USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1038 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 85 SER OG : rot -140:sc= -1.18 USER MOD Set 1.2: A 87 ASN : amide:sc= -1.35 K(o=-2.5,f=-0.87) USER MOD Set 2.1: A 63 SER OG : rot -62:sc= 1.2 USER MOD Set 2.2: A 66 ASN : amide:sc= 1.39 K(o=2.6,f=-3.8!) USER MOD Set 3.1: A 56 THR OG1 : rot -15:sc= -0.942 USER MOD Set 3.2: A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.06) USER MOD Single : A -2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -5 HIS : no HD1:sc= -0.0209 X(o=-0.021,f=-0.053) USER MOD Single : A -5 HIS N :NH3+ -118:sc= 0.0485 (180deg=-0.0256) USER MOD Single : A 11 MET CE :methyl -154:sc= -0.271 (180deg=-1.4) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.108) USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 23 HIS : no HE2:sc= -0.165 X(o=-0.16,f=-0.42) USER MOD Single : A 24 MET CE :methyl -153:sc= -0.272 (180deg=-1.24) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 60 GLN : amide:sc= -0.913 K(o=-0.91,f=-2.8!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -74:sc= 0.42 USER MOD Single : A 77 HIS : no HD1:sc= -1.31 K(o=-1.3,f=-3.8!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 168:sc= 0.0363 USER MOD Single : A 101 ASN : amide:sc= -2.52 K(o=-2.5,f=-5.6!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 HIS : no HD1:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 76:sc= 0.285 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot -30:sc= -0.805 USER MOD Single : A 136 ASN : amide:sc= -0.022 K(o=-0.022,f=-1.4) USER MOD Single : A 140 LYS NZ :NH3+ 170:sc= -1.46 (180deg=-2.16) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -5 66.709 25.176 -2.572 1.00 0.00 N ATOM 2 CA HIS A -5 65.982 24.751 -3.801 1.00 0.00 C ATOM 3 C HIS A -5 65.271 23.429 -3.537 1.00 0.00 C ATOM 4 O HIS A -5 65.662 22.670 -2.650 1.00 0.00 O ATOM 5 CB HIS A -5 66.979 24.587 -4.949 1.00 0.00 C ATOM 6 CG HIS A -5 67.671 25.869 -5.330 1.00 0.00 C ATOM 7 ND1 HIS A -5 68.884 26.247 -4.777 1.00 0.00 N ATOM 8 CD2 HIS A -5 67.332 26.869 -6.208 1.00 0.00 C ATOM 9 CE1 HIS A -5 69.227 27.428 -5.320 1.00 0.00 C ATOM 10 NE2 HIS A -5 68.317 27.853 -6.199 1.00 0.00 N ATOM 0 H1 HIS A -5 66.325 26.083 -2.238 1.00 0.00 H new ATOM 0 H2 HIS A -5 66.590 24.455 -1.832 1.00 0.00 H new ATOM 0 H3 HIS A -5 67.720 25.287 -2.788 1.00 0.00 H new ATOM 0 HA HIS A -5 65.244 25.506 -4.072 1.00 0.00 H new ATOM 0 HB2 HIS A -5 67.729 23.849 -4.666 1.00 0.00 H new ATOM 0 HB3 HIS A -5 66.456 24.192 -5.820 1.00 0.00 H new ATOM 0 HD2 HIS A -5 66.438 26.889 -6.813 1.00 0.00 H new ATOM 0 HE1 HIS A -5 70.130 27.968 -5.075 1.00 0.00 H new ATOM 0 HE2 HIS A -5 68.339 28.713 -6.746 1.00 0.00 H new ATOM 20 N HIS A -4 64.225 23.159 -4.313 1.00 0.00 N ATOM 21 CA HIS A -4 63.459 21.924 -4.162 1.00 0.00 C ATOM 22 C HIS A -4 63.561 21.076 -5.426 1.00 0.00 C ATOM 23 O HIS A -4 63.484 21.592 -6.541 1.00 0.00 O ATOM 24 CB HIS A -4 61.991 22.253 -3.889 1.00 0.00 C ATOM 25 CG HIS A -4 61.773 22.979 -2.589 1.00 0.00 C ATOM 26 ND1 HIS A -4 61.760 24.363 -2.508 1.00 0.00 N ATOM 27 CD2 HIS A -4 61.557 22.527 -1.310 1.00 0.00 C ATOM 28 CE1 HIS A -4 61.543 24.692 -1.223 1.00 0.00 C ATOM 29 NE2 HIS A -4 61.413 23.612 -0.449 1.00 0.00 N ATOM 0 H HIS A -4 63.888 23.777 -5.051 1.00 0.00 H new ATOM 0 HA HIS A -4 63.870 21.362 -3.323 1.00 0.00 H new ATOM 0 HB2 HIS A -4 61.605 22.862 -4.706 1.00 0.00 H new ATOM 0 HB3 HIS A -4 61.414 21.328 -3.881 1.00 0.00 H new ATOM 0 HD2 HIS A -4 61.507 21.489 -1.017 1.00 0.00 H new ATOM 0 HE1 HIS A -4 61.481 25.707 -0.860 1.00 0.00 H new ATOM 0 HE2 HIS A -4 61.244 23.587 0.557 1.00 0.00 H new ATOM 37 N HIS A -3 63.737 19.769 -5.244 1.00 0.00 N ATOM 38 CA HIS A -3 63.850 18.847 -6.371 1.00 0.00 C ATOM 39 C HIS A -3 62.807 17.740 -6.261 1.00 0.00 C ATOM 40 O HIS A -3 62.506 17.265 -5.166 1.00 0.00 O ATOM 41 CB HIS A -3 65.249 18.230 -6.400 1.00 0.00 C ATOM 42 CG HIS A -3 66.341 19.236 -6.643 1.00 0.00 C ATOM 43 ND1 HIS A -3 67.003 19.873 -5.605 1.00 0.00 N ATOM 44 CD2 HIS A -3 66.900 19.724 -7.799 1.00 0.00 C ATOM 45 CE1 HIS A -3 67.911 20.700 -6.150 1.00 0.00 C ATOM 46 NE2 HIS A -3 67.892 20.649 -7.485 1.00 0.00 N ATOM 0 H HIS A -3 63.804 19.325 -4.328 1.00 0.00 H new ATOM 0 HA HIS A -3 63.679 19.403 -7.292 1.00 0.00 H new ATOM 0 HB2 HIS A -3 65.435 17.725 -5.452 1.00 0.00 H new ATOM 0 HB3 HIS A -3 65.286 17.469 -7.179 1.00 0.00 H new ATOM 0 HD2 HIS A -3 66.614 19.434 -8.799 1.00 0.00 H new ATOM 0 HE1 HIS A -3 68.576 21.330 -5.578 1.00 0.00 H new ATOM 0 HE2 HIS A -3 68.478 21.174 -8.134 1.00 0.00 H new ATOM 54 N HIS A -2 62.260 17.330 -7.403 1.00 0.00 N ATOM 55 CA HIS A -2 61.253 16.273 -7.433 1.00 0.00 C ATOM 56 C HIS A -2 61.768 15.069 -8.217 1.00 0.00 C ATOM 57 O HIS A -2 62.385 15.220 -9.270 1.00 0.00 O ATOM 58 CB HIS A -2 59.972 16.794 -8.085 1.00 0.00 C ATOM 59 CG HIS A -2 59.348 17.944 -7.341 1.00 0.00 C ATOM 60 ND1 HIS A -2 58.741 17.784 -6.107 1.00 0.00 N ATOM 61 CD2 HIS A -2 59.231 19.278 -7.647 1.00 0.00 C ATOM 62 CE1 HIS A -2 58.289 18.989 -5.717 1.00 0.00 C ATOM 63 NE2 HIS A -2 58.560 19.936 -6.619 1.00 0.00 N ATOM 0 H HIS A -2 62.497 17.713 -8.318 1.00 0.00 H new ATOM 0 HA HIS A -2 61.042 15.966 -6.409 1.00 0.00 H new ATOM 0 HB2 HIS A -2 60.194 17.108 -9.105 1.00 0.00 H new ATOM 0 HB3 HIS A -2 59.250 15.980 -8.152 1.00 0.00 H new ATOM 0 HD2 HIS A -2 59.602 19.745 -8.547 1.00 0.00 H new ATOM 0 HE1 HIS A -2 57.770 19.169 -4.787 1.00 0.00 H new ATOM 0 HE2 HIS A -2 58.326 20.927 -6.566 1.00 0.00 H new ATOM 71 N HIS A -1 61.509 13.873 -7.694 1.00 0.00 N ATOM 72 CA HIS A -1 61.948 12.643 -8.347 1.00 0.00 C ATOM 73 C HIS A -1 60.782 11.671 -8.492 1.00 0.00 C ATOM 74 O HIS A -1 59.987 11.498 -7.569 1.00 0.00 O ATOM 75 CB HIS A -1 63.059 11.987 -7.526 1.00 0.00 C ATOM 76 CG HIS A -1 63.594 10.724 -8.145 1.00 0.00 C ATOM 77 ND1 HIS A -1 63.116 9.471 -7.799 1.00 0.00 N ATOM 78 CD2 HIS A -1 64.568 10.505 -9.090 1.00 0.00 C ATOM 79 CE1 HIS A -1 63.793 8.563 -8.523 1.00 0.00 C ATOM 80 NE2 HIS A -1 64.690 9.139 -9.326 1.00 0.00 N ATOM 0 H HIS A -1 60.999 13.730 -6.822 1.00 0.00 H new ATOM 0 HA HIS A -1 62.326 12.893 -9.338 1.00 0.00 H new ATOM 0 HB2 HIS A -1 63.877 12.697 -7.403 1.00 0.00 H new ATOM 0 HB3 HIS A -1 62.679 11.762 -6.529 1.00 0.00 H new ATOM 0 HD2 HIS A -1 65.149 11.275 -9.575 1.00 0.00 H new ATOM 0 HE1 HIS A -1 63.631 7.497 -8.462 1.00 0.00 H new ATOM 0 HE2 HIS A -1 65.328 8.677 -9.974 1.00 0.00 H new ATOM 88 N HIS A 0 60.687 11.037 -9.658 1.00 0.00 N ATOM 89 CA HIS A 0 59.619 10.076 -9.922 1.00 0.00 C ATOM 90 C HIS A 0 60.198 8.684 -10.146 1.00 0.00 C ATOM 91 O HIS A 0 61.211 8.524 -10.827 1.00 0.00 O ATOM 92 CB HIS A 0 58.829 10.505 -11.160 1.00 0.00 C ATOM 93 CG HIS A 0 58.106 11.812 -10.987 1.00 0.00 C ATOM 94 ND1 HIS A 0 58.677 13.025 -11.337 1.00 0.00 N ATOM 95 CD2 HIS A 0 56.857 12.113 -10.501 1.00 0.00 C ATOM 96 CE1 HIS A 0 57.783 13.990 -11.060 1.00 0.00 C ATOM 97 NE2 HIS A 0 56.655 13.491 -10.548 1.00 0.00 N ATOM 0 H HIS A 0 61.335 11.171 -10.434 1.00 0.00 H new ATOM 0 HA HIS A 0 58.956 10.048 -9.057 1.00 0.00 H new ATOM 0 HB2 HIS A 0 59.511 10.585 -12.007 1.00 0.00 H new ATOM 0 HB3 HIS A 0 58.105 9.728 -11.406 1.00 0.00 H new ATOM 0 HD2 HIS A 0 56.140 11.391 -10.138 1.00 0.00 H new ATOM 0 HE1 HIS A 0 57.956 15.042 -11.231 1.00 0.00 H new ATOM 0 HE2 HIS A 0 55.825 14.007 -10.255 1.00 0.00 H new ATOM 105 N SER A 1 59.548 7.677 -9.571 1.00 0.00 N ATOM 106 CA SER A 1 60.008 6.302 -9.713 1.00 0.00 C ATOM 107 C SER A 1 59.936 5.862 -11.173 1.00 0.00 C ATOM 108 O SER A 1 59.139 6.386 -11.950 1.00 0.00 O ATOM 109 CB SER A 1 59.150 5.371 -8.855 1.00 0.00 C ATOM 110 OG SER A 1 59.213 5.797 -7.501 1.00 0.00 O ATOM 0 H SER A 1 58.706 7.787 -9.006 1.00 0.00 H new ATOM 0 HA SER A 1 61.044 6.249 -9.379 1.00 0.00 H new ATOM 0 HB2 SER A 1 58.118 5.382 -9.205 1.00 0.00 H new ATOM 0 HB3 SER A 1 59.506 4.344 -8.943 1.00 0.00 H new ATOM 0 HG SER A 1 58.663 5.205 -6.946 1.00 0.00 H new ATOM 116 N SER A 2 60.774 4.894 -11.537 1.00 0.00 N ATOM 117 CA SER A 2 60.801 4.380 -12.903 1.00 0.00 C ATOM 118 C SER A 2 60.557 2.875 -12.912 1.00 0.00 C ATOM 119 O SER A 2 61.038 2.154 -12.037 1.00 0.00 O ATOM 120 CB SER A 2 62.157 4.680 -13.544 1.00 0.00 C ATOM 121 OG SER A 2 62.127 4.279 -14.908 1.00 0.00 O ATOM 0 H SER A 2 61.442 4.451 -10.906 1.00 0.00 H new ATOM 0 HA SER A 2 60.011 4.870 -13.473 1.00 0.00 H new ATOM 0 HB2 SER A 2 62.380 5.744 -13.470 1.00 0.00 H new ATOM 0 HB3 SER A 2 62.949 4.150 -13.014 1.00 0.00 H new ATOM 0 HG SER A 2 62.993 4.471 -15.324 1.00 0.00 H new ATOM 127 N GLY A 3 59.810 2.406 -13.906 1.00 0.00 N ATOM 128 CA GLY A 3 59.515 0.983 -14.021 1.00 0.00 C ATOM 129 C GLY A 3 60.625 0.255 -14.772 1.00 0.00 C ATOM 130 O GLY A 3 61.635 0.855 -15.140 1.00 0.00 O ATOM 0 H GLY A 3 59.401 2.986 -14.638 1.00 0.00 H new ATOM 0 HA2 GLY A 3 59.399 0.550 -13.027 1.00 0.00 H new ATOM 0 HA3 GLY A 3 58.567 0.845 -14.542 1.00 0.00 H new ATOM 134 N LEU A 4 60.431 -1.040 -14.997 1.00 0.00 N ATOM 135 CA LEU A 4 61.421 -1.839 -15.711 1.00 0.00 C ATOM 136 C LEU A 4 61.013 -2.010 -17.170 1.00 0.00 C ATOM 137 O LEU A 4 59.888 -2.414 -17.468 1.00 0.00 O ATOM 138 CB LEU A 4 61.556 -3.213 -15.050 1.00 0.00 C ATOM 139 CG LEU A 4 62.702 -3.988 -15.704 1.00 0.00 C ATOM 140 CD1 LEU A 4 64.038 -3.372 -15.288 1.00 0.00 C ATOM 141 CD2 LEU A 4 62.652 -5.448 -15.250 1.00 0.00 C ATOM 0 H LEU A 4 59.604 -1.556 -14.698 1.00 0.00 H new ATOM 0 HA LEU A 4 62.380 -1.322 -15.671 1.00 0.00 H new ATOM 0 HB2 LEU A 4 61.745 -3.097 -13.983 1.00 0.00 H new ATOM 0 HB3 LEU A 4 60.624 -3.769 -15.150 1.00 0.00 H new ATOM 0 HG LEU A 4 62.602 -3.939 -16.788 1.00 0.00 H new ATOM 0 HD11 LEU A 4 64.854 -3.924 -15.754 1.00 0.00 H new ATOM 0 HD12 LEU A 4 64.074 -2.331 -15.609 1.00 0.00 H new ATOM 0 HD13 LEU A 4 64.139 -3.421 -14.204 1.00 0.00 H new ATOM 0 HD21 LEU A 4 63.468 -6.002 -15.715 1.00 0.00 H new ATOM 0 HD22 LEU A 4 62.753 -5.496 -14.166 1.00 0.00 H new ATOM 0 HD23 LEU A 4 61.700 -5.888 -15.545 1.00 0.00 H new ATOM 153 N VAL A 5 61.933 -1.700 -18.077 1.00 0.00 N ATOM 154 CA VAL A 5 61.655 -1.819 -19.504 1.00 0.00 C ATOM 155 C VAL A 5 61.625 -3.291 -19.927 1.00 0.00 C ATOM 156 O VAL A 5 62.275 -4.122 -19.291 1.00 0.00 O ATOM 157 CB VAL A 5 62.720 -1.072 -20.311 1.00 0.00 C ATOM 158 CG1 VAL A 5 62.682 0.414 -19.953 1.00 0.00 C ATOM 159 CG2 VAL A 5 64.104 -1.638 -19.984 1.00 0.00 C ATOM 0 H VAL A 5 62.871 -1.367 -17.852 1.00 0.00 H new ATOM 0 HA VAL A 5 60.678 -1.378 -19.701 1.00 0.00 H new ATOM 0 HB VAL A 5 62.520 -1.197 -21.375 1.00 0.00 H new ATOM 0 HG11 VAL A 5 63.440 0.946 -20.527 1.00 0.00 H new ATOM 0 HG12 VAL A 5 61.698 0.820 -20.188 1.00 0.00 H new ATOM 0 HG13 VAL A 5 62.881 0.537 -18.888 1.00 0.00 H new ATOM 0 HG21 VAL A 5 64.860 -1.105 -20.560 1.00 0.00 H new ATOM 0 HG22 VAL A 5 64.305 -1.516 -18.920 1.00 0.00 H new ATOM 0 HG23 VAL A 5 64.134 -2.697 -20.239 1.00 0.00 H new ATOM 169 N PRO A 6 60.900 -3.637 -20.971 1.00 0.00 N ATOM 170 CA PRO A 6 60.835 -5.049 -21.442 1.00 0.00 C ATOM 171 C PRO A 6 61.974 -5.387 -22.400 1.00 0.00 C ATOM 172 O PRO A 6 62.838 -4.552 -22.670 1.00 0.00 O ATOM 173 CB PRO A 6 59.485 -5.119 -22.152 1.00 0.00 C ATOM 174 CG PRO A 6 59.257 -3.748 -22.695 1.00 0.00 C ATOM 175 CD PRO A 6 60.059 -2.774 -21.827 1.00 0.00 C ATOM 0 HA PRO A 6 60.934 -5.764 -20.626 1.00 0.00 H new ATOM 0 HB2 PRO A 6 59.498 -5.861 -22.950 1.00 0.00 H new ATOM 0 HB3 PRO A 6 58.692 -5.406 -21.462 1.00 0.00 H new ATOM 0 HG2 PRO A 6 59.577 -3.689 -23.735 1.00 0.00 H new ATOM 0 HG3 PRO A 6 58.196 -3.498 -22.673 1.00 0.00 H new ATOM 0 HD2 PRO A 6 60.669 -2.109 -22.439 1.00 0.00 H new ATOM 0 HD3 PRO A 6 59.401 -2.144 -21.229 1.00 0.00 H new ATOM 183 N ARG A 7 61.969 -6.613 -22.912 1.00 0.00 N ATOM 184 CA ARG A 7 63.001 -7.040 -23.850 1.00 0.00 C ATOM 185 C ARG A 7 62.930 -6.215 -25.130 1.00 0.00 C ATOM 186 O ARG A 7 61.845 -5.857 -25.588 1.00 0.00 O ATOM 187 CB ARG A 7 62.827 -8.524 -24.189 1.00 0.00 C ATOM 188 CG ARG A 7 63.501 -9.391 -23.122 1.00 0.00 C ATOM 189 CD ARG A 7 62.582 -9.541 -21.908 1.00 0.00 C ATOM 190 NE ARG A 7 63.244 -10.336 -20.869 1.00 0.00 N ATOM 191 CZ ARG A 7 63.364 -11.672 -20.923 1.00 0.00 C ATOM 192 NH1 ARG A 7 62.891 -12.378 -21.923 1.00 0.00 N ATOM 193 NH2 ARG A 7 63.971 -12.290 -19.947 1.00 0.00 N ATOM 0 H ARG A 7 61.269 -7.323 -22.696 1.00 0.00 H new ATOM 0 HA ARG A 7 63.974 -6.889 -23.382 1.00 0.00 H new ATOM 0 HB2 ARG A 7 61.767 -8.769 -24.251 1.00 0.00 H new ATOM 0 HB3 ARG A 7 63.260 -8.735 -25.167 1.00 0.00 H new ATOM 0 HG2 ARG A 7 63.735 -10.373 -23.534 1.00 0.00 H new ATOM 0 HG3 ARG A 7 64.446 -8.939 -22.819 1.00 0.00 H new ATOM 0 HD2 ARG A 7 62.323 -8.558 -21.515 1.00 0.00 H new ATOM 0 HD3 ARG A 7 61.650 -10.021 -22.205 1.00 0.00 H new ATOM 0 HE ARG A 7 63.634 -9.848 -20.063 1.00 0.00 H new ATOM 0 HH11 ARG A 7 62.413 -11.913 -22.695 1.00 0.00 H new ATOM 0 HH12 ARG A 7 63.002 -13.392 -21.929 1.00 0.00 H new ATOM 0 HH21 ARG A 7 64.345 -11.758 -19.161 1.00 0.00 H new ATOM 0 HH22 ARG A 7 64.072 -13.305 -19.970 1.00 0.00 H new ATOM 207 N GLY A 8 64.092 -5.916 -25.701 1.00 0.00 N ATOM 208 CA GLY A 8 64.145 -5.133 -26.931 1.00 0.00 C ATOM 209 C GLY A 8 65.576 -4.717 -27.252 1.00 0.00 C ATOM 210 O GLY A 8 66.518 -5.113 -26.566 1.00 0.00 O ATOM 0 H GLY A 8 65.001 -6.200 -25.337 1.00 0.00 H new ATOM 0 HA2 GLY A 8 63.739 -5.718 -27.756 1.00 0.00 H new ATOM 0 HA3 GLY A 8 63.519 -4.247 -26.829 1.00 0.00 H new ATOM 214 N SER A 9 65.731 -3.913 -28.299 1.00 0.00 N ATOM 215 CA SER A 9 67.051 -3.439 -28.699 1.00 0.00 C ATOM 216 C SER A 9 67.658 -2.564 -27.608 1.00 0.00 C ATOM 217 O SER A 9 66.941 -1.990 -26.788 1.00 0.00 O ATOM 218 CB SER A 9 66.948 -2.639 -29.997 1.00 0.00 C ATOM 219 OG SER A 9 66.368 -3.457 -31.005 1.00 0.00 O ATOM 0 H SER A 9 64.964 -3.578 -28.882 1.00 0.00 H new ATOM 0 HA SER A 9 67.695 -4.305 -28.856 1.00 0.00 H new ATOM 0 HB2 SER A 9 66.341 -1.747 -29.841 1.00 0.00 H new ATOM 0 HB3 SER A 9 67.936 -2.301 -30.310 1.00 0.00 H new ATOM 0 HG SER A 9 66.298 -2.948 -31.839 1.00 0.00 H new ATOM 225 N GLY A 10 68.983 -2.467 -27.602 1.00 0.00 N ATOM 226 CA GLY A 10 69.675 -1.656 -26.606 1.00 0.00 C ATOM 227 C GLY A 10 71.120 -1.399 -27.022 1.00 0.00 C ATOM 228 O GLY A 10 71.544 -1.793 -28.108 1.00 0.00 O ATOM 0 H GLY A 10 69.596 -2.936 -28.270 1.00 0.00 H new ATOM 0 HA2 GLY A 10 69.155 -0.707 -26.479 1.00 0.00 H new ATOM 0 HA3 GLY A 10 69.655 -2.162 -25.641 1.00 0.00 H new ATOM 232 N MET A 11 71.873 -0.735 -26.148 1.00 0.00 N ATOM 233 CA MET A 11 73.271 -0.422 -26.429 1.00 0.00 C ATOM 234 C MET A 11 74.165 -0.896 -25.286 1.00 0.00 C ATOM 235 O MET A 11 73.703 -1.081 -24.160 1.00 0.00 O ATOM 236 CB MET A 11 73.440 1.087 -26.615 1.00 0.00 C ATOM 237 CG MET A 11 72.654 1.539 -27.848 1.00 0.00 C ATOM 238 SD MET A 11 73.024 3.275 -28.208 1.00 0.00 S ATOM 239 CE MET A 11 72.442 3.974 -26.643 1.00 0.00 C ATOM 0 H MET A 11 71.540 -0.405 -25.242 1.00 0.00 H new ATOM 0 HA MET A 11 73.563 -0.937 -27.344 1.00 0.00 H new ATOM 0 HB2 MET A 11 73.085 1.615 -25.730 1.00 0.00 H new ATOM 0 HB3 MET A 11 74.495 1.334 -26.732 1.00 0.00 H new ATOM 0 HG2 MET A 11 72.914 0.917 -28.705 1.00 0.00 H new ATOM 0 HG3 MET A 11 71.585 1.414 -27.675 1.00 0.00 H new ATOM 0 HE1 MET A 11 72.144 5.011 -26.796 1.00 0.00 H new ATOM 0 HE2 MET A 11 71.588 3.400 -26.283 1.00 0.00 H new ATOM 0 HE3 MET A 11 73.244 3.932 -25.906 1.00 0.00 H new ATOM 249 N LYS A 12 75.445 -1.089 -25.585 1.00 0.00 N ATOM 250 CA LYS A 12 76.396 -1.539 -24.575 1.00 0.00 C ATOM 251 C LYS A 12 76.714 -0.410 -23.600 1.00 0.00 C ATOM 252 O LYS A 12 76.887 0.741 -24.002 1.00 0.00 O ATOM 253 CB LYS A 12 77.686 -2.015 -25.247 1.00 0.00 C ATOM 254 CG LYS A 12 78.615 -2.627 -24.198 1.00 0.00 C ATOM 255 CD LYS A 12 79.859 -3.194 -24.885 1.00 0.00 C ATOM 256 CE LYS A 12 80.698 -2.049 -25.452 1.00 0.00 C ATOM 257 NZ LYS A 12 82.032 -2.568 -25.866 1.00 0.00 N ATOM 0 H LYS A 12 75.846 -0.942 -26.511 1.00 0.00 H new ATOM 0 HA LYS A 12 75.949 -2.366 -24.023 1.00 0.00 H new ATOM 0 HB2 LYS A 12 77.456 -2.751 -26.018 1.00 0.00 H new ATOM 0 HB3 LYS A 12 78.180 -1.179 -25.742 1.00 0.00 H new ATOM 0 HG2 LYS A 12 78.903 -1.871 -23.467 1.00 0.00 H new ATOM 0 HG3 LYS A 12 78.096 -3.416 -23.653 1.00 0.00 H new ATOM 0 HD2 LYS A 12 80.448 -3.772 -24.173 1.00 0.00 H new ATOM 0 HD3 LYS A 12 79.567 -3.875 -25.685 1.00 0.00 H new ATOM 0 HE2 LYS A 12 80.190 -1.600 -26.305 1.00 0.00 H new ATOM 0 HE3 LYS A 12 80.817 -1.266 -24.