USER MOD reduce.3.24.130724 H: found=0, std=0, add=1494, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1496 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: B 85 MET CE :methyl 173:sc= 0 (180deg=-0.0278) USER MOD Set 1.2: B 86 CYS SG : rot -9:sc= 0.276 USER MOD Set 2.1: B 80 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B 84 MET CE :methyl -154:sc= -0.639 (180deg=-2.25!) USER MOD Set 3.1: A 76 CYS SG : rot -67:sc= -1.62! USER MOD Set 3.2: B 76 CYS SG : rot -56:sc= -1.69! USER MOD Set 4.1: B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 85 MET CE :methyl 179:sc= 0 (180deg=-0.00172) USER MOD Set 5.2: A 86 CYS SG : rot -15:sc= 0.283 USER MOD Set 6.1: A 80 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 84 MET CE :methyl -155:sc= -0.645 (180deg=-2.08!) USER MOD Set 7.1: A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 CYS SG : rot 180:sc= -0.3 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -158:sc= -0.172 (180deg=-1.4!) USER MOD Single : A 14 SER OG : rot 73:sc= 1.24 USER MOD Single : A 15 THR OG1 : rot -114:sc= 1.24 USER MOD Single : A 17 HIS : no HD1:sc=-0.00663 X(o=-0.0066,f=-0.11) USER MOD Single : A 18 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.12) USER MOD Single : A 19 TYR OH : rot -15:sc= -0.929 USER MOD Single : A 20 SER OG : rot -33:sc= 1.01 USER MOD Single : A 22 LYS NZ :NH3+ 141:sc= -0.255 (180deg=-1.47!) USER MOD Single : A 26 LYS NZ :NH3+ -166:sc=-0.00308 (180deg=-0.165) USER MOD Single : A 28 LYS NZ :NH3+ -138:sc= -0.19 (180deg=-0.975) USER MOD Single : A 30 ASN : amide:sc= -0.0508 X(o=-0.051,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 165:sc= 0.695 (180deg=0.522) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 78:sc= 0.762 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -159:sc= -0.0167 (180deg=-0.213) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -0.253 X(o=-0.25,f=-0.68) USER MOD Single : A 57 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.028) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -3.02! C(o=-3!,f=-3.6!) USER MOD Single : A 64 SER OG : rot 122:sc= 0.498 USER MOD Single : A 65 ASN : amide:sc= -0.0275 K(o=-0.028,f=-1.6!) USER MOD Single : A 68 ASN : amide:sc= -0.0317 K(o=-0.032,f=-1.8!) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 75 TYR OH : rot 91:sc= 0.147 USER MOD Single : A 81 CYS SG : rot -46:sc= -0.858 USER MOD Single : A 87 ASN : amide:sc= -0.615! C(o=-0.62!,f=-12!) USER MOD Single : A 96 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.563) USER MOD Single : B 3 CYS SG : rot 180:sc= -0.301 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl -161:sc= -0.185 (180deg=-1.44!) USER MOD Single : B 14 SER OG : rot 81:sc= 1.3 USER MOD Single : B 15 THR OG1 : rot -106:sc= 1.18 USER MOD Single : B 17 HIS : no HD1:sc=-0.00638 X(o=-0.0064,f=-0.1) USER MOD Single : B 18 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.157) USER MOD Single : B 19 TYR OH : rot -15:sc= -0.925 USER MOD Single : B 20 SER OG : rot -36:sc= 1.06 USER MOD Single : B 22 LYS NZ :NH3+ 145:sc= -0.252 (180deg=-1.51!) USER MOD Single : B 26 LYS NZ :NH3+ -167:sc=-0.00128 (180deg=-0.167) USER MOD Single : B 28 LYS NZ :NH3+ -137:sc= -0.206 (180deg=-0.885) USER MOD Single : B 30 ASN : amide:sc= -0.0639 X(o=-0.064,f=0) USER MOD Single : B 31 LYS NZ :NH3+ 165:sc= 0.723 (180deg=0.547) USER MOD Single : B 32 SER OG : rot 180:sc=-0.00268 USER MOD Single : B 39 THR OG1 : rot 78:sc= 0.782 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ -160:sc= -0.0163 (180deg=-0.211) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 GLN : amide:sc= -0.246 X(o=-0.25,f=-0.65) USER MOD Single : B 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 ASN : amide:sc= -2.92 K(o=-2.9,f=-3.5!) USER MOD Single : B 64 SER OG : rot 123:sc= 0.324 USER MOD Single : B 65 ASN : amide:sc= -0.0274 K(o=-0.027,f=-1.8!) USER MOD Single : B 68 ASN : amide:sc= -0.0202 K(o=-0.02,f=-1.8!) USER MOD Single : B 73 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : B 75 TYR OH : rot 91:sc= 0.271 USER MOD Single : B 81 CYS SG : rot -53:sc= -0.916! USER MOD Single : B 87 ASN : amide:sc= -0.635! C(o=-0.64!,f=-12!) USER MOD Single : B 96 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.76) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 76.096 2.266 -19.512 1.00 0.00 N ATOM 21 CA ALA A 2 75.782 3.557 -18.838 1.00 0.00 C ATOM 22 C ALA A 2 75.706 3.325 -17.327 1.00 0.00 C ATOM 23 O ALA A 2 75.100 4.090 -16.603 1.00 0.00 O ATOM 24 CB ALA A 2 74.440 4.097 -19.357 1.00 0.00 C ATOM 0 HA ALA A 2 76.562 4.287 -19.054 1.00 0.00 H new ATOM 0 HB1 ALA A 2 74.212 5.041 -18.863 1.00 0.00 H new ATOM 0 HB2 ALA A 2 74.504 4.257 -20.433 1.00 0.00 H new ATOM 0 HB3 ALA A 2 73.651 3.376 -19.144 1.00 0.00 H new ATOM 30 N CYS A 3 76.310 2.267 -16.852 1.00 0.00 N ATOM 31 CA CYS A 3 76.276 1.964 -15.388 1.00 0.00 C ATOM 32 C CYS A 3 77.663 1.498 -14.926 1.00 0.00 C ATOM 33 O CYS A 3 77.850 0.343 -14.596 1.00 0.00 O ATOM 34 CB CYS A 3 75.257 0.851 -15.134 1.00 0.00 C ATOM 35 SG CYS A 3 73.619 1.394 -15.679 1.00 0.00 S ATOM 0 H CYS A 3 76.829 1.595 -17.418 1.00 0.00 H new ATOM 0 HA CYS A 3 75.994 2.860 -14.835 1.00 0.00 H new ATOM 0 HB2 CYS A 3 75.549 -0.052 -15.669 1.00 0.00 H new ATOM 0 HB3 CYS A 3 75.234 0.600 -14.074 1.00 0.00 H new ATOM 0 HG CYS A 3 72.754 0.447 -15.465 1.00 0.00 H new ATOM 41 N PRO A 4 78.633 2.384 -14.897 1.00 0.00 N ATOM 42 CA PRO A 4 80.007 2.010 -14.455 1.00 0.00 C ATOM 43 C PRO A 4 80.082 1.744 -12.943 1.00 0.00 C ATOM 44 O PRO A 4 80.985 1.086 -12.467 1.00 0.00 O ATOM 45 CB PRO A 4 80.835 3.243 -14.861 1.00 0.00 C ATOM 46 CG PRO A 4 79.863 4.382 -15.230 1.00 0.00 C ATOM 47 CD PRO A 4 78.434 3.803 -15.306 1.00 0.00 C ATOM 0 HA PRO A 4 80.361 1.081 -14.903 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.485 3.550 -14.042 1.00 0.00 H new ATOM 0 HB3 PRO A 4 81.479 3.005 -15.707 1.00 0.00 H new ATOM 0 HG2 PRO A 4 79.910 5.176 -14.485 1.00 0.00 H new ATOM 0 HG3 PRO A 4 80.144 4.824 -16.186 1.00 0.00 H new ATOM 0 HD2 PRO A 4 77.750 4.325 -14.637 1.00 0.00 H new ATOM 0 HD3 PRO A 4 78.019 3.880 -16.311 1.00 0.00 H new ATOM 55 N LEU A 5 79.137 2.238 -12.191 1.00 0.00 N ATOM 56 CA LEU A 5 79.157 1.990 -10.722 1.00 0.00 C ATOM 57 C LEU A 5 79.096 0.485 -10.496 1.00 0.00 C ATOM 58 O LEU A 5 79.691 -0.047 -9.581 1.00 0.00 O ATOM 59 CB LEU A 5 77.950 2.660 -10.052 1.00 0.00 C ATOM 60 CG LEU A 5 77.972 2.403 -8.533 1.00 0.00 C ATOM 61 CD1 LEU A 5 79.222 3.034 -7.898 1.00 0.00 C ATOM 62 CD2 LEU A 5 76.714 3.012 -7.903 1.00 0.00 C ATOM 0 H LEU A 5 78.355 2.800 -12.528 1.00 0.00 H new ATOM 0 HA LEU A 5 80.066 2.407 -10.288 1.00 0.00 H new ATOM 0 HB2 LEU A 5 77.966 3.732 -10.247 1.00 0.00 H new ATOM 0 HB3 LEU A 5 77.026 2.272 -10.480 1.00 0.00 H new ATOM 0 HG LEU A 5 77.996 1.328 -8.354 1.00 0.00 H new ATOM 0 HD11 LEU A 5 79.221 2.843 -6.825 1.00 0.00 H new ATOM 0 HD12 LEU A 5 80.116 2.598 -8.344 1.00 0.00 H new ATOM 0 HD13 LEU A 5 79.216 4.110 -8.075 1.00 0.00 H new ATOM 0 HD21 LEU A 5 76.723 2.834 -6.828 1.00 0.00 H new ATOM 0 HD22 LEU A 5 76.695 4.085 -8.093 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.828 2.551 -8.340 1.00 0.00 H new ATOM 74 N GLU A 6 78.362 -0.202 -11.321 1.00 0.00 N ATOM 75 CA GLU A 6 78.236 -1.672 -11.164 1.00 0.00 C ATOM 76 C GLU A 6 79.625 -2.313 -11.279 1.00 0.00 C ATOM 77 O GLU A 6 79.973 -3.203 -10.529 1.00 0.00 O ATOM 78 CB GLU A 6 77.330 -2.190 -12.282 1.00 0.00 C ATOM 79 CG GLU A 6 77.029 -3.674 -12.071 1.00 0.00 C ATOM 80 CD GLU A 6 76.114 -4.168 -13.194 1.00 0.00 C ATOM 81 OE1 GLU A 6 75.624 -3.335 -13.940 1.00 0.00 O ATOM 82 OE2 GLU A 6 75.914 -5.367 -13.286 1.00 0.00 O ATOM 0 H GLU A 6 77.841 0.195 -12.102 1.00 0.00 H new ATOM 0 HA GLU A 6 77.812 -1.922 -10.192 1.00 0.00 H new ATOM 0 HB2 GLU A 6 76.400 -1.622 -12.300 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.812 -2.043 -13.249 1.00 0.00 H new ATOM 0 HG2 GLU A 6 77.956 -4.247 -12.063 1.00 0.00 H new ATOM 0 HG3 GLU A 6 76.551 -3.826 -11.103 1.00 0.00 H new ATOM 89 N LYS A 7 80.429 -1.854 -12.200 1.00 0.00 N ATOM 90 CA LYS A 7 81.800 -2.414 -12.347 1.00 0.00 C ATOM 91 C LYS A 7 82.669 -1.941 -11.184 1.00 0.00 C ATOM 92 O LYS A 7 83.412 -2.699 -10.603 1.00 0.00 O ATOM 93 CB LYS A 7 82.406 -1.951 -13.673 1.00 0.00 C ATOM 94 CG LYS A 7 83.817 -2.524 -13.812 1.00 0.00 C ATOM 95 CD LYS A 7 84.338 -2.283 -15.234 1.00 0.00 C ATOM 96 CE LYS A 7 84.464 -0.781 -15.501 1.00 0.00 C ATOM 97 NZ LYS A 7 85.386 -0.562 -16.652 1.00 0.00 N ATOM 0 H LYS A 7 80.193 -1.112 -12.859 1.00 0.00 H new ATOM 0 HA LYS A 7 81.751 -3.503 -12.340 1.00 0.00 H new ATOM 0 HB2 LYS A 7 81.784 -2.281 -14.505 1.00 0.00 H new ATOM 0 HB3 LYS A 7 82.438 -0.862 -13.711 1.00 0.00 H new ATOM 0 HG2 LYS A 7 84.483 -2.056 -13.087 1.00 0.00 H new ATOM 0 HG3 LYS A 7 83.809 -3.592 -13.594 1.00 0.00 H new ATOM 0 HD2 LYS A 7 85.307 -2.765 -15.361 1.00 0.00 H new ATOM 0 HD3 LYS A 7 83.660 -2.733 -15.959 1.00 0.00 H new ATOM 0 HE2 LYS A 7 83.485 -0.355 -15.718 1.00 0.00 H new ATOM 0 HE3 LYS A 7 84.843 -0.273 -14.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 85.474 0.458 -16.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 86.322 -0.956 -16.