOM 0 HB2 PHE A 197 23.793 -6.915 8.641 1.00 0.95 H new ATOM 0 HB3 PHE A 197 24.909 -6.905 9.992 1.00 0.95 H new ATOM 0 HD1 PHE A 197 24.360 -4.264 11.203 1.00 1.14 H new ATOM 0 HD2 PHE A 197 21.673 -7.155 9.610 1.00 0.92 H new ATOM 0 HE1 PHE A 197 22.588 -3.431 12.687 1.00 1.19 H new ATOM 0 HE2 PHE A 197 19.901 -6.332 11.092 1.00 0.95 H new ATOM 0 HZ PHE A 197 20.321 -4.456 12.590 1.00 1.03 H new ATOM 2821 N PHE A 198 27.335 -5.925 8.652 1.00 1.16 N ATOM 2822 CA PHE A 198 28.559 -6.376 8.015 1.00 1.33 C ATOM 2823 C PHE A 198 28.674 -7.894 8.037 1.00 1.58 C ATOM 2824 O PHE A 198 29.623 -8.442 8.603 1.00 2.05 O ATOM 2825 CB PHE A 198 29.783 -5.756 8.698 1.00 1.51 C ATOM 2826 CG PHE A 198 29.945 -4.287 8.438 1.00 1.40 C ATOM 2827 CD1 PHE A 198 30.520 -3.833 7.262 1.00 1.61 C ATOM 2828 CD2 PHE A 198 29.515 -3.361 9.370 1.00 1.53 C ATOM 2829 CE1 PHE A 198 30.663 -2.480 7.023 1.00 1.95 C ATOM 2830 CE2 PHE A 198 29.654 -2.008 9.138 1.00 1.78 C ATOM 2831 CZ PHE A 198 30.264 -1.572 7.952 1.00 2.00 C ATOM 0 H PHE A 198 27.425 -5.735 9.650 1.00 1.16 H new ATOM 0 HA PHE A 198 28.523 -6.050 6.975 1.00 1.33 H new ATOM 0 HB2 PHE A 198 29.708 -5.919 9.773 1.00 1.51 H new ATOM 0 HB3 PHE A 198 30.679 -6.276 8.358 1.00 1.51 H new ATOM 0 HD1 PHE A 198 30.860 -4.545 6.524 1.00 1.61 H new ATOM 0 HD2 PHE A 198 29.065 -3.701 10.291 1.00 1.53 H new ATOM 0 HE1 PHE A 198 31.094 -2.142 6.092 1.00 1.95 H new ATOM 0 HE2 PHE A 198 29.297 -1.291 9.863 1.00 1.78 H new ATOM 0 HZ PHE A 198 30.416 -0.517 7.778 1.00 2.00 H new ATOM 2841 N TYR A 199 27.703 -8.576 7.433 1.00 1.48 N ATOM 2842 CA TYR A 199 27.807 -10.020 7.247 1.00 1.79 C ATOM 2843 C TYR A 199 29.077 -10.361 6.474 1.00 2.06 C ATOM 2844 O TYR A 199 29.700 -11.390 6.718 1.00 2.27 O ATOM 2845 CB TYR A 199 26.567 -10.600 6.550 1.00 2.08 C ATOM 2846 CG TYR A 199 26.193 -9.955 5.232 1.00 2.04 C ATOM 2847 CD1 TYR A 199 26.780 -10.361 4.039 1.00 2.35 C ATOM 2848 CD2 TYR A 199 25.228 -8.959 5.178 1.00 2.05 C ATOM 2849 CE1 TYR A 199 26.418 -9.791 2.835 1.00 2.78 C ATOM 2850 CE2 TYR A 199 24.862 -8.383 3.980 1.00 2.47 C ATOM 2851 CZ TYR A 199 25.460 -8.802 2.812 1.00 2.89 C ATOM 2852 OH TYR A 199 25.092 -8.238 1.613 1.00 3.53 O ATOM 0 H TYR A 199 26.847 -8.158 7.069 1.00 1.48 H new ATOM 0 HA TYR A 199 27.861 -10.480 8.234 1.00 1.79 H new ATOM 0 HB2 TYR A 199 26.733 -11.664 6.379 1.00 2.08 H new ATOM 0 HB3 TYR A 199 25.718 -10.515 7.229 1.00 2.08 H new ATOM 0 HD1 TYR A 199 27.532 -11.136 4.054 1.00 2.35 H new ATOM 0 HD2 TYR A 199 24.755 -8.629 6.091 1.00 