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 82.603 -1.789 -26.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 82.516 -2.977 -25.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 81.909 -3.301 -26.594 1.00 0.00 H new ATOM 271 N GLU A 13 76.790 -0.747 -22.317 1.00 0.00 N ATOM 272 CA GLU A 13 77.083 0.249 -21.293 1.00 0.00 C ATOM 273 C GLU A 13 78.579 0.290 -21.001 1.00 0.00 C ATOM 274 O GLU A 13 79.238 -0.748 -20.929 1.00 0.00 O ATOM 275 CB GLU A 13 76.318 -0.082 -20.009 1.00 0.00 C ATOM 276 CG GLU A 13 76.515 1.044 -18.988 1.00 0.00 C ATOM 277 CD GLU A 13 75.790 2.315 -19.429 1.00 0.00 C ATOM 278 OE1 GLU A 13 74.823 2.214 -20.170 1.00 0.00 O ATOM 279 OE2 GLU A 13 76.216 3.382 -19.016 1.00 0.00 O ATOM 0 H GLU A 13 76.654 -1.694 -21.963 1.00 0.00 H new ATOM 0 HA GLU A 13 76.769 1.226 -21.660 1.00 0.00 H new ATOM 0 HB2 GLU A 13 75.257 -0.207 -20.228 1.00 0.00 H new ATOM 0 HB3 GLU A 13 76.672 -1.027 -19.596 1.00 0.00 H new ATOM 0 HG2 GLU A 13 76.141 0.727 -18.015 1.00 0.00 H new ATOM 0 HG3 GLU A 13 77.579 1.250 -18.869 1.00 0.00 H new ATOM 286 N THR A 14 79.111 1.498 -20.834 1.00 0.00 N ATOM 287 CA THR A 14 80.535 1.678 -20.561 1.00 0.00 C ATOM 288 C THR A 14 80.736 2.425 -19.246 1.00 0.00 C ATOM 289 O THR A 14 79.969 3.327 -18.909 1.00 0.00 O ATOM 290 CB THR A 14 81.186 2.466 -21.701 1.00 0.00 C ATOM 291 OG1 THR A 14 80.905 1.824 -22.937 1.00 0.00 O ATOM 292 CG2 THR A 14 82.699 2.524 -21.486 1.00 0.00 C ATOM 0 H THR A 14 78.578 2.366 -20.883 1.00 0.00 H new ATOM 0 HA THR A 14 81.001 0.696 -20.484 1.00 0.00 H new ATOM 0 HB THR A 14 80.786 3.480 -21.718 1.00 0.00 H new ATOM 0 HG1 THR A 14 81.319 2.327 -23.669 1.00 0.00 H new ATOM 0 HG21 THR A 14 83.161 3.085 -22.298 1.00 0.00 H new ATOM 0 HG22 THR A 14 82.913 3.016 -20.537 1.00 0.00 H new ATOM 0 HG23 THR A 14 83.103 1.512 -21.469 1.00 0.00 H new ATOM 300 N ALA A 15 81.772 2.041 -18.508 1.00 0.00 N ATOM 301 CA ALA A 15 82.064 2.679 -17.229 1.00 0.00 C ATOM 302 C ALA A 15 82.264 4.180 -17.412 1.00 0.00 C ATOM 303 O ALA A 15 82.750 4.629 -18.451 1.00 0.00 O ATOM 304 CB ALA A 15 83.323 2.064 -16.615 1.00 0.00 C ATOM 0 H ALA A 15 82.419 1.297 -18.770 1.00 0.00 H new ATOM 0 HA ALA A 15 81.218 2.517 -16.561 1.00 0.00 H new ATOM 0 HB1 ALA A 15 83.535 2.545 -15.660 1.00 0.00 H new ATOM 0 HB2 ALA A 15 83.167 0.997 -16.457 1.00 0.00 H new ATOM 0 HB3 ALA A 15 84.166 2.211 -17.290 1.00 0.00 H new ATOM 310 N ALA A 16 81.889 4.950 -16.396 1.00 0.00 N ATOM 311 CA ALA A 16 82.017 6.401 -16.458 1.00 0.00 C ATOM 312 C ALA A 16 82.505 6.954 -15.123 1.00 0.00 C ATOM 313 O ALA A 16 82.369 6.306 -14.085 1.00 0.00 O ATOM 314 CB ALA A 16 80.667 7.030 -16.811 1.00 0.00 C ATOM 0 H ALA A 16 81.496 4.596 -15.524 1.00 0.00 H new ATOM 0 HA ALA A 16 82.746 6.650 -17.229 1.00 0.00 H new ATOM 0 HB1 ALA A 16 80.771 8.114 -16.855 1.00 0.00 H new ATOM 0 HB2 ALA A 16 80.334 6.658 -17.780 1.00 0.00 H new ATOM 0 HB3 ALA A 16 79.933 6.767 -16.050 1.00 0.00 H new ATOM 320 N ALA A 17 83.074 8.155 -15.160 1.00 0.00 N ATOM 321 CA ALA A 17 83.590 8.782 -13.948 1.00 0.00 C ATOM 322 C ALA A 17 82.491 8.912 -12.900 1.00 0.00 C ATOM 323 O ALA A 17 81.320 9.094 -13.231 1.00 0.00 O ATOM 324 CB ALA A 17 84.151 10.167 -14.276 1.00 0.00 C ATOM 0 H ALA A 17 83.189 8.710 -16.008 1.00 0.00 H new ATOM 0 HA ALA A 17 84.384 8.153 -13.547 1.00 0.00 H new ATOM 0 HB1 ALA A 17 84.534 10.629 -13.366 1.00 0.00 H new ATOM 0 HB2 ALA A 17 84.958 10.070 -15.002 1.00 0.00 H new ATOM 0 HB3 ALA A 17 83.360 10.790 -14.694 1.00 0.00 H new ATOM 330 N LYS A 18 82.878 8.817 -11.631 1.00 0.00 N ATOM 331 CA LYS A 18 81.918 8.916 -10.538 1.00 0.00 C ATOM 332 C LYS A 18 81.653 10.376 -10.186 1.00 0.00 C ATOM 333 O LYS A 18 82.501 11.241 -10.407 1.00 0.00 O ATOM 334 CB LYS A 18 82.451 8.180 -9.307 1.00 0.00 C ATOM 335 CG LYS A 18 82.577 6.688 -9.618 1.00 0.00 C ATOM 336 CD LYS A 18 83.007 5.937 -8.356 1.00 0.00 C ATOM 337 CE LYS A 18 83.252 4.465 -8.694 1.00 0.00 C ATOM 338 NZ LYS A 18 81.949 3.795 -8.965 1.00 0.00 N ATOM 0 H LYS A 18 83.844 8.672 -11.336 1.00 0.00 H new ATOM 0 HA LYS A 18 80.983 8.457 -10.859 1.00 0.00 H new ATOM 0 HB2 LYS A 18 83.421 8.585 -9.020 1.00 0.00 H new ATOM 0 HB3 LYS A 18 81.780 8.330 -8.462 1.00 0.00 H new ATOM 0 HG2 LYS A 18 81.625 6.299 -9.978 1.00 0.00 H new ATOM 0 HG3 LYS A 18 83.306 6.532 -10.413 1.00 0.00 H new ATOM 0 HD2 LYS A 18 83.914 6.382 -7.947 1.00 0.00 H new ATOM 0 HD3 LYS A 18 82.236 6.021 -7.590 1.00 0.00 H new ATOM 0 HE2 LYS A 18 83.903 4.384 -9.565 1.00 0.00 H new ATOM 0 HE3 LYS A 18 83.762 3.971 -7.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 82.091 2.766 -9.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 81.278 4.019 -8.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 81.567 4.132 -9.872 1.00 0.00 H new ATOM 352 N PHE A 19 80.472 10.642 -9.636 1.00 0.00 N ATOM 353 CA PHE A 19 80.092 12.001 -9.263 1.00 0.00 C ATOM 354 C PHE A 19 79.532 12.030 -7.844 1.00 0.00 C ATOM 355 O PHE A 19 79.188 10.991 -7.282 1.00 0.00 O ATOM 356 CB PHE A 19 79.044 12.535 -10.241 1.00 0.00 C ATOM 357 CG PHE A 19 77.748 11.758 -10.218 1.00 0.00 C ATOM 358 CD1 PHE A 19 77.616 10.593 -10.981 1.00 0.00 C ATOM 359 CD2 PHE A 19 76.678 12.206 -9.433 1.00 0.00 C ATOM 360 CE1 PHE A 19 76.415 9.874 -10.960 1.00 0.00 C ATOM 361 CE2 PHE A 19 75.477 11.487 -9.412 1.00 0.00 C ATOM 362 CZ PHE A 19 75.345 10.321 -10.175 1.00 0.00 C ATOM 0 H PHE A 19 79.763 9.936 -9.439 1.00 0.00 H new ATOM 0 HA PHE A 19 80.980 12.632 -9.302 1.00 0.00 H new ATOM 0 HB2 PHE A 19 78.837 13.579 -10.005 1.00 0.00 H new ATOM 0 HB3 PHE A 19 79.455 12.511 -11.250 1.00 0.00 H new ATOM 0 HD1 PHE A 19 78.441 10.248 -11.587 1.00 0.00 H new ATOM 0 HD2 PHE A 19 76.779 13.106 -8.844 1.00 0.00 H new ATOM 0 HE1 PHE A 19 76.314 8.975 -11.549 1.00 0.00 H new ATOM 0 HE2 PHE A 19 74.652 11.832 -8.807 1.00 0.00 H new ATOM 0 HZ PHE A 19 74.418 9.766 -10.158 1.00 0.00 H new ATOM 372 N GLU A 20 79.444 13.228 -7.273 1.00 0.00 N ATOM 373 CA GLU A 20 78.952 13.381 -5.908 1.00 0.00 C ATOM 374 C GLU A 20 77.562 12.767 -5.759 1.00 0.00 C ATOM 375 O GLU A 20 76.743 12.830 -6.675 1.00 0.00 O ATOM 376 CB GLU A 20 78.898 14.863 -5.538 1.00 0.00 C ATOM 377 CG GLU A 20 80.311 15.455 -5.581 1.00 0.00 C ATOM 378 CD GLU A 20 80.328 16.921 -5.135 1.00 0.00 C ATOM 379 OE1 GLU A 20 79.270 17.515 -4.989 1.00 0.00 O ATOM 380 OE2 GLU A 20 81.418 17.435 -4.942 1.00 0.00 O ATOM 0 H GLU A 20 79.705 14.101 -7.731 1.00 0.00 H new ATOM 0 HA GLU A 20 79.636 12.861 -5.238 1.00 0.00 H new ATOM 0 HB2 GLU A 20 78.248 15.398 -6.230 1.00 0.00 H new ATOM 0 HB3 GLU A 20 78.472 14.984 -4.542 1.00 0.00 H new ATOM 0 HG2 GLU A 20 80.969 14.872 -4.937 1.00 0.00 H new ATOM 0 HG3 GLU A 20 80.706 15.379 -6.594 1.00 0.00 H new ATOM 387 N ARG A 21 77.306 12.176 -4.595 1.00 0.00 N ATOM 388 CA ARG A 21 76.017 11.545 -4.324 1.00 0.00 C ATOM 389 C ARG A 21 75.394 12.142 -3.067 1.00 0.00 C ATOM 390 O ARG A 21 76.092 12.429 -2.093 1.00 0.00 O ATOM 391 CB ARG A 21 76.214 10.037 -4.138 1.00 0.00 C ATOM 392 CG ARG A 21 74.863 9.335 -3.962 1.00 0.00 C ATOM 393 CD ARG A 21 74.152 9.220 -5.313 1.00 0.00 C ATOM 394 NE ARG A 21 72.835 8.602 -5.140 1.00 0.00 N ATOM 395 CZ ARG A 21 71.981 8.384 -6.153 1.00 0.00 C ATOM 396 NH1 ARG A 21 72.265 8.712 -7.390 1.00 0.00 N ATOM 397 NH2 ARG A 21 70.830 7.826 -5.896 1.00 0.00 N ATOM 0 H ARG A 21 77.973 12.121 -3.825 1.00 0.00 H new ATOM 0 HA ARG A 21 75.349 11.723 -5.167 1.00 0.00 H new ATOM 0 HB2 ARG A 21 76.735 9.623 -5.001 1.00 0.00 H new ATOM 0 HB3 ARG A 21 76.843 9.851 -3.267 1.00 0.00 H new ATOM 0 HG2 ARG A 21 75.012 8.343 -3.535 1.00 0.00 H new ATOM 0 HG3 ARG A 21 74.242 9.894 -3.262 1.00 0.00 H new ATOM 0 HD2 ARG A 21 74.042 10.208 -5.760 1.00 0.00 H new ATOM 0 HD3 ARG A 21 74.754 8.625 -6.000 1.00 0.00 H new ATOM 0 HE ARG A 21 72.552 8.323 -4.201 1.00 0.00 H new ATOM 0 HH11 ARG A 21 73.160 9.149 -7.609 1.00 0.00 H new ATOM 0 HH12 ARG A 21 71.591 8.531 -8.133 1.00 0.00 H new ATOM 0 HH21 ARG A 21 70.593 7.564 -4.939 1.00 0.00 H new ATOM 0 HH22 ARG A 21 70.168 7.652 -6.652 1.00 0.00 H new ATOM 411 N GLN A 22 74.078 12.329 -3.092 1.00 0.00 N ATOM 412 CA GLN A 22 73.370 12.905 -1.953 1.00 0.00 C ATOM 413 C GLN A 22 72.614 11.824 -1.188 1.00 0.00 C ATOM 414 O GLN A 22 72.145 10.848 -1.775 1.00 0.00 O ATOM 415 CB GLN A 22 72.384 13.969 -2.438 1.00 0.00 C ATOM 416 CG GLN A 22 73.154 15.124 -3.086 1.00 0.00 C ATOM 417 CD GLN A 22 72.188 16.161 -3.656 1.00 0.00 C ATOM 418 OE1 GLN A 22 71.008 15.873 -3.867 1.00 0.00 O ATOM 419 NE2 GLN A 22 72.623 17.362 -3.922 1.00 0.00 N ATOM 0 H GLN A 22 73.482 12.091 -3.885 1.00 0.00 H new ATOM 0 HA GLN A 22 74.103 13.361 -1.287 1.00 0.00 H new ATOM 0 HB2 GLN A 22 71.688 13.534 -3.156 1.00 0.00 H new ATOM 0 HB3 GLN A 22 71.791 14.338 -1.601 1.00 0.00 H new ATOM 0 HG2 GLN A 22 73.806 15.593 -2.349 1.00 0.00 H new ATOM 0 HG3 GLN A 22 73.795 14.741 -3.880 1.00 0.00 H new ATOM 0 HE21 GLN A 22 73.599 17.601 -3.748 1.00 0.00 H new ATOM 0 HE22 GLN A 22 71.987 18.062 -4.304 1.00 0.00 H new ATOM 428 N HIS A 23 72.502 12.004 0.125 1.00 0.00 N ATOM 429 CA HIS A 23 71.803 11.043 0.974 1.00 0.00 C ATOM 430 C HIS A 23 70.660 11.723 1.720 1.00 0.00 C ATOM 431 O HIS A 23 70.770 12.882 2.118 1.00 0.00 O ATOM 432 CB HIS A 23 72.779 10.434 1.981 1.00 0.00 C ATOM 433 CG HIS A 23 73.917 9.688 1.337 1.00 0.00 C ATOM 434 ND1 HIS A 23 73.732 8.480 0.684 1.00 0.00 N ATOM 435 CD2 HIS A 23 75.258 9.968 1.236 1.00 0.00 C ATOM 436 CE1 HIS A 23 74.931 8.080 0.224 1.00 0.00 C ATOM 437 NE2 HIS A 23 75.896 8.949 0.532 1.00 0.00 N ATOM 0 H HIS A 23 72.886 12.806 0.625 1.00 0.00 H new ATOM 0 HA HIS A 23 71.393 10.255 0.342 1.00 0.00 H new ATOM 0 HB2 HIS A 23 73.184 11.228 2.608 1.00 0.00 H new ATOM 0 HB3 HIS A 23 72.235 9.755 2.638 1.00 0.00 H new ATOM 0 HD1 HIS A 23 72.848 7.984 0.572 1.00 0.00 H new ATOM 0 HD2 HIS A 23 75.743 10.844 1.640 1.00 0.00 H new ATOM 0 HE1 HIS A 23 75.093 7.166 -0.328 1.00 0.00 H new ATOM 445 N MET A 24 69.563 10.993 1.907 1.00 0.00 N ATOM 446 CA MET A 24 68.396 11.533 2.600 1.00 0.00 C ATOM 447 C MET A 24 68.152 10.769 3.898 1.00 0.00 C ATOM 448 O MET A 24 68.399 9.566 3.977 1.00 0.00 O ATOM 449 CB MET A 24 67.160 11.418 1.704 1.00 0.00 C ATOM 450 CG MET A 24 67.385 12.159 0.380 1.00 0.00 C ATOM 451 SD MET A 24 67.758 13.906 0.685 1.00 0.00 S ATOM 452 CE MET A 24 66.183 14.350 1.458 1.00 0.00 C ATOM 0 H MET A 24 69.458 10.029 1.590 1.00 0.00 H new ATOM 0 HA MET A 24 68.583 12.582 2.832 1.00 0.00 H new ATOM 0 HB2 MET A 24 66.943 10.368 1.507 1.00 0.00 H new ATOM 0 HB3 MET A 24 66.292 11.833 2.217 1.00 0.00 H new ATOM 0 HG2 MET A 24 68.206 11.696 -0.168 1.00 0.00 H new ATOM 0 HG3 MET A 24 66.497 12.075 -0.246 1.00 0.00 H new ATOM 0 HE1 MET A 24 65.986 15.410 1.299 1.00 0.00 H new ATOM 0 HE2 MET A 24 65.381 13.761 1.013 1.00 0.00 H new ATOM 0 HE3 MET A 24 66.232 14.146 2.528 1.00 0.00 H new ATOM 462 N ASP A 25 67.663 11.476 4.911 1.00 0.00 N ATOM 463 CA ASP A 25 67.386 10.855 6.202 1.00 0.00 C ATOM 464 C ASP A 25 66.018 10.181 6.189 1.00 0.00 C ATOM 465 O ASP A 25 64.998 10.831 5.963 1.00 0.00 O ATOM 466 CB ASP A 25 67.428 11.911 7.308 1.00 0.00 C ATOM 467 CG ASP A 25 67.272 11.243 8.671 1.00 0.00 C ATOM 468 OD1 ASP A 25 68.268 10.778 9.198 1.00 0.00 O ATOM 469 OD2 ASP A 25 66.158 11.209 9.167 1.00 0.00 O ATOM 0 H ASP A 25 67.451 12.473 4.865 1.00 0.00 H new ATOM 0 HA ASP A 25 68.148 10.099 6.393 1.00 0.00 H new ATOM 0 HB2 ASP A 25 68.371 12.456 7.266 1.00 0.00 H new ATOM 0 HB3 ASP A 25 66.632 12.640 7.157 1.00 0.00 H new ATOM 474 N SER A 26 66.006 8.874 6.434 1.00 0.00 N ATOM 475 CA SER A 26 64.757 8.122 6.441 1.00 0.00 C ATOM 476 C SER A 26 63.821 8.644 7.533 1.00 0.00 C ATOM 477 O SER A 26 64.294 9.179 8.538 1.00 0.00 O ATOM 478 CB SER A 26 65.042 6.638 6.677 1.00 0.00 C ATOM 479 OG SER A 26 65.708 6.105 5.541 1.00 0.00 O ATOM 0 H SER A 26 66.839 8.319 6.629 1.00 0.00 H new ATOM 0 HA SER A 26 64.273 8.249 5.473 1.00 0.00 H new ATOM 0 HB2 SER A 26 65.657 6.511 7.568 1.00 0.00 H new ATOM 0 HB3 SER A 26 64.111 6.100 6.853 1.00 0.00 H new ATOM 0 HG SER A 26 65.895 5.154 5.688 1.00 0.00 H new ATOM 485 N PRO A 27 62.520 8.508 7.376 1.00 0.00 N ATOM 486 CA PRO A 27 61.553 9.008 8.395 1.00 0.00 C ATOM 487 C PRO A 27 61.336 8.006 9.526 1.00 0.00 C ATOM 488 O PRO A 27 61.991 6.966 9.583 1.00 0.00 O ATOM 489 CB PRO A 27 60.270 9.212 7.592 1.00 0.00 C ATOM 490 CG PRO A 27 60.321 8.192 6.505 1.00 0.00 C ATOM 491 CD PRO A 27 61.798 7.880 6.248 1.00 0.00 C ATOM 0 HA PRO A 27 61.905 9.914 8.889 1.00 0.00 H new ATOM 0 HB2 PRO A 27 59.388 9.076 8.218 1.00 0.00 H new ATOM 0 HB3 PRO A 27 60.218 10.221 7.183 1.00 0.00 H new ATOM 0 HG2 PRO A 27 59.782 7.291 6.797 1.00 0.00 H new ATOM 0 HG3 PRO A 27 59.844 8.569 5.600 1.00 0.00 H new ATOM 0 HD2 PRO A 27 61.975 6.805 6.215 1.00 0.00 H new ATOM 0 HD3 PRO A 27 62.128 8.287 5.292 1.00 0.00 H new ATOM 499 N ASP A 28 60.410 8.332 10.423 1.00 0.00 N ATOM 500 CA ASP A 28 60.107 7.455 11.548 1.00 0.00 C ATOM 501 C ASP A 28 59.458 6.163 11.062 1.00 0.00 C ATOM 502 O ASP A 28 58.738 6.157 10.064 1.00 0.00 O ATOM 503 CB ASP A 28 59.168 8.165 12.526 1.00 0.00 C ATOM 504 CG ASP A 28 59.846 9.397 13.123 1.00 0.00 C ATOM 505 OD1 ASP A 28 61.059 9.381 13.262 1.00 0.00 O ATOM 506 OD2 ASP A 28 59.140 10.342 13.433 1.00 0.00 O ATOM 0 H ASP A 28 59.860 9.191 10.393 1.00 0.00 H new ATOM 0 HA ASP A 28 61.041 7.210 12.055 1.00 0.00 H new ATOM 0 HB2 ASP A 28 58.253 8.460 12.012 1.00 0.00 H new ATOM 0 HB3 ASP A 28 58.879 7.480 13.323 1.00 0.00 H new ATOM 511 N LEU A 29 59.715 5.072 11.775 1.00 0.00 N ATOM 512 CA LEU A 29 59.150 3.778 11.405 1.00 0.00 C ATOM 513 C LEU A 29 57.755 3.617 11.999 1.00 0.00 C ATOM 514 O LEU A 29 57.488 4.067 13.113 1.00 0.00 O ATOM 515 CB LEU A 29 60.052 2.645 11.901 1.00 0.00 C ATOM 516 CG LEU A 29 61.411 2.718 11.199 1.00 0.00 C ATOM 517 CD1 LEU A 29 62.328 3.688 11.949 1.00 0.00 C ATOM 518 CD2 LEU A 29 62.054 1.328 11.180 1.00 0.00 C ATOM 0 H LEU A 29 