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 85.006 -1.035 -17.496 1.00 0.00 H new ATOM 111 N ALA A 8 82.569 -0.695 -10.818 1.00 0.00 N ATOM 112 CA ALA A 8 83.389 -0.215 -9.678 1.00 0.00 C ATOM 113 C ALA A 8 82.994 -1.047 -8.469 1.00 0.00 C ATOM 114 O ALA A 8 83.819 -1.467 -7.685 1.00 0.00 O ATOM 115 CB ALA A 8 83.133 1.268 -9.423 1.00 0.00 C ATOM 0 H ALA A 8 81.964 0.002 -11.253 1.00 0.00 H new ATOM 0 HA ALA A 8 84.453 -0.324 -9.889 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.742 1.603 -8.584 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.394 1.841 -10.313 1.00 0.00 H new ATOM 0 HB3 ALA A 8 82.079 1.421 -9.190 1.00 0.00 H new ATOM 121 N LEU A 9 81.735 -1.345 -8.347 1.00 0.00 N ATOM 122 CA LEU A 9 81.299 -2.214 -7.233 1.00 0.00 C ATOM 123 C LEU A 9 82.055 -3.519 -7.445 1.00 0.00 C ATOM 124 O LEU A 9 82.668 -4.074 -6.555 1.00 0.00 O ATOM 125 CB LEU A 9 79.789 -2.453 -7.368 1.00 0.00 C ATOM 126 CG LEU A 9 79.165 -3.077 -6.099 1.00 0.00 C ATOM 127 CD1 LEU A 9 80.087 -4.109 -5.438 1.00 0.00 C ATOM 128 CD2 LEU A 9 78.841 -1.978 -5.084 1.00 0.00 C ATOM 0 H LEU A 9 80.993 -1.024 -8.970 1.00 0.00 H new ATOM 0 HA LEU A 9 81.492 -1.788 -6.249 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.294 -1.506 -7.583 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.604 -3.109 -8.218 1.00 0.00 H new ATOM 0 HG LEU A 9 78.256 -3.591 -6.412 1.00 0.00 H new ATOM 0 HD11 LEU A 9 79.601 -4.516 -4.552 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.294 -4.916 -6.141 1.00 0.00 H new ATOM 0 HD13 LEU A 9 81.023 -3.630 -5.151 1.00 0.00 H new ATOM 0 HD21 LEU A 9 78.402 -2.425 -4.192 1.00 0.00 H new ATOM 0 HD22 LEU A 9 79.756 -1.452 -4.813 1.00 0.00 H new ATOM 0 HD23 LEU A 9 78.134 -1.274 -5.523 1.00 0.00 H new ATOM 140 N ASP A 10 82.038 -3.980 -8.659 1.00 0.00 N ATOM 141 CA ASP A 10 82.774 -5.224 -8.994 1.00 0.00 C ATOM 142 C ASP A 10 84.263 -5.014 -8.697 1.00 0.00 C ATOM 143 O ASP A 10 84.940 -5.910 -8.240 1.00 0.00 O ATOM 144 CB ASP A 10 82.565 -5.571 -10.474 1.00 0.00 C ATOM 145 CG ASP A 10 82.944 -7.032 -10.724 1.00 0.00 C ATOM 146 OD1 ASP A 10 83.730 -7.560 -9.955 1.00 0.00 O ATOM 147 OD2 ASP A 10 82.443 -7.597 -11.682 1.00 0.00 O ATOM 0 H ASP A 10 81.543 -3.546 -9.438 1.00 0.00 H new ATOM 0 HA ASP A 10 82.399 -6.052 -8.392 1.00 0.00 H new ATOM 0 HB2 ASP A 10 81.525 -5.403 -10.753 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.172 -4.916 -11.099 1.00 0.00 H new ATOM 152 N VAL A 11 84.786 -3.837 -8.947 1.00 0.00 N ATOM 153 CA VAL A 11 86.238 -3.606 -8.667 1.00 0.00 C ATOM 154 C VAL A 11 86.500 -3.839 -7.172 1.00 0.00 C ATOM 155 O VAL A 11 87.490 -4.432 -6.795 1.00 0.00 O ATOM 156 CB VAL A 11 86.627 -2.163 -9.032 1.00 0.00 C ATOM 157 CG1 VAL A 11 88.042 -1.855 -8.539 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.572 -1.976 -10.554 1.00 0.00 C ATOM 0 H VAL A 11 84.279 -3.038 -9.327 1.00 0.00 H new ATOM 0 HA VAL A 11 86.834 -4.295 -9.266 1.00 0.00 H new ATOM 0 HB VAL A 11 85.923 -1.483 -8.553 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.305 -0.831 -8.804 1.00 0.00 H new ATOM 0 HG12 VAL A 11 88.083 -1.972 -7.456 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.748 -2.543 -9.005 1.00 0.00 H new ATOM 0 HG21 VAL A 11 86.849 -0.952 -10.805 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.267 -2.667 -11.031 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.561 -2.176 -10.909 1.00 0.00 H new ATOM 168 N MET A 12 85.613 -3.389 -6.321 1.00 0.00 N ATOM 169 CA MET A 12 85.815 -3.604 -4.856 1.00 0.00 C ATOM 170 C MET A 12 85.818 -5.103 -4.582 1.00 0.00 C ATOM 171 O MET A 12 86.582 -5.609 -3.789 1.00 0.00 O ATOM 172 CB MET A 12 84.666 -2.964 -4.072 1.00 0.00 C ATOM 173 CG MET A 12 85.007 -2.950 -2.575 1.00 0.00 C ATOM 174 SD MET A 12 83.482 -2.820 -1.605 1.00 0.00 S ATOM 175 CE MET A 12 82.722 -1.477 -2.544 1.00 0.00 C ATOM 0 H MET A 12 84.763 -2.885 -6.575 1.00 0.00 H new ATOM 0 HA MET A 12 86.759 -3.154 -4.548 1.00 0.00 H new ATOM 0 HB2 MET A 12 84.494 -1.947 -4.425 1.00 0.00 H new ATOM 0 HB3 MET A 12 83.744 -3.520 -4.240 1.00 0.00 H new ATOM 0 HG2 MET A 12 85.545 -3.859 -2.306 1.00 0.00 H new ATOM 0 HG3 MET A 12 85.666 -2.111 -2.350 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.982 -0.973 -1.923 1.00 0.00 H new ATOM 0 HE2 MET A 12 83.489 -0.764 -2.845 1.00 0.00 H new ATOM 0 HE3 MET A 12 82.236 -1.883 -3.431 1.00 0.00 H new ATOM 185 N VAL A 13 84.945 -5.813 -5.228 1.00 0.00 N ATOM 186 CA VAL A 13 84.873 -7.284 -5.021 1.00 0.00 C ATOM 187 C VAL A 13 85.987 -7.986 -5.810 1.00 0.00 C ATOM 188 O VAL A 13 86.634 -8.887 -5.316 1.00 0.00 O ATOM 189 CB VAL A 13 83.509 -7.780 -5.490 1.00 0.00 C ATOM 190 CG1 VAL A 13 83.412 -9.293 -5.290 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.424 -7.081 -4.672 1.00 0.00 C ATOM 0 H VAL A 13 84.272 -5.437 -5.896 1.00 0.00 H new ATOM 0 HA VAL A 13 85.005 -7.511 -3.963 1.00 0.00 H new ATOM 0 HB VAL A 13 83.378 -7.555 -6.548 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.436 -9.643 -5.626 1.00 0.00 H new ATOM 0 HG12 VAL A 13 84.193 -9.787 -5.867 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.538 -9.529 -4.233 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.443 -7.427 -4.998 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.558 -7.313 -3.616 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.496 -6.003 -4.818 1.00 0.00 H new ATOM 201 N SER A 14 86.206 -7.593 -7.039 1.00 0.00 N ATOM 202 CA SER A 14 87.268 -8.253 -7.857 1.00 0.00 C ATOM 203 C SER A 14 88.635 -8.090 -7.187 1.00 0.00 C ATOM 204 O SER A 14 89.384 -9.038 -7.052 1.00 0.00 O ATOM 205 CB SER A 14 87.314 -7.622 -9.250 1.00 0.00 C ATOM 206 OG SER A 14 86.107 -7.917 -9.943 1.00 0.00 O ATOM 0 H SER A 14 85.697 -6.845 -7.510 1.00 0.00 H new ATOM 0 HA SER A 14 87.034 -9.314 -7.939 1.00 0.00 H new ATOM 0 HB2 SER A 14 87.445 -6.543 -9.168 1.00 0.00 H new ATOM 0 HB3 SER A 14 88.169 -8.005 -9.807 1.00 0.00 H new ATOM 0 HG SER A 14 85.375 -7.387 -9.565 1.00 0.00 H new ATOM 212 N THR A 15 88.969 -6.901 -6.761 1.00 0.00 N ATOM 213 CA THR A 15 90.289 -6.698 -6.097 1.00 0.00 C ATOM 214 C THR A 15 90.334 -7.554 -4.830 1.00 0.00 C ATOM 215 O THR A 15 91.327 -8.177 -4.508 1.00 0.00 O ATOM 216 CB THR A 15 90.460 -5.207 -5.760 1.00 0.00 C ATOM 217 OG1 THR A 15 91.841 -4.909 -5.613 1.00 0.00 O ATOM 218 CG2 THR A 15 89.714 -4.848 -4.470 1.00 0.00 C ATOM 0 H THR A 15 88.389 -6.066 -6.843 1.00 0.00 H new ATOM 0 HA THR A 15 91.104 -6.998 -6.756 1.00 0.00 H new ATOM 0 HB THR A 15 90.040 -4.617 -6.575 1.00 0.00 H new ATOM 0 HG1 THR A 15 92.025 -4.660 -4.683 1.00 0.00 H new ATOM 0 HG21 THR A 15 89.851 -3.788 -4.254 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.652 -5.059 -4.593 1.00 0.00 H new ATOM 0 HG23 THR A 15 90.108 -5.441 -3.645 1.00 0.00 H new ATOM 226 N PHE A 16 89.247 -7.590 -4.123 1.00 0.00 N ATOM 227 CA PHE A 16 89.182 -8.408 -2.882 1.00 0.00 C ATOM 228 C PHE A 16 89.446 -9.872 -3.250 1.00 0.00 C ATOM 229 O PHE A 16 90.137 -10.591 -2.556 1.00 0.00 O ATOM 230 CB PHE A 16 87.782 -8.252 -2.280 1.00 0.00 C ATOM 231 CG PHE A 16 87.653 -9.060 -1.012 1.00 0.00 C ATOM 232 CD1 PHE A 16 87.976 -8.485 0.222 1.00 0.00 C ATOM 233 CD2 PHE A 16 87.191 -10.379 -1.070 1.00 0.00 C ATOM 234 CE1 PHE A 16 87.838 -9.231 1.400 1.00 0.00 C ATOM 235 CE2 PHE A 16 87.055 -11.124 0.105 1.00 0.00 C ATOM 236 CZ PHE A 16 87.379 -10.550 1.341 1.00 0.00 C ATOM 0 H PHE A 16 88.391 -7.084 -4.351 1.00 0.00 H new ATOM 0 HA PHE A 16 89.927 -8.084 -2.155 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.587 -7.201 -2.068 1.00 0.00 H new ATOM 0 HB3 PHE A 16 87.032 -8.576 -3.002 1.00 0.00 H new ATOM 0 HD1 PHE A 16 88.332 -7.466 0.267 1.00 0.00 H new ATOM 0 HD2 PHE A 16 86.939 -10.822 -2.022 1.00 0.00 H new ATOM 0 HE1 PHE A 16 88.086 -8.787 2.353 1.00 0.00 H new ATOM 0 HE2 PHE A 16 86.700 -12.143 0.060 1.00 0.00 H new ATOM 0 HZ PHE A 16 87.274 -11.126 2.248 1.00 0.00 H new ATOM 246 N HIS A 17 88.903 -10.305 -4.354 1.00 0.00 N ATOM 247 CA HIS A 17 89.111 -11.709 -4.810 1.00 0.00 C ATOM 248 C HIS A 17 90.557 -11.882 -5.275 1.00 0.00 C ATOM 249 O HIS A 17 91.098 -12.970 -5.255 1.00 0.00 O ATOM 250 CB HIS A 17 88.155 -12.012 -5.966 1.00 0.00 C ATOM 251 CG HIS A 17 88.346 -13.430 -6.427 1.00 0.00 C ATOM 252 ND1 HIS A 17 89.130 -13.753 -7.528 1.00 0.00 N ATOM 253 CD2 HIS A 17 87.854 -14.623 -5.956 1.00 0.00 C ATOM 254 CE1 HIS A 17 89.086 -15.090 -7.681 1.00 0.00 C ATOM 255 NE2 HIS A 17 88.323 -15.664 -6.750 1.00 0.00 N ATOM 0 H HIS A 17 88.317 -9.739 -4.967 1.00 0.00 H new ATOM 0 HA HIS A 17 88.913 -12.397 -3.988 1.00 0.00 H new ATOM 0 HB2 HIS A 17 87.124 -11.860 -5.647 1.00 0.00 H new ATOM 0 HB3 HIS A 17 88.338 -11.324 -6.791 1.00 0.00 H new ATOM 0 HD2 HIS A 17 87.204 -14.735 -5.101 1.00 0.00 H new ATOM 0 HE1 HIS A 17 89.604 -15.630 -8.460 1.00 0.00 H new ATOM 0 HE2 HIS A 17 88.125 -16.659 -6.643 1.00 0.00 H new ATOM 264 N LYS A 18 91.196 -10.817 -5.687 1.00 0.00 N ATOM 265 CA LYS A 18 92.608 -10.933 -6.137 1.00 0.00 C ATOM 266 C LYS A 18 93.398 -11.571 -5.001 1.00 0.00 C ATOM 267 O LYS A 18 94.229 -12.434 -5.205 1.00 0.00 O ATOM 268 CB LYS A 18 93.161 -9.541 -6.444 1.00 0.00 C ATOM 269 CG LYS A 18 94.519 -9.663 -7.132 1.00 0.00 C ATOM 270 CD LYS A 18 95.036 -8.267 -7.482 1.00 0.00 C ATOM 271 CE LYS A 18 96.393 -8.388 -8.171 1.00 0.00 C ATOM 272 NZ LYS A 18 96.197 -8.878 -9.565 1.00 0.00 N ATOM 0 H LYS A 18 90.800 -9.878 -5.730 1.00 0.00 H new ATOM 0 HA LYS A 18 92.682 -11.540 -7.039 1.00 0.00 H new ATOM 0 HB2 LYS A 18 92.466 -8.997 -7.084 1.00 0.00 H new ATOM 0 HB3 LYS A 18 93.260 -8.968 -5.522 1.00 0.00 H new ATOM 0 HG2 LYS A 18 95.227 -10.172 -6.477 1.00 0.00 H new ATOM 0 HG3 LYS A 18 94.429 -10.267 -8.035 1.00 0.00 H new ATOM 0 HD2 LYS A 18 94.328 -7.758 -8.136 1.00 0.00 H new ATOM 0 HD3 LYS A 18 95.127 -7.663 -6.579 1.00 0.00 H new ATOM 0 HE2 LYS A 18 96.896 -7.421 -8.181 1.00 0.00 H new ATOM 0 HE3 LYS A 18 97.034 -9.075 -7.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 97.078 -8.754 -10.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 95.942 -9.886 -9.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 95.434 -8.336 -10.019 1.00 0.00 H new ATOM 286 N TYR A 19 93.099 -11.180 -3.796 1.00 0.00 N ATOM 287 CA TYR A 19 93.779 -11.788 -2.623 1.00 0.00 C ATOM 288 C TYR A 19 93.407 -13.266 -2.582 1.00 0.00 C ATOM 289 O TYR A 19 94.219 -14.113 -2.276 1.00 0.00 O ATOM 290 CB TYR A 19 93.307 -11.077 -1.351 1.00 0.00 C ATOM 291 CG TYR A 19 93.871 -9.675 -1.334 1.00 0.00 C ATOM 292 CD1 TYR A 19 93.154 -8.623 -1.918 1.00 0.00 C ATOM 293 CD2 TYR A 19 95.116 -9.426 -0.744 1.00 0.00 C ATOM 294 CE1 TYR A 19 93.684 -7.324 -1.913 1.00 0.00 C ATOM 295 CE2 TYR A 19 95.644 -8.130 -0.736 1.00 0.00 C ATOM 296 CZ TYR A 19 94.930 -7.078 -1.322 1.00 0.00 C ATOM 297 OH TYR A 19 95.455 -5.801 -1.320 1.00 0.00 O ATOM 0 H TYR A 19 92.410 -10.462 -3.573 1.00 0.00 H new ATOM 0 HA TYR A 19 94.862 -11.685 -2.696 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.218 -11.045 -1.319 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.636 -11.626 -0.469 1.00 0.00 H new ATOM 0 HD1 TYR A 19 92.193 -8.812 -2.372 1.00 0.00 H new ATOM 0 HD2 TYR A 19 95.670 -10.236 -0.294 1.00 0.00 H new ATOM 0 HE1 TYR A 19 93.131 -6.514 -2.365 1.00 0.00 H new ATOM 0 HE2 TYR A 19 96.603 -7.941 -0.277 1.00 0.00 H new ATOM 0 HH TYR A 19 94.967 -5.246 -1.963 1.00 0.00 H new ATOM 307 N SER A 20 92.182 -13.591 -2.896 1.00 0.00 N ATOM 308 CA SER A 20 91.769 -15.023 -2.882 1.00 0.00 C ATOM 309 C SER A 20 92.214 -15.653 -1.565 1.00 0.00 C ATOM 310 O SER A 20 92.226 -16.857 -1.408 1.00 0.00 O ATOM 311 CB SER A 20 92.437 -15.752 -4.045 1.00 0.00 C ATOM 312 OG SER A 20 92.045 -17.118 -4.036 1.00 0.00 O ATOM 0 H SER A 20 91.452 -12.929 -3.161 1.00 0.00 H new ATOM 0 HA SER A 20 90.686 -15.099 -2.981 1.00 0.00 H new ATOM 0 HB2 SER A 20 92.154 -15.288 -4.990 1.00 0.00 H new ATOM 0 HB3 SER A 20 93.521 -15.673 -3.963 1.00 0.00 H new ATOM 0 HG SER A 20 91.914 -17.415 -3.111 1.00 0.00 H new ATOM 318 N GLY A 21 92.589 -14.838 -0.621 1.00 0.00 N ATOM 319 CA GLY A 21 93.040 -15.377 0.694 1.00 0.00 C ATOM 320 C GLY A 21 94.229 -16.311 0.483 1.00 0.00 C ATOM 321 O GLY A 21 94.150 -17.498 0.733 1.00 0.00 O ATOM 0 H GLY A 21 92.603 -13.821 -0.701 1.00 0.00 H new ATOM 0 HA2 GLY A 21 93.320 -14.559 1.357 1.00 0.00 H new ATOM 0 HA3 GLY A 21 92.224 -15.914 1.178 1.00 0.00 H new ATOM 325 N LYS A 22 95.330 -15.789 0.024 1.00 0.00 N ATOM 326 CA LYS A 22 96.520 -16.653 -0.201 1.00 0.00 C ATOM 327 C LYS A 22 96.838 -17.397 1.099 1.00 0.00 C ATOM 328 O LYS A 22 97.480 -18.430 1.100 1.00 0.00 O ATOM 329 CB LYS A 22 97.712 -15.778 -0.610 1.00 0.00 C ATOM 330 CG LYS A 22 97.246 -14.657 -1.580 1.00 0.00 C ATOM 331 CD LYS A 22 96.889 -13.353 -0.805 1.00 0.00 C ATOM 332 CE LYS A 22 97.953 -12.277 -1.059 1.00 0.00 C ATOM 333 NZ LYS A 22 98.097 -12.057 -2.525 1.00 0.00 N ATOM 0 H LYS A 22 95.458 -14.803 -0.205 1.00 0.00 H new ATOM 0 HA LYS A 22 96.320 -17.373 -0.995 1.00 0.00 H new ATOM 0 HB2 LYS A 22 98.169 -15.336 0.275 1.00 0.00 H new ATOM 0 HB3 LYS A 22 98.475 -16.391 -1.090 1.00 0.00 H new ATOM 0 HG2 LYS A 22 98.034 -14.449 -2.304 1.00 0.00 H new ATOM 0 HG3 LYS A 22 96.377 -14.998 -2.143 1.00 0.00 H new ATOM 0 HD2 LYS A 22 95.911 -12.990 -1.121 1.00 0.00 H new ATOM 0 HD3 LYS A 22 96.821 -13.563 0.262 1.00 0.00 H new ATOM 0 HE2 LYS A 22 97.669 -11.347 -0.567 1.00 0.00 H new ATOM 0 HE3 LYS A 22 98.907 -12.586 -0.