2.05 H new ATOM 0 HE1 TYR A 199 26.883 -10.119 1.917 1.00 2.78 H new ATOM 0 HE2 TYR A 199 24.111 -7.608 3.957 1.00 2.47 H new ATOM 0 HH TYR A 199 25.195 -8.898 0.896 1.00 3.53 H new ATOM 2862 N SER A 200 29.450 -9.476 5.549 1.00 2.43 N ATOM 2863 CA SER A 200 30.740 -9.538 4.862 1.00 3.08 C ATOM 2864 C SER A 200 30.964 -10.866 4.143 1.00 3.06 C ATOM 2865 O SER A 200 32.102 -11.326 4.019 1.00 3.33 O ATOM 2866 CB SER A 200 31.859 -9.286 5.871 1.00 3.56 C ATOM 2867 OG SER A 200 31.607 -8.106 6.620 1.00 4.12 O ATOM 0 H SER A 200 28.865 -8.694 5.255 1.00 2.43 H new ATOM 0 HA SER A 200 30.743 -8.765 4.093 1.00 3.08 H new ATOM 0 HB2 SER A 200 31.946 -10.138 6.545 1.00 3.56 H new ATOM 0 HB3 SER A 200 32.811 -9.194 5.349 1.00 3.56 H new ATOM 0 HG SER A 200 31.021 -8.318 7.377 1.00 4.12 H new ATOM 2873 N ASP A 201 29.874 -11.458 3.661 1.00 2.98 N ATOM 2874 CA ASP A 201 29.923 -12.712 2.905 1.00 3.19 C ATOM 2875 C ASP A 201 30.452 -13.863 3.777 1.00 3.05 C ATOM 2876 O ASP A 201 30.801 -14.934 3.282 1.00 3.25 O ATOM 2877 CB ASP A 201 30.790 -12.513 1.652 1.00 3.87 C ATOM 2878 CG ASP A 201 30.751 -13.680 0.686 1.00 4.29 C ATOM 2879 OD1 ASP A 201 29.739 -13.825 -0.037 1.00 4.89 O ATOM 2880 OD2 ASP A 201 31.735 -14.446 0.624 1.00 4.31 O ATOM 0 H ASP A 201 28.932 -11.085 3.782 1.00 2.98 H new ATOM 0 HA ASP A 201 28.914 -12.985 2.596 1.00 3.19 H new ATOM 0 HB2 ASP A 201 30.460 -11.613 1.133 1.00 3.87 H new ATOM 0 HB3 ASP A 201 31.822 -12.343 1.959 1.00 3.87 H new ATOM 2885 N GLN A 202 30.467 -13.641 5.088 1.00 3.02 N ATOM 2886 CA GLN A 202 30.985 -14.618 6.035 1.00 3.45 C ATOM 2887 C GLN A 202 30.018 -15.787 6.185 1.00 3.85 C ATOM 2888 O GLN A 202 30.346 -16.892 5.707 1.00 4.18 O ATOM 2889 CB GLN A 202 31.240 -13.951 7.390 1.00 3.65 C ATOM 2890 CG GLN A 202 31.792 -14.886 8.453 1.00 4.42 C ATOM 2891 CD GLN A 202 32.070 -14.169 9.762 1.00 5.07 C ATOM 2892 OE1 GLN A 202 32.403 -12.982 9.781 1.00 5.73 O ATOM 2893 NE2 GLN A 202 31.928 -14.880 10.868 1.00 5.30 N ATOM 2894 OXT GLN A 202 28.928 -15.593 6.760 1.00 4.27 O ATOM 0 H GLN A 202 30.122 -12.784 5.520 1.00 3.02 H new ATOM 0 HA GLN A 202 31.929 -15.007 5.654 1.00 3.45 H new ATOM 0 HB2 GLN A 202 31.939 -13.126 7.250 1.00 3.65 H new ATOM 0 HB3 GLN A 202 30.306 -13.520 7.751 1.00 3.65 H new ATOM 0 HG2 GLN A 202 31.082 -15.694 8.628 1.00 4.42 H new ATOM 0 HG3 GLN A 202 32.712 -15.343 8.089 1.00 4.42 H new ATOM 0 HE21 GLN A 202 31.651 -15.860 10.812 1.00 5.30 H new ATOM 0 HE22 GLN A 202 32.095 -14.448 11.777 1.00 5.30 H new TER 2903 GLN A 202