60.306 5.056 12.606 1.00 0.00 H new ATOM 0 HA LEU A 29 59.081 3.732 10.318 1.00 0.00 H new ATOM 0 HB2 LEU A 29 60.185 2.720 12.980 1.00 0.00 H new ATOM 0 HB3 LEU A 29 59.582 1.681 11.704 1.00 0.00 H new ATOM 0 HG LEU A 29 61.268 3.069 10.177 1.00 0.00 H new ATOM 0 HD11 LEU A 29 63.294 3.737 11.447 1.00 0.00 H new ATOM 0 HD12 LEU A 29 61.875 4.679 11.963 1.00 0.00 H new ATOM 0 HD13 LEU A 29 62.468 3.339 12.972 1.00 0.00 H new ATOM 0 HD21 LEU A 29 63.021 1.381 10.680 1.00 0.00 H new ATOM 0 HD22 LEU A 29 62.193 0.977 12.203 1.00 0.00 H new ATOM 0 HD23 LEU A 29 61.406 0.635 10.644 1.00 0.00 H new ATOM 530 N GLY A 30 56.869 2.970 11.248 1.00 0.00 N ATOM 531 CA GLY A 30 55.497 2.772 11.700 1.00 0.00 C ATOM 532 C GLY A 30 55.001 1.373 11.351 1.00 0.00 C ATOM 533 O GLY A 30 55.741 0.395 11.463 1.00 0.00 O ATOM 0 H GLY A 30 57.075 2.576 10.330 1.00 0.00 H new ATOM 0 HA2 GLY A 30 55.441 2.923 12.778 1.00 0.00 H new ATOM 0 HA3 GLY A 30 54.848 3.517 11.239 1.00 0.00 H new ATOM 537 N THR A 31 53.744 1.285 10.927 1.00 0.00 N ATOM 538 CA THR A 31 53.151 0.000 10.576 1.00 0.00 C ATOM 539 C THR A 31 53.655 -0.467 9.214 1.00 0.00 C ATOM 540 O THR A 31 54.240 0.309 8.458 1.00 0.00 O ATOM 541 CB THR A 31 51.624 0.110 10.545 1.00 0.00 C ATOM 542 OG1 THR A 31 51.237 1.013 9.519 1.00 0.00 O ATOM 543 CG2 THR A 31 51.109 0.615 11.895 1.00 0.00 C ATOM 0 H THR A 31 53.119 2.084 10.819 1.00 0.00 H new ATOM 0 HA THR A 31 53.444 -0.728 11.333 1.00 0.00 H new ATOM 0 HB THR A 31 51.197 -0.873 10.347 1.00 0.00 H new ATOM 0 HG1 THR A 31 50.260 1.083 9.497 1.00 0.00 H new ATOM 0 HG21 THR A 31 50.022 0.690 11.865 1.00 0.00 H new ATOM 0 HG22 THR A 31 51.403 -0.082 12.680 1.00 0.00 H new ATOM 0 HG23 THR A 31 51.535 1.596 12.103 1.00 0.00 H new ATOM 551 N ASP A 32 53.422 -1.740 8.908 1.00 0.00 N ATOM 552 CA ASP A 32 53.880 -2.306 7.645 1.00 0.00 C ATOM 553 C ASP A 32 53.244 -1.575 6.466 1.00 0.00 C ATOM 554 O ASP A 32 52.077 -1.189 6.518 1.00 0.00 O ATOM 555 CB ASP A 32 53.522 -3.793 7.579 1.00 0.00 C ATOM 556 CG ASP A 32 54.249 -4.568 8.675 1.00 0.00 C ATOM 557 OD1 ASP A 32 55.343 -4.167 9.042 1.00 0.00 O ATOM 558 OD2 ASP A 32 53.700 -5.556 9.133 1.00 0.00 O ATOM 0 H ASP A 32 52.923 -2.394 9.512 1.00 0.00 H new ATOM 0 HA ASP A 32 54.962 -2.189 7.588 1.00 0.00 H new ATOM 0 HB2 ASP A 32 52.445 -3.919 7.690 1.00 0.00 H new ATOM 0 HB3 ASP A 32 53.791 -4.195 6.602 1.00 0.00 H new ATOM 563 N ASP A 33 54.023 -1.389 5.405 1.00 0.00 N ATOM 564 CA ASP A 33 53.538 -0.685 4.224 1.00 0.00 C ATOM 565 C ASP A 33 54.230 -1.203 2.965 1.00 0.00 C ATOM 566 O ASP A 33 54.978 -2.178 3.015 1.00 0.00 O ATOM 567 CB ASP A 33 53.781 0.821 4.378 1.00 0.00 C ATOM 568 CG ASP A 33 55.266 1.137 4.582 1.00 0.00 C ATOM 569 OD1 ASP A 33 56.098 0.295 4.283 1.00 0.00 O ATOM 570 OD2 ASP A 33 55.549 2.232 5.040 1.00 0.00 O ATOM 0 H ASP A 33 54.988 -1.714 5.339 1.00 0.00 H new ATOM 0 HA ASP A 33 52.468 -0.867 4.126 1.00 0.00 H new ATOM 0 HB2 ASP A 33 53.417 1.341 3.492 1.00 0.00 H new ATOM 0 HB3 ASP A 33 53.209 1.197 5.226 1.00 0.00 H new ATOM 575 N ASP A 34 53.974 -0.544 1.838 1.00 0.00 N ATOM 576 CA ASP A 34 54.579 -0.947 0.573 1.00 0.00 C ATOM 577 C ASP A 34 56.100 -0.949 0.683 1.00 0.00 C ATOM 578 O ASP A 34 56.674 -0.223 1.494 1.00 0.00 O ATOM 579 CB ASP A 34 54.146 0.010 -0.541 1.00 0.00 C ATOM 580 CG ASP A 34 52.636 -0.063 -0.755 1.00 0.00 C ATOM 581 OD1 ASP A 34 52.068 -1.121 -0.534 1.00 0.00 O ATOM 582 OD2 ASP A 34 52.066 0.945 -1.138 1.00 0.00 O ATOM 0 H ASP A 34 53.356 0.265 1.775 1.00 0.00 H new ATOM 0 HA ASP A 34 54.243 -1.956 0.336 1.00 0.00 H new ATOM 0 HB2 ASP A 34 54.434 1.030 -0.284 1.00 0.00 H new ATOM 0 HB3 ASP A 34 54.663 -0.243 -1.467 1.00 0.00 H new ATOM 587 N ASP A 35 56.748 -1.772 -0.137 1.00 0.00 N ATOM 588 CA ASP A 35 58.201 -1.893 -0.094 1.00 0.00 C ATOM 589 C ASP A 35 58.869 -0.534 -0.281 1.00 0.00 C ATOM 590 O ASP A 35 58.291 0.381 -0.869 1.00 0.00 O ATOM 591 CB ASP A 35 58.678 -2.866 -1.179 1.00 0.00 C ATOM 592 CG ASP A 35 58.237 -2.414 -2.572 1.00 0.00 C ATOM 593 OD1 ASP A 35 57.916 -1.248 -2.744 1.00 0.00 O ATOM 594 OD2 ASP A 35 58.233 -3.251 -3.461 1.00 0.00 O ATOM 0 H ASP A 35 56.293 -2.361 -0.835 1.00 0.00 H new ATOM 0 HA ASP A 35 58.483 -2.279 0.885 1.00 0.00 H new ATOM 0 HB2 ASP A 35 59.765 -2.943 -1.148 1.00 0.00 H new ATOM 0 HB3 ASP A 35 58.282 -3.861 -0.976 1.00 0.00 H new ATOM 599 N LYS A 36 60.088 -0.409 0.235 1.00 0.00 N ATOM 600 CA LYS A 36 60.827 0.846 0.148 1.00 0.00 C ATOM 601 C LYS A 36 62.277 0.592 -0.252 1.00 0.00 C ATOM 602 O LYS A 36 62.705 -0.555 -0.379 1.00 0.00 O ATOM 603 CB LYS A 36 60.779 1.573 1.496 1.00 0.00 C ATOM 604 CG LYS A 36 61.385 0.687 2.587 1.00 0.00 C ATOM 605 CD LYS A 36 61.097 1.296 3.960 1.00 0.00 C ATOM 606 CE LYS A 36 61.841 2.626 4.096 1.00 0.00 C ATOM 607 NZ LYS A 36 61.694 3.137 5.488 1.00 0.00 N ATOM 0 H LYS A 36 60.584 -1.159 0.716 1.00 0.00 H new ATOM 0 HA LYS A 36 60.361 1.469 -0.616 1.00 0.00 H new ATOM 0 HB2 LYS A 36 61.328 2.513 1.432 1.00 0.00 H new ATOM 0 HB3 LYS A 36 59.748 1.822 1.748 1.00 0.00 H new ATOM 0 HG2 LYS A 36 60.966 -0.318 2.528 1.00 0.00 H new ATOM 0 HG3 LYS A 36 62.461 0.593 2.438 1.00 0.00 H new ATOM 0 HD2 LYS A 36 60.025 1.453 4.082 1.00 0.00 H new ATOM 0 HD3 LYS A 36 61.411 0.610 4.747 1.00 0.00 H new ATOM 0 HE2 LYS A 36 62.896 2.491 3.856 1.00 0.00 H new ATOM 0 HE3 LYS A 36 61.443 3.352 3.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 62.200 4.041 5.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 60.686 3.280 5.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 62.094 2.447 6.155 1.00 0.00 H new ATOM 621 N THR A 37 63.029 1.671 -0.448 1.00 0.00 N ATOM 622 CA THR A 37 64.431 1.555 -0.831 1.00 0.00 C ATOM 623 C THR A 37 65.277 1.128 0.363 1.00 0.00 C ATOM 624 O THR A 37 64.825 1.185 1.507 1.00 0.00 O ATOM 625 CB THR A 37 64.947 2.892 -1.372 1.00 0.00 C ATOM 626 OG1 THR A 37 64.903 3.866 -0.338 1.00 0.00 O ATOM 627 CG2 THR A 37 64.081 3.351 -2.547 1.00 0.00 C ATOM 0 H THR A 37 62.693 2.629 -0.349 1.00 0.00 H new ATOM 0 HA THR A 37 64.510 0.798 -1.611 1.00 0.00 H new ATOM 0 HB THR A 37 65.974 2.768 -1.716 1.00 0.00 H new ATOM 0 HG1 THR A 37 65.234 4.722 -0.681 1.00 0.00 H new ATOM 0 HG21 THR A 37 64.455 4.302 -2.925 1.00 0.00 H new ATOM 0 HG22 THR A 37 64.119 2.605 -3.341 1.00 0.00 H new ATOM 0 HG23 THR A 37 63.051 3.473 -2.214 1.00 0.00 H new ATOM 635 N GLY A 38 66.506 0.701 0.091 1.00 0.00 N ATOM 636 CA GLY A 38 67.397 0.242 1.149 1.00 0.00 C ATOM 637 C GLY A 38 68.012 1.420 1.898 1.00 0.00 C ATOM 638 O GLY A 38 67.659 2.574 1.657 1.00 0.00 O ATOM 0 H GLY A 38 66.905 0.663 -0.847 1.00 0.00 H new ATOM 0 HA2 GLY A 38 66.845 -0.388 1.846 1.00 0.00 H new ATOM 0 HA3 GLY A 38 68.188 -0.374 0.721 1.00 0.00 H new ATOM 642 N GLY A 39 68.933 1.119 2.807 1.00 0.00 N ATOM 643 CA GLY A 39 69.575 2.156 3.605 1.00 0.00 C ATOM 644 C GLY A 39 70.698 2.831 2.825 1.00 0.00 C ATOM 645 O GLY A 39 70.896 2.558 1.640 1.00 0.00 O ATOM 0 H GLY A 39 69.250 0.171 3.009 1.00 0.00 H new ATOM 0 HA2 GLY A 39 68.836 2.900 3.903 1.00 0.00 H new ATOM 0 HA3 GLY A 39 69.975 1.720 4.520 1.00 0.00 H new ATOM 649 N GLY A 40 71.430 3.713 3.496 1.00 0.00 N ATOM 650 CA GLY A 40 72.520 4.437 2.853 1.00 0.00 C ATOM 651 C GLY A 40 73.787 3.590 2.804 1.00 0.00 C ATOM 652 O GLY A 40 73.779 2.418 3.180 1.00 0.00 O ATOM 0 H GLY A 40 71.290 3.943 4.480 1.00 0.00 H new ATOM 0 HA2 GLY A 40 72.227 4.718 1.841 1.00 0.00 H new ATOM 0 HA3 GLY A 40 72.717 5.361 3.396 1.00 0.00 H new ATOM 656 N ARG A 41 74.876 4.193 2.336 1.00 0.00 N ATOM 657 CA ARG A 41 76.145 3.485 2.223 1.00 0.00 C ATOM 658 C ARG A 41 76.589 2.952 3.581 1.00 0.00 C ATOM 659 O ARG A 41 76.288 3.539 4.620 1.00 0.00 O ATOM 660 CB ARG A 41 77.218 4.421 1.664 1.00 0.00 C ATOM 661 CG ARG A 41 76.847 4.829 0.236 1.00 0.00 C ATOM 662 CD ARG A 41 77.978 5.661 -0.373 1.00 0.00 C ATOM 663 NE ARG A 41 78.255 6.835 0.460 1.00 0.00 N ATOM 664 CZ ARG A 41 79.208 7.736 0.177 1.00 0.00 C ATOM 665 NH1 ARG A 41 79.975 7.633 -0.882 1.00 0.00 N ATOM 666 NH2 ARG A 41 79.379 8.747 0.983 1.00 0.00 N ATOM 0 H ARG A 41 74.905 5.166 2.030 1.00 0.00 H new ATOM 0 HA ARG A 41 76.008 2.643 1.545 1.00 0.00 H new ATOM 0 HB2 ARG A 41 77.308 5.306 2.294 1.00 0.00 H new ATOM 0 HB3 ARG A 41 78.188 3.924 1.671 1.00 0.00 H new ATOM 0 HG2 ARG A 41 76.668 3.942 -0.371 1.00 0.00 H new ATOM 0 HG3 ARG A 41 75.921 5.404 0.241 1.00 0.00 H new ATOM 0 HD2 ARG A 41 78.877 5.052 -0.465 1.00 0.00 H new ATOM 0 HD3 ARG A 41 77.704 5.978 -1.379 1.00 0.00 H new ATOM 0 HE ARG A 41 77.693 6.974 1.300 1.00 0.00 H new ATOM 0 HH11 ARG A 41 79.857 6.848 -1.523 1.00 0.00 H new ATOM 0 HH12 ARG A 41 80.689 8.338 -1.065 1.00 0.00 H new ATOM 0 HH21 ARG A 41 78.793 8.843 1.812 1.00 0.00 H new ATOM 0 HH22 ARG A 41 80.099 9.442 0.784 1.00 0.00 H new ATOM 680 N ALA A 42 77.309 1.834 3.562 1.00 0.00 N ATOM 681 CA ALA A 42 77.793 1.222 4.794 1.00 0.00 C ATOM 682 C ALA A 42 78.645 2.209 5.586 1.00 0.00 C ATOM 683 O ALA A 42 79.235 3.129 5.020 1.00 0.00 O ATOM 684 CB ALA A 42 78.622 -0.021 4.468 1.00 0.00 C ATOM 0 H ALA A 42 77.569 1.336 2.711 1.00 0.00 H new ATOM 0 HA ALA A 42 76.931 0.937 5.398 1.00 0.00 H new ATOM 0 HB1 ALA A 42 78.980 -0.473 5.393 1.00 0.00 H new ATOM 0 HB2 ALA A 42 78.004 -0.739 3.929 1.00 0.00 H new ATOM 0 HB3 ALA A 42 79.474 0.262 3.849 1.00 0.00 H new ATOM 690 N ASP A 43 78.703 2.010 6.900 1.00 0.00 N ATOM 691 CA ASP A 43 79.470 2.896 7.770 1.00 0.00 C ATOM 692 C ASP A 43 80.924 2.999 7.301 1.00 0.00 C ATOM 693 O ASP A 43 81.374 2.158 6.521 1.00 0.00 O ATOM 694 CB ASP A 43 79.434 2.372 9.207 1.00 0.00 C ATOM 695 CG ASP A 43 77.990 2.265 9.687 1.00 0.00 C ATOM 696 OD1 ASP A 43 77.375 3.298 9.887 1.00 0.00 O ATOM 697 OD2 ASP A 43 77.521 1.150 9.846 1.00 0.00 O ATOM 0 H ASP A 43 78.230 1.247 7.384 1.00 0.00 H new ATOM 0 HA ASP A 43 79.020 3.888 7.729 1.00 0.00 H new ATOM 0 HB2 ASP A 43 79.917 1.396 9.259 1.00 0.00 H new ATOM 0 HB3 ASP A 43 79.995 3.040 9.861 1.00 0.00 H new ATOM 702 N PRO A 44 81.667 3.993 7.746 1.00 0.00 N ATOM 703 CA PRO A 44 83.082 4.168 7.295 1.00 0.00 C ATOM 704 C PRO A 44 83.949 2.960 7.641 1.00 0.00 C ATOM 705 O PRO A 44 83.813 2.369 8.712 1.00 0.00 O ATOM 706 CB PRO A 44 83.574 5.423 8.030 1.00 0.00 C ATOM 707 CG PRO A 44 82.344 6.135 8.480 1.00 0.00 C ATOM 708 CD PRO A 44 81.284 5.058 8.695 1.00 0.00 C ATOM 0 HA PRO A 44 83.144 4.266 6.211 1.00 0.00 H new ATOM 0 HB2 PRO A 44 84.205 5.158 8.878 1.00 0.00 H new ATOM 0 HB3 PRO A 44 84.172 6.053 7.372 1.00 0.00 H new ATOM 0 HG2 PRO A 44 82.529 6.688 9.401 1.00 0.00 H new ATOM 0 HG3 PRO A 44 82.018 6.859 7.733 1.00 0.00 H new ATOM 0 HD2 PRO A 44 81.284 4.696 9.723 1.00 0.00 H new ATOM 0 HD3 PRO A 44 80.282 5.436 8.490 1.00 0.00 H new ATOM 716 N ALA A 45 84.841 2.602 6.722 1.00 0.00 N ATOM 717 CA ALA A 45 85.728 1.463 6.930 1.00 0.00 C ATOM 718 C ALA A 45 86.847 1.824 7.903 1.00 0.00 C ATOM 719 O ALA A 45 86.849 2.907 8.486 1.00 0.00 O ATOM 720 CB ALA A 45 86.326 1.023 5.591 1.00 0.00 C ATOM 0 H ALA A 45 84.968 3.081 5.831 1.00 0.00 H new ATOM 0 HA ALA A 45 85.149 0.644 7.356 1.00 0.00 H new ATOM 0 HB1 ALA A 45 86.988 0.172 5.750 1.00 0.00 H new ATOM 0 HB2 ALA A 45 85.524 0.736 4.911 1.00 0.00 H new ATOM 0 HB3 ALA A 45 86.892 1.847 5.157 1.00 0.00 H new ATOM 726 N HIS A 46 87.797 0.908 8.074 1.00 0.00 N ATOM 727 CA HIS A 46 88.915 1.142 8.981 1.00 0.00 C ATOM 728 C HIS A 46 89.966 2.025 8.316 1.00 0.00 C ATOM 729 O HIS A 46 90.035 2.111 7.091 1.00 0.00 O ATOM 730 CB HIS A 46 89.548 -0.191 9.384 1.00 0.00 C ATOM 731 CG HIS A 46 88.606 -1.102 10.123 1.00 0.00 C ATOM 732 ND1 HIS A 46 88.152 -0.818 11.401 1.00 0.00 N ATOM 733 CD2 HIS A 46 88.024 -2.297 9.775 1.00 0.00 C ATOM 734 CE1 HIS A 46 87.335 -1.818 11.774 1.00 0.00 C ATOM 735 NE2 HIS A 46 87.221 -2.748 10.821 1.00 0.00 N ATOM 0 H HIS A 46 87.815 0.005 7.601 1.00 0.00 H new ATOM 0 HA HIS A 46 88.539 1.649 9.870 1.00 0.00 H new ATOM 0 HB2 HIS A 46 89.906 -0.700 8.489 1.00 0.00 H new ATOM 0 HB3 HIS A 46 90.419 0.004 10.010 1.00 0.00 H new ATOM 0 HD2 HIS A 46 88.167 -2.809 8.835 1.00 0.00 H new ATOM 0 HE1 HIS A 46 86.832 -1.864 12.728 1.00 0.00 H new ATOM 0 HE2 HIS A 46 86.666 -3.603 10.852 1.00 0.00 H new ATOM 743 N ARG A 47 90.784 2.681 9.134 1.00 0.00 N ATOM 744 CA ARG A 47 91.804 3.585 8.614 1.00 0.00 C ATOM 745 C ARG A 47 92.829 2.823 7.781 1.00 0.00 C ATOM 746 O ARG A 47 93.243 1.720 8.139 1.00 0.00 O ATOM 747 CB ARG A 47 92.510 4.295 9.771 1.00 0.00 C ATOM 748 CG ARG A 47 93.450 5.367 9.214 1.00 0.00 C ATOM 749 CD ARG A 47 94.078 6.154 10.367 1.00 0.00 C ATOM 750 NE ARG A 47 95.017 5.312 11.113 1.00 0.00 N ATOM 751 CZ ARG A 47 94.666 4.567 12.172 1.00 0.00 C ATOM 752 NH1 ARG A 47 93.431 4.511 12.612 1.00 0.00 N ATOM 753 NH2 ARG A 47 95.584 3.868 12.783 1.00 0.00 N ATOM 0 H ARG A 47 90.761 2.605 10.151 1.00 0.00 H new ATOM 0 HA ARG A 47 91.315 4.322 7.977 1.00 0.00 H new ATOM 0 HB2 ARG A 47 91.775 4.750 10.435 1.00 0.00 H new ATOM 0 HB3 ARG A 47 93.073 3.575 10.364 1.00 0.00 H new ATOM 0 HG2 ARG A 47 94.230 4.902 8.611 1.00 0.00 H new ATOM 0 HG3 ARG A 47 92.900 6.042 8.558 1.00 0.00 H new ATOM 0 HD2 ARG A 47 94.597 7.030 9.977 1.00 0.00 H new ATOM 0 HD3 ARG A 47 93.297 6.517 11.035 1.00 0.00 H new ATOM 0 HE ARG A 47 95.991 5.291 10.811 1.00 0.00 H new ATOM 0 HH11 ARG A 47 92.699 5.046 12.145 1.00 0.00 H new ATOM 0 HH12 ARG A 47 93.203 3.933 13.421 1.00 0.00 H new ATOM 0 HH21 ARG A 47 96.549 3.894 12.453 1.00 0.00 H new ATOM 0 HH22 ARG A 47 95.336 3.296 13.590 1.00 0.00 H new ATOM 767 N SER A 48 93.233 3.424 6.667 1.00 0.00 N ATOM 768 CA SER A 48 94.206 2.802 5.774 1.00 0.00 C ATOM 769 C SER A 48 95.213 3.853 5.296 1.00 0.00 C ATOM 770 O SER A 48 94.977 5.047 5.487 1.00 0.00 O ATOM 771 CB SER A 48 93.497 2.177 4.568 1.00 0.00 C ATOM 772 OG SER A 48 92.225 1.678 4.964 1.00 0.00 O ATOM 0 H SER A 48 92.903 4.339 6.361 1.00 0.00 H new ATOM 0 HA SER A 48 94.732 2.017 6.317 1.00 0.00 H new ATOM 0 HB2 SER A 48 93.377 2.920 3.779 1.00 0.00 H new ATOM 0 HB3 SER A 48 94.103 1.370 4.156 1.00 0.00 H new ATOM 0 HG SER A 48 91.774 1.281 4.190 1.00 0.00 H new ATOM 778 N PRO A 49 96.313 3.459 4.686 1.00 0.00 N ATOM 779 CA PRO A 49 97.330 4.445 4.201 1.00 0.00 C ATOM 780 C PRO A 49 96.691 5.584 3.409 1.00 0.00 C ATOM 781 O PRO A 49 95.687 5.386 2.724 1.00 0.00 O ATOM 782 CB PRO A 49 98.264 3.616 3.319 1.00 0.00 C ATOM 783 CG PRO A 49 98.163 2.228 3.850 1.00 0.00 C ATOM 784 CD PRO A 49 96.737 2.076 4.381 1.00 0.00 C ATOM 0 HA PRO A 49 97.850 4.932 5.026 1.00 0.00 H new ATOM 0 HB2 PRO A 49 97.962 3.661 2.273 1.00 0.00 H new ATOM 0 HB3 PRO A 49 99.288 3.985 3.372 1.00 0.00 H new ATOM 0 HG2 PRO A 49 98.367 1.496 3.068 1.00 0.00 H new ATOM 0 HG3 PRO A 49 98.893 2.060 4.642 1.00 0.00 H new ATOM 0 HD2 PRO A 49 96.084 1.613 3.641 1.00 0.00 H new ATOM 0 HD3 PRO A 49 96.708 1.446 5.270 1.00 0.00 H new ATOM 792 N VAL A 50 97.275 6.773 3.506 1.00 0.00 N ATOM 793 CA VAL A 50 96.681 7.952 2.885 1.00 0.00 C ATOM 794 C VAL A 50 97.214 8.110 1.455 1.00 0.00 C ATOM 795 O VAL A 50 98.403 7.874 1.237 1.00 0.00 O ATOM 796 CB VAL A 50 97.028 9.197 3.713 1.00 0.00 C ATOM 797 CG1 VAL A 50 96.375 10.440 3.103 1.00 0.00 C ATOM 798 CG2 VAL A 50 96.518 9.023 5.146 1.00 0.00 C ATOM 0 H