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 98.229 -11.043 -2.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 98.922 -12.584 -2.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 97.241 -12.390 -3.012 1.00 0.00 H new ATOM 347 N GLU A 23 96.387 -16.872 2.206 1.00 0.00 N ATOM 348 CA GLU A 23 96.647 -17.531 3.518 1.00 0.00 C ATOM 349 C GLU A 23 95.637 -18.668 3.725 1.00 0.00 C ATOM 350 O GLU A 23 95.772 -19.472 4.625 1.00 0.00 O ATOM 351 CB GLU A 23 96.498 -16.493 4.639 1.00 0.00 C ATOM 352 CG GLU A 23 96.954 -17.090 5.974 1.00 0.00 C ATOM 353 CD GLU A 23 96.928 -16.006 7.056 1.00 0.00 C ATOM 354 OE1 GLU A 23 96.587 -14.881 6.731 1.00 0.00 O ATOM 355 OE2 GLU A 23 97.244 -16.322 8.190 1.00 0.00 O ATOM 0 H GLU A 23 95.846 -16.009 2.258 1.00 0.00 H new ATOM 0 HA GLU A 23 97.657 -17.941 3.534 1.00 0.00 H new ATOM 0 HB2 GLU A 23 97.090 -15.608 4.407 1.00 0.00 H new ATOM 0 HB3 GLU A 23 95.459 -16.171 4.712 1.00 0.00 H new ATOM 0 HG2 GLU A 23 96.301 -17.916 6.257 1.00 0.00 H new ATOM 0 HG3 GLU A 23 97.960 -17.498 5.877 1.00 0.00 H new ATOM 362 N GLY A 24 94.633 -18.749 2.880 1.00 0.00 N ATOM 363 CA GLY A 24 93.608 -19.841 3.000 1.00 0.00 C ATOM 364 C GLY A 24 92.218 -19.242 3.246 1.00 0.00 C ATOM 365 O GLY A 24 91.221 -19.789 2.823 1.00 0.00 O ATOM 0 H GLY A 24 94.478 -18.101 2.107 1.00 0.00 H new ATOM 0 HA2 GLY A 24 93.597 -20.440 2.090 1.00 0.00 H new ATOM 0 HA3 GLY A 24 93.873 -20.510 3.819 1.00 0.00 H new ATOM 369 N ASP A 25 92.136 -18.126 3.926 1.00 0.00 N ATOM 370 CA ASP A 25 90.796 -17.508 4.191 1.00 0.00 C ATOM 371 C ASP A 25 90.494 -16.460 3.118 1.00 0.00 C ATOM 372 O ASP A 25 91.035 -15.371 3.132 1.00 0.00 O ATOM 373 CB ASP A 25 90.814 -16.835 5.564 1.00 0.00 C ATOM 374 CG ASP A 25 91.893 -15.751 5.583 1.00 0.00 C ATOM 375 OD1 ASP A 25 92.837 -15.872 4.820 1.00 0.00 O ATOM 376 OD2 ASP A 25 91.756 -14.818 6.357 1.00 0.00 O ATOM 0 H ASP A 25 92.933 -17.617 4.308 1.00 0.00 H new ATOM 0 HA ASP A 25 90.028 -18.281 4.170 1.00 0.00 H new ATOM 0 HB2 ASP A 25 89.839 -16.397 5.780 1.00 0.00 H new ATOM 0 HB3 ASP A 25 91.011 -17.574 6.341 1.00 0.00 H new ATOM 381 N LYS A 26 89.636 -16.784 2.181 1.00 0.00 N ATOM 382 CA LYS A 26 89.292 -15.817 1.092 1.00 0.00 C ATOM 383 C LYS A 26 87.961 -15.127 1.386 1.00 0.00 C ATOM 384 O LYS A 26 87.651 -14.108 0.812 1.00 0.00 O ATOM 385 CB LYS A 26 89.188 -16.573 -0.236 1.00 0.00 C ATOM 386 CG LYS A 26 88.088 -17.632 -0.139 1.00 0.00 C ATOM 387 CD LYS A 26 88.106 -18.505 -1.397 1.00 0.00 C ATOM 388 CE LYS A 26 86.963 -19.519 -1.332 1.00 0.00 C ATOM 389 NZ LYS A 26 87.264 -20.540 -0.289 1.00 0.00 N ATOM 0 H LYS A 26 89.156 -17.682 2.124 1.00 0.00 H new ATOM 0 HA LYS A 26 90.073 -15.059 1.033 1.00 0.00 H new ATOM 0 HB2 LYS A 26 88.967 -15.878 -1.046 1.00 0.00 H new ATOM 0 HB3 LYS A 26 90.141 -17.045 -0.473 1.00 0.00 H new ATOM 0 HG2 LYS A 26 88.240 -18.249 0.747 1.00 0.00 H new ATOM 0 HG3 LYS A 26 87.115 -17.152 -0.030 1.00 0.00 H new ATOM 0 HD2 LYS A 26 88.004 -17.882 -2.286 1.00 0.00 H new ATOM 0 HD3 LYS A 26 89.061 -19.023 -1.479 1.00 0.00 H new ATOM 0 HE2 LYS A 26 86.026 -19.013 -1.101 1.00 0.00 H new ATOM 0 HE3 LYS A 26 86.834 -20.001 -2.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 86.622 -21.350 -0.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 88.248 -20.861 -0.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 87.133 -20.122 0.654 1.00 0.00 H new ATOM 403 N PHE A 27 87.167 -15.670 2.264 1.00 0.00 N ATOM 404 CA PHE A 27 85.854 -15.030 2.569 1.00 0.00 C ATOM 405 C PHE A 27 86.043 -13.969 3.648 1.00 0.00 C ATOM 406 O PHE A 27 85.120 -13.265 4.008 1.00 0.00 O ATOM 407 CB PHE A 27 84.874 -16.088 3.079 1.00 0.00 C ATOM 408 CG PHE A 27 83.504 -15.473 3.223 1.00 0.00 C ATOM 409 CD1 PHE A 27 82.618 -15.492 2.141 1.00 0.00 C ATOM 410 CD2 PHE A 27 83.118 -14.889 4.436 1.00 0.00 C ATOM 411 CE1 PHE A 27 81.345 -14.924 2.270 1.00 0.00 C ATOM 412 CE2 PHE A 27 81.845 -14.321 4.565 1.00 0.00 C ATOM 413 CZ PHE A 27 80.958 -14.339 3.481 1.00 0.00 C ATOM 0 H PHE A 27 87.367 -16.525 2.783 1.00 0.00 H new ATOM 0 HA PHE A 27 85.461 -14.570 1.663 1.00 0.00 H new ATOM 0 HB2 PHE A 27 84.836 -16.929 2.386 1.00 0.00 H new ATOM 0 HB3 PHE A 27 85.212 -16.480 4.038 1.00 0.00 H new ATOM 0 HD1 PHE A 27 82.916 -15.945 1.207 1.00 0.00 H new ATOM 0 HD2 PHE A 27 83.802 -14.877 5.272 1.00 0.00 H new ATOM 0 HE1 PHE A 27 80.661 -14.937 1.434 1.00 0.00 H new ATOM 0 HE2 PHE A 27 81.547 -13.869 5.500 1.00 0.00 H new ATOM 0 HZ PHE A 27 79.976 -13.901 3.580 1.00 0.00 H new ATOM 423 N LYS A 28 87.225 -13.852 4.178 1.00 0.00 N ATOM 424 CA LYS A 28 87.455 -12.841 5.247 1.00 0.00 C ATOM 425 C LYS A 28 88.944 -12.519 5.343 1.00 0.00 C ATOM 426 O LYS A 28 89.779 -13.293 4.918 1.00 0.00 O ATOM 427 CB LYS A 28 86.970 -13.420 6.581 1.00 0.00 C ATOM 428 CG LYS A 28 87.630 -14.784 6.818 1.00 0.00 C ATOM 429 CD LYS A 28 87.001 -15.459 8.038 1.00 0.00 C ATOM 430 CE LYS A 28 87.628 -16.838 8.232 1.00 0.00 C ATOM 431 NZ LYS A 28 87.424 -17.647 6.998 1.00 0.00 N ATOM 0 H LYS A 28 88.040 -14.409 3.920 1.00 0.00 H new ATOM 0 HA LYS A 28 86.909 -11.927 5.014 1.00 0.00 H new ATOM 0 HB2 LYS A 28 87.216 -12.739 7.396 1.00 0.00 H new ATOM 0 HB3 LYS A 28 85.885 -13.526 6.570 1.00 0.00 H new ATOM 0 HG2 LYS A 28 87.507 -15.415 5.938 1.00 0.00 H new ATOM 0 HG3 LYS A 28 88.702 -14.658 6.973 1.00 0.00 H new ATOM 0 HD2 LYS A 28 87.157 -14.848 8.927 1.00 0.00 H new ATOM 0 HD3 LYS A 28 85.924 -15.553 7.901 1.00 0.00 H new ATOM 0 HE2 LYS A 28 88.692 -16.740 8.445 1.00 0.00 H new ATOM 0 HE3 LYS A 28 87.176 -17.339 9.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 87.160 -18.618 7.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 86.665 -17.224 6.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 88.304 -17.664 6.445 1.00 0.00 H new ATOM 445 N LEU A 29 89.283 -11.387 5.915 1.00 0.00 N ATOM 446 CA LEU A 29 90.725 -11.008 6.062 1.00 0.00 C ATOM 447 C LEU A 29 90.986 -10.631 7.515 1.00 0.00 C ATOM 448 O LEU A 29 90.074 -10.403 8.284 1.00 0.00 O ATOM 449 CB LEU A 29 91.076 -9.792 5.184 1.00 0.00 C ATOM 450 CG LEU A 29 90.417 -9.880 3.807 1.00 0.00 C ATOM 451 CD1 LEU A 29 90.601 -8.537 3.093 1.00 0.00 C ATOM 452 CD2 LEU A 29 91.090 -10.979 2.979 1.00 0.00 C ATOM 0 H LEU A 29 88.620 -10.707 6.288 1.00 0.00 H new ATOM 0 HA LEU A 29 91.335 -11.857 5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 29 90.755 -8.878 5.683 1.00 0.00 H new ATOM 0 HB3 LEU A 29 92.158 -9.728 5.066 1.00 0.00 H new ATOM 0 HG LEU A 29 89.358 -10.112 3.920 1.00 0.00 H new ATOM 0 HD11 LEU A 29 90.136 -8.582 2.108 1.00 0.00 H new ATOM 0 HD12 LEU A 29 90.133 -7.746 3.679 1.00 0.00 H new ATOM 0 HD13 LEU A 29 91.665 -8.326 2.983 1.00 0.00 H new ATOM 0 HD21 LEU A 29 90.617 -11.038 1.999 1.00 0.00 H new ATOM 0 HD22 LEU A 29 92.148 -10.747 2.858 1.00 0.00 H new ATOM 0 HD23 LEU A 29 90.985 -11.936 3.490 1.00 0.00 H new ATOM 464 N ASN A 30 92.231 -10.539 7.884 1.00 0.00 N ATOM 465 CA ASN A 30 92.575 -10.135 9.272 1.00 0.00 C ATOM 466 C ASN A 30 92.856 -8.634 9.252 1.00 0.00 C ATOM 467 O ASN A 30 93.477 -8.133 8.341 1.00 0.00 O ATOM 468 CB ASN A 30 93.830 -10.884 9.726 1.00 0.00 C ATOM 469 CG ASN A 30 93.570 -12.391 9.686 1.00 0.00 C ATOM 470 OD1 ASN A 30 94.152 -13.098 8.889 1.00 0.00 O ATOM 471 ND2 ASN A 30 92.716 -12.915 10.520 1.00 0.00 N ATOM 0 H ASN A 30 93.030 -10.728 7.279 1.00 0.00 H new ATOM 0 HA ASN A 30 91.761 -10.369 9.958 1.00 0.00 H new ATOM 0 HB2 ASN A 30 94.670 -10.632 9.079 1.00 0.00 H new ATOM 0 HB3 ASN A 30 94.103 -10.578 10.736 1.00 0.00 H new ATOM 0 HD21 ASN A 30 92.537 -13.919 10.503 1.00 0.00 H new ATOM 0 HD22 ASN A 30 92.227 -12.321 11.190 1.00 0.00 H new ATOM 478 N LYS A 31 92.393 -7.910 10.229 1.00 0.00 N ATOM 479 CA LYS A 31 92.623 -6.435 10.254 1.00 0.00 C ATOM 480 C LYS A 31 94.056 -6.114 9.842 1.00 0.00 C ATOM 481 O LYS A 31 94.325 -5.104 9.245 1.00 0.00 O ATOM 482 CB LYS A 31 92.386 -5.903 11.666 1.00 0.00 C ATOM 483 CG LYS A 31 93.376 -6.554 12.636 1.00 0.00 C ATOM 484 CD LYS A 31 93.020 -6.160 14.070 1.00 0.00 C ATOM 485 CE LYS A 31 94.153 -6.587 15.005 1.00 0.00 C ATOM 486 NZ LYS A 31 93.762 -6.323 16.418 1.00 0.00 N ATOM 0 H LYS A 31 91.861 -8.276 11.018 1.00 0.00 H new ATOM 0 HA LYS A 31 91.932 -5.964 9.555 1.00 0.00 H new ATOM 0 HB2 LYS A 31 92.506 -4.820 11.682 1.00 0.00 H new ATOM 0 HB3 LYS A 31 91.363 -6.115 11.978 1.00 0.00 H new ATOM 0 HG2 LYS A 31 93.348 -7.638 12.528 1.00 0.00 H new ATOM 0 HG3 LYS A 31 94.392 -6.237 12.402 1.00 0.00 H new ATOM 0 HD2 LYS A 31 92.864 -5.083 14.136 1.00 0.00 H new ATOM 0 HD3 LYS A 31 92.086 -6.636 14.370 1.00 0.00 H new ATOM 0 HE2 LYS A 31 94.370 -7.646 14.869 1.00 0.00 H new ATOM 0 HE3 LYS A 31 95.064 -6.041 14.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 94.404 -6.834 17.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 93.823 -5.303 16.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 92.786 -6.647 16.575 1.00 0.00 H new ATOM 500 N SER A 32 94.982 -6.963 10.137 1.00 0.00 N ATOM 501 CA SER A 32 96.372 -6.663 9.726 1.00 0.00 C ATOM 502 C SER A 32 96.387 -6.556 8.214 1.00 0.00 C ATOM 503 O SER A 32 97.057 -5.720 7.640 1.00 0.00 O ATOM 504 CB SER A 32 97.327 -7.754 10.175 1.00 0.00 C ATOM 505 OG SER A 32 96.894 -9.008 9.666 1.00 0.00 O ATOM 0 H SER A 32 94.845 -7.841 10.638 1.00 0.00 H new ATOM 0 HA SER A 32 96.700 -5.733 10.190 1.00 0.00 H new ATOM 0 HB2 SER A 32 98.335 -7.536 9.823 1.00 0.00 H new ATOM 0 HB3 SER A 32 97.370 -7.788 11.264 1.00 0.00 H new ATOM 0 HG SER A 32 97.513 -9.710 9.956 1.00 0.00 H new ATOM 511 N GLU A 33 95.616 -7.380 7.563 1.00 0.00 N ATOM 512 CA GLU A 33 95.548 -7.303 6.088 1.00 0.00 C ATOM 513 C GLU A 33 95.057 -5.922 5.746 1.00 0.00 C ATOM 514 O GLU A 33 95.338 -5.411 4.693 1.00 0.00 O ATOM 515 CB GLU A 33 94.585 -8.356 5.535 1.00 0.00 C ATOM 516 CG GLU A 33 95.142 -9.755 5.802 1.00 0.00 C ATOM 517 CD GLU A 33 96.401 -9.975 4.961 1.00 0.00 C ATOM 518 OE1 GLU A 33 96.516 -9.339 3.925 1.00 0.00 O ATOM 519 OE2 GLU A 33 97.229 -10.774 5.365 1.00 0.00 O ATOM 0 H GLU A 33 95.034 -8.100 7.991 1.00 0.00 H new ATOM 0 HA GLU A 33 96.527 -7.494 5.648 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.606 -8.249 6.002 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.445 -8.208 4.464 1.00 0.00 H new ATOM 0 HG2 GLU A 33 95.375 -9.869 6.861 1.00 0.00 H new ATOM 0 HG3 GLU A 33 94.393 -10.508 5.558 1.00 0.00 H new ATOM 526 N LEU A 34 94.358 -5.276 6.638 1.00 0.00 N ATOM 527 CA LEU A 34 93.930 -3.897 6.294 1.00 0.00 C ATOM 528 C LEU A 34 95.197 -3.100 6.054 1.00 0.00 C ATOM 529 O LEU A 34 95.292 -2.363 5.105 1.00 0.00 O ATOM 530 CB LEU A 34 93.099 -3.251 7.422 1.00 0.00 C ATOM 531 CG LEU A 34 92.715 -1.786 7.056 1.00 0.00 C ATOM 532 CD1 LEU A 34 91.281 -1.491 7.511 1.00 0.00 C ATOM 533 CD2 LEU A 34 93.663 -0.790 7.763 1.00 0.00 C ATOM 0 H LEU A 34 94.075 -5.627 7.553 1.00 0.00 H new ATOM 0 HA LEU A 34 93.289 -3.914 5.413 1.00 0.00 H new ATOM 0 HB2 LEU A 34 92.196 -3.836 7.595 1.00 0.00 H new ATOM 0 HB3 LEU A 34 93.669 -3.261 8.351 1.00 0.00 H new ATOM 0 HG LEU A 34 92.798 -1.673 5.975 1.00 0.00 H new ATOM 0 HD11 LEU A 34 91.021 -0.465 7.251 1.00 0.00 H new ATOM 0 HD12 LEU A 34 90.594 -2.176 7.015 1.00 0.00 H new ATOM 0 HD13 LEU A 34 91.208 -1.622 8.591 1.00 0.00 H new ATOM 0 HD21 LEU A 34 93.383 0.230 7.498 1.00 0.00 H new ATOM 0 HD22 LEU A 34 93.586 -0.918 8.843 1.00 0.00 H new ATOM 0 HD23 LEU A 34 94.689 -0.978 7.447 1.00 0.00 H new ATOM 545 N LYS A 35 96.193 -3.262 6.884 1.00 0.00 N ATOM 546 CA LYS A 35 97.447 -2.501 6.638 1.00 0.00 C ATOM 547 C LYS A 35 98.048 -2.903 5.294 1.00 0.00 C ATOM 548 O LYS A 35 98.373 -2.068 4.473 1.00 0.00 O ATOM 549 CB LYS A 35 98.455 -2.810 7.741 1.00 0.00 C ATOM 550 CG LYS A 35 99.668 -1.890 7.599 1.00 0.00 C ATOM 551 CD LYS A 35 100.672 -2.207 8.708 1.00 0.00 C ATOM 552 CE LYS A 35 101.889 -1.290 8.577 1.00 0.00 C ATOM 553 NZ LYS A 35 102.844 -1.576 9.684 1.00 0.00 N ATOM 0 H LYS A 35 96.193 -3.873 7.701 1.00 0.00 H new ATOM 0 HA LYS A 35 97.217 -1.436 6.630 1.00 0.00 H new ATOM 0 HB2 LYS A 35 97.993 -2.672 8.719 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.767 -3.853 7.681 1.00 0.00 H new ATOM 0 HG2 LYS A 35 100.132 -2.028 6.622 1.00 0.00 H new ATOM 0 HG3 LYS A 35 99.358 -0.847 7.660 1.00 0.00 H new ATOM 0 HD2 LYS A 35 100.206 -2.072 9.684 1.00 0.00 H new ATOM 0 HD3 LYS A 35 100.982 -3.250 8.645 1.00 0.00 H new ATOM 0 HE2 LYS A 35 102.374 -1.446 7.614 1.00 0.00 H new ATOM 0 HE3 LYS A 35 101.577 -0.246 8.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 103.673 -0.954 9.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 102.377 -1.406 10.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 103.150 -2.569 9.631 1.00 0.00 H new ATOM 567 N GLU A 36 98.210 -4.175 5.064 1.00 0.00 N ATOM 568 CA GLU A 36 98.802 -4.619 3.771 1.00 0.00 C ATOM 569 C GLU A 36 97.825 -4.382 2.628 1.00 0.00 C ATOM 570 O GLU A 36 98.185 -3.882 1.583 1.00 0.00 O ATOM 571 CB GLU A 36 99.152 -6.108 3.862 1.00 0.00 C ATOM 572 CG GLU A 36 99.688 -6.605 2.516 1.00 0.00 C ATOM 573 CD GLU A 36 100.188 -8.043 2.669 1.00 0.00 C ATOM 574 OE1 GLU A 36 100.199 -8.531 3.788 1.00 0.00 O ATOM 575 OE2 GLU A 36 100.551 -8.634 1.665 1.00 0.00 O ATOM 0 H GLU A 36 97.960 -4.923 5.711 1.00 0.00 H new ATOM 0 HA GLU A 36 99.705 -4.042 3.574 1.00 0.00 H new ATOM 0 HB2 GLU A 36 99.898 -6.267 4.641 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.269 -6.681 4.145 1.00 0.00 H new ATOM 0 HG2 GLU A 36 98.904 -6.559 1.760 1.00 0.00 H new ATOM 0 HG3 GLU A 36 100.498 -5.961 2.174 1.00 0.00 H new ATOM 582 N LEU A 37 96.595 -4.730 2.813 1.00 0.00 N ATOM 583 CA LEU A 37 95.608 -4.521 1.735 1.00 0.00 C ATOM 584 C LEU A 37 95.386 -3.030 1.558 1.00 0.00 C ATOM 585 O LEU A 37 95.137 -2.560 0.465 1.00 0.00 O ATOM 586 CB LEU A 37 94.286 -5.220 2.094 1.00 0.00 C ATOM 587 CG LEU A 37 93.255 -5.063 0.939 1.00 0.00 C ATOM 588 CD1 LEU A 37 92.442 -6.354 0.763 1.00 0.00 C ATOM 589 CD2 LEU A 37 92.277 -3.924 1.257 1.00 0.00 C ATOM 0 H LEU A 37 96.228 -5.152 3.666 1.00 0.00 H new ATOM 0 HA LEU A 37 95.979 -4.946 0.803 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.467 -6.277 2.286 1.00 0.00 H new ATOM 0 HB3 LEU A 37 93.880 -4.794 3.012 1.00 0.00 H new ATOM 0 HG LEU A 37 93.807 -4.845 0.025 1.00 0.00 H new ATOM 0 HD11 LEU A 37 91.726 -6.225 -0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 37 93.115 -7.178 0.526 1.00 0.00 H new ATOM 0 HD13 LEU A 37 91.907 -6.576 1.686 1.00 0.00 H new ATOM 0 HD21 LEU A 37 91.560 -3.822 0.443 1.00 0.00 H new ATOM 0 HD22 LEU A 37 91.746 -4.148 2.182 1.00 0.00 H new ATOM 0 HD23 LEU A 37 92.830 -2.992 1.372 1.00 0.00 H new ATOM 601 N LEU A 38 95.444 -2.268 2.619 1.00 0.00 N ATOM 602 CA LEU A 38 95.194 -0.802 2.445 1.00 0.00 C ATOM 603 C LEU A 38 96.343 -0.124 1.689 1.00 0.00 C ATOM 604 O LEU A 38 96.121 0.735 0.859 1.00 0.00 O ATOM 605 CB LEU A 38 95.008 -0.112 3.805 1.00 0.00 C ATOM 606 CG LEU A 38 94.812 1.404 3.615 1.00 0.00 C ATOM 607 CD1 LEU A 38 93.680 1.677 2.618 1.00 0.00 C ATOM 608 CD2 LEU A 38 94.463 2.039 4.968 1.00 0.00 C ATOM 0 H LEU A 38 95.646 -2.580 3.569 1.00 0.00 H new ATOM 0 HA LEU A 38 94.280 -0.701 1.860 1.00 0.00 H new ATOM 0 HB2 LEU A 38 94.145 -0.535 4.320 1.00 0.00 H new ATOM 0 HB3 LEU A 38 95.878 -0.297 4.436 1.00 0.00 H new ATOM 0 HG LEU A 38 95.734 1.835 3.225 1.00 0.00 H new ATOM 0 HD11 LEU A 38 93.555 2.753 2.495 1.00 0.00 H new ATOM 0 HD12 LEU A 38 93.927 1.228 1.656 1.00 0.00 H new ATOM 0 HD13 LEU A 38 92.753 1.244 2.993 1.00 0.00 H new ATOM 0 HD21 LEU A 38 94.323 3.112 4.841 1.00 0.00 H new ATOM 0 HD22 LEU A 38 93.544 1.596 5.352 1.00 0.00 H new ATOM 0 HD23 LEU A 38 95.274 1.860 5.674 1.00 0.00 H new ATOM 620 N THR A 39 97.568 -0.470 1.976 1.00 0.00 N ATOM 621 CA THR A 39 98.703 0.204 1.278 1.00 0.00 C ATOM 622 C THR A 39 98.911 -0.392 -0.117 1.00 0.00 C ATOM 623 O THR A 39 99.441 0.246 -1.003 1.00 0.00 O ATOM 624 CB THR A 39 99.983 0.034 2.100 1.00 0.00 C ATOM 625 OG1 THR A 39 99.708 0.297 3.469 1.00 0.00 O ATOM 626 CG2 THR A 39 101.037 1.016 1.593 1.00 0.00 C ATOM 0 H THR A 39 97.832 -1.183 2.656 1.00 0.00 H new ATOM 0 HA THR A 39 98.467 1.263 1.174 1.00 0.00 H new ATOM 0 HB THR A 39 100.352 -0.986 1.997 1.00 0.00 H new ATOM 0 HG1 THR A 39 99.265 -0.481 3.869 1.00 0.00 H new ATOM 0 HG21 THR A 39 101.952 0.900 2.174 1.00 0.00 H new ATOM 0 HG22 THR A 39 101.247 0.814 0.543 1.00 0.00 H new ATOM 0 HG23 THR A 39 100.666 2.035 1.700 1.00 0.00 H new ATOM 634 N ARG A 40 98.504 -1.609 -0.312 1.00 0.00 N ATOM 635 CA ARG A 40 98.679 -2.259 -1.641 1.00 0.00 C ATOM 636 C ARG A 40 97.716 -1.646 -2.650 1.00 0.00 C ATOM 637 O ARG A 40 98.010 -1.563 -3.827 1.00 0.00 O ATOM 638 CB ARG A 40 98.413 -3.765 -1.520 1.00 0.00 C ATOM 639 CG ARG A 40 99.558 -4.454 -0.753 1.00 0.00 C ATOM 640 CD ARG A 40 100.723 -4.773 -1.703 1.00 0.00 C ATOM 641 NE ARG A 40 101.770 -5.530 -0.964 1.00 0.00 N ATOM 642 CZ ARG A 40 102.683 -6.190 -1.624 1.00 0.00 C ATOM 643 NH1 ARG A 40 102.662 -6.210 -2.929 1.00 0.00 N ATOM 644 NH2 ARG A 40 103.614 -6.836 -0.977 1.00 0.00 N ATOM 0 H ARG A 40 98.053 -2.189 0.396 1.00 0.00 H new ATOM 0 HA ARG A 40 99.702 -2.101 -1.983 1.00 0.00 H new ATOM 0 HB2 ARG A 40 97.468 -3.933 -1.003 1.00 0.00 H new ATOM 0 HB3 ARG A 40 98.316 -4.204 -2.513 1.00 0.00 H new ATOM 0 HG2 ARG A 40 99.905 -3.808 0.054 1.00 0.00 H new ATOM 0 HG3 ARG A 40 99.194 -5.372 -0.292 1.00 0.00 H new ATOM 0 HD2 ARG A 40 100.366 -5.358 -2.551 1.00 0.00 H new ATOM 0 HD3 ARG A 40 101.141 -3.851 -2.106 1.00 0.00 H new ATOM 0 HE ARG A 40 101.774 -5.533 0.056 1.00 0.00 H new ATOM 0 HH11 ARG A 40 101.931 -5.709 -3.435 1.00 0.00 H new ATOM 0 HH12 ARG A 40 103.376 -6.726 -3.443 1.00 0.00 H new ATOM 0 HH21 ARG A 40 103.628 -6.825 0.043 1.00 0.00 H new ATOM 0 HH22 ARG A 40 104.328 -7.352 -1.491 1.00 0.00 H new ATOM 658 N GLU A 41 96.559 -1.232 -2.207 1.00 0.00 N ATOM 659 CA GLU A 41 95.561 -0.643 -3.150 1.00 0.00 C ATOM 660 C GLU A 41 95.580 0.864 -3.050 1.00 0.00 C ATOM 661 O GLU A 41 95.217 1.549 -3.983 1.00 0.00 O ATOM 662 CB GLU A 41 94.167 -1.150 -2.784 1.00 0.00 C ATOM 663 CG GLU A 41 94.054 -2.638 -3.123 1.00 0.00 C ATOM 664 CD GLU A 41 92.732 -3.185 -2.581 1.00 0.00 C ATOM 665 OE1 GLU A 41 92.135 -2.521 -1.749 1.00 0.00 O ATOM 666 OE2 GLU A 41 92.344 -4.262 -3.000 1.00 0.00 O ATOM 0 H GLU A 41 96.261 -1.276 -1.233 1.00 0.00 H new ATOM 0 HA GLU A 41 95.813 -0.938 -4.169 1.00 0.00 H new ATOM 0 HB2 GLU A 41 93.980 -0.994 -1.722 1.00 0.00 H new ATOM 0 HB3 GLU A 41 93.410 -0.585 -3.327 1.00 0.00 H new ATOM 0 HG2 GLU A 41 94.104 -2.781 -4.202 1.00 0.00 H new ATOM 0 HG3 GLU A 41 94.891 -3.185 -2.690 1.00 0.00 H new ATOM 673 N LEU A 42 96.005 1.395 -1.938 1.00 0.00 N ATOM 674 CA LEU A 42 96.048 2.886 -1.803 1.00 0.00 C ATOM 675 C LEU A 42 97.340 3.286 -1.070 1.00 0.00 C ATOM 676 O LEU A 42 97.315 3.559 0.115 1.00 0.00 O ATOM 677 CB LEU A 42 94.843 3.379 -0.984 1.00 0.00 C ATOM 678 CG LEU A 42 93.512 2.958 -1.637 1.00 0.00 C ATOM 679 CD1 LEU A 42 92.360 3.198 -0.654 1.00 0.00 C ATOM 680 CD2 LEU A 42 93.261 3.789 -2.908 1.00 0.00 C ATOM 0 H LEU A 42 96.322 0.872 -1.122 1.00 0.00 H new ATOM 0 HA LEU A 42 96.018 3.334 -2.796 1.00 0.00 H new ATOM 0 HB2 LEU A 42 94.898 2.975 0.027 1.00 0.00 H new ATOM 0 HB3 LEU A 42 94.880 4.465 -0.896 1.00 0.00 H new ATOM 0 HG LEU A 42 93.567 1.901 -1.898 1.00 0.00 H new ATOM 0 HD11 LEU A 42 91.419 2.900 -1.116 1.00 0.00 H new ATOM 0 HD12 LEU A 42 92.523 2.609 0.249 1.00 0.00 H new ATOM 0 HD13 LEU A 42 92.318 4.256 -0.394 1.00 0.00 H new ATOM 0 HD21 LEU A 42 92.318 3.484 -3.362 1.00 0.00 H new ATOM 0 HD22 LEU A 42 93.213 4.846 -2.648 1.00 0.00 H new ATOM 0 HD23 LEU A 42 94.074 3.626 -3.616 1.00 0.00 H new ATOM 692 N PRO A 43 98.468 