VAL A 50 98.149 6.946 4.003 1.00 0.00 H new ATOM 0 HA VAL A 50 95.598 7.835 2.849 1.00 0.00 H new ATOM 0 HB VAL A 50 98.111 9.321 3.715 1.00 0.00 H new ATOM 0 HG11 VAL A 50 96.630 11.315 3.701 1.00 0.00 H new ATOM 0 HG12 VAL A 50 96.737 10.578 2.084 1.00 0.00 H new ATOM 0 HG13 VAL A 50 95.293 10.313 3.089 1.00 0.00 H new ATOM 0 HG21 VAL A 50 96.766 9.909 5.731 1.00 0.00 H new ATOM 0 HG22 VAL A 50 95.436 8.888 5.133 1.00 0.00 H new ATOM 0 HG23 VAL A 50 96.988 8.148 5.596 1.00 0.00 H new ATOM 808 N PRO A 51 96.411 8.527 0.497 1.00 0.00 N ATOM 809 CA PRO A 51 96.913 8.740 -0.896 1.00 0.00 C ATOM 810 C PRO A 51 98.145 9.636 -0.909 1.00 0.00 C ATOM 811 O PRO A 51 98.403 10.361 0.053 1.00 0.00 O ATOM 812 CB PRO A 51 95.746 9.405 -1.628 1.00 0.00 C ATOM 813 CG PRO A 51 94.528 9.006 -0.869 1.00 0.00 C ATOM 814 CD PRO A 51 94.966 8.828 0.584 1.00 0.00 C ATOM 0 HA PRO A 51 97.220 7.806 -1.367 1.00 0.00 H new ATOM 0 HB2 PRO A 51 95.860 10.489 -1.647 1.00 0.00 H new ATOM 0 HB3 PRO A 51 95.690 9.072 -2.664 1.00 0.00 H new ATOM 0 HG2 PRO A 51 93.752 9.768 -0.951 1.00 0.00 H new ATOM 0 HG3 PRO A 51 94.109 8.081 -1.265 1.00 0.00 H new ATOM 0 HD2 PRO A 51 94.782 9.730 1.168 1.00 0.00 H new ATOM 0 HD3 PRO A 51 94.420 8.018 1.068 1.00 0.00 H new ATOM 822 N LEU A 52 98.903 9.587 -2.000 1.00 0.00 N ATOM 823 CA LEU A 52 100.138 10.359 -2.088 1.00 0.00 C ATOM 824 C LEU A 52 99.836 11.858 -2.040 1.00 0.00 C ATOM 825 O LEU A 52 98.742 12.270 -2.433 1.00 0.00 O ATOM 826 CB LEU A 52 100.870 10.039 -3.392 1.00 0.00 C ATOM 827 CG LEU A 52 101.255 8.559 -3.429 1.00 0.00 C ATOM 828 CD1 LEU A 52 101.835 8.222 -4.803 1.00 0.00 C ATOM 829 CD2 LEU A 52 102.305 8.278 -2.352 1.00 0.00 C ATOM 0 H LEU A 52 98.688 9.028 -2.826 1.00 0.00 H new ATOM 0 HA LEU A 52 100.768 10.090 -1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 52 100.233 10.279 -4.244 1.00 0.00 H new ATOM 0 HB3 LEU A 52 101.763 10.657 -3.478 1.00 0.00 H new ATOM 0 HG LEU A 52 100.372 7.948 -3.244 1.00 0.00 H new ATOM 0 HD11 LEU A 52 102.111 7.168 -4.833 1.00 0.00 H new ATOM 0 HD12 LEU A 52 101.090 8.424 -5.572 1.00 0.00 H new ATOM 0 HD13 LEU A 52 102.719 8.833 -4.985 1.00 0.00 H new ATOM 0 HD21 LEU A 52 102.580 7.223 -2.378 1.00 0.00 H new ATOM 0 HD22 LEU A 52 103.189 8.888 -2.538 1.00 0.00 H new ATOM 0 HD23 LEU A 52 101.895 8.522 -1.372 1.00 0.00 H new ATOM 841 N PRO A 53 100.756 12.678 -1.576 1.00 0.00 N ATOM 842 CA PRO A 53 100.526 14.153 -1.526 1.00 0.00 C ATOM 843 C PRO A 53 100.626 14.783 -2.910 1.00 0.00 C ATOM 844 O PRO A 53 101.313 14.261 -3.792 1.00 0.00 O ATOM 845 CB PRO A 53 101.632 14.673 -0.607 1.00 0.00 C ATOM 846 CG PRO A 53 102.745 13.692 -0.742 1.00 0.00 C ATOM 847 CD PRO A 53 102.102 12.341 -1.061 1.00 0.00 C ATOM 0 HA PRO A 53 99.528 14.401 -1.165 1.00 0.00 H new ATOM 0 HB2 PRO A 53 101.951 15.673 -0.901 1.00 0.00 H new ATOM 0 HB3 PRO A 53 101.288 14.739 0.425 1.00 0.00 H new ATOM 0 HG2 PRO A 53 103.431 13.991 -1.535 1.00 0.00 H new ATOM 0 HG3 PRO A 53 103.326 13.637 0.178 1.00 0.00 H new ATOM 0 HD2 PRO A 53 102.683 11.791 -1.801 1.00 0.00 H new ATOM 0 HD3 PRO A 53 102.040 11.712 -0.173 1.00 0.00 H new ATOM 855 N SER A 54 99.967 15.928 -3.084 1.00 0.00 N ATOM 856 CA SER A 54 99.946 16.598 -4.381 1.00 0.00 C ATOM 857 C SER A 54 101.375 16.863 -4.862 1.00 0.00 C ATOM 858 O SER A 54 102.236 17.198 -4.046 1.00 0.00 O ATOM 859 CB SER A 54 99.187 17.921 -4.274 1.00 0.00 C ATOM 860 OG SER A 54 97.814 17.654 -4.025 1.00 0.00 O ATOM 0 H SER A 54 99.445 16.407 -2.350 1.00 0.00 H new ATOM 0 HA SER A 54 99.442 15.952 -5.100 1.00 0.00 H new ATOM 0 HB2 SER A 54 99.603 18.529 -3.470 1.00 0.00 H new ATOM 0 HB3 SER A 54 99.297 18.493 -5.196 1.00 0.00 H new ATOM 0 HG SER A 54 97.324 18.500 -3.954 1.00 0.00 H new ATOM 866 N PRO A 55 101.652 16.733 -6.140 1.00 0.00 N ATOM 867 CA PRO A 55 103.056 16.775 -6.632 1.00 0.00 C ATOM 868 C PRO A 55 103.600 18.192 -6.763 1.00 0.00 C ATOM 869 O PRO A 55 103.066 19.010 -7.511 1.00 0.00 O ATOM 870 CB PRO A 55 102.976 16.095 -7.998 1.00 0.00 C ATOM 871 CG PRO A 55 101.600 16.379 -8.497 1.00 0.00 C ATOM 872 CD PRO A 55 100.710 16.580 -7.269 1.00 0.00 C ATOM 0 HA PRO A 55 103.739 16.286 -5.937 1.00 0.00 H new ATOM 0 HB2 PRO A 55 103.731 16.489 -8.679 1.00 0.00 H new ATOM 0 HB3 PRO A 55 103.151 15.022 -7.915 1.00 0.00 H new ATOM 0 HG2 PRO A 55 101.594 17.269 -9.127 1.00 0.00 H new ATOM 0 HG3 PRO A 55 101.234 15.554 -9.108 1.00 0.00 H new ATOM 0 HD2 PRO A 55 100.078 17.461 -7.379 1.00 0.00 H new ATOM 0 HD3 PRO A 55 100.047 15.729 -7.118 1.00 0.00 H new ATOM 880 N THR A 56 104.672 18.471 -6.028 1.00 0.00 N ATOM 881 CA THR A 56 105.418 19.704 -6.232 1.00 0.00 C ATOM 882 C THR A 56 106.327 19.510 -7.439 1.00 0.00 C ATOM 883 O THR A 56 106.617 18.374 -7.816 1.00 0.00 O ATOM 884 CB THR A 56 106.252 20.044 -4.994 1.00 0.00 C ATOM 885 OG1 THR A 56 107.232 19.036 -4.795 1.00 0.00 O ATOM 886 CG2 THR A 56 105.346 20.132 -3.764 1.00 0.00 C ATOM 0 H THR A 56 105.039 17.866 -5.294 1.00 0.00 H new ATOM 0 HA THR A 56 104.728 20.530 -6.404 1.00 0.00 H new ATOM 0 HB THR A 56 106.743 21.006 -5.143 1.00 0.00 H new ATOM 0 HG1 THR A 56 107.004 18.248 -5.331 1.00 0.00 H new ATOM 0 HG21 THR A 56 105.946 20.374 -2.887 1.00 0.00 H new ATOM 0 HG22 THR A 56 104.598 20.910 -3.918 1.00 0.00 H new ATOM 0 HG23 THR A 56 104.848 19.175 -3.610 1.00 0.00 H new ATOM 894 N SER A 57 106.810 20.602 -8.027 1.00 0.00 N ATOM 895 CA SER A 57 107.535 20.500 -9.291 1.00 0.00 C ATOM 896 C SER A 57 108.692 19.504 -9.204 1.00 0.00 C ATOM 897 O SER A 57 109.555 19.603 -8.332 1.00 0.00 O ATOM 898 CB SER A 57 108.078 21.874 -9.686 1.00 0.00 C ATOM 899 OG SER A 57 106.992 22.773 -9.863 1.00 0.00 O ATOM 0 H SER A 57 106.716 21.548 -7.659 1.00 0.00 H new ATOM 0 HA SER A 57 106.836 20.140 -10.046 1.00 0.00 H new ATOM 0 HB2 SER A 57 108.752 22.247 -8.915 1.00 0.00 H new ATOM 0 HB3 SER A 57 108.657 21.799 -10.607 1.00 0.00 H new ATOM 0 HG SER A 57 107.336 23.656 -10.115 1.00 0.00 H new ATOM 905 N ASN A 58 108.686 18.545 -10.126 1.00 0.00 N ATOM 906 CA ASN A 58 109.805 17.623 -10.304 1.00 0.00 C ATOM 907 C ASN A 58 110.062 16.721 -9.093 1.00 0.00 C ATOM 908 O ASN A 58 111.083 16.032 -9.069 1.00 0.00 O ATOM 909 CB ASN A 58 111.078 18.415 -10.614 1.00 0.00 C ATOM 910 CG ASN A 58 110.912 19.189 -11.919 1.00 0.00 C ATOM 911 OD1 ASN A 58 110.099 18.820 -12.766 1.00 0.00 O ATOM 912 ND2 ASN A 58 111.641 20.251 -12.131 1.00 0.00 N ATOM 0 H ASN A 58 107.910 18.385 -10.768 1.00 0.00 H new ATOM 0 HA ASN A 58 109.533 16.970 -11.133 1.00 0.00 H new ATOM 0 HB2 ASN A 58 111.294 19.105 -9.798 1.00 0.00 H new ATOM 0 HB3 ASN A 58 111.928 17.737 -10.691 1.00 0.00 H new ATOM 0 HD21 ASN A 58 111.537 20.776 -12.999 1.00 0.00 H new ATOM 0 HD22 ASN A 58 112.314 20.556 -11.428 1.00 0.00 H new ATOM 919 N LYS A 59 109.166 16.705 -8.102 1.00 0.00 N ATOM 920 CA LYS A 59 109.407 15.902 -6.901 1.00 0.00 C ATOM 921 C LYS A 59 108.130 15.596 -6.111 1.00 0.00 C ATOM 922 O LYS A 59 107.092 16.230 -6.304 1.00 0.00 O ATOM 923 CB LYS A 59 110.442 16.608 -6.012 1.00 0.00 C ATOM 924 CG LYS A 59 109.863 17.896 -5.414 1.00 0.00 C ATOM 925 CD LYS A 59 110.958 18.639 -4.646 1.00 0.00 C ATOM 926 CE LYS A 59 110.327 19.742 -3.795 1.00 0.00 C ATOM 927 NZ LYS A 59 110.004 20.912 -4.660 1.00 0.00 N ATOM 0 H LYS A 59 108.288 17.225 -8.105 1.00 0.00 H new ATOM 0 HA LYS A 59 109.794 14.937 -7.228 1.00 0.00 H new ATOM 0 HB2 LYS A 59 110.755 15.939 -5.210 1.00 0.00 H new ATOM 0 HB3 LYS A 59 111.331 16.842 -6.598 1.00 0.00 H new ATOM 0 HG2 LYS A 59 109.465 18.530 -6.206 1.00 0.00 H new ATOM 0 HG3 LYS A 59 109.033 17.659 -4.748 1.00 0.00 H new ATOM 0 HD2 LYS A 59 111.507 17.944 -4.010 1.00 0.00 H new ATOM 0 HD3 LYS A 59 111.677 19.069 -5.343 1.00 0.00 H new ATOM 0 HE2 LYS A 59 109.422 19.372 -3.313 1.00 0.00 H new ATOM 0 HE3 LYS A 59 111.012 20.041 -3.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 109.575 21.663 -4.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 110.876 21.269 -5.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 109.336 20.621 -5.402 1.00 0.00 H new ATOM 941 N GLN A 60 108.236 14.611 -5.220 1.00 0.00 N ATOM 942 CA GLN A 60 107.167 14.297 -4.272 1.00 0.00 C ATOM 943 C GLN A 60 107.754 13.875 -2.929 1.00 0.00 C ATOM 944 O GLN A 60 108.866 13.353 -2.866 1.00 0.00 O ATOM 945 CB GLN A 60 106.280 13.155 -4.776 1.00 0.00 C ATOM 946 CG GLN A 60 105.451 13.613 -5.973 1.00 0.00 C ATOM 947 CD GLN A 60 104.480 12.508 -6.381 1.00 0.00 C ATOM 948 OE1 GLN A 60 104.853 11.602 -7.125 1.00 0.00 O ATOM 949 NE2 GLN A 60 103.253 12.512 -5.927 1.00 0.00 N ATOM 0 H GLN A 60 109.058 14.013 -5.135 1.00 0.00 H new ATOM 0 HA GLN A 60 106.567 15.201 -4.164 1.00 0.00 H new ATOM 0 HB2 GLN A 60 106.899 12.303 -5.059 1.00 0.00 H new ATOM 0 HB3 GLN A 60 105.620 12.818 -3.976 1.00 0.00 H new ATOM 0 HG2 GLN A 60 104.900 14.519 -5.721 1.00 0.00 H new ATOM 0 HG3 GLN A 60 106.106 13.861 -6.808 1.00 0.00 H new ATOM 0 HE21 GLN A 60 102.940 13.261 -5.310 1.00 0.00 H new ATOM 0 HE22 GLN A 60 102.609 11.766 -6.190 1.00 0.00 H new ATOM 958 N ASP A 61 106.997 14.091 -1.860 1.00 0.00 N ATOM 959 CA ASP A 61 107.386 13.584 -0.549 1.00 0.00 C ATOM 960 C ASP A 61 106.738 12.222 -0.322 1.00 0.00 C ATOM 961 O ASP A 61 105.515 12.095 -0.395 1.00 0.00 O ATOM 962 CB ASP A 61 106.944 14.557 0.547 1.00 0.00 C ATOM 963 CG ASP A 61 107.639 15.906 0.377 1.00 0.00 C ATOM 964 OD1 ASP A 61 108.760 15.925 -0.108 1.00 0.00 O ATOM 965 OD2 ASP A 61 107.039 16.905 0.738 1.00 0.00 O ATOM 0 H ASP A 61 106.118 14.609 -1.873 1.00 0.00 H new ATOM 0 HA ASP A 61 108.471 13.484 -0.511 1.00 0.00 H new ATOM 0 HB2 ASP A 61 105.863 14.691 0.508 1.00 0.00 H new ATOM 0 HB3 ASP A 61 107.179 14.141 1.527 1.00 0.00 H new ATOM 970 N ILE A 62 107.549 11.202 -0.044 1.00 0.00 N ATOM 971 CA ILE A 62 107.030 9.842 0.112 1.00 0.00 C ATOM 972 C ILE A 62 107.457 9.257 1.461 1.00 0.00 C ATOM 973 O ILE A 62 108.558 9.537 1.937 1.00 0.00 O ATOM 974 CB ILE A 62 107.513 8.986 -1.070 1.00 0.00 C ATOM 975 CG1 ILE A 62 106.735 7.668 -1.099 1.00 0.00 C ATOM 976 CG2 ILE A 62 109.018 8.698 -0.986 1.00 0.00 C ATOM 977 CD1 ILE A 62 105.365 7.897 -1.746 1.00 0.00 C ATOM 0 H ILE A 62 108.558 11.288 0.077 1.00 0.00 H new ATOM 0 HA ILE A 62 105.940 9.853 0.106 1.00 0.00 H new ATOM 0 HB ILE A 62 107.333 9.547 -1.987 1.00 0.00 H new ATOM 0 HG12 ILE A 62 107.292 6.917 -1.659 1.00 0.00 H new ATOM 0 HG13 ILE A 62 106.611 7.284 -0.086 1.00 0.00 H new ATOM 0 HG21 ILE A 62 109.320 8.091 -1.839 1.00 0.00 H new ATOM 0 HG22 ILE A 62 109.569 9.638 -0.996 1.00 0.00 H new ATOM 0 HG23 ILE A 62 109.235 8.160 -0.063 1.00 0.00 H new ATOM 0 HD11 ILE A 62 104.811 6.959 -1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 62 104.808 8.634 -1.168 1.00 0.00 H new ATOM 0 HD13 ILE A 62 105.500 8.261 -2.764 1.00 0.00 H new ATOM 989 N SER A 63 106.599 8.436 2.066 1.00 0.00 N ATOM 990 CA SER A 63 106.873 7.938 3.412 1.00 0.00 C ATOM 991 C SER A 63 106.302 6.539 3.639 1.00 0.00 C ATOM 992 O SER A 63 105.427 6.068 2.908 1.00 0.00 O ATOM 993 CB SER A 63 106.286 8.897 4.448 1.00 0.00 C ATOM 994 OG SER A 63 104.869 8.801 4.424 1.00 0.00 O ATOM 0 H SER A 63 105.725 8.107 1.655 1.00 0.00 H new ATOM 0 HA SER A 63 107.956 7.878 3.521 1.00 0.00 H new ATOM 0 HB2 SER A 63 106.662 8.653 5.441 1.00 0.00 H new ATOM 0 HB3 SER A 63 106.597 9.919 4.232 1.00 0.00 H new ATOM 0 HG SER A 63 104.538 9.064 3.540 1.00 0.00 H new ATOM 1000 N GLU A 64 106.804 5.889 4.685 1.00 0.00 N ATOM 1001 CA GLU A 64 106.357 4.549 5.040 1.00 0.00 C ATOM 1002 C GLU A 64 104.846 4.504 5.263 1.00 0.00 C ATOM 1003 O GLU A 64 104.197 3.517 4.921 1.00 0.00 O ATOM 1004 CB GLU A 64 107.079 4.086 6.310 1.00 0.00 C ATOM 1005 CG GLU A 64 106.771 5.042 7.470 1.00 0.00 C ATOM 1006 CD GLU A 64 107.562 4.681 8.732 1.00 0.00 C ATOM 1007 OE1 GLU A 64 108.233 3.658 8.748 1.00 0.00 O ATOM 1008 OE2 GLU A 64 107.479 5.443 9.682 1.00 0.00 O ATOM 0 H GLU A 64 107.522 6.271 5.301 1.00 0.00 H new ATOM 0 HA GLU A 64 106.596 3.882 4.212 1.00 0.00 H new ATOM 0 HB2 GLU A 64 106.764 3.075 6.568 1.00 0.00 H new ATOM 0 HB3 GLU A 64 108.154 4.050 6.134 1.00 0.00 H new ATOM 0 HG2 GLU A 64 107.009 6.063 7.172 1.00 0.00 H new ATOM 0 HG3 GLU A 64 105.704 5.014 7.690 1.00 0.00 H new ATOM 1015 N ALA A 65 104.281 5.579 5.806 1.00 0.00 N ATOM 1016 CA ALA A 65 102.859 5.595 6.132 1.00 0.00 C ATOM 1017 C ALA A 65 102.009 5.348 4.890 1.00 0.00 C ATOM 1018 O ALA A 65 101.054 4.572 4.927 1.00 0.00 O ATOM 1019 CB ALA A 65 102.477 6.945 6.744 1.00 0.00 C ATOM 0 H ALA A 65 104.780 6.441 6.027 1.00 0.00 H new ATOM 0 HA ALA A 65 102.670 4.797 6.850 1.00 0.00 H new ATOM 0 HB1 ALA A 65 101.414 6.948 6.984 1.00 0.00 H new ATOM 0 HB2 ALA A 65 103.055 7.109 7.654 1.00 0.00 H new ATOM 0 HB3 ALA A 65 102.690 7.741 6.031 1.00 0.00 H new ATOM 1025 N ASN A 66 102.358 6.010 3.793 1.00 0.00 N ATOM 1026 CA ASN A 66 101.561 5.915 2.574 1.00 0.00 C ATOM 1027 C ASN A 66 101.672 4.525 1.954 1.00 0.00 C ATOM 1028 O ASN A 66 100.670 3.923 1.570 1.00 0.00 O ATOM 1029 CB ASN A 66 102.020 6.952 1.545 1.00 0.00 C ATOM 1030 CG ASN A 66 102.099 8.346 2.162 1.00 0.00 C ATOM 1031 OD1 ASN A 66 103.170 8.778 2.588 1.00 0.00 O ATOM 1032 ND2 ASN A 66 101.025 9.082 2.227 1.00 0.00 N ATOM 0 H ASN A 66 103.178 6.612 3.721 1.00 0.00 H new ATOM 0 HA ASN A 66 100.523 6.105 2.849 1.00 0.00 H new ATOM 0 HB2 ASN A 66 102.997 6.670 1.152 1.00 0.00 H new ATOM 0 HB3 ASN A 66 101.328 6.963 0.703 1.00 0.00 H new ATOM 0 HD21 ASN A 66 101.071 10.017 2.631 1.00 0.00 H new ATOM 0 HD22 ASN A 66 100.138 8.723 1.874 1.00 0.00 H new ATOM 1039 N LEU A 67 102.900 4.023 1.852 1.00 0.00 N ATOM 1040 CA LEU A 67 103.137 2.732 1.206 1.00 0.00 C ATOM 1041 C LEU A 67 102.668 1.548 2.051 1.00 0.00 C ATOM 1042 O LEU A 67 102.375 0.483 1.506 1.00 0.00 O ATOM 1043 CB LEU A 67 104.624 2.578 0.871 1.00 0.00 C ATOM 1044 CG LEU A 67 104.938 3.341 -0.421 1.00 0.00 C ATOM 1045 CD1 LEU A 67 104.932 4.845 -0.140 1.00 0.00 C ATOM 1046 CD2 LEU A 67 106.308 2.915 -0.969 1.00 0.00 C ATOM 0 H LEU A 67 103.739 4.484 2.204 1.00 0.00 H new ATOM 0 HA LEU A 67 102.545 2.723 0.291 1.00 0.00 H new ATOM 0 HB2 LEU A 67 105.234 2.961 1.689 1.00 0.00 H new ATOM 0 HB3 LEU A 67 104.874 1.524 0.753 1.00 0.00 H new ATOM 0 HG LEU A 67 104.177 3.110 -1.167 1.00 0.00 H new ATOM 0 HD11 LEU A 67 105.155 5.388 -1.059 1.00 0.00 H new ATOM 0 HD12 LEU A 67 103.950 5.143 0.228 1.00 0.00 H new ATOM 0 HD13 LEU A 67 105.687 5.078 0.611 1.00 0.00 H new ATOM 0 HD21 LEU A 67 106.519 3.464 -1.887 1.00 0.00 H new ATOM 0 HD22 LEU A 67 107.079 3.133 -0.230 1.00 0.00 H new ATOM 0 HD23 LEU A 67 106.299 1.846 -1.180 1.00 0.00 H new ATOM 1058 N ALA A 68 102.603 1.718 3.373 1.00 0.00 N ATOM 1059 CA ALA A 68 102.217 0.631 4.276 1.00 0.00 C ATOM 1060 C ALA A 68 103.345 -0.413 4.316 1.00 0.00 C ATOM 1061 O ALA A 68 104.507 -0.044 4.150 1.00 0.00 O ATOM 1062 CB ALA A 68 100.863 0.033 3.848 1.00 0.00 C ATOM 0 H ALA A 68 102.813 2.599 3.843 1.00 0.00 H new ATOM 0 HA ALA A 68 102.079 1.010 5.289 1.00 0.00 H new ATOM 0 HB1 ALA A 68 100.590 -0.773 4.529 1.00 0.00 H new ATOM 0 HB2 ALA A 68 100.097 0.808 3.878 1.00 0.00 H new ATOM 0 HB3 ALA A 68 100.943 -0.359 2.834 1.00 0.00 H new ATOM 1068 N TYR A 69 103.040 -1.700 4.508 1.00 0.00 N