3.306 -1.749 1.00 0.00 N ATOM 693 CA PRO A 43 99.759 3.667 -1.092 1.00 0.00 C ATOM 694 C PRO A 43 99.925 5.192 -0.895 1.00 0.00 C ATOM 695 O PRO A 43 99.336 5.768 -0.002 1.00 0.00 O ATOM 696 CB PRO A 43 100.774 3.083 -2.089 1.00 0.00 C ATOM 697 CG PRO A 43 100.071 2.970 -3.453 1.00 0.00 C ATOM 698 CD PRO A 43 98.549 2.972 -3.201 1.00 0.00 C ATOM 0 HA PRO A 43 99.862 3.282 -0.077 1.00 0.00 H new ATOM 0 HB2 PRO A 43 101.652 3.725 -2.162 1.00 0.00 H new ATOM 0 HB3 PRO A 43 101.121 2.105 -1.754 1.00 0.00 H new ATOM 0 HG2 PRO A 43 100.352 3.802 -4.098 1.00 0.00 H new ATOM 0 HG3 PRO A 43 100.372 2.055 -3.963 1.00 0.00 H new ATOM 0 HD2 PRO A 43 98.036 3.710 -3.817 1.00 0.00 H new ATOM 0 HD3 PRO A 43 98.099 2.004 -3.421 1.00 0.00 H new ATOM 706 N SER A 44 100.722 5.847 -1.703 1.00 0.00 N ATOM 707 CA SER A 44 100.915 7.321 -1.536 1.00 0.00 C ATOM 708 C SER A 44 99.576 8.041 -1.700 1.00 0.00 C ATOM 709 O SER A 44 99.270 8.969 -0.983 1.00 0.00 O ATOM 710 CB SER A 44 101.895 7.826 -2.595 1.00 0.00 C ATOM 711 OG SER A 44 103.168 7.235 -2.374 1.00 0.00 O ATOM 0 H SER A 44 101.246 5.426 -2.470 1.00 0.00 H new ATOM 0 HA SER A 44 101.312 7.522 -0.541 1.00 0.00 H new ATOM 0 HB2 SER A 44 101.533 7.575 -3.592 1.00 0.00 H new ATOM 0 HB3 SER A 44 101.972 8.912 -2.548 1.00 0.00 H new ATOM 0 HG SER A 44 103.799 7.555 -3.052 1.00 0.00 H new ATOM 717 N PHE A 45 98.781 7.604 -2.637 1.00 0.00 N ATOM 718 CA PHE A 45 97.444 8.228 -2.888 1.00 0.00 C ATOM 719 C PHE A 45 96.611 8.273 -1.602 1.00 0.00 C ATOM 720 O PHE A 45 95.476 8.707 -1.596 1.00 0.00 O ATOM 721 CB PHE A 45 96.711 7.357 -3.882 1.00 0.00 C ATOM 722 CG PHE A 45 97.386 7.454 -5.230 1.00 0.00 C ATOM 723 CD1 PHE A 45 97.045 8.488 -6.111 1.00 0.00 C ATOM 724 CD2 PHE A 45 98.356 6.514 -5.593 1.00 0.00 C ATOM 725 CE1 PHE A 45 97.675 8.579 -7.359 1.00 0.00 C ATOM 726 CE2 PHE A 45 98.985 6.606 -6.841 1.00 0.00 C ATOM 727 CZ PHE A 45 98.644 7.637 -7.724 1.00 0.00 C ATOM 0 H PHE A 45 99.004 6.823 -3.255 1.00 0.00 H new ATOM 0 HA PHE A 45 97.586 9.244 -3.256 1.00 0.00 H new ATOM 0 HB2 PHE A 45 96.705 6.322 -3.540 1.00 0.00 H new ATOM 0 HB3 PHE A 45 95.671 7.673 -3.961 1.00 0.00 H new ATOM 0 HD1 PHE A 45 96.297 9.214 -5.829 1.00 0.00 H new ATOM 0 HD2 PHE A 45 98.620 5.718 -4.912 1.00 0.00 H new ATOM 0 HE1 PHE A 45 97.413 9.376 -8.039 1.00 0.00 H new ATOM 0 HE2 PHE A 45 99.734 5.881 -7.122 1.00 0.00 H new ATOM 0 HZ PHE A 45 99.128 7.706 -8.687 1.00 0.00 H new ATOM 737 N LEU A 46 97.173 7.811 -0.529 1.00 0.00 N ATOM 738 CA LEU A 46 96.455 7.783 0.787 1.00 0.00 C ATOM 739 C LEU A 46 97.245 8.638 1.752 1.00 0.00 C ATOM 740 O LEU A 46 96.762 9.609 2.300 1.00 0.00 O ATOM 741 CB LEU A 46 96.427 6.344 1.311 1.00 0.00 C ATOM 742 CG LEU A 46 95.534 6.235 2.561 1.00 0.00 C ATOM 743 CD1 LEU A 46 94.045 6.287 2.171 1.00 0.00 C ATOM 744 CD2 LEU A 46 95.818 4.909 3.276 1.00 0.00 C ATOM 0 H LEU A 46 98.123 7.440 -0.498 1.00 0.00 H new ATOM 0 HA LEU A 46 95.435 8.152 0.681 1.00 0.00 H new ATOM 0 HB2 LEU A 46 96.056 5.676 0.534 1.00 0.00 H new ATOM 0 HB3 LEU A 46 97.439 6.020 1.552 1.00 0.00 H new ATOM 0 HG LEU A 46 95.756 7.074 3.221 1.00 0.00 H new ATOM 0 HD11 LEU A 46 93.431 6.208 3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 46 93.833 7.230 1.668 1.00 0.00 H new ATOM 0 HD13 LEU A 46 93.815 5.459 1.501 1.00 0.00 H new ATOM 0 HD21 LEU A 46 95.187 4.830 4.161 1.00 0.00 H new ATOM 0 HD22 LEU A 46 95.604 4.079 2.602 1.00 0.00 H new ATOM 0 HD23 LEU A 46 96.866 4.873 3.574 1.00 0.00 H new ATOM 756 N GLY A 47 98.484 8.294 1.928 1.00 0.00 N ATOM 757 CA GLY A 47 99.359 9.087 2.813 1.00 0.00 C ATOM 758 C GLY A 47 99.793 10.310 2.026 1.00 0.00 C ATOM 759 O GLY A 47 100.854 10.858 2.244 1.00 0.00 O ATOM 0 H GLY A 47 98.930 7.488 1.490 1.00 0.00 H new ATOM 0 HA2 GLY A 47 98.828 9.380 3.719 1.00 0.00 H new ATOM 0 HA3 GLY A 47 100.224 8.502 3.125 1.00 0.00 H new ATOM 763 N LYS A 48 98.978 10.725 1.077 1.00 0.00 N ATOM 764 CA LYS A 48 99.342 11.900 0.234 1.00 0.00 C ATOM 765 C LYS A 48 99.952 13.001 1.123 1.00 0.00 C ATOM 766 O LYS A 48 100.970 13.580 0.802 1.00 0.00 O ATOM 767 CB LYS A 48 98.074 12.467 -0.456 1.00 0.00 C ATOM 768 CG LYS A 48 97.844 11.798 -1.819 1.00 0.00 C ATOM 769 CD LYS A 48 98.732 12.450 -2.901 1.00 0.00 C ATOM 770 CE LYS A 48 98.020 13.665 -3.510 1.00 0.00 C ATOM 771 NZ LYS A 48 96.931 13.200 -4.414 1.00 0.00 N ATOM 0 H LYS A 48 98.079 10.296 0.856 1.00 0.00 H new ATOM 0 HA LYS A 48 100.062 11.584 -0.520 1.00 0.00 H new ATOM 0 HB2 LYS A 48 97.206 12.307 0.183 1.00 0.00 H new ATOM 0 HB3 LYS A 48 98.178 13.544 -0.588 1.00 0.00 H new ATOM 0 HG2 LYS A 48 98.068 10.733 -1.750 1.00 0.00 H new ATOM 0 HG3 LYS A 48 96.795 11.886 -2.101 1.00 0.00 H new ATOM 0 HD2 LYS A 48 99.683 12.757 -2.465 1.00 0.00 H new ATOM 0 HD3 LYS A 48 98.959 11.724 -3.681 1.00 0.00 H new ATOM 0 HE2 LYS A 48 97.608 14.293 -2.720 1.00 0.00 H new ATOM 0 HE3 LYS A 48 98.731 14.277 -4.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 96.688 13.958 -5.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 97.251 12.362 -4.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 96.092 12.955 -3.850 1.00 0.00 H new ATOM 785 N ARG A 49 99.331 13.286 2.239 1.00 0.00 N ATOM 786 CA ARG A 49 99.867 14.343 3.149 1.00 0.00 C ATOM 787 C ARG A 49 101.015 13.774 3.985 1.00 0.00 C ATOM 788 O ARG A 49 101.126 12.580 4.180 1.00 0.00 O ATOM 789 CB ARG A 49 98.762 14.830 4.089 1.00 0.00 C ATOM 790 CG ARG A 49 97.727 15.631 3.301 1.00 0.00 C ATOM 791 CD ARG A 49 96.637 16.128 4.253 1.00 0.00 C ATOM 792 NE ARG A 49 96.094 14.983 5.059 1.00 0.00 N ATOM 793 CZ ARG A 49 95.587 13.917 4.494 1.00 0.00 C ATOM 794 NH1 ARG A 49 95.355 13.890 3.210 1.00 0.00 N ATOM 795 NH2 ARG A 49 95.255 12.892 5.232 1.00 0.00 N ATOM 0 H ARG A 49 98.476 12.832 2.560 1.00 0.00 H new ATOM 0 HA ARG A 49 100.228 15.176 2.545 1.00 0.00 H new ATOM 0 HB2 ARG A 49 98.284 13.979 4.574 1.00 0.00 H new ATOM 0 HB3 ARG A 49 99.190 15.448 4.878 1.00 0.00 H new ATOM 0 HG2 ARG A 49 98.205 16.476 2.805 1.00 0.00 H new ATOM 0 HG3 ARG A 49 97.288 15.010 2.520 1.00 0.00 H new ATOM 0 HD2 ARG A 49 97.044 16.890 4.918 1.00 0.00 H new ATOM 0 HD3 ARG A 49 95.833 16.596 3.685 1.00 0.00 H new ATOM 0 HE ARG A 49 96.121 15.038 6.077 1.00 0.00 H new ATOM 0 HH11 ARG A 49 95.569 14.705 2.636 1.00 0.00 H new ATOM 0 HH12 ARG A 49 94.960 13.053 2.781 1.00 0.00 H new ATOM 0 HH21 ARG A 49 95.391 12.925 6.242 1.00 0.00 H new ATOM 0 HH22 ARG A 49 94.859 12.058 4.798 1.00 0.00 H new ATOM 809 N THR A 50 101.870 14.628 4.484 1.00 0.00 N ATOM 810 CA THR A 50 103.016 14.155 5.315 1.00 0.00 C ATOM 811 C THR A 50 102.616 14.164 6.796 1.00 0.00 C ATOM 812 O THR A 50 103.388 13.792 7.656 1.00 0.00 O ATOM 813 CB THR A 50 104.213 15.089 5.106 1.00 0.00 C ATOM 814 OG1 THR A 50 103.887 16.388 5.580 1.00 0.00 O ATOM 815 CG2 THR A 50 104.553 15.158 3.617 1.00 0.00 C ATOM 0 H THR A 50 101.823 15.638 4.351 1.00 0.00 H new ATOM 0 HA THR A 50 103.285 13.141 5.019 1.00 0.00 H new ATOM 0 HB THR A 50 105.073 14.707 5.656 1.00 0.00 H new ATOM 0 HG1 THR A 50 104.652 16.986 5.448 1.00 0.00 H new ATOM 0 HG21 THR A 50 105.404 15.822 3.469 1.00 0.00 H new ATOM 0 HG22 THR A 50 104.803 14.161 3.254 1.00 0.00 H new ATOM 0 HG23 THR A 50 103.694 15.540 3.065 1.00 0.00 H new ATOM 823 N ASP A 51 101.416 14.594 7.100 1.00 0.00 N ATOM 824 CA ASP A 51 100.972 14.634 8.528 1.00 0.00 C ATOM 825 C ASP A 51 100.281 13.320 8.897 1.00 0.00 C ATOM 826 O ASP A 51 99.786 13.167 9.996 1.00 0.00 O ATOM 827 CB ASP A 51 99.996 15.797 8.730 1.00 0.00 C ATOM 828 CG ASP A 51 98.699 15.524 7.966 1.00 0.00 C ATOM 829 OD1 ASP A 51 97.952 14.660 8.397 1.00 0.00 O ATOM 830 OD2 ASP A 51 98.476 16.183 6.965 1.00 0.00 O ATOM 0 H ASP A 51 100.726 14.918 6.423 1.00 0.00 H new ATOM 0 HA ASP A 51 101.843 14.773 9.168 1.00 0.00 H new ATOM 0 HB2 ASP A 51 99.783 15.925 9.791 1.00 0.00 H new ATOM 0 HB3 ASP A 51 100.446 16.726 8.381 1.00 0.00 H new ATOM 835 N GLU A 52 100.256 12.375 7.984 1.00 0.00 N ATOM 836 CA GLU A 52 99.605 11.044 8.240 1.00 0.00 C ATOM 837 C GLU A 52 98.435 11.181 9.231 1.00 0.00 C ATOM 838 O GLU A 52 97.323 11.470 8.844 1.00 0.00 O ATOM 839 CB GLU A 52 100.659 10.063 8.799 1.00 0.00 C ATOM 840 CG GLU A 52 101.717 10.828 9.604 1.00 0.00 C ATOM 841 CD GLU A 52 102.726 9.838 10.187 1.00 0.00 C ATOM 842 OE1 GLU A 52 102.295 8.850 10.760 1.00 0.00 O ATOM 843 OE2 GLU A 52 103.913 10.081 10.046 1.00 0.00 O ATOM 0 H GLU A 52 100.666 12.471 7.055 1.00 0.00 H new ATOM 0 HA GLU A 52 99.205 10.663 7.300 1.00 0.00 H new ATOM 0 HB2 GLU A 52 100.175 9.320 9.433 1.00 0.00 H new ATOM 0 HB3 GLU A 52 101.134 9.522 7.980 1.00 0.00 H new ATOM 0 HG2 GLU A 52 102.226 11.548 8.964 1.00 0.00 H new ATOM 0 HG3 GLU A 52 101.241 11.394 10.405 1.00 0.00 H new ATOM 850 N ALA A 53 98.683 10.976 10.500 1.00 0.00 N ATOM 851 CA ALA A 53 97.593 11.092 11.521 1.00 0.00 C ATOM 852 C ALA A 53 96.423 10.171 11.155 1.00 0.00 C ATOM 853 O ALA A 53 96.255 9.121 11.734 1.00 0.00 O ATOM 854 CB ALA A 53 97.109 12.546 11.604 1.00 0.00 C ATOM 0 H ALA A 53 99.599 10.732 10.877 1.00 0.00 H new ATOM 0 HA ALA A 53 97.986 10.790 12.492 1.00 0.00 H new ATOM 0 HB1 ALA A 53 96.316 12.624 12.348 1.00 0.00 H new ATOM 0 HB2 ALA A 53 97.940 13.190 11.890 1.00 0.00 H new ATOM 0 HB3 ALA A 53 96.726 12.858 10.632 1.00 0.00 H new ATOM 860 N ALA A 54 95.608 10.533 10.207 1.00 0.00 N ATOM 861 CA ALA A 54 94.484 9.626 9.855 1.00 0.00 C ATOM 862 C ALA A 54 95.070 8.295 9.401 1.00 0.00 C ATOM 863 O ALA A 54 94.554 7.237 9.694 1.00 0.00 O ATOM 864 CB ALA A 54 93.628 10.222 8.749 1.00 0.00 C ATOM 0 H ALA A 54 95.668 11.398 9.671 1.00 0.00 H new ATOM 0 HA ALA A 54 93.845 9.484 10.727 1.00 0.00 H new ATOM 0 HB1 ALA A 54 92.813 9.538 8.511 1.00 0.00 H new ATOM 0 HB2 ALA A 54 93.216 11.175 9.081 1.00 0.00 H new ATOM 0 HB3 ALA A 54 94.240 10.381 7.861 1.00 0.00 H new ATOM 870 N PHE A 55 96.172 8.323 8.715 1.00 0.00 N ATOM 871 CA PHE A 55 96.788 7.043 8.297 1.00 0.00 C ATOM 872 C PHE A 55 97.004 6.234 9.568 1.00 0.00 C ATOM 873 O PHE A 55 96.770 5.043 9.622 1.00 0.00 O ATOM 874 CB PHE A 55 98.138 7.303 7.642 1.00 0.00 C ATOM 875 CG PHE A 55 98.743 5.985 7.226 1.00 0.00 C ATOM 876 CD1 PHE A 55 99.564 5.286 8.120 1.00 0.00 C ATOM 877 CD2 PHE A 55 98.482 5.458 5.958 1.00 0.00 C ATOM 878 CE1 PHE A 55 100.123 4.060 7.745 1.00 0.00 C ATOM 879 CE2 PHE A 55 99.041 4.231 5.581 1.00 0.00 C ATOM 880 CZ PHE A 55 99.861 3.531 6.475 1.00 0.00 C ATOM 0 H PHE A 55 96.668 9.167 8.429 1.00 0.00 H new ATOM 0 HA PHE A 55 96.152 6.520 7.583 1.00 0.00 H new ATOM 0 HB2 PHE A 55 98.017 7.952 6.775 1.00 0.00 H new ATOM 0 HB3 PHE A 55 98.801 7.819 8.337 1.00 0.00 H new ATOM 0 HD1 PHE A 55 99.766 5.694 9.099 1.00 0.00 H new ATOM 0 HD2 PHE A 55 97.849 5.997 5.269 1.00 0.00 H new ATOM 0 HE1 PHE A 55 100.756 3.522 8.434 1.00 0.00 H new ATOM 0 HE2 PHE A 55 98.840 3.824 4.601 1.00 0.00 H new ATOM 0 HZ PHE A 55 100.291 2.584 6.185 1.00 0.00 H new ATOM 890 N GLN A 56 97.417 6.905 10.607 1.00 0.00 N ATOM 891 CA GLN A 56 97.619 6.214 11.906 1.00 0.00 C ATOM 892 C GLN A 56 96.245 5.834 12.452 1.00 0.00 C ATOM 893 O GLN A 56 96.106 4.905 13.217 1.00 0.00 O ATOM 894 CB GLN A 56 98.352 7.128 12.898 1.00 0.00 C ATOM 895 CG GLN A 56 99.767 7.412 12.390 1.00 0.00 C ATOM 896 CD GLN A 56 100.595 6.125 12.415 1.00 0.00 C ATOM 897 OE1 GLN A 56 100.490 5.338 13.336 1.00 0.00 O ATOM 898 NE2 GLN A 56 101.431 5.884 11.442 1.00 0.00 N ATOM 0 H GLN A 56 97.623 7.904 10.610 1.00 0.00 H new ATOM 0 HA GLN A 56 98.232 5.324 11.764 1.00 0.00 H new ATOM 0 HB2 GLN A 56 97.804 8.063 13.019 1.00 0.00 H new ATOM 0 HB3 GLN A 56 98.396 6.655 13.879 1.00 0.00 H new ATOM 0 HG2 GLN A 56 99.726 7.809 11.376 1.00 0.00 H new ATOM 0 HG3 GLN A 56 100.241 8.172 13.011 1.00 0.00 H new ATOM 0 HE21 GLN A 56 101.519 6.544 10.670 1.00 0.00 H new ATOM 0 HE22 GLN A 56 101.997 5.035 11.454 1.00 0.00 H new ATOM 907 N LYS A 57 95.226 6.539 12.042 1.00 0.00 N ATOM 908 CA LYS A 57 93.851 6.196 12.516 1.00 0.00 C ATOM 909 C LYS A 57 93.454 4.870 11.882 1.00 0.00 C ATOM 910 O LYS A 57 92.898 4.005 12.529 1.00 0.00 O ATOM 911 CB LYS A 57 92.851 7.307 12.148 1.00 0.00 C ATOM 912 CG LYS A 57 91.454 6.931 12.646 1.00 0.00 C ATOM 913 CD LYS A 57 90.562 8.176 12.702 1.00 0.00 C ATOM 914 CE LYS A 57 90.368 8.738 11.292 1.00 0.00 C ATOM 915 NZ LYS A 57 89.175 9.631 11.276 1.00 0.00 N ATOM 0 H LYS A 57 95.283 7.333 11.404 1.00 0.00 H new ATOM 0 HA LYS A 57 93.840 6.106 13.602 1.00 0.00 H new ATOM 0 HB2 LYS A 57 93.163 8.252 12.592 1.00 0.00 H new ATOM 0 HB3 LYS A 57 92.835 7.452 11.068 1.00 0.00 H new ATOM 0 HG2 LYS A 57 91.012 6.187 11.984 1.00 0.00 H new ATOM 0 HG3 LYS A 57 91.522 6.478 13.635 1.00 0.00 H new ATOM 0 HD2 LYS A 57 89.596 7.923 13.139 1.00 0.00 H new ATOM 0 HD3 LYS A 57 91.015 8.931 13.345 1.00 0.00 H new ATOM 0 HE2 LYS A 57 91.255 9.292 10.984 1.00 0.00 H new ATOM 0 HE3 LYS A 57 90.237 7.924 10.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 88.981 9.933 10.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 88.352 9.117 11.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 89.359 10.467 11.867 1.00 0.00 H new ATOM 929 N LEU A 58 93.788 4.672 10.634 1.00 0.00 N ATOM 930 CA LEU A 58 93.480 3.362 10.005 1.00 0.00 C ATOM 931 C LEU A 58 94.385 2.365 10.704 1.00 0.00 C ATOM 932 O LEU A 58 93.999 1.272 11.050 1.00 0.00 O ATOM 933 CB LEU A 58 93.795 3.384 8.497 1.00 0.00 C ATOM 934 CG LEU A 58 92.607 3.944 7.701 1.00 0.00 C ATOM 935 CD1 LEU A 58 91.391 2.998 7.787 1.00 0.00 C ATOM 936 CD2 LEU A 58 92.234 5.331 8.241 1.00 0.00 C ATOM 0 H LEU A 58 94.254 5.352 10.033 1.00 0.00 H new ATOM 0 HA LEU A 58 92.424 3.112 10.104 1.00 0.00 H new ATOM 0 HB2 LEU A 58 94.680 3.993 8.315 1.00 0.00 H new ATOM 0 HB3 LEU A 58 94.026 2.375 8.154 1.00 0.00 H new ATOM 0 HG LEU A 58 92.898 4.027 6.654 1.00 0.00 H new ATOM 0 HD11 LEU A 58 90.563 3.417 7.215 1.00 0.00 H new ATOM 0 HD12 LEU A 58 91.658 2.024 7.378 1.00 0.00 H new ATOM 0 HD13 LEU A 58 91.092 2.884 8.829 1.00 0.00 H new ATOM 0 HD21 LEU A 58 91.391 5.727 7.675 1.00 0.00 H new ATOM 0 HD22 LEU A 58 91.959 5.250 9.293 1.00 0.00 H new ATOM 0 HD23 LEU A 58 93.087 6.002 8.139 1.00 0.00 H new ATOM 948 N MET A 59 95.590 2.770 10.955 1.00 0.00 N ATOM 949 CA MET A 59 96.519 1.878 11.683 1.00 0.00 C ATOM 950 C MET A 59 95.910 1.637 13.052 1.00 0.00 C ATOM 951 O MET A 59 95.928 0.541 13.580 1.00 0.00 O ATOM 952 CB MET A 59 97.902 2.533 11.828 1.00 0.00 C ATOM 953 CG MET A 59 98.961 1.468 12.115 1.00 0.00 C ATOM 954 SD MET A 59 100.561 2.273 12.372 1.00 0.00 S ATOM 955 CE MET A 59 101.508 0.779 12.750 1.00 0.00 C ATOM 0 H MET A 59 95.971 3.678 10.688 1.00 0.00 H new ATOM 0 HA MET A 59 96.658 0.943 11.141 1.00 0.00 H new ATOM 0 HB2 MET A 59 98.155 3.072 10.915 1.00 0.00 H new ATOM 0 HB3 MET A 59 97.883 3.265 12.635 1.00 0.00 H new ATOM 0 HG2 MET A 59 98.684 0.892 12.998 1.00 0.00 H new ATOM 0 HG3 MET A 59 99.023 0.766 11.283 1.00 0.00 H new ATOM 0 HE1 MET A 59 102.546 1.046 12.946 1.00 0.00 H new ATOM 0 HE2 MET A 59 101.086 0.294 13.630 1.00 0.00 H new ATOM 0 HE3 MET A 59 101.463 0.096 11.902 1.00 0.00 H new ATOM 965 N SER A 60 95.350 2.666 13.620 1.00 0.00 N ATOM 966 CA SER A 60 94.709 2.516 14.952 1.00 0.00 C ATOM 967 C SER A 60 93.560 1.522 14.828 1.00 0.00 C ATOM 968 O SER A 60 93.182 0.881 15.787 1.00 0.00 O ATOM 969 CB SER A 60 94.170 3.865 15.430 1.00 0.00 C ATOM 970 OG SER A 60 93.837 3.776 16.810 1.00 0.00 O ATOM 0 H SER A 60 95.309 3.603 13.220 1.00 0.00 H new ATOM 0 HA SER A 60 95.442 2.157 15.674 1.00 0.00 H new ATOM 0 HB2 SER A 60 94.916 4.644 15.274 1.00 0.00 H new ATOM 0 HB3 SER A 60 93.291 4.145 14.849 1.00 0.00 H new ATOM 0 HG SER A 60 93.493 4.640 17.120 1.00 0.00 H new ATOM 976 N ASN A 61 93.007 1.369 13.654 1.00 0.00 N ATOM 977 CA ASN A 61 91.892 0.385 13.508 1.00 0.00 C ATOM 978 C ASN A 61 92.485 -0.998 13.711 1.00 0.00 C ATOM 979 O ASN A 61 91.865 -1.884 14.263 1.00 0.00 O ATOM 980 CB ASN A 61 91.238 0.482 12.126 1.00 0.00 C ATOM 981 CG ASN A 61 90.631 1.874 11.947 1.00 0.00 C ATOM 982 OD1 ASN A 61 90.345 2.289 10.840 1.00 0.00 O ATOM 983 ND2 ASN A 61 90.421 2.618 12.997 1.00 0.00 N ATOM 0 H ASN A 61 93.271 1.870 12.806 1.00 0.00 H new ATOM 0 HA ASN A 61 91.114 0.592 14.243 1.00 0.00 H new ATOM 0 HB2 ASN A 61 91.977 0.293 11.348 1.00 0.00 H new ATOM 0 HB3 ASN A 61 90.465 -0.280 12.023 1.00 0.00 H new ATOM 0 HD21 ASN A 61 90.017 3.548 12.890 1.00 0.00 H new ATOM 0 HD22 ASN A 61 90.661 2.270 13.925 1.00 0.00 H new ATOM 990 N LEU A 62 93.713 -1.175 13.306 1.00 0.00 N ATOM 991 CA LEU A 62 94.379 -2.482 13.514 1.00 0.00 C ATOM 992 C LEU A 62 94.381 -2.692 15.022 1.00 0.00 C ATOM 993 O LEU A 62 94.277 -3.792 15.528 1.00 0.00 O ATOM 994 CB LEU A 62 95.821 -2.416 13.002 1.00 0.00 C ATOM 995 CG LEU A 62 95.843 -1.855 11.579 1.00 0.00 C ATOM 996 CD1 LEU A 62 97.292 -1.622 11.154 1.00 0.00 C ATOM 997 CD2 LEU A 62 95.180 -2.840 10.614 1.00 0.00 C ATOM 0 H LEU A 62 94.281 -0.467 12.840 1.00 0.00 H new ATOM 0 HA LEU A 62 93.873 -3.290 12.985 1.00 0.00 H new ATOM 0 HB2 LEU A 62 96.421 -1.787 13.660 1.00 0.00 H new ATOM 0 HB3 LEU A 62 96.267 -3.410 13.017 1.00 0.00 H new ATOM 0 HG LEU A 62 95.294 -0.914 11.556 1.00 0.00 H new ATOM 0 HD11 LEU A 62 97.314 -1.222 10.140 1.00 0.00 H new ATOM 0 HD12 LEU A 62 97.761 -0.912 11.835 1.00 0.00 H new ATOM 0 HD13 LEU A 62 97.836 -2.566 11.183 1.00 0.00 H new ATOM 0 HD21 LEU A 62 95.201 -2.430 9.604 1.00 0.00 H new ATOM 0 HD22 LEU A 62 95.720 -3.787 10.633 1.00 0.00 H new ATOM 0 HD23 LEU A 62 94.146 -3.006 10.917 1.00 0.00 H new ATOM 1009 N ASP A 63 94.460 -1.598 15.735 1.00 0.00 N ATOM 1010 CA ASP A 63 94.425 -1.637 17.218 1.00 0.00 C ATOM 1011 C ASP A 63 92.961 -1.508 17.644 1.00 0.00 C ATOM 1012 O ASP A 63 92.642 -0.916 18.656 1.00 0.00 O ATOM 1013 CB ASP A 63 95.231 -0.461 17.778 1.00 0.00 C ATOM 1014 CG ASP A 63 95.375 -0.612 19.293 1.00 0.00 C ATOM 1015 OD1 ASP A 63 94.629 -1.391 19.864 1.00 0.00 O ATOM 1016 OD2 ASP A 63 96.227 0.054 19.856 1.00 0.00 O ATOM 0 H ASP A 63 94.549 -0.663 15.338 1.00 0.00 H new ATOM 0 HA ASP A 63 94.855 -2.565 17.594 1.00 0.00 H new ATOM 0 HB2 ASP A 63 96.215 -0.426 17.311 1.00 0.00 H new ATOM 0 HB3 ASP A 63 94.733 0.479 17.542 1.00 0.00 H new ATOM 1021 N SER A 64 92.070 -2.047 16.852 1.00 0.00 N ATOM 1022 CA SER A 64 90.617 -1.955 17.172 1.00 0.00 C ATOM 1023 C SER A 64 90.349 -2.597 18.535 1.00 0.00 C ATOM 1024 O SER A 64 91.076 -3.463 18.979 1.00 0.00 O ATOM 1025 CB SER A 64 89.812 -2.679 16.091 1.00 0.00 C ATOM 1026 OG SER A 64 90.466 -3.897 15.754 1.00 0.00 O ATOM 0 H SER A 64 92.290 -2.550 15.992 1.00 0.00 H new ATOM 0 HA SER A 64 90.317 -0.908 17.206 1.00 0.00 H new ATOM 0 HB2 SER A 64 88.802 -2.882 16.448 1.00 0.00 H new ATOM 0 HB3 SER A 64 89.717 -2.047 15.208 1.00 0.00 H new ATOM 0 HG SER A 64 89.854 -4.648 15.901 1.00 0.00 H new ATOM 1032 N ASN A 65 89.320 -2.162 19.210 1.00 0.00 N ATOM 1033 CA ASN A 65 89.014 -2.726 20.554 1.00 0.00 C ATOM 1034 C ASN A 65 88.588 -4.196 20.457 1.00 0.00 C ATOM 1035 O ASN A 65 88.965 -5.005 21.283 1.00 0.00 O ATOM 1036 CB ASN A 65 87.874 -1.926 21.186 1.00 0.00 C ATOM 1037 CG ASN A 65 88.370 -0.528 21.556 1.00 0.00 C ATOM 1038 OD1 ASN A 65 89.550 -0.321 21.752 1.00 0.00 O ATOM 1039 ND2 ASN A 65 87.510 0.448 21.661 1.00 0.00 N ATOM 0 H ASN A 65 88.677 -1.439 18.887 1.00 0.00 H new ATOM 0 HA ASN A 65 89.916 -2.663 21.163 1.00 0.00 H new ATOM 0 HB2 ASN A 65 87.038 -1.854 20.490 1.00 0.00 H new ATOM 0 HB3 ASN A 65 87.506 -2.439 22.074 1.00 0.00 H new ATOM 0 HD21 ASN A 65 87.829 1.385 21.908 1.00 0.00 H new ATOM 0 HD22 ASN A 65 86.519 0.274 21.496 1.00 0.00 H new ATOM 1046 N ARG A 66 87.793 -4.557 19.475 1.00 0.00 N ATOM 1047 CA ARG A 66 87.340 -5.986 19.367 1.00 0.00 C ATOM 1048 C ARG A 66 87.248 -6.438 17.904 1.00 0.00 C ATOM 1049 O ARG A 66 86.852 -7.551 17.626 1.00 0.00 O ATOM 1050 CB ARG A 66 85.962 -6.130 20.023 1.00 0.00 C ATOM 1051 CG ARG A 66 86.100 -5.992 21.541 1.00 0.00 C ATOM 1052 CD ARG A 66 84.724 -6.136 22.194 1.00 0.00 C ATOM 1053 NE ARG A 66 84.155 -7.473 21.867 1.00 0.00 N ATOM 1054 CZ ARG A 66 83.137 -7.927 22.543 1.00 0.00 C ATOM 1055 NH1 ARG A 66 82.625 -7.210 23.505 1.00 0.00 N ATOM 1056 NH2 ARG A 66 82.634 -9.097 22.260 1.00 0.00 N ATOM 0 H ARG A 66 87.440 -3.932 18.750 1.00 0.00 H new ATOM 0 HA ARG A 66 88.074 -6.613 19.873 1.00 0.00 H new ATOM 0 HB2 ARG A 66 85.283 -5.368 19.639 1.00 0.00 H new ATOM 0 HB3 ARG A 66 85.529 -7.098 19.773 1.00 0.00 H new ATOM 0 HG2 ARG A 66 86.778 -6.753 21.926 1.00 0.00 H new ATOM 0 HG3 ARG A 66 86.533 -5.024 21.791 1.00 0.00 H new ATOM 0 HD2 ARG A 66 84.809 -6.020 23.274 1.00 0.00 H new ATOM 0 HD3 ARG A 66 84.058 -5.349 21.840 1.00 0.00 H new ATOM 0 HE ARG A 66 84.561 -8.032 21.116 1.00 0.00 H new ATOM 0 HH11 ARG A 66 83.021 -6.297 23.727 1.00 0.00 H new ATOM 0 HH12 ARG A 66 81.828 -7.563 24.036 1.00 0.00 H new ATOM 0 HH21 ARG A 66 83.037 -9.657 21.509 1.00 0.00 H new ATOM 0 HH22 ARG A 66 81.837 -9.451 22.790 1.00 0.00 H new ATOM 1070 N ASP A 67 87.604 -5.606 16.963 1.00 0.00 N ATOM 1071 CA ASP A 67 87.518 -6.039 15.534 1.00 0.00 C ATOM 1072 C ASP A 67 88.771 -6.846 15.184 1.00 0.00 C ATOM 1073 O ASP A 67 89.849 -6.303 15.046 1.00 0.00 O ATOM 1074 CB ASP