ATOM 1069 CA TYR A 69 104.085 -2.722 4.605 1.00 0.00 C ATOM 1070 C TYR A 69 105.017 -2.724 3.385 1.00 0.00 C ATOM 1071 O TYR A 69 106.137 -3.229 3.459 1.00 0.00 O ATOM 1072 CB TYR A 69 103.444 -4.103 4.751 1.00 0.00 C ATOM 1073 CG TYR A 69 102.621 -4.256 6.008 1.00 0.00 C ATOM 1074 CD1 TYR A 69 103.249 -4.551 7.224 1.00 0.00 C ATOM 1075 CD2 TYR A 69 101.230 -4.104 5.958 1.00 0.00 C ATOM 1076 CE1 TYR A 69 102.487 -4.693 8.389 1.00 0.00 C ATOM 1077 CE2 TYR A 69 100.468 -4.247 7.123 1.00 0.00 C ATOM 1078 CZ TYR A 69 101.097 -4.542 8.339 1.00 0.00 C ATOM 1079 OH TYR A 69 100.345 -4.683 9.488 1.00 0.00 O ATOM 0 H TYR A 69 102.088 -2.056 4.598 1.00 0.00 H new ATOM 0 HA TYR A 69 104.687 -2.485 5.482 1.00 0.00 H new ATOM 0 HB2 TYR A 69 102.809 -4.293 3.885 1.00 0.00 H new ATOM 0 HB3 TYR A 69 104.227 -4.861 4.745 1.00 0.00 H new ATOM 0 HD1 TYR A 69 104.322 -4.669 7.263 1.00 0.00 H new ATOM 0 HD2 TYR A 69 100.745 -3.876 5.020 1.00 0.00 H new ATOM 0 HE1 TYR A 69 102.972 -4.919 9.327 1.00 0.00 H new ATOM 0 HE2 TYR A 69 99.395 -4.130 7.084 1.00 0.00 H new ATOM 0 HH TYR A 69 99.398 -4.546 9.278 1.00 0.00 H new ATOM 1089 N LEU A 70 104.558 -2.162 2.268 1.00 0.00 N ATOM 1090 CA LEU A 70 105.352 -2.121 1.041 1.00 0.00 C ATOM 1091 C LEU A 70 106.677 -1.373 1.228 1.00 0.00 C ATOM 1092 O LEU A 70 107.627 -1.599 0.477 1.00 0.00 O ATOM 1093 CB LEU A 70 104.546 -1.448 -0.074 1.00 0.00 C ATOM 1094 CG LEU A 70 103.234 -2.205 -0.301 1.00 0.00 C ATOM 1095 CD1 LEU A 70 102.386 -1.455 -1.330 1.00 0.00 C ATOM 1096 CD2 LEU A 70 103.533 -3.611 -0.826 1.00 0.00 C ATOM 0 H LEU A 70 103.639 -1.728 2.187 1.00 0.00 H new ATOM 0 HA LEU A 70 105.587 -3.151 0.774 1.00 0.00 H new ATOM 0 HB2 LEU A 70 104.336 -0.412 0.192 1.00 0.00 H new ATOM 0 HB3 LEU A 70 105.129 -1.429 -0.995 1.00 0.00 H new ATOM 0 HG LEU A 70 102.693 -2.276 0.642 1.00 0.00 H new ATOM 0 HD11 LEU A 70 101.452 -1.992 -1.493 1.00 0.00 H new ATOM 0 HD12 LEU A 70 102.168 -0.453 -0.961 1.00 0.00 H new ATOM 0 HD13 LEU A 70 102.933 -1.385 -2.270 1.00 0.00 H new ATOM 0 HD21 LEU A 70 102.597 -4.146 -0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 70 104.076 -3.540 -1.768 1.00 0.00 H new ATOM 0 HD23 LEU A 70 104.139 -4.150 -0.098 1.00 0.00 H new ATOM 1108 N TRP A 71 106.749 -0.486 2.219 1.00 0.00 N ATOM 1109 CA TRP A 71 107.941 0.329 2.430 1.00 0.00 C ATOM 1110 C TRP A 71 109.178 -0.567 2.593 1.00 0.00 C ATOM 1111 O TRP A 71 109.269 -1.286 3.590 1.00 0.00 O ATOM 1112 CB TRP A 71 107.762 1.160 3.701 1.00 0.00 C ATOM 1113 CG TRP A 71 108.718 2.306 3.804 1.00 0.00 C ATOM 1114 CD1 TRP A 71 109.657 2.448 4.766 1.00 0.00 C ATOM 1115 CD2 TRP A 71 108.849 3.465 2.931 1.00 0.00 C ATOM 1116 NE1 TRP A 71 110.340 3.630 4.552 1.00 0.00 N ATOM 1117 CE2 TRP A 71 109.887 4.290 3.428 1.00 0.00 C ATOM 1118 CE3 TRP A 71 108.173 3.880 1.773 1.00 0.00 C ATOM 1119 CZ2 TRP A 71 110.243 5.484 2.792 1.00 0.00 C ATOM 1120 CZ3 TRP A 71 108.526 5.077 1.131 1.00 0.00 C ATOM 1121 CH2 TRP A 71 109.558 5.876 1.638 1.00 0.00 C ATOM 0 H TRP A 71 105.997 -0.315 2.886 1.00 0.00 H new ATOM 0 HA TRP A 71 108.081 0.980 1.567 1.00 0.00 H new ATOM 0 HB2 TRP A 71 106.742 1.544 3.734 1.00 0.00 H new ATOM 0 HB3 TRP A 71 107.888 0.513 4.569 1.00 0.00 H new ATOM 0 HD1 TRP A 71 109.843 1.752 5.570 1.00 0.00 H new ATOM 0 HE1 TRP A 71 111.089 3.973 5.153 1.00 0.00 H new ATOM 0 HE3 TRP A 71 107.374 3.273 1.373 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 111.039 6.097 3.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 107.998 5.384 0.240 1.00 0.00 H new ATOM 0 HH2 TRP A 71 109.825 6.795 1.138 1.00 0.00 H new ATOM 1132 N PRO A 72 110.127 -0.560 1.676 1.00 0.00 N ATOM 1133 CA PRO A 72 111.301 -1.481 1.749 1.00 0.00 C ATOM 1134 C PRO A 72 112.493 -0.916 2.525 1.00 0.00 C ATOM 1135 O PRO A 72 113.436 -1.645 2.827 1.00 0.00 O ATOM 1136 CB PRO A 72 111.664 -1.674 0.279 1.00 0.00 C ATOM 1137 CG PRO A 72 111.348 -0.366 -0.364 1.00 0.00 C ATOM 1138 CD PRO A 72 110.242 0.287 0.470 1.00 0.00 C ATOM 0 HA PRO A 72 111.055 -2.397 2.287 1.00 0.00 H new ATOM 0 HB2 PRO A 72 112.717 -1.929 0.161 1.00 0.00 H new ATOM 0 HB3 PRO A 72 111.088 -2.484 -0.168 1.00 0.00 H new ATOM 0 HG2 PRO A 72 112.232 0.271 -0.398 1.00 0.00 H new ATOM 0 HG3 PRO A 72 111.020 -0.511 -1.393 1.00 0.00 H new ATOM 0 HD2 PRO A 72 110.498 1.314 0.731 1.00 0.00 H new ATOM 0 HD3 PRO A 72 109.301 0.323 -0.079 1.00 0.00 H new ATOM 1146 N LEU A 73 112.477 0.385 2.806 1.00 0.00 N ATOM 1147 CA LEU A 73 113.626 1.035 3.434 1.00 0.00 C ATOM 1148 C LEU A 73 113.492 1.074 4.953 1.00 0.00 C ATOM 1149 O LEU A 73 112.393 1.204 5.493 1.00 0.00 O ATOM 1150 CB LEU A 73 113.767 2.470 2.922 1.00 0.00 C ATOM 1151 CG LEU A 73 113.856 2.490 1.395 1.00 0.00 C ATOM 1152 CD1 LEU A 73 113.911 3.945 0.928 1.00 0.00 C ATOM 1153 CD2 LEU A 73 115.121 1.757 0.938 1.00 0.00 C ATOM 0 H LEU A 73 111.691 1.005 2.612 1.00 0.00 H new ATOM 0 HA LEU A 73 114.508 0.450 3.173 1.00 0.00 H new ATOM 0 HB2 LEU A 73 112.914 3.064 3.250 1.00 0.00 H new ATOM 0 HB3 LEU A 73 114.658 2.929 3.350 1.00 0.00 H new ATOM 0 HG LEU A 73 112.986 1.992 0.968 1.00 0.00 H new ATOM 0 HD11 LEU A 73 113.975 3.976 -0.160 1.00 0.00 H new ATOM 0 HD12 LEU A 73 113.011 4.466 1.254 1.00 0.00 H new ATOM 0 HD13 LEU A 73 114.787 4.432 1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 73 115.179 1.775 -0.150 1.00 0.00 H new ATOM 0 HD22 LEU A 73 115.998 2.250 1.356 1.00 0.00 H new ATOM 0 HD23 LEU A 73 115.087 0.724 1.283 1.00 0.00 H new ATOM 1165 N THR A 74 114.630 0.958 5.629 1.00 0.00 N ATOM 1166 CA THR A 74 114.679 1.094 7.080 1.00 0.00 C ATOM 1167 C THR A 74 114.426 2.542 7.494 1.00 0.00 C ATOM 1168 O THR A 74 113.784 2.791 8.516 1.00 0.00 O ATOM 1169 CB THR A 74 116.043 0.642 7.605 1.00 0.00 C ATOM 1170 OG1 THR A 74 117.057 1.481 7.069 1.00 0.00 O ATOM 1171 CG2 THR A 74 116.304 -0.808 7.190 1.00 0.00 C ATOM 0 H THR A 74 115.533 0.770 5.194 1.00 0.00 H new ATOM 0 HA THR A 74 113.900 0.464 7.509 1.00 0.00 H new ATOM 0 HB THR A 74 116.051 0.709 8.693 1.00 0.00 H new ATOM 0 HG1 THR A 74 117.203 1.257 6.126 1.00 0.00 H new ATOM 0 HG21 THR A 74 117.277 -1.125 7.566 1.00 0.00 H new ATOM 0 HG22 THR A 74 115.527 -1.451 7.605 1.00 0.00 H new ATOM 0 HG23 THR A 74 116.294 -0.883 6.103 1.00 0.00 H new ATOM 1179 N VAL A 75 114.929 3.496 6.707 1.00 0.00 N ATOM 1180 CA VAL A 75 114.645 4.902 6.973 1.00 0.00 C ATOM 1181 C VAL A 75 113.149 5.125 6.810 1.00 0.00 C ATOM 1182 O VAL A 75 112.564 4.707 5.816 1.00 0.00 O ATOM 1183 CB VAL A 75 115.432 5.825 6.034 1.00 0.00 C ATOM 1184 CG1 VAL A 75 116.922 5.734 6.368 1.00 0.00 C ATOM 1185 CG2 VAL A 75 115.222 5.421 4.571 1.00 0.00 C ATOM 0 H VAL A 75 115.523 3.323 5.896 1.00 0.00 H new ATOM 0 HA VAL A 75 114.956 5.145 7.989 1.00 0.00 H new ATOM 0 HB VAL A 75 115.075 6.846 6.171 1.00 0.00 H new ATOM 0 HG11 VAL A 75 117.485 6.389 5.703 1.00 0.00 H new ATOM 0 HG12 VAL A 75 117.083 6.042 7.401 1.00 0.00 H new ATOM 0 HG13 VAL A 75 117.262 4.706 6.239 1.00 0.00 H new ATOM 0 HG21 VAL A 75 115.790 6.090 3.924 1.00 0.00 H new ATOM 0 HG22 VAL A 75 115.564 4.397 4.424 1.00 0.00 H new ATOM 0 HG23 VAL A 75 114.163 5.489 4.323 1.00 0.00 H new ATOM 1195 N ASP A 76 112.529 5.763 7.793 1.00 0.00 N ATOM 1196 CA ASP A 76 111.072 5.808 7.849 1.00 0.00 C ATOM 1197 C ASP A 76 110.468 6.564 6.672 1.00 0.00 C ATOM 1198 O ASP A 76 109.347 6.256 6.264 1.00 0.00 O ATOM 1199 CB ASP A 76 110.610 6.429 9.170 1.00 0.00 C ATOM 1200 CG ASP A 76 111.063 7.884 9.269 1.00 0.00 C ATOM 1201 OD1 ASP A 76 112.102 8.208 8.716 1.00 0.00 O ATOM 1202 OD2 ASP A 76 110.360 8.656 9.900 1.00 0.00 O ATOM 0 H ASP A 76 113.003 6.251 8.553 1.00 0.00 H new ATOM 0 HA ASP A 76 110.717 4.779 7.788 1.00 0.00 H new ATOM 0 HB2 ASP A 76 109.524 6.375 9.243 1.00 0.00 H new ATOM 0 HB3 ASP A 76 111.014 5.859 10.007 1.00 0.00 H new ATOM 1207 N HIS A 77 111.180 7.556 6.141 1.00 0.00 N ATOM 1208 CA HIS A 77 110.681 8.268 4.970 1.00 0.00 C ATOM 1209 C HIS A 77 111.832 8.791 4.128 1.00 0.00 C ATOM 1210 O HIS A 77 112.997 8.585 4.462 1.00 0.00 O ATOM 1211 CB HIS A 77 109.741 9.409 5.380 1.00 0.00 C ATOM 1212 CG HIS A 77 110.414 10.583 6.038 1.00 0.00 C ATOM 1213 ND1 HIS A 77 110.753 10.588 7.381 1.00 0.00 N ATOM 1214 CD2 HIS A 77 110.779 11.818 5.557 1.00 0.00 C ATOM 1215 CE1 HIS A 77 111.292 11.787 7.661 1.00 0.00 C ATOM 1216 NE2 HIS A 77 111.332 12.577 6.586 1.00 0.00 N ATOM 0 H HIS A 77 112.082 7.878 6.493 1.00 0.00 H new ATOM 0 HA HIS A 77 110.109 7.564 4.365 1.00 0.00 H new ATOM 0 HB2 HIS A 77 109.214 9.762 4.493 1.00 0.00 H new ATOM 0 HB3 HIS A 77 108.988 9.012 6.061 1.00 0.00 H new ATOM 0 HD2 HIS A 77 110.656 12.149 4.537 1.00 0.00 H new ATOM 0 HE1 HIS A 77 111.650 12.076 8.638 1.00 0.00 H new ATOM 0 HE2 HIS A 77 111.690 13.530 6.530 1.00 0.00 H new ATOM 1224 N GLY A 78 111.489 9.400 3.002 1.00 0.00 N ATOM 1225 CA GLY A 78 112.475 10.010 2.128 1.00 0.00 C ATOM 1226 C GLY A 78 111.772 10.802 1.034 1.00 0.00 C ATOM 1227 O GLY A 78 110.575 10.630 0.793 1.00 0.00 O ATOM 0 H GLY A 78 110.527 9.484 2.672 1.00 0.00 H new ATOM 0 HA2 GLY A 78 113.128 10.667 2.703 1.00 0.00 H new ATOM 0 HA3 GLY A 78 113.107 9.241 1.684 1.00 0.00 H new ATOM 1231 N THR A 79 112.508 11.698 0.394 1.00 0.00 N ATOM 1232 CA THR A 79 111.950 12.504 -0.685 1.00 0.00 C ATOM 1233 C THR A 79 112.504 12.034 -2.024 1.00 0.00 C ATOM 1234 O THR A 79 113.685 11.716 -2.134 1.00 0.00 O ATOM 1235 CB THR A 79 112.301 13.976 -0.468 1.00 0.00 C ATOM 1236 OG1 THR A 79 112.172 14.290 0.912 1.00 0.00 O ATOM 1237 CG2 THR A 79 111.331 14.839 -1.276 1.00 0.00 C ATOM 0 H THR A 79 113.489 11.886 0.601 1.00 0.00 H new ATOM 0 HA THR A 79 110.866 12.391 -0.688 1.00 0.00 H new ATOM 0 HB THR A 79 113.325 14.166 -0.790 1.00 0.00 H new ATOM 0 HG1 THR A 79 112.398 15.233 1.055 1.00 0.00 H new ATOM 0 HG21 THR A 79 111.572 15.892 -1.129 1.00 0.00 H new ATOM 0 HG22 THR A 79 111.418 14.591 -2.334 1.00 0.00 H new ATOM 0 HG23 THR A 79 110.311 14.650 -0.942 1.00 0.00 H new ATOM 1245 N ILE A 80 111.655 11.990 -3.044 1.00 0.00 N ATOM 1246 CA ILE A 80 112.076 11.535 -4.367 1.00 0.00 C ATOM 1247 C ILE A 80 112.121 12.713 -5.332 1.00 0.00 C ATOM 1248 O ILE A 80 111.232 13.566 -5.319 1.00 0.00 O ATOM 1249 CB ILE A 80 111.111 10.462 -4.881 1.00 0.00 C ATOM 1250 CG1 ILE A 80 109.681 11.018 -4.918 1.00 0.00 C ATOM 1251 CG2 ILE A 80 111.167 9.251 -3.947 1.00 0.00 C ATOM 1252 CD1 ILE A 80 108.735 9.983 -5.530 1.00 0.00 C ATOM 0 H ILE A 80 110.674 12.262 -2.983 1.00 0.00 H new ATOM 0 HA ILE A 80 113.074 11.103 -4.296 1.00 0.00 H new ATOM 0 HB ILE A 80 111.401 10.165 -5.889 1.00 0.00 H new ATOM 0 HG12 ILE A 80 109.354 11.271 -3.910 1.00 0.00 H new ATOM 0 HG13 ILE A 80 109.654 11.938 -5.502 1.00 0.00 H new ATOM 0 HG21 ILE A 80 110.483 8.482 -4.306 1.00 0.00 H new ATOM 0 HG22 ILE A 80 112.182 8.853 -3.928 1.00 0.00 H new ATOM 0 HG23 ILE A 80 110.877 9.554 -2.941 1.00 0.00 H new ATOM 0 HD11 ILE A 80 107.722 10.385 -5.553 1.00 0.00 H new ATOM 0 HD12 ILE A 80 109.057 9.752 -6.545 1.00 0.00 H new ATOM 0 HD13 ILE A 80 108.751 9.074 -4.928 1.00 0.00 H new ATOM 1264 N GLU A 81 113.167 12.769 -6.154 1.00 0.00 N ATOM 1265 CA GLU A 81 113.339 13.898 -7.060 1.00 0.00 C ATOM 1266 C GLU A 81 113.955 13.475 -8.390 1.00 0.00 C ATOM 1267 O GLU A 81 114.799 12.579 -8.448 1.00 0.00 O ATOM 1268 CB GLU A 81 114.227 14.956 -6.400 1.00 0.00 C ATOM 1269 CG GLU A 81 114.264 16.220 -7.269 1.00 0.00 C ATOM 1270 CD GLU A 81 115.211 17.282 -6.697 1.00 0.00 C ATOM 1271 OE1 GLU A 81 115.838 17.038 -5.677 1.00 0.00 O ATOM 1272 OE2 GLU A 81 115.295 18.340 -7.299 1.00 0.00 O ATOM 0 H GLU A 81 113.896 12.058 -6.210 1.00 0.00 H new ATOM 0 HA GLU A 81 112.351 14.310 -7.266 1.00 0.00 H new ATOM 0 HB2 GLU A 81 113.845 15.197 -5.408 1.00 0.00 H new ATOM 0 HB3 GLU A 81 115.236 14.565 -6.267 1.00 0.00 H new ATOM 0 HG2 GLU A 81 114.581 15.957 -8.278 1.00 0.00 H new ATOM 0 HG3 GLU A 81 113.259 16.635 -7.348 1.00 0.00 H new ATOM 1279 N CYS A 82 113.504 14.128 -9.457 1.00 0.00 N ATOM 1280 CA CYS A 82 114.090 13.941 -10.779 1.00 0.00 C ATOM 1281 C CYS A 82 114.877 15.187 -11.174 1.00 0.00 C ATOM 1282 O CYS A 82 114.330 16.290 -11.212 1.00 0.00 O ATOM 1283 CB CYS A 82 112.986 13.685 -11.808 1.00 0.00 C ATOM 1284 SG CYS A 82 112.542 11.930 -11.792 1.00 0.00 S ATOM 0 H CYS A 82 112.732 14.794 -9.431 1.00 0.00 H new ATOM 0 HA CYS A 82 114.761 13.082 -10.752 1.00 0.00 H new ATOM 0 HB2 CYS A 82 112.112 14.294 -11.579 1.00 0.00 H new ATOM 0 HB3 CYS A 82 113.326 13.976 -12.802 1.00 0.00 H new ATOM 1289 N LEU A 83 116.160 15.009 -11.468 1.00 0.00 N ATOM 1290 CA LEU A 83 117.018 16.138 -11.814 1.00 0.00 C ATOM 1291 C LEU A 83 116.872 16.505 -13.293 1.00 0.00 C ATOM 1292 O LEU A 83 116.442 15.671 -14.089 1.00 0.00 O ATOM 1293 CB LEU A 83 118.479 15.791 -11.517 1.00 0.00 C ATOM 1294 CG LEU A 83 118.745 15.945 -10.019 1.00 0.00 C ATOM 1295 CD1 LEU A 83 120.069 15.265 -9.662 1.00 0.00 C ATOM 1296 CD2 LEU A 83 118.826 17.431 -9.665 1.00 0.00 C ATOM 0 H LEU A 83 116.627 14.102 -11.474 1.00 0.00 H new ATOM 0 HA LEU A 83 116.713 16.994 -11.212 1.00 0.00 H new ATOM 0 HB2 LEU A 83 118.693 14.770 -11.832 1.00 0.00 H new ATOM 0 HB3 LEU A 83 119.142 16.445 -12.084 1.00 0.00 H new ATOM 0 HG LEU A 83 117.934 15.480 -9.458 1.00 0.00 H new ATOM 0 HD11 LEU A 83 120.258 15.375 -8.594 1.00 0.00 H new ATOM 0 HD12 LEU A 83 120.013 14.206 -9.913 1.00 0.00 H new ATOM 0 HD13 LEU A 83 120.880 15.729 -10.224 1.00 0.00 H new ATOM 0 HD21 LEU A 83 119.016 17.541 -8.597 1.00 0.00 H new ATOM 0 HD22 LEU A 83 119.636 17.895 -10.227 1.00 0.00 H new ATOM 0 HD23 LEU A 83 117.884 17.917 -9.918 1.00 0.00 H new ATOM 1308 N PRO A 84 117.219 17.713 -13.689 1.00 0.00 N ATOM 1309 CA PRO A 84 117.132 18.118 -15.131 1.00 0.00 C ATOM 1310 C PRO A 84 117.830 17.135 -16.076 1.00 0.00 C ATOM 1311 O PRO A 84 117.531 17.096 -17.269 1.00 0.00 O ATOM 1312 CB PRO A 84 117.815 19.486 -15.183 1.00 0.00 C ATOM 1313 CG PRO A 84 117.711 20.034 -13.801 1.00 0.00 C ATOM 1314 CD PRO A 84 117.717 18.830 -12.859 1.00 0.00 C ATOM 0 HA PRO A 84 116.095 18.137 -15.466 1.00 0.00 H new ATOM 0 HB2 PRO A 84 118.856 19.394 -15.491 1.00 0.00 H new ATOM 0 HB3 PRO A 84 117.326 20.142 -15.903 1.00 0.00 H new ATOM 0 HG2 PRO A 84 118.545 20.701 -13.584 1.00 0.00 H new ATOM 0 HG3 PRO A 84 116.797 20.616 -13.682 1.00 0.00 H new ATOM 0 HD2 PRO A 84 118.718 18.627 -12.479 1.00 0.00 H new ATOM 0 HD3 PRO A 84 117.076 18.999 -11.994 1.00 0.00 H new ATOM 1322 N SER A 85 118.759 16.347 -15.542 1.00 0.00 N ATOM 1323 CA SER A 85 119.512 15.384 -16.348 1.00 0.00 C ATOM 1324 C SER A 85 118.734 14.092 -16.641 1.00 0.00 C ATOM 1325 O SER A 85 119.290 13.168 -17.233 1.00 0.00 O ATOM 1326 CB SER A 85 120.816 15.030 -15.632 1.00 0.00 C ATOM 1327 OG SER A 85 120.529 14.157 -14.548 1.00 0.00 O ATOM 0 H SER A 85 119.010 16.355 -14.554 1.00 0.00 H new ATOM 0 HA SER A 85 119.706 15.864 -17.307 1.00 0.00 H new ATOM 0 HB2 SER A 85 121.508 14.553 -16.326 1.00 0.00 H new ATOM 0 HB3 SER A 85 121.302 15.935 -15.268 1.00 0.00 H new ATOM 0 HG SER A 85 121.082 14.400 -13.777 1.00 0.00 H new ATOM 1333 N ASP A 86 117.476 14.012 -16.200 1.00 0.00 N ATOM 1334 CA ASP A 86 116.665 12.805 -16.339 1.00 0.00 C ATOM 1335 C ASP A 86 117.274 11.653 -15.542 1.00 0.00 C ATOM 1336 O ASP A 86 117.285 10.506 -15.986 1.00 0.00 O ATOM 1337 CB ASP A 86 116.516 12.413 -17.815 1.00 0.00 C ATOM 1338 CG ASP A 86 115.877 13.552 -18.606 1.00 0.00 C ATOM 1339 OD1 ASP A 86 115.069 14.269 -18.037 1.00 0.00 O ATOM 1340 OD2 ASP A 86 116.202 13.687 -19.774 1.00 0.00 O ATOM 0 H ASP A 86 116.994 14.783 -15.737 1.00 0.00 H new ATOM 0 HA ASP A 86 115.673 13.017 -15.940 1.00 0.00 H new ATOM 0 HB2 ASP A 86 117.493 12.174 -18.235 1.00 0.00 H new ATOM 0 HB3 ASP A 86 115.904 11.515 -17.899 1.00 0.00 H new ATOM 1345 N ASN A 87 117.764 11.970 -14.346 1.00 0.00 N ATOM 1346 CA ASN A 87 118.275 10.957 -13.430 1.00 0.00 C ATOM 1347 C ASN A 87 117.387 10.901 -12.194 1.00 0.00 C ATOM 1348 O ASN A 87 117.098 11.932 -11.586 1.00 0.00 O ATOM 1349 CB ASN A 87 119.710 11.297 -13.019 1.00 0.00 C ATOM 1350 CG ASN A 87 120.641 11.227 -14.227 1.00 0.00 C ATOM 1351 OD1 ASN A 87 120.325 10.579 -15.226 1.00 0.00 O ATOM 1352 ND2 ASN A 87 121.780 11.862 -14.196 1.00 0.00 N ATOM 0 H ASN A 87 117.817 12.924 -13.989 1.00 0.00 H new ATOM 0 HA ASN A 87 118.271 9.987 -13.928 1.00 0.00 H new ATOM 0 HB2 ASN A 87 119.743 12.296 -12.584 1.00 0.00 H new ATOM 0 HB3 ASN A 87 120.049 10.603 -12.250 1.00 0.00 H new ATOM 0 HD21 ASN A 87 122.408 11.822 -14.999 1.00 0.00 H new ATOM 0 HD22 ASN A 87 122.042 12.399 -13.369 1.00 0.00 H new ATOM 1359 N ALA A 88 116.937 9.702 -11.843 1.00 0.00 N ATOM 1360 CA ALA A 88 116.062 9.536 -10.690 1.00 0.00 C ATOM 1361 C ALA A 88 116.876 9.171 -9.455 1.00 0.00 C ATOM 1362 O ALA A 88 117.609 8.180 -9.456 1.00 0.00 O ATOM 1363 CB ALA A 88 115.037 8.434 -10.972 1.00 0.00 C ATOM 0 H ALA A 88 117.161 8.838 -12.336 1.00 0.00 H new ATOM 0 HA ALA A 88 115.544 10.477 -10.506 1.00 0.00 H new ATOM 0 HB1 ALA A 88 114.385 8.314 -10.107 1.00 0.00 H new ATOM 0 HB2 ALA A 88 114.439 8.707 -11.842 1.00 0.00 H new ATOM 0 HB3 ALA A 88 115.556 7.496 -11.168 1.00 0.00 H new ATOM 1369 N VAL A 89 116.734 9.965 -8.396 1.00 0.00 N ATOM 1370 CA VAL A 89 117.458 9.703 -7.153 1.00 0.00 C ATOM 1371 C VAL A 89 116.535 9.801 -5.940 1.00 0.00 C ATOM 1372 O VAL A 89 115.494 10.460 -5.978 1.00 0.00 O ATOM 1373 CB VAL A 89 118.608 10.700 -6.993 1.00 0.00 C ATOM 1374 CG1 VAL A 89 119.602 10.523 -8.142 1.00 0.00 C ATOM 1375 CG2 VAL A 89 118.059 12.128 -7.012 1.00 0.00 C ATOM 0 H VAL A 89 116.131 10.787 -8.372 1.00 0.00 H new ATOM 0 HA VAL A 89 117.853 8.688 -7.208 1.00 0.00 H new ATOM 0 HB VAL A 89 119.112 10.518 -6.044 1.00 0.00 H new ATOM 0 HG11 VAL A 89 120.421 11.233 -8.027 1.00 0.00 H new ATOM 0 HG12 VAL A 89 119.998 9.508 -8.127 1.00 0.00 H new ATOM 0 HG13 VAL A 89 119.097 10.702 -9.091 1.00 0.00 H new ATOM 0 HG21 VAL A 89 118.881 12.835 -6.898 1.00 0.00 H new ATOM 0 HG22 VAL A 89 117.552 12.310 -7.960 1.00 0.00 H new ATOM 0 HG23 VAL A 89 117.353 12.257 -6.192 1.00 0.00 H new ATOM 1385 N PHE A 90 116.955 9.146 -4.863 1.00 0.00 N ATOM 1386 CA PHE A 90 116.211 9.124 -3.608 1.00 0.00 C ATOM 1387 C PHE A 90 116.998 9.847 -2.518 1.00 0.00 C ATOM 1388 O PHE A 90 118.162 9.538 -2.283 1.00 0.00 O ATOM 1389 CB PHE A 90 115.991 7.663 -3.202 1.00 0.00 C ATOM 1390 CG PHE A 90 115.284 7.470 -1.880 1.00 0.00 C ATOM 1391 CD1 PHE A 90 113.898 7.643 -1.789 1.00 0.00 C ATOM 1392 CD2 PHE A 90 116.020 7.101 -0.747 1.00 0.00 C ATOM 1393 CE1 PHE A 90 113.247 7.444 -0.562 1.00 0.00 C ATOM 1394 CE2 PHE A 90 115.371 6.903 0.476 1.00 0.00 C ATOM 1395 CZ PHE A 90 113.985 7.073 0.568 1.00 0.00 C ATOM 0 H PHE A 90 117.824 8.613 -4.835 1.00 0.00 H new ATOM 0 HA PHE A 90 115.254 9.629 -3.737 1.00 0.00 H new ATOM 0 HB2 PHE A 90 115.413 7.167 -3.982 1.00 0.00 H new ATOM 0 HB3 PHE A 90 116.959 7.164 -3.156 1.00 0.00 H new ATOM 0 HD1 PHE A 90 113.330 7.929 -2.662 1.00 0.00 H new ATOM 0 HD2 PHE A 90 117.090 6.969 -0.818 1.00 0.00 H new ATOM 0 HE1 PHE A 90 112.178 7.577 -0.490 1.00 0.00 H new ATOM 0 HE2 PHE A 90 115.939 6.619 1.349 1.00 0.00 H new ATOM 0 HZ PHE A 90 113.484 6.918 1.512 1.00 0.00 H new ATOM 1405 N VAL A 91 116.367 10.809 -1.856 1.00 0.00 N ATOM 1406 CA VAL A 91 117.014 11.541 -0.770 1.00 0.00 C ATOM 1407 C VAL A 91 116.429 11.091 0.562 1.00 0.00 C ATOM 1408 O VAL A 91 115.213 11.062 0.727 1.00 0.00 O ATOM 1409 CB VAL A 91 116.784 13.047 -0.951 1.00 0.00 C ATOM 1410 CG1 VAL A 91 117.478 13.849 0.158 1.00 0.00 C ATOM 1411 CG2 VAL A 91 117.343 13.488 -2.305 1.00 0.00 C ATOM 0 H VAL A 91 115.409 11.101 -2.050 1.00 0.00 H new ATOM 0 HA VAL A 91 118.085 11.338 -0.785 1.00 0.00 H new ATOM 0 HB VAL A 91 115.712 13.236 -0.902 1.00 0.00 H new ATOM 0 HG11 VAL A 91 117.298 14.913 0.004 1.00 0.00 H new ATOM 0 HG12 VAL A 91 117.079 13.550 1.127 1.00 0.00 H new ATOM 0 HG13 VAL A 91 118.550 13.655 0.131 1.00 0.00 H new ATOM 0 HG21 VAL A 91 117.180 14.558 -2.435 1.00 0.00 H new ATOM 0 HG22 VAL A 91 118.412 13.276 -2.344 1.00 0.00 H new ATOM 0 HG23 VAL A 91 116.836 12.944 -3.102 1.00 0.00 H new ATOM 1421 N ALA A 92 117.295 10.764 1.515 1.00 0.00 N ATOM 1422 CA ALA A 92 116.826 10.337 2.833 1.00 0.00 C ATOM 1423 C ALA A 92 116.906 11.491 3.837 1.00 0.00 C ATOM 1424 O ALA A 92 117.698 12.410 3.643 1.00 0.00 O ATOM 1425 CB ALA A 92 117.677 9.167 3.333 1.00 0.00 C ATOM 0 H ALA A 92 118.309 10.785 1.406 1.00 0.00 H new ATOM 0 HA ALA A 92 115.786 10.022 2.742 1.00 0.00 H new ATOM 0 HB1 ALA A 92 117.323 8.853 4.315 1.00 0.00 H new ATOM 0 HB2 ALA A 92 117.596 8.334 2.635 1.00 0.00 H new ATOM 0 HB3 ALA A 92 118.719 9.480 3.406 1.00 0.00 H new ATOM 1431 N PRO A 93 116.118 11.476 4.894 1.00 0.00 N ATOM 1432 CA PRO A 93 116.167 12.565 5.920 1.00 0.00 C ATOM 1433 C PRO A 93 117.585 12.890 6.382 1.00 0.00 C ATOM 1434 O PRO A 93 117.864 14.010 6.808 1.00 0.00 O ATOM 1435 CB PRO A 93 115.338 12.028 7.089 1.00 0.00 C ATOM 1436 CG PRO A 93 114.417 11.013 6.503 1.00 0.00 C ATOM 1437 CD PRO A 93 115.077 10.481 5.232 1.00 0.00 C ATOM 0 HA PRO A 93 115.784 13.499 5.509 1.00 0.00 H new ATOM 0 HB2 PRO A 93 115.978 11.582 7.850 1.00 0.00 H new ATOM 0 HB3 PRO A 93 114.780 12.829 7.573 1.00 0.00 H new ATOM 0 HG2 PRO A 93 114.237 10.203 7.210 1.00 0.00 H new ATOM 0 HG3 PRO A 93 113.449 11.459 6.276 1.00 0.00 H new ATOM 0 HD2 PRO A 93 115.512 9.495 5.397 1.00 0.00 H new ATOM 0 HD3 PRO A 93 114.352 10.379 4.424 1.00 0.00 H new ATOM 1445 N ASP A 94 118.476 11.911 6.296 1.00 0.00 N ATOM 1446 CA ASP A 94 119.852 12.102 6.748 1.00 0.00 C ATOM 1447 C ASP A 94 120.607 13.160 5.929 1.00 0.00 C ATOM 1448 O ASP A 94 121.686 13.595 6.331 1.00 0.00 O ATOM 1449 CB ASP A 94 120.599 10.760 6.694 1.00 0.00 C ATOM 1450 CG ASP A 94 120.506 10.108 5.310 1.00 0.00 C ATOM 1451 OD1 ASP A 94 120.080 10.766 4.375 1.00 0.00 O ATOM 1452 OD2 ASP A 94 120.875 8.949 5.199 1.00 0.00 O ATOM 0 H ASP A 94 118.276 10.984 5.921 1.00 0.00 H new ATOM 0 HA ASP A 94 119.810 12.470 7.773 1.00 0.00 H new ATOM 0 HB2 ASP A 94 121.646 10.917 6.951 1.00 0.00 H new ATOM 0 HB3 ASP A 94 120.185 10.084 7.442 1.00 0.00 H new ATOM 1457 N GLY A 95 120.054 13.578 4.789 1.00 0.00 N ATOM 1458 CA GLY A 95 120.731 14.544 3.919 1.00 0.00 C ATOM 1459 C GLY A 95 121.634 13.875 2.871 1.00 0.00 C ATOM 1460 O GLY A 95 122.394 14.556 2.183 1.00 0.00 O ATOM 0 H GLY A 95 119.145 13.266 4.447 1.00 0.00 H new ATOM 0 HA2 GLY A 95 119.984 15.154 3.411 1.00 0.00 H new ATOM 0 HA3 GLY A 95 121.331 15.218 4.531 1.00 0.00 H new ATOM 1464 N THR A 96 121.554 12.550 2.748 1.00 0.00 N ATOM 1465 CA THR A 96 122.359 11.808 1.793 1.00 0.00 C ATOM 1466 C THR A 96 121.525 11.502 0.560 1.00 0.00 C ATOM 1467 O THR A 96 120.346 11.168 0.673 1.00 0.00 O ATOM 1468 CB THR A 96 122.824 10.495 2.428 1.00 0.00 C ATOM 1469 OG1 THR A 96 123.513 10.774 3.638 1.00 0.00 O ATOM 1470 CG2 THR A 96 123.753 9.748 1.468 1.00 0.00 C ATOM 0 H THR A 96 120.931 11.968 3.307 1.00 0.00 H new ATOM 0 HA THR A 96 123.227 12.404 1.510 1.00 0.00 H new ATOM 0 HB THR A 96 121.955 9.871 2.637 1.00 0.00 H new ATOM 0 HG1 THR A 96 123.810 9.934 4.047 1.00 0.00 H new ATOM 0 HG21 THR A 96 124.079 8.815 1.929 1.00 0.00 H new ATOM 0 HG22 THR A 96 123.220 9.529 0.543 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.623 10.367 1.248 1.00 0.00 H new ATOM 1478 N THR A 97 122.134 11.623 -0.614 1.00 0.00 N ATOM 1479 CA THR A 97 121.436 11.311 -1.854 1.00 0.00 C ATOM 1480 C THR A 97 121.892 9.957 -2.384 1.00 0.00 C ATOM 1481 O THR A 97 123.087 9.674 -2.462 1.00 0.00 O ATOM 1482 CB THR A 97 121.715 12.395 -2.898 1.00 0.00 C ATOM 1483 OG1 THR A 97 121.383 13.666 -2.357 1.00 0.00 O ATOM 1484 CG2 THR A 97 120.872 12.134 -4.147 1.00 0.00 C ATOM 0 H THR A 97 123.099 11.931 -0.733 1.00 0.00 H new ATOM 0 HA THR A 97 120.365 11.273 -1.655 1.00 0.00 H new ATOM 0 HB THR A 97 122.771 12.378 -3.167 1.00 0.00 H new ATOM 0 HG1 THR A 97 121.562 14.362 -3.023 1.00 0.00 H new ATOM 0 HG21 THR A 97 121.072 12.907 -4.889 1.00 0.00 H new ATOM 0 HG22 THR A 97 121.127 11.159 -4.561 1.00 0.00 H new ATOM 0 HG23 THR A 97 119.815 12.150 -3.882 1.00 0.00 H new ATOM 1492 N TYR A 98 120.919 9.130 -2.740 1.00 0.00 N ATOM 1493 CA TYR A 98 121.184 7.801 -3.273 1.00 0.00 C ATOM 1494 C TYR A 98 120.635 7.709 -4.694 1.00 0.00 C ATOM 1495 O TYR A 98 119.672 8.393 -5.030 1.00 0.00 O ATOM 1496 CB TYR A 98 120.494 6.751 -2.400 1.00 0.00 C ATOM 1497 CG TYR A 98 120.911 6.766 -0.945 1.00 0.00 C ATOM 1498 CD1 TYR A 98 122.000 5.996 -0.518 1.00 0.00 C ATOM 1499 CD2 TYR A 98 120.200 7.541 -0.019 1.00 0.00 C ATOM 1500 CE1 TYR A 98 122.377 6.002 0.832 1.00 0.00 C ATOM 1501 CE2 TYR A 98 120.579 7.548 1.330 1.00 0.00 C ATOM 1502 CZ TYR A 98 121.666 6.779 1.757 1.00 0.00 C ATOM 1503 OH TYR A 98 122.040 6.782 3.087 1.00 0.00 O ATOM 0 H TYR A 98 119.928 9.360 -2.668 1.00 0.00 H new ATOM 0 HA TYR A 98 122.259 7.621 -3.279 1.00 0.00 H new ATOM 0 HB2 TYR A 98 119.416 6.902 -2.457 1.00 0.00 H new ATOM 0 HB3 TYR A 98 120.699 5.763 -2.813 1.00 0.00 H new ATOM 0 HD1 TYR A 98 122.550 5.397 -1.229 1.00 0.00 H new ATOM 0 HD2 TYR A 98 119.358 8.134 -0.346 1.00 0.00 H new ATOM 0 HE1 TYR A 98 123.217 5.407 1.160 1.00 0.00 H new ATOM 0 HE2 TYR A 98 120.031 8.148 2.041 1.00 0.00 H new ATOM 0 HH TYR A 98 121.581 7.511 3.554 1.00 0.00 H new ATOM 1513 N ALA A 99 121.237 6.864 -5.521 1.00 0.00 N ATOM 1514 CA ALA A 99 120.786 6.707 -6.900 1.00 0.00 C ATOM 1515 C ALA A 99 119.716 5.624 -7.000 1.00 0.00 C ATOM 1516 O ALA A 99 119.900 4.512 -6.507 1.00 0.00 O ATOM 1517 CB ALA A 99 121.973 6.331 -7.791 1.00 0.00 C ATOM 0 H ALA A 99 122.033 6.280 -5.265 1.00 0.00 H new ATOM 0 HA ALA A 99 120.359 7.653 -7.232 1.00 0.00 H new ATOM 0 HB1 ALA A 99 121.633 6.214 -8.820 1.00 0.00 H new ATOM 0 HB2 ALA A 99 122.726 7.117 -7.745 1.00 0.00 H new ATOM 0 HB3 ALA A 99 122.406 5.393 -7.444 1.00 0.00 H new ATOM 1523 N LEU A 100 118.598 5.956 -7.640 1.00 0.00 N ATOM 1524 CA LEU A 100 117.525 4.988 -7.828 1.00 0.00 C ATOM 1525 C LEU A 100 117.746 4.199 -9.112 1.00 0.00 C ATOM 1526 O LEU A 100 117.727 2.968 -9.108 1.00 0.00 O ATOM 1527 CB LEU A 100 116.171 5.695 -7.914 1.00 0.00 C ATOM 1528 CG LEU A 100 115.733 6.168 -6.530 1.00 0.00 C ATOM 1529 CD1 LEU A 100 114.677 7.264 -6.688 1.00 0.00 C ATOM 1530 CD2 LEU A 100 115.125 4.990 -5.765 1.00 0.00 C ATOM 0 H LEU A 100 118.414 6.879 -8.033 1.00 0.00 H new ATOM 0 HA LEU A 100 117.529 4.312 -6.973 1.00 0.00 H new ATOM 0 HB2 LEU A 100 116.239 6.546 -8.592 1.00 0.00 H new ATOM 0 HB3 LEU A 100 115.424 5.017 -8.328 1.00 0.00 H new ATOM 0 HG LEU A 100 116.592 6.558 -5.983 1.00 0.00 H new ATOM 0 HD11 LEU A 100 114.359 7.607 -5.704 1.00 0.00 H new ATOM 0 HD12 LEU A 100 115.101 8.100 -7.244 1.00 0.00 H new ATOM 0 HD13 LEU A 100 113.818 6.866 -7.229 1.00 0.00 H new ATOM 0 HD21 LEU A 100 114.810 5.322 -4.776 1.00 0.00 H new ATOM 0 HD22 LEU A 100 114.262 4.608 -6.311 1.00 0.00 H new ATOM 0 HD23 LEU A 100 115.869 4.200 -5.663 1.00 0.00 H new ATOM 1542 N ASN A 101 117.955 4.921 -10.211 1.00 0.00 N ATOM 1543 CA ASN A 101 118.087 4.279 -11.521 1.00 0.00 C ATOM 1544 C ASN A 101 119.542 4.221 -11.985 1.00 0.00 C ATOM 1545 O ASN A 101 120.426 4.866 -11.420 1.00 0.00 O ATOM 1546 CB ASN A 101 117.209 4.998 -12.556 1.00 0.00 C ATOM 1547 CG ASN A 101 117.746 6.386 -12.893 1.00 0.00 C ATOM 1548 OD1 ASN A 101 118.761 6.817 -12.349 1.00 0.00 O ATOM 1549 ND2 ASN A 101 117.118 7.116 -13.773 1.00 0.00 N ATOM 0 H ASN A 101 118.036 5.938 -10.224 1.00 0.00 H new ATOM 0 HA ASN A 101 117.743 3.249 -11.422 1.00 0.00 H new ATOM 0 HB2 ASN A 101 117.155 4.399 -13.465 1.00 0.00 H new ATOM 0 HB3 ASN A 101 116.193 5.086 -12.172 1.00 0.00 H new ATOM 0 HD21 ASN A 101 117.469 8.044 -14.010 1.00 0.00 H new ATOM 0 HD22 ASN A 101 116.276 6.759 -14.224 1.00 0.00 H new ATOM 1556 N ASP A 102 119.780 3.435 -13.030 1.00 0.00 N ATOM 1557 CA ASP A 102 121.137 3.164 -13.488 1.00 0.00 C ATOM 1558 C ASP A 102 121.905 4.448 -13.790 1.00 0.00 C ATOM 1559 O ASP A 102 123.088 4.552 -13.471 1.00 0.00 O ATOM 1560 CB ASP A 102 121.093 2.293 -14.746 1.00 0.00 C ATOM 1561 CG ASP A 102 120.501 0.921 -14.430 1.00 0.00 C ATOM 1562 OD1 ASP A 102 120.670 0.461 -13.311 1.00 0.00 O ATOM 1563 OD2 ASP A 102 119.886 0.349 -15.314 1.00 0.00 O ATOM 0 H ASP A 102 119.051 2.975 -13.575 1.00 0.00 H new ATOM 0 HA ASP A 102 121.657 2.642 -12.685 1.00 0.00 H new ATOM 0 HB2 ASP A 102 120.496 2.784 -15.514 1.00 0.00 H new ATOM 0 HB3 ASP A 102 122.099 2.177 -15.150 1.00 0.00 H new ATOM 1568 N ARG A 103 121.241 5.425 -14.400 1.00 0.00 N ATOM 1569 CA ARG A 103 121.920 6.653 -14.802 1.00 0.00 C ATOM 1570 C ARG A 103 122.456 7.414 -13.590 1.00 0.00 C ATOM 1571 O ARG A 103 123.585 7.905 -13.607 1.00 0.00 O ATOM 1572 CB ARG A 103 120.972 7.523 -15.628 1.00 0.00 C ATOM 1573 CG ARG A 103 120.697 6.812 -16.956 1.00 0.00 C ATOM 1574 CD ARG A 103 119.838 7.694 -17.863 1.00 0.00 C ATOM 1575 NE ARG A 103 118.568 8.010 -17.209 1.00 0.00 N ATOM 1576 CZ ARG A 103 117.584 7.117 -17.032 1.00 0.00 C ATOM 1577 NH1 ARG A 103 117.689 5.870 -17.419 1.00 0.00 N ATOM 1578 NH2 ARG A 103 116.485 7.515 -16.454 1.00 0.00 N ATOM 0 H ARG A 103 120.247 5.393 -14.625 1.00 0.00 H new ATOM 0 HA ARG A 103 122.779 6.389 -15.420 1.00 0.00 H new ATOM 0 HB2 ARG A 103 120.041 7.689 -15.087 1.00 0.00 H new ATOM 0 HB3 ARG A 103 121.415 8.503 -15.807 1.00 0.00 H new ATOM 0 HG2 ARG A 103 121.639 6.577 -17.452 1.00 0.00 H new ATOM 0 HG3 ARG A 103 120.189 5.865 -16.771 1.00 0.00 H new ATOM 0 HD2 ARG A 103 120.372 8.614 -18.099 1.00 0.00 H new ATOM 0 HD3 ARG A 103 119.651 7.183 -18.808 1.00 0.00 H new ATOM 0 HE ARG A 103 118.424 8.961 -16.869 1.00 0.00 H new ATOM 0 HH11 ARG A 103 118.543 5.547 -17.874 1.00 0.00 H new ATOM 0 HH12 ARG A 103 116.917 5.222 -17.266 1.00 0.00 H new ATOM 0 HH21 ARG A 103 116.391 8.484 -16.150 1.00 0.00 H new ATOM 0 HH22 ARG A 103 115.719 6.857 -16.306 1.00 0.00 H new ATOM 1592 N ALA A 104 121.667 7.478 -12.523 1.00 0.00 N ATOM 1593 CA ALA A 104 122.119 8.116 -11.289 1.00 0.00 C ATOM 1594 C ALA A 104 123.368 7.421 -10.743 1.00 0.00 C ATOM 1595 O ALA A 104 124.266 8.070 -10.197 1.00 0.00 O ATOM 1596 CB ALA A 104 121.003 8.075 -10.244 1.00 0.00 C ATOM 0 H ALA A 104 120.720 7.100 -12.485 1.00 0.00 H new ATOM 0 HA ALA A 104 122.371 9.153 -11.510 1.00 0.00 H new ATOM 0 HB1 ALA A 104 121.346 8.552 -9.326 1.00 0.00 H new ATOM 0 HB2 ALA A 104 120.129 8.605 -10.624 1.00 0.00 H new ATOM 0 HB3 ALA A 104 120.737 7.039 -10.036 1.00 0.00 H new ATOM 1602 N GLU A 105 123.416 6.095 -10.866 1.00 0.00 N ATOM 1603 CA GLU A 105 124.603 5.349 -10.459 1.00 0.00 C ATOM 1604 C GLU A 105 125.805 5.758 -11.308 1.00 0.00 C ATOM 1605 O GLU A 105 126.907 5.942 -10.794 1.00 0.00 O ATOM 1606 CB GLU A 105 124.360 3.845 -10.600 1.00 0.00 C ATOM 1607 CG GLU A 105 123.231 3.417 -9.654 1.00 0.00 C ATOM 1608 CD GLU A 105 122.999 1.903 -9.692 1.00 0.00 C ATOM 1609 OE1 GLU A 105 123.549 1.236 -10.557 1.00 0.00 O ATOM 1610 OE2 GLU A 105 122.265 1.426 -8.843 1.00 0.00 O ATOM 0 H GLU A 105 122.658 5.523 -11.239 1.00 0.00 H new ATOM 0 HA GLU A 105 124.812 5.579 -9.414 1.00 0.00 H new ATOM 0 HB2 GLU A 105 124.097 3.604 -11.630 1.00 0.00 H new ATOM 0 HB3 GLU A 105 125.272 3.295 -10.367 1.00 0.00 H new ATOM 0 HG2 GLU A 105 123.475 3.722 -8.636 1.00 0.00 H new ATOM 0 HG3 GLU A 105 122.311 3.933 -9.930 1.00 0.00 H new ATOM 1617 N LYS A 106 125.582 5.939 -12.605 1.00 0.00 N ATOM 1618 CA LYS A 106 126.641 6.401 -13.503 1.00 0.00 C ATOM 1619 C LYS A 106 127.199 7.755 -13.055 1.00 0.00 C ATOM 1620 O LYS A 106 128.389 8.029 -13.215 1.00 0.00 O ATOM 1621 CB LYS A 106 126.097 6.517 -14.929 1.00 0.00 C ATOM 1622 CG LYS A 106 127.241 6.846 -15.892 1.00 0.00 C ATOM 1623 CD LYS A 106 126.682 7.043 -17.303 1.00 0.00 C ATOM 1624 CE LYS A 106 127.837 7.216 -18.290 1.00 0.00 C ATOM 1625 NZ LYS A 106 127.293 7.505 -19.646 1.00 0.00 N ATOM 0 H LYS A 106 124.683 5.775 -13.059 1.00 0.00 H new ATOM 0 HA LYS A 106 127.450 5.672 -13.474 1.00 0.00 H new ATOM 0 HB2 LYS A 106 125.618 5.583 -15.223 1.00 0.00 H new ATOM 0 HB3 LYS A 106 125.334 7.294 -14.976 1.00 0.00 H new ATOM 0 HG2 LYS A 106 127.757 7.749 -15.565 1.00 0.00 H new ATOM 0 HG3 LYS A 106 127.975 6.040 -15.890 1.00 0.00 H new ATOM 0 HD2 LYS A 106 126.072 6.185 -17.587 1.00 0.00 H new ATOM 0 HD3 LYS A 106 126.033 7.918 -17.330 1.00 0.00 H new ATOM 0 HE2 LYS A 106 128.487 8.029 -17.967 1.00 0.00 H new ATOM 0 HE3 LYS A 106 128.446 6.312 -18.