A 67 87.425 -4.808 14.629 1.00 0.00 C ATOM 1075 CG ASP A 67 87.094 -5.247 13.202 1.00 0.00 C ATOM 1076 OD1 ASP A 67 87.342 -6.399 12.883 1.00 0.00 O ATOM 1077 OD2 ASP A 67 86.600 -4.423 12.450 1.00 0.00 O ATOM 0 H ASP A 67 87.946 -4.657 17.116 1.00 0.00 H new ATOM 0 HA ASP A 67 86.631 -6.655 15.386 1.00 0.00 H new ATOM 0 HB2 ASP A 67 86.657 -4.129 14.999 1.00 0.00 H new ATOM 0 HB3 ASP A 67 88.368 -4.261 14.643 1.00 0.00 H new ATOM 1082 N ASN A 68 88.640 -8.145 15.058 1.00 0.00 N ATOM 1083 CA ASN A 68 89.826 -9.006 14.737 1.00 0.00 C ATOM 1084 C ASN A 68 89.795 -9.463 13.274 1.00 0.00 C ATOM 1085 O ASN A 68 90.822 -9.739 12.686 1.00 0.00 O ATOM 1086 CB ASN A 68 89.798 -10.244 15.635 1.00 0.00 C ATOM 1087 CG ASN A 68 91.127 -10.990 15.507 1.00 0.00 C ATOM 1088 OD1 ASN A 68 92.132 -10.408 15.148 1.00 0.00 O ATOM 1089 ND2 ASN A 68 91.177 -12.264 15.786 1.00 0.00 N ATOM 0 H ASN A 68 87.760 -8.649 15.164 1.00 0.00 H new ATOM 0 HA ASN A 68 90.732 -8.423 14.904 1.00 0.00 H new ATOM 0 HB2 ASN A 68 89.630 -9.952 16.672 1.00 0.00 H new ATOM 0 HB3 ASN A 68 88.973 -10.896 15.350 1.00 0.00 H new ATOM 0 HD21 ASN A 68 92.059 -12.770 15.703 1.00 0.00 H new ATOM 0 HD22 ASN A 68 90.334 -12.754 16.087 1.00 0.00 H new ATOM 1096 N GLU A 69 88.625 -9.571 12.692 1.00 0.00 N ATOM 1097 CA GLU A 69 88.513 -10.043 11.271 1.00 0.00 C ATOM 1098 C GLU A 69 87.820 -8.986 10.415 1.00 0.00 C ATOM 1099 O GLU A 69 86.957 -8.267 10.873 1.00 0.00 O ATOM 1100 CB GLU A 69 87.679 -11.324 11.239 1.00 0.00 C ATOM 1101 CG GLU A 69 87.725 -11.944 9.842 1.00 0.00 C ATOM 1102 CD GLU A 69 89.124 -12.504 9.575 1.00 0.00 C ATOM 1103 OE1 GLU A 69 89.842 -12.735 10.533 1.00 0.00 O ATOM 1104 OE2 GLU A 69 89.452 -12.694 8.414 1.00 0.00 O ATOM 0 H GLU A 69 87.736 -9.352 13.141 1.00 0.00 H new ATOM 0 HA GLU A 69 89.513 -10.226 10.877 1.00 0.00 H new ATOM 0 HB2 GLU A 69 88.060 -12.034 11.973 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.648 -11.103 11.514 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.983 -12.738 9.761 1.00 0.00 H new ATOM 0 HG3 GLU A 69 87.473 -11.194 9.092 1.00 0.00 H new ATOM 1111 N VAL A 70 88.186 -8.903 9.163 1.00 0.00 N ATOM 1112 CA VAL A 70 87.552 -7.910 8.246 1.00 0.00 C ATOM 1113 C VAL A 70 86.512 -8.620 7.395 1.00 0.00 C ATOM 1114 O VAL A 70 86.830 -9.344 6.473 1.00 0.00 O ATOM 1115 CB VAL A 70 88.627 -7.319 7.323 1.00 0.00 C ATOM 1116 CG1 VAL A 70 88.175 -5.960 6.808 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.932 -7.160 8.091 1.00 0.00 C ATOM 0 H VAL A 70 88.904 -9.486 8.733 1.00 0.00 H new ATOM 0 HA VAL A 70 87.084 -7.116 8.827 1.00 0.00 H new ATOM 0 HB VAL A 70 88.781 -7.992 6.480 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.942 -5.545 6.154 1.00 0.00 H new ATOM 0 HG12 VAL A 70 87.245 -6.073 6.251 1.00 0.00 H new ATOM 0 HG13 VAL A 70 88.014 -5.287 7.650 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.693 -6.740 7.433 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.777 -6.492 8.938 1.00 0.00 H new ATOM 0 HG23 VAL A 70 90.262 -8.134 8.453 1.00 0.00 H new ATOM 1127 N ASP A 71 85.276 -8.381 7.674 1.00 0.00 N ATOM 1128 CA ASP A 71 84.204 -8.995 6.858 1.00 0.00 C ATOM 1129 C ASP A 71 84.085 -8.138 5.608 1.00 0.00 C ATOM 1130 O ASP A 71 84.659 -7.069 5.543 1.00 0.00 O ATOM 1131 CB ASP A 71 82.885 -8.972 7.636 1.00 0.00 C ATOM 1132 CG ASP A 71 81.851 -9.847 6.927 1.00 0.00 C ATOM 1133 OD1 ASP A 71 82.115 -10.257 5.809 1.00 0.00 O ATOM 1134 OD2 ASP A 71 80.813 -10.097 7.518 1.00 0.00 O ATOM 0 H ASP A 71 84.955 -7.784 8.436 1.00 0.00 H new ATOM 0 HA ASP A 71 84.429 -10.032 6.611 1.00 0.00 H new ATOM 0 HB2 ASP A 71 83.045 -9.333 8.652 1.00 0.00 H new ATOM 0 HB3 ASP A 71 82.517 -7.949 7.715 1.00 0.00 H new ATOM 1139 N PHE A 72 83.356 -8.550 4.619 1.00 0.00 N ATOM 1140 CA PHE A 72 83.245 -7.691 3.425 1.00 0.00 C ATOM 1141 C PHE A 72 82.687 -6.349 3.889 1.00 0.00 C ATOM 1142 O PHE A 72 83.044 -5.297 3.395 1.00 0.00 O ATOM 1143 CB PHE A 72 82.300 -8.334 2.414 1.00 0.00 C ATOM 1144 CG PHE A 72 82.283 -7.491 1.169 1.00 0.00 C ATOM 1145 CD1 PHE A 72 83.215 -7.736 0.161 1.00 0.00 C ATOM 1146 CD2 PHE A 72 81.353 -6.457 1.031 1.00 0.00 C ATOM 1147 CE1 PHE A 72 83.221 -6.951 -0.991 1.00 0.00 C ATOM 1148 CE2 PHE A 72 81.357 -5.668 -0.121 1.00 0.00 C ATOM 1149 CZ PHE A 72 82.291 -5.914 -1.136 1.00 0.00 C ATOM 0 H PHE A 72 82.841 -9.430 4.586 1.00 0.00 H new ATOM 0 HA PHE A 72 84.214 -7.559 2.944 1.00 0.00 H new ATOM 0 HB2 PHE A 72 82.628 -9.347 2.180 1.00 0.00 H new ATOM 0 HB3 PHE A 72 81.296 -8.413 2.831 1.00 0.00 H new ATOM 0 HD1 PHE A 72 83.933 -8.535 0.273 1.00 0.00 H new ATOM 0 HD2 PHE A 72 80.633 -6.269 1.814 1.00 0.00 H new ATOM 0 HE1 PHE A 72 83.943 -7.142 -1.771 1.00 0.00 H new ATOM 0 HE2 PHE A 72 80.640 -4.868 -0.230 1.00 0.00 H new ATOM 0 HZ PHE A 72 82.294 -5.305 -2.028 1.00 0.00 H new ATOM 1159 N GLN A 73 81.805 -6.396 4.847 1.00 0.00 N ATOM 1160 CA GLN A 73 81.195 -5.154 5.387 1.00 0.00 C ATOM 1161 C GLN A 73 82.222 -4.334 6.188 1.00 0.00 C ATOM 1162 O GLN A 73 82.235 -3.124 6.102 1.00 0.00 O ATOM 1163 CB GLN A 73 80.017 -5.524 6.293 1.00 0.00 C ATOM 1164 CG GLN A 73 79.349 -4.251 6.827 1.00 0.00 C ATOM 1165 CD GLN A 73 78.123 -4.632 7.660 1.00 0.00 C ATOM 1166 OE1 GLN A 73 77.710 -5.775 7.666 1.00 0.00 O ATOM 1167 NE2 GLN A 73 77.514 -3.712 8.359 1.00 0.00 N ATOM 0 H GLN A 73 81.477 -7.257 5.284 1.00 0.00 H new ATOM 0 HA GLN A 73 80.850 -4.545 4.551 1.00 0.00 H new ATOM 0 HB2 GLN A 73 79.293 -6.119 5.737 1.00 0.00 H new ATOM 0 HB3 GLN A 73 80.365 -6.138 7.123 1.00 0.00 H new ATOM 0 HG2 GLN A 73 80.054 -3.685 7.435 1.00 0.00 H new ATOM 0 HG3 GLN A 73 79.054 -3.607 5.999 1.00 0.00 H new ATOM 0 HE21 GLN A 73 77.862 -2.753 8.353 1.00 0.00 H new ATOM 0 HE22 GLN A 73 76.691 -3.952 8.911 1.00 0.00 H new ATOM 1176 N GLU A 74 83.080 -4.951 6.976 1.00 0.00 N ATOM 1177 CA GLU A 74 84.048 -4.134 7.752 1.00 0.00 C ATOM 1178 C GLU A 74 85.042 -3.489 6.805 1.00 0.00 C ATOM 1179 O GLU A 74 85.412 -2.342 6.968 1.00 0.00 O ATOM 1180 CB GLU A 74 84.776 -5.005 8.774 1.00 0.00 C ATOM 1181 CG GLU A 74 83.799 -5.419 9.876 1.00 0.00 C ATOM 1182 CD GLU A 74 84.543 -6.238 10.929 1.00 0.00 C ATOM 1183 OE1 GLU A 74 85.761 -6.253 10.882 1.00 0.00 O ATOM 1184 OE2 GLU A 74 83.884 -6.836 11.763 1.00 0.00 O ATOM 0 H GLU A 74 83.144 -5.961 7.107 1.00 0.00 H new ATOM 0 HA GLU A 74 83.509 -3.353 8.288 1.00 0.00 H new ATOM 0 HB2 GLU A 74 85.188 -5.889 8.287 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.615 -4.457 9.203 1.00 0.00 H new ATOM 0 HG2 GLU A 74 83.354 -4.536 10.334 1.00 0.00 H new ATOM 0 HG3 GLU A 74 82.983 -6.005 9.453 1.00 0.00 H new ATOM 1191 N TYR A 75 85.477 -4.196 5.805 1.00 0.00 N ATOM 1192 CA TYR A 75 86.437 -3.576 4.863 1.00 0.00 C ATOM 1193 C TYR A 75 85.760 -2.351 4.243 1.00 0.00 C ATOM 1194 O TYR A 75 86.370 -1.318 4.053 1.00 0.00 O ATOM 1195 CB TYR A 75 86.815 -4.563 3.752 1.00 0.00 C ATOM 1196 CG TYR A 75 87.643 -3.836 2.713 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.878 -3.280 3.069 1.00 0.00 C ATOM 1198 CD2 TYR A 75 87.167 -3.700 1.401 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.638 -2.592 2.115 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.928 -3.012 0.447 1.00 0.00 C ATOM 1201 CZ TYR A 75 89.163 -2.458 0.805 1.00 0.00 C ATOM 1202 OH TYR A 75 89.916 -1.780 -0.133 1.00 0.00 O ATOM 0 H TYR A 75 85.214 -5.160 5.602 1.00 0.00 H new ATOM 0 HA TYR A 75 87.346 -3.294 5.394 1.00 0.00 H new ATOM 0 HB2 TYR A 75 87.379 -5.399 4.166 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.917 -4.979 3.295 1.00 0.00 H new ATOM 0 HD1 TYR A 75 89.245 -3.382 4.080 1.00 0.00 H new ATOM 0 HD2 TYR A 75 86.213 -4.126 1.126 1.00 0.00 H new ATOM 0 HE1 TYR A 75 90.591 -2.165 2.390 1.00 0.00 H new ATOM 0 HE2 TYR A 75 87.562 -2.909 -0.564 1.00 0.00 H new ATOM 0 HH TYR A 75 90.503 -2.411 -0.599 1.00 0.00 H new ATOM 1212 N CYS A 76 84.500 -2.468 3.930 1.00 0.00 N ATOM 1213 CA CYS A 76 83.768 -1.323 3.329 1.00 0.00 C ATOM 1214 C CYS A 76 83.633 -0.215 4.367 1.00 0.00 C ATOM 1215 O CYS A 76 83.791 0.950 4.062 1.00 0.00 O ATOM 1216 CB CYS A 76 82.373 -1.778 2.897 1.00 0.00 C ATOM 1217 SG CYS A 76 81.541 -0.429 2.026 1.00 0.00 S ATOM 0 H CYS A 76 83.944 -3.313 4.066 1.00 0.00 H new ATOM 0 HA CYS A 76 84.316 -0.955 2.462 1.00 0.00 H new ATOM 0 HB2 CYS A 76 82.448 -2.651 2.249 1.00 0.00 H new ATOM 0 HB3 CYS A 76 81.790 -2.077 3.768 1.00 0.00 H new ATOM 0 HG CYS A 76 81.294 0.538 2.859 1.00 0.00 H new ATOM 1223 N VAL A 77 83.363 -0.559 5.601 1.00 0.00 N ATOM 1224 CA VAL A 77 83.251 0.502 6.629 1.00 0.00 C ATOM 1225 C VAL A 77 84.590 1.223 6.678 1.00 0.00 C ATOM 1226 O VAL A 77 84.658 2.434 6.736 1.00 0.00 O ATOM 1227 CB VAL A 77 82.939 -0.123 7.991 1.00 0.00 C ATOM 1228 CG1 VAL A 77 83.054 0.938 9.089 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.516 -0.696 7.981 1.00 0.00 C ATOM 0 H VAL A 77 83.219 -1.513 5.931 1.00 0.00 H new ATOM 0 HA VAL A 77 82.448 1.197 6.385 1.00 0.00 H new ATOM 0 HB VAL A 77 83.652 -0.923 8.188 1.00 0.00 H new ATOM 0 HG11 VAL A 77 82.831 0.487 10.056 1.00 0.00 H new ATOM 0 HG12 VAL A 77 84.067 1.340 9.102 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.346 1.743 8.892 1.00 0.00 H new ATOM 0 HG21 VAL A 77 81.296 -1.141 8.952 1.00 0.00 H new ATOM 0 HG22 VAL A 77 80.803 0.103 7.778 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.436 -1.459 7.206 1.00 0.00 H new ATOM 1239 N PHE A 78 85.664 0.479 6.630 1.00 0.00 N ATOM 1240 CA PHE A 78 87.000 1.122 6.646 1.00 0.00 C ATOM 1241 C PHE A 78 87.208 1.845 5.315 1.00 0.00 C ATOM 1242 O PHE A 78 87.738 2.931 5.269 1.00 0.00 O ATOM 1243 CB PHE A 78 88.099 0.071 6.847 1.00 0.00 C ATOM 1244 CG PHE A 78 88.037 -0.483 8.259 1.00 0.00 C ATOM 1245 CD1 PHE A 78 88.209 0.365 9.367 1.00 0.00 C ATOM 1246 CD2 PHE A 78 87.802 -1.852 8.463 1.00 0.00 C ATOM 1247 CE1 PHE A 78 88.146 -0.157 10.667 1.00 0.00 C ATOM 1248 CE2 PHE A 78 87.742 -2.369 9.762 1.00 0.00 C ATOM 1249 CZ PHE A 78 87.913 -1.522 10.863 1.00 0.00 C ATOM 0 H PHE A 78 85.669 -0.540 6.581 1.00 0.00 H new ATOM 0 HA PHE A 78 87.053 1.832 7.471 1.00 0.00 H new ATOM 0 HB2 PHE A 78 87.977 -0.737 6.125 1.00 0.00 H new ATOM 0 HB3 PHE A 78 89.077 0.516 6.665 1.00 0.00 H new ATOM 0 HD1 PHE A 78 88.390 1.419 9.217 1.00 0.00 H new ATOM 0 HD2 PHE A 78 87.667 -2.508 7.615 1.00 0.00 H new ATOM 0 HE1 PHE A 78 88.278 0.496 11.517 1.00 0.00 H new ATOM 0 HE2 PHE A 78 87.563 -3.423 9.915 1.00 0.00 H new ATOM 0 HZ PHE A 78 87.865 -1.923 11.865 1.00 0.00 H new ATOM 1259 N LEU A 79 86.795 1.261 4.219 1.00 0.00 N ATOM 1260 CA LEU A 79 86.990 1.960 2.917 1.00 0.00 C ATOM 