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 128.079 7.623 -20.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 126.690 6.716 -19.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 126.730 8.379 -19.615 1.00 0.00 H new ATOM 1639 N ALA A 107 126.333 8.596 -12.495 1.00 0.00 N ATOM 1640 CA ALA A 107 126.741 9.909 -11.988 1.00 0.00 C ATOM 1641 C ALA A 107 127.551 9.827 -10.684 1.00 0.00 C ATOM 1642 O ALA A 107 127.926 10.858 -10.127 1.00 0.00 O ATOM 1643 CB ALA A 107 125.501 10.774 -11.754 1.00 0.00 C ATOM 0 H ALA A 107 125.340 8.393 -12.379 1.00 0.00 H new ATOM 0 HA ALA A 107 127.389 10.352 -12.744 1.00 0.00 H new ATOM 0 HB1 ALA A 107 125.805 11.751 -11.377 1.00 0.00 H new ATOM 0 HB2 ALA A 107 124.962 10.899 -12.693 1.00 0.00 H new ATOM 0 HB3 ALA A 107 124.852 10.289 -11.025 1.00 0.00 H new ATOM 1649 N GLY A 108 127.821 8.617 -10.195 1.00 0.00 N ATOM 1650 CA GLY A 108 128.629 8.440 -8.994 1.00 0.00 C ATOM 1651 C GLY A 108 127.853 8.691 -7.702 1.00 0.00 C ATOM 1652 O GLY A 108 128.454 9.007 -6.675 1.00 0.00 O ATOM 0 H GLY A 108 127.491 7.747 -10.613 1.00 0.00 H new ATOM 0 HA2 GLY A 108 129.028 7.426 -8.979 1.00 0.00 H new ATOM 0 HA3 GLY A 108 129.482 9.117 -9.035 1.00 0.00 H new ATOM 1656 N HIS A 109 126.527 8.556 -7.747 1.00 0.00 N ATOM 1657 CA HIS A 109 125.733 8.620 -6.524 1.00 0.00 C ATOM 1658 C HIS A 109 125.708 7.236 -5.865 1.00 0.00 C ATOM 1659 O HIS A 109 125.657 6.232 -6.578 1.00 0.00 O ATOM 1660 CB HIS A 109 124.308 9.073 -6.848 1.00 0.00 C ATOM 1661 CG HIS A 109 124.150 10.569 -6.875 1.00 0.00 C ATOM 1662 ND1 HIS A 109 124.331 11.353 -5.747 1.00 0.00 N ATOM 1663 CD2 HIS A 109 123.826 11.440 -7.888 1.00 0.00 C ATOM 1664 CE1 HIS A 109 124.118 12.631 -6.101 1.00 0.00 C ATOM 1665 NE2 HIS A 109 123.807 12.743 -7.396 1.00 0.00 N ATOM 0 H HIS A 109 125.990 8.405 -8.601 1.00 0.00 H new ATOM 0 HA HIS A 109 126.180 9.340 -5.838 1.00 0.00 H new ATOM 0 HB2 HIS A 109 124.016 8.666 -7.816 1.00 0.00 H new ATOM 0 HB3 HIS A 109 123.625 8.656 -6.108 1.00 0.00 H new ATOM 0 HD2 HIS A 109 123.618 11.157 -8.909 1.00 0.00 H new ATOM 0 HE1 HIS A 109 124.189 13.467 -5.421 1.00 0.00 H new ATOM 0 HE2 HIS A 109 123.600 13.598 -7.912 1.00 0.00 H new ATOM 1673 N PRO A 110 125.738 7.139 -4.549 1.00 0.00 N ATOM 1674 CA PRO A 110 125.774 5.807 -3.869 1.00 0.00 C ATOM 1675 C PRO A 110 124.420 5.091 -3.940 1.00 0.00 C ATOM 1676 O PRO A 110 123.393 5.759 -4.015 1.00 0.00 O ATOM 1677 CB PRO A 110 126.138 6.140 -2.421 1.00 0.00 C ATOM 1678 CG PRO A 110 125.638 7.527 -2.205 1.00 0.00 C ATOM 1679 CD PRO A 110 125.717 8.233 -3.558 1.00 0.00 C ATOM 0 HA PRO A 110 126.483 5.127 -4.341 1.00 0.00 H new ATOM 0 HB2 PRO A 110 125.673 5.440 -1.727 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.214 6.079 -2.261 1.00 0.00 H new ATOM 0 HG2 PRO A 110 124.614 7.516 -1.832 1.00 0.00 H new ATOM 0 HG3 PRO A 110 126.243 8.046 -1.461 1.00 0.00 H new ATOM 0 HD2 PRO A 110 124.862 8.891 -3.712 1.00 0.00 H new ATOM 0 HD3 PRO A 110 126.612 8.851 -3.631 1.00 0.00 H new ATOM 1687 N PRO A 111 124.381 3.773 -3.938 1.00 0.00 N ATOM 1688 CA PRO A 111 123.080 3.033 -3.993 1.00 0.00 C ATOM 1689 C PRO A 111 122.333 3.041 -2.658 1.00 0.00 C ATOM 1690 O PRO A 111 122.947 3.128 -1.595 1.00 0.00 O ATOM 1691 CB PRO A 111 123.477 1.611 -4.399 1.00 0.00 C ATOM 1692 CG PRO A 111 124.898 1.444 -3.975 1.00 0.00 C ATOM 1693 CD PRO A 111 125.524 2.837 -3.919 1.00 0.00 C ATOM 0 HA PRO A 111 122.386 3.499 -4.692 1.00 0.00 H new ATOM 0 HB2 PRO A 111 122.836 0.874 -3.915 1.00 0.00 H new ATOM 0 HB3 PRO A 111 123.371 1.468 -5.474 1.00 0.00 H new ATOM 0 HG2 PRO A 111 124.953 0.959 -3.001 1.00 0.00 H new ATOM 0 HG3 PRO A 111 125.437 0.809 -4.678 1.00 0.00 H new ATOM 0 HD2 PRO A 111 126.123 2.964 -3.017 1.00 0.00 H new ATOM 0 HD3 PRO A 111 126.186 3.006 -4.768 1.00 0.00 H new ATOM 1701 N ILE A 112 121.004 2.949 -2.722 1.00 0.00 N ATOM 1702 CA ILE A 112 120.177 2.951 -1.511 1.00 0.00 C ATOM 1703 C ILE A 112 120.484 1.753 -0.596 1.00 0.00 C ATOM 1704 O ILE A 112 120.100 1.776 0.571 1.00 0.00 O ATOM 1705 CB ILE A 112 118.677 2.980 -1.880 1.00 0.00 C ATOM 1706 CG1 ILE A 112 118.382 4.256 -2.676 1.00 0.00 C ATOM 1707 CG2 ILE A 112 117.804 2.984 -0.614 1.00 0.00 C ATOM 1708 CD1 ILE A 112 116.952 4.233 -3.226 1.00 0.00 C ATOM 0 H ILE A 112 120.478 2.873 -3.593 1.00 0.00 H new ATOM 0 HA ILE A 112 120.423 3.855 -0.953 1.00 0.00 H new ATOM 0 HB ILE A 112 118.448 2.093 -2.470 1.00 0.00 H new ATOM 0 HG12 ILE A 112 118.517 5.129 -2.037 1.00 0.00 H new ATOM 0 HG13 ILE A 112 119.092 4.350 -3.498 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.752 3.005 -0.898 1.00 0.00 H new ATOM 0 HG22 ILE A 112 118.005 2.086 -0.031 1.00 0.00 H new ATOM 0 HG23 ILE A 112 118.036 3.865 -0.015 1.00 0.00 H new ATOM 0 HD11 ILE A 112 116.763 5.148 -3.788 1.00 0.00 H new ATOM 0 HD12 ILE A 112 116.829 3.372 -3.883 1.00 0.00 H new ATOM 0 HD13 ILE A 112 116.245 4.163 -2.399 1.00 0.00 H new ATOM 1720 N THR A 113 121.210 0.745 -1.080 1.00 0.00 N ATOM 1721 CA THR A 113 121.377 -0.497 -0.324 1.00 0.00 C ATOM 1722 C THR A 113 121.739 -0.326 1.164 1.00 0.00 C ATOM 1723 O THR A 113 121.230 -1.125 1.952 1.00 0.00 O ATOM 1724 CB THR A 113 122.354 -1.464 -1.011 1.00 0.00 C ATOM 1725 OG1 THR A 113 122.601 -2.567 -0.151 1.00 0.00 O ATOM 1726 CG2 THR A 113 123.681 -0.784 -1.341 1.00 0.00 C ATOM 0 H THR A 113 121.687 0.762 -1.981 1.00 0.00 H new ATOM 0 HA THR A 113 120.378 -0.933 -0.327 1.00 0.00 H new ATOM 0 HB THR A 113 121.900 -1.796 -1.944 1.00 0.00 H new ATOM 0 HG1 THR A 113 123.223 -3.188 -0.585 1.00 0.00 H new ATOM 0 HG21 THR A 113 124.346 -1.499 -1.826 1.00 0.00 H new ATOM 0 HG22 THR A 113 123.502 0.057 -2.011 1.00 0.00 H new ATOM 0 HG23 THR A 113 124.144 -0.424 -0.422 1.00 0.00 H new ATOM 1734 N PRO A 114 122.522 0.651 1.612 1.00 0.00 N ATOM 1735 CA PRO A 114 122.870 0.739 3.073 1.00 0.00 C ATOM 1736 C PRO A 114 121.626 0.849 3.953 1.00 0.00 C ATOM 1737 O PRO A 114 121.600 0.337 5.072 1.00 0.00 O ATOM 1738 CB PRO A 114 123.747 1.989 3.198 1.00 0.00 C ATOM 1739 CG PRO A 114 124.256 2.239 1.823 1.00 0.00 C ATOM 1740 CD PRO A 114 123.138 1.786 0.890 1.00 0.00 C ATOM 0 HA PRO A 114 123.383 -0.161 3.413 1.00 0.00 H new ATOM 0 HB2 PRO A 114 123.173 2.839 3.567 1.00 0.00 H new ATOM 0 HB3 PRO A 114 124.566 1.828 3.899 1.00 0.00 H new ATOM 0 HG2 PRO A 114 124.488 3.294 1.675 1.00 0.00 H new ATOM 0 HG3 PRO A 114 125.174 1.682 1.636 1.00 0.00 H new ATOM 0 HD2 PRO A 114 122.418 2.584 0.709 1.00 0.00 H new ATOM 0 HD3 PRO A 114 123.526 1.480 -0.082 1.00 0.00 H new ATOM 1748 N ILE A 115 120.595 1.519 3.441 1.00 0.00 N ATOM 1749 CA ILE A 115 119.328 1.659 4.171 1.00 0.00 C ATOM 1750 C ILE A 115 118.255 0.660 3.715 1.00 0.00 C ATOM 1751 O ILE A 115 117.110 0.760 4.144 1.00 0.00 O ATOM 1752 CB ILE A 115 118.769 3.087 4.045 1.00 0.00 C ATOM 1753 CG1 ILE A 115 118.750 3.542 2.576 1.00 0.00 C ATOM 1754 CG2 ILE A 115 119.619 4.046 4.883 1.00 0.00 C ATOM 1755 CD1 ILE A 115 117.934 4.832 2.430 1.00 0.00 C ATOM 0 H ILE A 115 120.608 1.973 2.528 1.00 0.00 H new ATOM 0 HA ILE A 115 119.565 1.442 5.213 1.00 0.00 H new ATOM 0 HB ILE A 115 117.743 3.094 4.414 1.00 0.00 H new ATOM 0 HG12 ILE A 115 119.769 3.706 2.226 1.00 0.00 H new ATOM 0 HG13 ILE A 115 118.321 2.759 1.951 1.00 0.00 H new ATOM 0 HG21 ILE A 115 119.222 5.057 4.793 1.00 0.00 H new ATOM 0 HG22 ILE A 115 119.592 3.737 5.928 1.00 0.00 H new ATOM 0 HG23 ILE A 115 120.648 4.027 4.525 1.00 0.00 H new ATOM 0 HD11 ILE A 115 117.929 5.143 1.385 1.00 0.00 H new ATOM 0 HD12 ILE A 115 116.911 4.655 2.761 1.00 0.00 H new ATOM 0 HD13 ILE A 115 118.382 5.617 3.040 1.00 0.00 H new ATOM 1767 N ARG A 116 118.606 -0.298 2.861 1.00 0.00 N ATOM 1768 CA ARG A 116 117.643 -1.279 2.369 1.00 0.00 C ATOM 1769 C ARG A 116 117.370 -2.345 3.428 1.00 0.00 C ATOM 1770 O ARG A 116 118.278 -2.760 4.149 1.00 0.00 O ATOM 1771 CB ARG A 116 118.204 -1.934 1.105 1.00 0.00 C ATOM 1772 CG ARG A 116 117.175 -2.888 0.498 1.00 0.00 C ATOM 1773 CD ARG A 116 117.783 -3.557 -0.736 1.00 0.00 C ATOM 1774 NE ARG A 116 116.792 -4.402 -1.404 1.00 0.00 N ATOM 1775 CZ ARG A 116 116.825 -4.690 -2.714 1.00 0.00 C ATOM 1776 NH1 ARG A 116 117.755 -4.220 -3.511 1.00 0.00 N ATOM 1777 NH2 ARG A 116 115.902 -5.465 -3.214 1.00 0.00 N ATOM 0 H ARG A 116 119.551 -0.416 2.495 1.00 0.00 H new ATOM 0 HA ARG A 116 116.703 -0.775 2.142 1.00 0.00 H new ATOM 0 HB2 ARG A 116 118.471 -1.167 0.378 1.00 0.00 H new ATOM 0 HB3 ARG A 116 119.117 -2.478 1.345 1.00 0.00 H new ATOM 0 HG2 ARG A 116 116.883 -3.642 1.229 1.00 0.00 H new ATOM 0 HG3 ARG A 116 116.272 -2.343 0.224 1.00 0.00 H new ATOM 0 HD2 ARG A 116 118.146 -2.796 -1.427 1.00 0.00 H new ATOM 0 HD3 ARG A 116 118.644 -4.158 -0.444 1.00 0.00 H new ATOM 0 HE ARG A 116 116.035 -4.793 -0.843 1.00 0.00 H new ATOM 0 HH11 ARG A 116 118.486 -3.613 -3.140 1.00 0.00 H new ATOM 0 HH12 ARG A 116 117.747 -4.461 -4.502 1.00 0.00 H new ATOM 0 HH21 ARG A 116 115.171 -5.842 -2.611 1.00 0.00 H new ATOM 0 HH22 ARG A 116 115.912 -5.694 -4.208 1.00 0.00 H new ATOM 1791 N ALA A 117 116.119 -2.785 3.519 1.00 0.00 N ATOM 1792 CA ALA A 117 115.736 -3.772 4.521 1.00 0.00 C ATOM 1793 C ALA A 117 115.880 -5.193 3.987 1.00 0.00 C ATOM 1794 O ALA A 117 115.542 -5.479 2.838 1.00 0.00 O ATOM 1795 CB ALA A 117 114.282 -3.545 4.936 1.00 0.00 C ATOM 0 H ALA A 117 115.358 -2.476 2.915 1.00 0.00 H new ATOM 0 HA ALA A 117 116.400 -3.653 5.377 1.00 0.00 H new ATOM 0 HB1 ALA A 117 113.998 -4.284 5.685 1.00 0.00 H new ATOM 0 HB2 ALA A 117 114.175 -2.544 5.355 1.00 0.00 H new ATOM 0 HB3 ALA A 117 113.635 -3.645 4.064 1.00 0.00 H new ATOM 1801 N LYS A 118 116.377 -6.086 4.839 1.00 0.00 N ATOM 1802 CA LYS A 118 116.475 -7.501 4.493 1.00 0.00 C ATOM 1803 C LYS A 118 115.374 -8.294 5.199 1.00 0.00 C ATOM 1804 O LYS A 118 115.032 -8.007 6.345 1.00 0.00 O ATOM 1805 CB LYS A 118 117.871 -8.029 4.861 1.00 0.00 C ATOM 1806 CG LYS A 118 118.076 -8.044 6.380 1.00 0.00 C ATOM 1807 CD LYS A 118 119.516 -8.451 6.697 1.00 0.00 C ATOM 1808 CE LYS A 118 119.643 -8.767 8.189 1.00 0.00 C ATOM 1809 NZ LYS A 118 121.062 -9.087 8.510 1.00 0.00 N ATOM 0 H LYS A 118 116.718 -5.855 5.772 1.00 0.00 H new ATOM 0 HA LYS A 118 116.336 -7.624 3.419 1.00 0.00 H new ATOM 0 HB2 LYS A 118 117.998 -9.036 4.464 1.00 0.00 H new ATOM 0 HB3 LYS A 118 118.633 -7.405 4.395 1.00 0.00 H new ATOM 0 HG2 LYS A 118 117.866 -7.059 6.796 1.00 0.00 H new ATOM 0 HG3 LYS A 118 117.379 -8.741 6.845 1.00 0.00 H new ATOM 0 HD2 LYS A 118 119.797 -9.322 6.105 1.00 0.00 H new ATOM 0 HD3 LYS A 118 120.200 -7.647 6.426 1.00 0.00 H new ATOM 0 HE2 LYS A 118 119.308 -7.916 8.782 1.00 0.00 H new ATOM 0 HE3 LYS A 118 119.001 -9.609 8.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 121.149 -9.302 9.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 121.366 -9.912 7.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 121.663 -8.271 8.276 1.00 0.00 H new ATOM 1823 N GLY A 119 114.823 -9.288 4.509 1.00 0.00 N ATOM 1824 CA GLY A 119 113.746 -10.090 5.077 1.00 0.00 C ATOM 1825 C GLY A 119 114.267 -11.412 5.630 1.00 0.00 C ATOM 1826 O GLY A 119 115.268 -11.943 5.148 1.00 0.00 O ATOM 0 H GLY A 119 115.101 -9.555 3.565 1.00 0.00 H new ATOM 0 HA2 GLY A 119 113.254 -9.530 5.872 1.00 0.00 H new ATOM 0 HA3 GLY A 119 112.994 -10.285 4.313 1.00 0.00 H new ATOM 1830 N SER A 120 113.584 -11.940 6.641 1.00 0.00 N ATOM 1831 CA SER A 120 113.998 -13.199 7.250 1.00 0.00 C ATOM 1832 C SER A 120 114.044 -14.310 6.206 1.00 0.00 C ATOM 1833 O SER A 120 114.958 -15.135 6.203 1.00 0.00 O ATOM 1834 CB SER A 120 113.022 -13.584 8.363 1.00 0.00 C ATOM 1835 OG SER A 120 113.532 -14.713 9.061 1.00 0.00 O ATOM 0 H SER A 120 112.750 -11.521 7.052 1.00 0.00 H new ATOM 0 HA SER A 120 114.996 -13.068 7.669 1.00 0.00 H new ATOM 0 HB2 SER A 120 112.886 -12.748 9.049 1.00 0.00 H new ATOM 0 HB3 SER A 120 112.043 -13.813 7.942 1.00 0.00 H new ATOM 0 HG SER A 120 112.911 -14.963 9.777 1.00 0.00 H new ATOM 1841 N GLY A 121 113.053 -14.328 5.319 1.00 0.00 N ATOM 1842 CA GLY A 121 113.008 -15.320 4.251 1.00 0.00 C ATOM 1843 C GLY A 121 113.400 -14.693 2.917 1.00 0.00 C ATOM 1844 O GLY A 121 113.554 -13.476 2.815 1.00 0.00 O ATOM 0 H GLY A 121 112.274 -13.670 5.319 1.00 0.00 H new ATOM 0 HA2 GLY A 121 113.683 -16.143 4.484 1.00 0.00 H new ATOM 0 HA3 GLY A 121 112.005 -15.740 4.180 1.00 0.00 H new ATOM 1848 N GLY A 122 113.562 -15.529 1.897 1.00 0.00 N ATOM 1849 CA GLY A 122 113.912 -15.037 0.571 1.00 0.00 C ATOM 1850 C GLY A 122 115.249 -14.303 0.597 1.00 0.00 C ATOM 1851 O GLY A 122 116.276 -14.874 0.959 1.00 0.00 O ATOM 0 H GLY A 122 113.458 -16.542 1.962 1.00 0.00 H new ATOM 0 HA2 GLY A 122 113.964 -15.871 -0.128 1.00 0.00 H new ATOM 0 HA3 GLY A 122 113.132 -14.367 0.210 1.00 0.00 H new ATOM 1855 N GLY A 123 115.223 -13.031 0.210 1.00 0.00 N ATOM 1856 CA GLY A 123 116.439 -12.225 0.174 1.00 0.00 C ATOM 1857 C GLY A 123 116.174 -10.813 0.683 1.00 0.00 C ATOM 1858 O GLY A 123 115.766 -10.615 1.827 1.00 0.00 O ATOM 0 H GLY A 123 114.379 -12.539 -0.081 1.00 0.00 H new ATOM 0 HA2 GLY A 123 117.210 -12.696 0.783 1.00 0.00 H new ATOM 0 HA3 GLY A 123 116.821 -12.182 -0.846 1.00 0.00 H new ATOM 1862 N TYR A 124 116.415 -9.825 -0.173 1.00 0.00 N ATOM 1863 CA TYR A 124 116.209 -8.429 0.200 1.00 0.00 C ATOM 1864 C TYR A 124 114.921 -7.896 -0.419 1.00 0.00 C ATOM 1865 O TYR A 124 114.477 -8.373 -1.464 1.00 0.00 O ATOM 1866 CB TYR A 124 117.400 -7.590 -0.258 1.00 0.00 C ATOM 1867 CG TYR A 124 118.603 -7.728 0.644 1.00 0.00 C ATOM 1868 CD1 TYR A 124 119.065 -9.000 1.002 1.00 0.00 C ATOM 1869 CD2 TYR A 124 119.260 -6.586 1.117 1.00 0.00 C ATOM 1870 CE1 TYR A 124 120.183 -9.131 1.833 1.00 0.00 C ATOM 1871 CE2 TYR A 124 120.378 -6.717 1.950 1.00 0.00 C ATOM 1872 CZ TYR A 124 120.840 -7.989 2.307 1.00 0.00 C ATOM 1873 OH TYR A 124 121.942 -8.118 3.127 1.00 0.00 O ATOM 0 H TYR A 124 116.752 -9.964 -1.126 1.00 0.00 H new ATOM 0 HA TYR A 124 116.123 -8.364 1.285 1.00 0.00 H new ATOM 0 HB2 TYR A 124 117.677 -7.885 -1.270 1.00 0.00 H new ATOM 0 HB3 TYR A 124 117.104 -6.542 -0.301 1.00 0.00 H new ATOM 0 HD1 TYR A 124 118.558 -9.881 0.637 1.00 0.00 H new ATOM 0 HD2 TYR A 124 118.905 -5.604 0.840 1.00 0.00 H new ATOM 0 HE1 TYR A 124 120.539 -10.113 2.109 1.00 0.00 H new ATOM 0 HE2 TYR A 124 120.884 -5.836 2.317 1.00 0.00 H new ATOM 0 HH TYR A 124 122.279 -7.229 3.365 1.00 0.00 H new ATOM 1883 N ILE A 125 114.327 -6.904 0.235 1.00 0.00 N ATOM 1884 CA ILE A 125 113.030 -6.387 -0.185 1.00 0.00 C ATOM 1885 C ILE A 125 113.198 -5.445 -1.377 1.00 0.00 C ATOM 1886 O ILE A 125 113.989 -4.503 -1.336 1.00 0.00 O ATOM 1887 CB ILE A 125 112.367 -5.681 1.007 1.00 0.00 C ATOM 1888 CG1 ILE A 125 112.158 -6.694 2.141 1.00 0.00 C ATOM 1889 CG2 ILE A 125 111.004 -5.109 0.605 1.00 0.00 C ATOM 1890 CD1 ILE A 125 111.903 -5.965 3.462 1.00 0.00 C ATOM 0 H ILE A 125 114.721 -6.443 1.055 1.00 0.00 H new ATOM 0 HA ILE A 125 112.386 -7.205 -0.507 1.00 0.00 H new ATOM 0 HB ILE A 125 113.015 -4.868 1.334 1.00 0.00 H new ATOM 0 HG12 ILE A 125 111.314 -7.343 1.907 1.00 0.00 H new ATOM 0 HG13 ILE A 125 113.036 -7.333 2.234 1.00 0.00 H new ATOM 0 HG21 ILE A 125 110.550 -4.613 1.463 1.00 0.00 H new ATOM 0 HG22 ILE A 125 111.135 -4.389 -0.203 1.00 0.00 H new ATOM 0 HG23 ILE A 125 110.355 -5.918 0.268 1.00 0.00 H new ATOM 0 HD11 ILE A 125 111.756 -6.695 4.258 1.00 0.00 H new ATOM 0 HD12 ILE A 125 112.760 -5.335 3.701 1.00 0.00 H new ATOM 0 HD13 ILE A 125 111.011 -5.345 3.369 1.00 0.00 H new ATOM 1902 N SER A 126 112.432 -5.708 -2.432 1.00 0.00 N ATOM 1903 CA SER A 126 112.572 -4.978 -3.689 1.00 0.00 C ATOM 1904 C SER A 126 112.282 -3.491 -3.526 1.00 0.00 C ATOM 1905 O SER A 126 111.367 -3.092 -2.806 1.00 0.00 O ATOM 1906 CB SER A 126 111.617 -5.565 -4.729 1.00 0.00 C ATOM 1907 OG SER A 126 111.921 -6.940 -4.918 1.00 0.00 O ATOM 0 H SER A 126 111.705 -6.424 -2.441 1.00 0.00 H new ATOM 0 HA SER A 126 113.607 -5.083 -4.016 1.00 0.00 H new ATOM 0 HB2 SER A 126 110.585 -5.450 -4.398 1.00 0.00 H new ATOM 0 HB3 SER A 126 111.711 -5.026 -5.672 1.00 0.00 H new ATOM 0 HG SER A 126 111.310 -7.322 -5.583 1.00 0.00 H new ATOM 1913 N LEU A 127 113.082 -2.683 -4.214 1.00 0.00 N ATOM 1914 CA LEU A 127 112.828 -1.243 -4.308 1.00 0.00 C ATOM 1915 C LEU A 127 112.033 -0.873 -5.573 1.00 0.00 C ATOM 1916 O LEU A 127 111.854 0.308 -5.865 1.00 0.00 O ATOM 1917 CB LEU A 127 114.158 -0.479 -4.328 1.00 0.00 C ATOM 1918 CG LEU A 127 115.015 -0.847 -3.112 1.00 0.00 C ATOM 1919 CD1 LEU A 127 116.355 -0.114 -3.194 1.00 0.00 C ATOM 1920 CD2 LEU A 127 114.296 -0.432 -1.827 1.00 0.00 C ATOM 0 H LEU A 127 113.913 -2.997 -4.716 1.00 0.00 H new ATOM 0 HA LEU A 127 112.235 -0.967 -3.436 1.00 0.00 H new ATOM 0 HB2 LEU A 127 114.701 -0.709 -5.245 1.00 0.00 H new ATOM 0 HB3 LEU A 127 113.966 0.594 -4.332 1.00 0.00 H new ATOM 0 HG LEU A 127 115.182 -1.924 -3.104 1.00 0.00 H new ATOM 0 HD11 LEU A 127 116.966 -0.375 -2.330 1.00 0.00 H new ATOM 0 HD12 LEU A 127 116.874 -0.406 -4.107 1.00 0.00 H new ATOM 0 HD13 LEU A 127 116.181 0.962 -3.204 1.00 0.00 H new ATOM 0 HD21 LEU A 127 114.909 -0.696 -0.965 1.00 0.00 H new ATOM 0 HD22 LEU A 127 114.127 0.645 -1.836 1.00 0.00 H new ATOM 0 HD23 LEU A 127 113.339 -0.949 -1.763 1.00 0.00 H new ATOM 1932 N GLY A 128 111.558 -1.865 -6.329 1.00 0.00 N ATOM 1933 CA GLY A 128 110.904 -1.607 -7.610 1.00 0.00 C ATOM 1934 C GLY A 128 109.829 -0.525 -7.514 1.00 0.00 C ATOM 1935 O GLY A 128 109.774 0.370 -8.357 1.00 0.00 O ATOM 0 H GLY A 128 111.615 -2.851 -6.076 1.00 0.00 H new ATOM 0 HA2 GLY A 128 111.653 -1.305 -8.342 1.00 0.00 H new ATOM 0 HA3 GLY A 128 110.454 -2.530 -7.976 1.00 0.00 H new ATOM 1939 N ALA A 129 108.992 -0.591 -6.483 1.00 0.00 N ATOM 1940 CA ALA A 129 107.890 0.359 -6.355 1.00 0.00 C ATOM 1941 C ALA A 129 108.415 1.790 -6.291 1.00 0.00 C ATOM 1942 O ALA A 129 107.941 2.672 -7.009 1.00 0.00 O ATOM 1943 CB ALA A 129 107.081 0.052 -5.092 1.00 0.00 C ATOM 0 H ALA A 129 109.053 -1.281 -5.734 1.00 0.00 H new ATOM 0 HA ALA A 129 107.249 0.261 -7.231 1.00 0.00 H new ATOM 0 HB1 ALA A 129 106.261 0.764 -5.003 1.00 0.00 H new ATOM 0 HB2 ALA A 129 106.678 -0.959 -5.155 1.00 0.00 H new ATOM 0 HB3 ALA A 129 107.727 0.132 -4.218 1.00 0.00 H new ATOM 1949 N LEU A 130 109.420 2.009 -5.452 1.00 0.00 N ATOM 1950 CA LEU A 130 109.981 3.343 -5.286 1.00 0.00 C ATOM 1951 C LEU A 130 110.520 3.864 -6.615 1.00 0.00 C ATOM 1952 O LEU A 130 110.306 5.022 -6.976 1.00 0.00 O ATOM 1953 CB LEU A 130 111.104 3.296 -4.248 1.00 0.00 C ATOM 1954 CG LEU A 130 111.623 4.709 -3.979 1.00 0.00 C ATOM 1955 CD1 LEU A 130 110.551 5.518 -3.247 1.00 0.00 C ATOM 1956 CD2 LEU A 130 112.879 4.625 -3.108 1.00 0.00 C ATOM 0 H LEU A 130 109.860 1.287 -4.881 1.00 0.00 H new ATOM 0 HA LEU A 130 109.197 4.019 -4.944 1.00 0.00 H new ATOM 0 HB2 LEU A 130 110.737 2.851 -3.323 1.00 0.00 H new ATOM 0 HB3 LEU A 130 111.916 2.663 -4.606 1.00 0.00 H new ATOM 0 HG LEU A 130 111.861 5.197 -4.924 1.00 0.00 H new ATOM 0 HD11 LEU A 130 110.922 6.525 -3.056 1.00 0.00 H new ATOM 0 HD12 LEU A 130 109.653 5.573 -3.863 1.00 0.00 H new ATOM 0 HD13 LEU A 130 110.313 5.033 -2.300 1.00 0.00 H new ATOM 0 HD21 LEU A 130 113.254 5.630 -2.913 1.00 0.00 H new ATOM 0 HD22 LEU A 130 112.635 4.139 -2.164 1.00 0.00 H new ATOM 0 HD23 LEU A 130 113.644 4.047 -3.627 1.00 0.00 H new ATOM 1968 N LEU A 131 111.196 2.993 -7.356 1.00 0.00 N ATOM 1969 CA LEU A 131 111.776 3.387 -8.635 1.00 0.00 C ATOM 1970 C LEU A 131 110.688 3.866 -9.588 1.00 0.00 C ATOM 1971 O LEU A 131 110.841 4.892 -10.247 1.00 0.00 O ATOM 1972 CB LEU A 131 112.527 2.202 -9.250 1.00 0.00 C ATOM 1973 CG LEU A 131 113.222 2.630 -10.545 1.00 0.00 C ATOM 1974 CD1 LEU A 131 114.398 3.553 -10.217 1.00 0.00 C ATOM 1975 CD2 LEU A 131 113.742 1.390 -11.276 1.00 0.00 C ATOM 0 H LEU A 131 111.355 2.019 -7.097 1.00 0.00 H new ATOM 0 HA LEU A 131 112.474 4.207 -8.466 1.00 0.00 H new ATOM 0 HB2 LEU A 131 113.264 1.822 -8.542 1.00 0.00 H new ATOM 0 HB3 LEU A 131 111.832 1.388 -9.454 1.00 0.00 H new ATOM 0 HG LEU A 131 112.511 3.159 -11.179 1.00 0.00 H new ATOM 0 HD11 LEU A 131 114.891 3.856 -11.141 1.00 0.00 H new ATOM 0 HD12 LEU A 131 114.032 4.437 -9.694 1.00 0.00 H new ATOM 0 HD13 LEU A 131 115.109 3.024 -9.583 1.00 0.00 H new ATOM 0 HD21 LEU A 131 114.237 1.693 -12.199 1.00 0.00 H new ATOM 0 HD22 LEU A 131 114.452 0.863 -10.639 1.00 0.00 H new ATOM 0 HD23 LEU A 131 112.907 0.730 -11.512 1.00 0.00 H new ATOM 1987 N SER A 132 109.578 3.138 -9.636 1.00 0.00 N ATOM 1988 CA SER A 132 108.502 3.477 -10.558 1.00 0.00 C ATOM 1989 C SER A 132 107.987 4.886 -10.288 1.00 0.00 C ATOM 1990 O SER A 132 107.785 5.670 -11.216 1.00 0.00 O ATOM 1991 CB SER A 132 107.354 2.477 -10.415 1.00 0.00 C ATOM 1992 OG SER A 132 107.859 1.159 -10.593 1.00 0.00 O ATOM 0 H SER A 132 109.401 2.319 -9.055 1.00 0.00 H new ATOM 0 HA SER A 132 108.896 3.435 -11.574 1.00 0.00 H new ATOM 0 HB2 SER A 132 106.892 2.573 -9.432 1.00 0.00 H new ATOM 0 HB3 SER A 132 106.580 2.686 -11.153 1.00 0.00 H new ATOM 0 HG SER A 132 108.340 0.881 -9.786 1.00 0.00 H new ATOM 1998 N THR A 133 107.814 5.216 -9.013 1.00 0.00 N ATOM 1999 CA THR A 133 107.284 6.527 -8.650 1.00 0.00 C ATOM 2000 C THR A 133 108.201 7.635 -9.158 1.00 0.00 C ATOM 2001 O THR A 133 107.748 8.590 -9.796 1.00 0.00 O ATOM 2002 CB THR A 133 107.143 6.631 -7.129 1.00 0.00 C ATOM 2003 OG1 THR A 133 106.370 5.538 -6.653 1.00 0.00 O ATOM 2004 CG2 THR A 133 106.449 7.945 -6.765 1.00 0.00 C ATOM 0 H THR A 133 108.029 4.606 -8.224 1.00 0.00 H new ATOM 0 HA THR A 133 106.304 6.643 -9.113 1.00 0.00 H new ATOM 0 HB THR A 133 108.131 6.607 -6.670 1.00 0.00 H new ATOM 0 HG1 THR A 133 106.279 5.601 -5.679 1.00 0.00 H new ATOM 0 HG21 THR A 133 106.350 8.016 -5.682 1.00 0.00 H new ATOM 0 HG22 THR A 133 107.042 8.783 -7.131 1.00 0.00 H new ATOM 0 HG23 THR A 133 105.460 7.973 -7.222 1.00 0.00 H new ATOM 2012 N THR A 134 109.497 7.487 -8.906 1.00 0.00 N ATOM 2013 CA THR A 134 110.452 8.517 -9.302 1.00 0.00 C ATOM 2014 C THR A 134 110.469 8.685 -10.819 1.00 0.00 C ATOM 2015 O THR A 134 110.528 9.805 -11.325 1.00 0.00 O ATOM 2016 CB THR A 134 111.852 8.172 -8.796 1.00 0.00 C ATOM 2017 OG1 THR A 134 111.779 7.844 -7.415 1.00 0.00 O ATOM 2018 CG2 THR A 134 112.771 9.381 -8.982 1.00 0.00 C ATOM 0 H THR A 134 109.906 6.679 -8.437 1.00 0.00 H new ATOM 0 HA THR A 134 110.139 9.460 -8.853 1.00 0.00 H new ATOM 0 HB THR A 134 112.248 7.325 -9.356 1.00 0.00 H new ATOM 0 HG1 THR A 134 111.043 8.341 -6.999 1.00 0.00 H new ATOM 0 HG21 THR A 134 113.770 9.137 -8.622 1.00 0.00 H new ATOM 0 HG22 THR A 134 112.820 9.642 -10.039 1.00 0.00 H new ATOM 0 HG23 THR A 134 112.378 10.227 -8.418 1.00 0.00 H new ATOM 2026 N LEU A 135 110.397 7.574 -11.547 1.00 0.00 N ATOM 2027 CA LEU A 135 110.405 7.626 -13.005 1.00 0.00 C ATOM 2028 C LEU A 135 109.215 8.422 -13.529 1.00 0.00 C ATOM 2029 O LEU A 135 109.341 9.172 -14.498 1.00 0.00 O ATOM 2030 CB LEU A 135 110.370 6.210 -13.583 1.00 0.00 C ATOM 2031 CG LEU A 135 111.671 5.481 -13.241 1.00 0.00 C ATOM 2032 CD1 LEU A 135 111.535 3.999 -13.596 1.00 0.00 C ATOM 2033 CD2 LEU A 135 112.821 6.088 -14.047 1.00 0.00 C ATOM 0 H LEU A 135 110.333 6.635 -11.155 1.00 0.00 H new ATOM 0 HA LEU A 135 111.322 8.124 -13.320 1.00 0.00 H new ATOM 0 HB2 LEU A 135 109.518 5.663 -13.179 1.00 0.00 H new ATOM 0 HB3 LEU A 135 110.238 6.251 -14.664 1.00 0.00 H new ATOM 0 HG LEU A 135 111.874 5.585 -12.175 1.00 0.00 H new ATOM 0 HD11 LEU A 135 112.462 3.480 -13.352 1.00 0.00 H new ATOM 0 HD12 LEU A 135 110.714 3.562 -13.027 1.00 0.00 H new ATOM 0 HD13 LEU A 135 111.332 3.897 -14.662 1.00 0.00 H new ATOM 0 HD21 LEU A 135 113.749 5.570 -13.804 1.00 0.00 H new ATOM 0 HD22 LEU A 135 112.614 5.983 -15.112 1.00 0.00 H new ATOM 0 HD23 LEU A 135 112.921 7.145 -13.800 1.00 0.00 H new ATOM 2045 N ASN A 136 108.059 8.257 -12.892 1.00 0.00 N ATOM 2046 CA ASN A 136 106.866 8.986 -13.304 1.00 0.00 C ATOM 2047 C ASN A 136 107.112 10.490 -13.228 1.00 0.00 C ATOM 2048 O ASN A 136 106.726 11.239 -14.124 1.00 0.00 O ATOM 2049 CB ASN A 136 105.686 8.613 -12.403 1.00 0.00 C ATOM 2050 CG ASN A 136 105.344 7.135 -12.566 1.00 0.00 C ATOM 2051 OD1 ASN A 136 105.659 6.528 -13.591 1.00 0.00 O ATOM 2052 ND2 ASN A 136 104.713 6.513 -11.607 1.00 0.00 N ATOM 0 H ASN A 136 107.924 7.632 -12.097 1.00 0.00 H new ATOM 0 HA ASN A 136 106.632 8.716 -14.334 1.00 0.00 H new ATOM 0 HB2 ASN A 136 105.933 8.824 -11.362 1.00 0.00 H new ATOM 0 HB3 ASN A 136 104.819 9.224 -12.655 1.00 0.00 H new ATOM 0 HD21 ASN A 136 104.481 5.525 -11.706 1.00 0.00 H new ATOM 0 HD22 ASN A 136 104.452 7.015 -10.758 1.00 0.00 H new ATOM 2059 N LEU A 137 107.758 10.920 -12.149 1.00 0.00 N ATOM 2060 CA LEU A 137 108.105 12.330 -11.991 1.00 0.00 C ATOM 2061 C LEU A 137 109.085 12.781 -13.072 1.00 0.00 C ATOM 2062 O LEU A 137 108.991 13.900 -13.576 1.00 0.00 O ATOM 2063 CB LEU A 137 108.716 12.570 -10.609 1.00 0.00 C ATOM 2064 CG LEU A 137 107.719 12.161 -9.521 1.00 0.00 C ATOM 2065 CD1 LEU A 137 108.385 12.283 -8.149 1.00 0.00 C ATOM 2066 CD2 LEU A 137 106.499 13.084 -9.569 1.00 0.00 C ATOM 0 H LEU A 137 108.050 10.320 -11.377 1.00 0.00 H new ATOM 0 HA LEU A 137 107.190 12.914 -12.090 1.00 0.00 H new ATOM 0 HB2 LEU A 137 109.637 11.997 -10.504 1.00 0.00 H new ATOM 0 HB3 LEU A 137 108.980 13.621 -10.496 1.00 0.00 H new ATOM 0 HG LEU A 137 107.405 11.131 -9.689 1.00 0.00 H new ATOM 0 HD11 LEU A 137 107.676 11.992 -7.373 1.00 0.00 H new ATOM 0 HD12 LEU A 137 109.256 11.629 -8.108 1.00 0.00 H new ATOM 0 HD13 LEU A 137 108.697 13.315 -7.987 1.00 0.00 H new ATOM 0 HD21 LEU A 137 105.791 12.791 -8.794 1.00 0.00 H new ATOM 0 HD22 LEU A 137 106.815 14.114 -9.402 1.00 0.00 H new ATOM 0 HD23 LEU A 137 106.021 13.005 -10.546 1.00 0.00 H new ATOM 2078 N CYS A 138 110.022 11.908 -13.426 1.00 0.00 N ATOM 2079 CA CYS A 138 110.978 12.212 -14.490 1.00 0.00 C ATOM 2080 C CYS A 138 110.275 12.478 -15.828 1.00 0.00 C ATOM 2081 O CYS A 138 110.818 13.177 -16.683 1.00 0.00 O ATOM 2082 CB CYS A 138 111.958 11.046 -14.656 1.00 0.00 C ATOM 2083 SG CYS A 138 113.344 11.206 -13.499 1.00 0.00 S ATOM 0 H CYS A 138 110.142 10.990 -12.997 1.00 0.00 H new ATOM 0 HA CYS A 138 111.515 13.116 -14.203 1.00 0.00 H new ATOM 0 HB2 CYS A 138 111.441 10.102 -14.484 1.00 0.00 H new ATOM 0 HB3 CYS A 138 112.333 11.022 -15.679 1.00 0.00 H new ATOM 2088 N GLY A 139 109.074 11.928 -16.014 1.00 0.00 N ATOM 2089 CA GLY A 139 108.331 12.131 -17.257 1.00 0.00 C ATOM 2090 C GLY A 139 108.423 10.933 -18.210 1.00 0.00 C ATOM 2091 O GLY A 139 107.605 10.808 -19.121 1.00 0.00 O ATOM 0 H GLY A 139 108.599 11.344 -15.326 1.00 0.00 H new ATOM 0 HA2 GLY A 139 107.284 12.322 -17.021 1.00 0.00 H new ATOM 0 HA3 GLY A 139 108.711 13.020 -17.761 1.00 0.00 H new ATOM 2095 N LYS A 140 109.407 10.056 -18.009 1.00 0.00 N ATOM 2096 CA LYS A 140 109.573 8.894 -18.875 1.00 0.00 C ATOM 2097 C LYS A 140 108.909 7.666 -18.260 1.00 0.00 C ATOM 2098 O LYS A 140 108.897 7.501 -17.039 1.00 0.00 O ATOM 2099 CB LYS A 140 111.061 8.618 -19.093 1.00 0.00 C ATOM 2100 CG LYS A 140 111.694 9.799 -19.831 1.00 0.00 C ATOM 2101 CD LYS A 140 113.158 9.484 -20.146 1.00 0.00 C ATOM 2102 CE LYS A 140 113.822 10.714 -20.769 1.00 0.00 C ATOM 2103 NZ LYS A 140 113.718 11.864 -19.828 1.00 0.00 N ATOM 0 H LYS A 140 110.095 10.129 -17.260 1.00 0.00 H new ATOM 0 HA LYS A 140 109.098 9.106 -19.833 1.00 0.00 H new ATOM 0 HB2 LYS A 140 111.558 8.465 -18.135 1.00 0.00 H new ATOM 0 HB3 LYS A 140 111.192 7.702 -19.670 1.00 0.00 H new ATOM 0 HG2 LYS A 140 111.148 9.999 -20.753 1.00 0.00 H new ATOM 0 HG3 LYS A 140 111.629 10.699 -19.220 1.00 0.00 H new ATOM 0 HD2 LYS A 140 113.683 9.196 -19.235 1.00 0.00 H new ATOM 0 HD3 LYS A 140 113.220 8.638 -20.831 1.00 0.00 H new ATOM 0 HE2 LYS A 140 114.869 10.503 -20.989 1.00 0.00 H new ATOM 0 HE3 LYS A 140 113.341 10.960 -21.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 114.310 12.647 -20.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 112.728 12.178 -19.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 114.043 11.571 -18.885 1.00 0.00 H new ATOM 2117 N GLY A 141 108.358 6.809 -19.112 1.00 0.00 N ATOM 2118 CA GLY A 141 107.694 5.598 -18.641 1.00 0.00 C ATOM 2119 C GLY A 141 108.614 4.389 -18.763 1.00 0.00 C ATOM 2120 O GLY A 141 108.920 3.796 -17.743 1.00 0.00 O ATOM 2121 OXT GLY A 141 109.000 4.074 -19.878 1.00 0.00 O ATOM 0 H GLY A 141 108.357 6.928 -20.125 1.00 0.00 H new ATOM 0 HA2 GLY A 141 107.391 5.726 -17.602 1.00 0.00 H new ATOM 0 HA3 GLY A 141 106.786 5.428 -19.219 1.00 0.00 H new TER 2125 GLY A 141