1261 C LEU A 79 86.101 3.208 2.881 1.00 0.00 C ATOM 1262 O LEU A 79 86.482 4.246 2.378 1.00 0.00 O ATOM 1263 CB LEU A 79 86.616 1.032 1.761 1.00 0.00 C ATOM 1264 CG LEU A 79 86.977 1.691 0.422 1.00 0.00 C ATOM 1265 CD1 LEU A 79 88.507 1.866 0.302 1.00 0.00 C ATOM 1266 CD2 LEU A 79 86.457 0.804 -0.718 1.00 0.00 C ATOM 0 H LEU A 79 86.340 0.349 4.170 1.00 0.00 H new ATOM 0 HA LEU A 79 88.037 2.247 2.814 1.00 0.00 H new ATOM 0 HB2 LEU A 79 87.141 0.082 1.862 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.549 0.811 1.791 1.00 0.00 H new ATOM 0 HG LEU A 79 86.517 2.678 0.365 1.00 0.00 H new ATOM 0 HD11 LEU A 79 88.746 2.334 -0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 79 88.866 2.497 1.115 1.00 0.00 H new ATOM 0 HD13 LEU A 79 88.990 0.891 0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 79 86.706 1.260 -1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.920 -0.181 -0.653 1.00 0.00 H new ATOM 0 HD23 LEU A 79 85.375 0.702 -0.635 1.00 0.00 H new ATOM 1278 N SER A 80 84.914 3.102 3.412 1.00 0.00 N ATOM 1279 CA SER A 80 83.979 4.263 3.421 1.00 0.00 C ATOM 1280 C SER A 80 84.561 5.345 4.318 1.00 0.00 C ATOM 1281 O SER A 80 84.577 6.511 3.977 1.00 0.00 O ATOM 1282 CB SER A 80 82.617 3.821 3.958 1.00 0.00 C ATOM 1283 OG SER A 80 81.672 4.865 3.763 1.00 0.00 O ATOM 0 H SER A 80 84.549 2.253 3.844 1.00 0.00 H new ATOM 0 HA SER A 80 83.850 4.649 2.410 1.00 0.00 H new ATOM 0 HB2 SER A 80 82.288 2.917 3.446 1.00 0.00 H new ATOM 0 HB3 SER A 80 82.693 3.577 5.018 1.00 0.00 H new ATOM 0 HG SER A 80 80.798 4.583 4.105 1.00 0.00 H new ATOM 1289 N CYS A 81 85.072 4.962 5.453 1.00 0.00 N ATOM 1290 CA CYS A 81 85.685 5.968 6.348 1.00 0.00 C ATOM 1291 C CYS A 81 86.835 6.604 5.579 1.00 0.00 C ATOM 1292 O CYS A 81 87.095 7.786 5.683 1.00 0.00 O ATOM 1293 CB CYS A 81 86.196 5.302 7.637 1.00 0.00 C ATOM 1294 SG CYS A 81 87.827 4.556 7.374 1.00 0.00 S ATOM 0 H CYS A 81 85.090 4.001 5.794 1.00 0.00 H new ATOM 0 HA CYS A 81 84.955 6.722 6.643 1.00 0.00 H new ATOM 0 HB2 CYS A 81 86.254 6.042 8.435 1.00 0.00 H new ATOM 0 HB3 CYS A 81 85.490 4.538 7.961 1.00 0.00 H new ATOM 0 HG CYS A 81 87.821 3.880 6.264 1.00 0.00 H new ATOM 1300 N ILE A 82 87.517 5.817 4.782 1.00 0.00 N ATOM 1301 CA ILE A 82 88.641 6.382 3.983 1.00 0.00 C ATOM 1302 C ILE A 82 88.065 7.313 2.916 1.00 0.00 C ATOM 1303 O ILE A 82 88.594 8.371 2.650 1.00 0.00 O ATOM 1304 CB ILE A 82 89.447 5.249 3.331 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.247 4.512 4.413 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.411 5.823 2.287 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.803 3.195 3.853 1.00 0.00 C ATOM 0 H ILE A 82 87.344 4.820 4.653 1.00 0.00 H new ATOM 0 HA ILE A 82 89.312 6.944 4.632 1.00 0.00 H new ATOM 0 HB ILE A 82 88.762 4.557 2.840 1.00 0.00 H new ATOM 0 HG12 ILE A 82 91.065 5.141 4.763 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.609 4.310 5.274 1.00 0.00 H new ATOM 0 HG21 ILE A 82 90.978 5.012 1.830 1.00 0.00 H new ATOM 0 HG22 ILE A 82 89.844 6.347 1.518 1.00 0.00 H new ATOM 0 HG23 ILE A 82 91.098 6.519 2.769 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.369 2.680 4.629 1.00 0.00 H new ATOM 0 HD12 ILE A 82 89.978 2.562 3.525 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.457 3.407 3.007 1.00 0.00 H new ATOM 1319 N ALA A 83 86.974 6.940 2.314 1.00 0.00 N ATOM 1320 CA ALA A 83 86.370 7.827 1.287 1.00 0.00 C ATOM 1321 C ALA A 83 85.998 9.154 1.940 1.00 0.00 C ATOM 1322 O ALA A 83 86.334 10.209 1.457 1.00 0.00 O ATOM 1323 CB ALA A 83 85.112 7.182 0.725 1.00 0.00 C ATOM 0 H ALA A 83 86.477 6.066 2.487 1.00 0.00 H new ATOM 0 HA ALA A 83 87.084 7.989 0.480 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.673 7.837 -0.028 1.00 0.00 H new ATOM 0 HB2 ALA A 83 85.366 6.225 0.270 1.00 0.00 H new ATOM 0 HB3 ALA A 83 84.395 7.022 1.530 1.00 0.00 H new ATOM 1329 N MET A 84 85.310 9.107 3.047 1.00 0.00 N ATOM 1330 CA MET A 84 84.924 10.370 3.736 1.00 0.00 C ATOM 1331 C MET A 84 86.182 11.052 4.247 1.00 0.00 C ATOM 1332 O MET A 84 86.265 12.263 4.299 1.00 0.00 O ATOM 1333 CB MET A 84 83.984 10.054 4.895 1.00 0.00 C ATOM 1334 CG MET A 84 82.633 9.595 4.340 1.00 0.00 C ATOM 1335 SD MET A 84 81.513 9.216 5.710 1.00 0.00 S ATOM 1336 CE MET A 84 82.417 7.784 6.352 1.00 0.00 C ATOM 0 H MET A 84 84.999 8.250 3.504 1.00 0.00 H new ATOM 0 HA MET A 84 84.408 11.034 3.042 1.00 0.00 H new ATOM 0 HB2 MET A 84 84.414 9.276 5.526 1.00 0.00 H new ATOM 0 HB3 MET A 84 83.852 10.936 5.522 1.00 0.00 H new ATOM 0 HG2 MET A 84 82.203 10.374 3.710 1.00 0.00 H new ATOM 0 HG3 MET A 84 82.767 8.714 3.712 1.00 0.00 H new ATOM 0 HE1 MET A 84 81.730 7.131 6.890 1.00 0.00 H new ATOM 0 HE2 MET A 84 82.865 7.235 5.524 1.00 0.00 H new ATOM 0 HE3 MET A 84 83.201 8.122 7.029 1.00 0.00 H new ATOM 1346 N MET A 85 87.177 10.290 4.594 1.00 0.00 N ATOM 1347 CA MET A 85 88.434 10.917 5.060 1.00 0.00 C ATOM 1348 C MET A 85 88.930 11.791 3.917 1.00 0.00 C ATOM 1349 O MET A 85 89.519 12.833 4.125 1.00 0.00 O ATOM 1350 CB MET A 85 89.472 9.837 5.382 1.00 0.00 C ATOM 1351 CG MET A 85 90.771 10.492 5.864 1.00 0.00 C ATOM 1352 SD MET A 85 91.996 9.205 6.216 1.00 0.00 S ATOM 1353 CE MET A 85 92.655 9.032 4.539 1.00 0.00 C ATOM 0 H MET A 85 87.173 9.270 4.575 1.00 0.00 H new ATOM 0 HA MET A 85 88.271 11.503 5.965 1.00 0.00 H new ATOM 0 HB2 MET A 85 89.086 9.166 6.149 1.00 0.00 H new ATOM 0 HB3 MET A 85 89.666 9.231 4.497 1.00 0.00 H new ATOM 0 HG2 MET A 85 91.152 11.174 5.104 1.00 0.00 H new ATOM 0 HG3 MET A 85 90.582 11.085 6.759 1.00 0.00 H new ATOM 0 HE1 MET A 85 93.450 8.287 4.536 1.00 0.00 H new ATOM 0 HE2 MET A 85 91.858 8.716 3.866 1.00 0.00 H new ATOM 0 HE3 MET A 85 93.054 9.990 4.204 1.00 0.00 H new ATOM 1363 N CYS A 86 88.669 11.384 2.700 1.00 0.00 N ATOM 1364 CA CYS A 86 89.105 12.213 1.544 1.00 0.00 C ATOM 1365 C CYS A 86 88.300 11.832 0.304 1.00 0.00 C ATOM 1366 O CYS A 86 88.820 11.279 -0.644 1.00 0.00 O ATOM 1367 CB CYS A 86 90.598 11.995 1.283 1.00 0.00 C ATOM 1368 SG CYS A 86 90.960 10.222 1.263 1.00 0.00 S ATOM 0 H CYS A 86 88.178 10.522 2.462 1.00 0.00 H new ATOM 0 HA CYS A 86 88.934 13.265 1.772 1.00 0.00 H new ATOM 0 HB2 CYS A 86 90.880 12.445 0.331 1.00 0.00 H new ATOM 0 HB3 CYS A 86 91.188 12.488 2.056 1.00 0.00 H new ATOM 0 HG CYS A 86 89.965 9.570 1.788 1.00 0.00 H new ATOM 1374 N ASN A 87 87.031 12.128 0.305 1.00 0.00 N ATOM 1375 CA ASN A 87 86.185 11.789 -0.871 1.00 0.00 C ATOM 1376 C ASN A 87 86.508 12.747 -2.018 1.00 0.00 C ATOM 1377 O ASN A 87 86.583 12.356 -3.165 1.00 0.00 O ATOM 1378 CB ASN A 87 84.710 11.908 -0.485 1.00 0.00 C ATOM 1379 CG ASN A 87 84.421 13.326 0.014 1.00 0.00 C ATOM 1380 OD1 ASN A 87 85.323 14.043 0.400 1.00 0.00 O ATOM 1381 ND2 ASN A 87 83.191 13.763 0.024 1.00 0.00 N ATOM 0 H ASN A 87 86.543 12.591 1.071 1.00 0.00 H new ATOM 0 HA ASN A 87 86.387 10.767 -1.192 1.00 0.00 H new ATOM 0 HB2 ASN A 87 84.080 11.679 -1.344 1.00 0.00 H new ATOM 0 HB3 ASN A 87 84.467 11.182 0.291 1.00 0.00 H new ATOM 0 HD21 ASN A 87 82.987 14.706 0.356 1.00 0.00 H new ATOM 0 HD22 ASN A 87 82.433 13.162 -0.300 1.00 0.00 H new ATOM 1388 N GLU A 88 86.710 13.999 -1.708 1.00 0.00 N ATOM 1389 CA GLU A 88 87.041 15.000 -2.765 1.00 0.00 C ATOM 1390 C GLU A 88 87.365 16.335 -2.092 1.00 0.00 C ATOM 1391 O GLU A 88 88.464 16.844 -2.194 1.00 0.00 O ATOM 1392 CB GLU A 88 85.844 15.177 -3.708 1.00 0.00 C ATOM 1393 CG GLU A 88 86.191 16.174 -4.823 1.00 0.00 C ATOM 1394 CD GLU A 88 87.348 15.630 -5.665 1.00 0.00 C ATOM 1395 OE1 GLU A 88 87.561 14.430 -5.639 1.00 0.00 O ATOM 1396 OE2 GLU A 88 88.003 16.424 -6.322 1.00 0.00 O ATOM 0 H GLU A 88 86.660 14.375 -0.761 1.00 0.00 H new ATOM 0 HA GLU A 88 87.898 14.655 -3.343 1.00 0.00 H new ATOM 0 HB2 GLU A 88 85.568 14.216 -4.142 1.00 0.00 H new ATOM 0 HB3 GLU A 88 84.980 15.533 -3.148 1.00 0.00 H new ATOM 0 HG2 GLU A 88 85.319 16.345 -5.454 1.00 0.00 H new ATOM 0 HG3 GLU A 88 86.465 17.136 -4.390 1.00 0.00 H new ATOM 1403 N PHE A 89 86.415 16.904 -1.398 1.00 0.00 N ATOM 1404 CA PHE A 89 86.665 18.202 -0.710 1.00 0.00 C ATOM 1405 C PHE A 89 87.454 17.949 0.577 1.00 0.00 C ATOM 1406 O PHE A 89 87.143 17.053 1.336 1.00 0.00 O ATOM 1407 CB PHE A 89 85.329 18.863 -0.356 1.00 0.00 C ATOM 1408 CG PHE A 89 84.612 19.280 -1.618 1.00 0.00 C ATOM 1409 CD1 PHE A 89 84.891 20.520 -2.203 1.00 0.00 C ATOM 1410 CD2 PHE A 89 83.666 18.427 -2.200 1.00 0.00 C ATOM 1411 CE1 PHE A 89 84.226 20.909 -3.371 1.00 0.00 C ATOM 1412 CE2 PHE A 89 83.000 18.815 -3.368 1.00 0.00 C ATOM 1413 CZ PHE A 89 83.279 20.056 -3.954 1.00 0.00 C ATOM 0 H PHE A 89 85.476 16.524 -1.278 1.00 0.00 H new ATOM 0 HA PHE A 89 87.233 18.857 -1.371 1.00 0.00 H new ATOM 0 HB2 PHE A 89 84.709 18.169 0.212 1.00 0.00 H new ATOM 0 HB3 PHE A 89 85.500 19.732 0.279 1.00 0.00 H new ATOM 0 HD1 PHE A 89 85.620 21.177 -1.753 1.00 0.00 H new ATOM 0 HD2 PHE A 89 83.451 17.470 -1.748 1.00 0.00 H new ATOM 0 HE1 PHE A 89 84.442 21.866 -3.823 1.00 0.00 H new ATOM 0 HE2 PHE A 89 82.271 18.157 -3.818 1.00 0.00 H new ATOM 0 HZ PHE A 89 82.764 20.356 -4.855 1.00 0.00 H new ATOM 1423 N PHE A 90 88.468 18.733 0.838 1.00 0.00 N ATOM 1424 CA PHE A 90 89.267 18.531 2.086 1.00 0.00 C ATOM 1425 C PHE A 90 88.659 19.378 3.207 1.00 0.00 C ATOM 1426 O PHE A 90 88.971 19.211 4.370 1.00 0.00 O ATOM 1427 CB PHE A 90 90.709 18.977 1.841 1.00 0.00 C ATOM 1428 CG PHE A 90 91.246 18.268 0.624 1.00 0.00 C ATOM 1429 CD1 PHE A 90 91.826 16.998 0.742 1.00 0.00 C ATOM 1430 CD2 PHE A 90 91.153 18.881 -0.630 1.00 0.00 C ATOM 1431 CE1 PHE A 90 92.312 16.344 -0.396 1.00 0.00 C ATOM 1432 CE2 PHE A 90 91.639 18.228 -1.767 1.00 0.00 C ATOM 1433 CZ PHE A 90 92.218 16.959 -1.651 1.00 0.00 C ATOM 0 H PHE A 90 88.777 19.502 0.244 1.00 0.00 H new ATOM 0 HA PHE A 90 89.255 17.478 2.368 1.00 0.00 H new ATOM 0 HB2 PHE A 90 90.749 20.056 1.695 1.00 0.00 H new ATOM 0 HB3 PHE A 90 91.325 18.750 2.711 1.00 0.00 H new ATOM 0 HD1 PHE A 90 91.898 16.524 1.710 1.00 0.00 H new ATOM 0 HD2 PHE A 90 90.705 19.860 -0.720 1.00 0.00 H new ATOM 0 HE1 PHE A 90 92.759 15.365 -0.306 1.00 0.00 H new ATOM 0 HE2 PHE A 90 91.568 18.703 -2.734 1.00 0.00 H new ATOM 0 HZ PHE A 90 92.592 16.454 -2.529 1.00 0.00 H new ATOM 1443 N GLU A 91 87.790 20.288 2.861 1.00 0.00 N ATOM 1444 CA GLU A 91 87.153 21.156 3.894 1.00 0.00 C ATOM 1445 C GLU A 91 86.289 20.315 4.839 1.00 0.00 C ATOM 1446 O GLU A 91 86.261 20.543 6.031 1.00 0.00 O ATOM 1447 CB GLU A 91 86.282 22.212 3.208 1.00 0.00 C ATOM 1448 CG GLU A 91 87.176 23.225 2.487 1.00 0.00 C ATOM 1449 CD GLU A 91 87.913 24.077 3.523 1.00 0.00 C ATOM 1450 OE1 GLU A 91 87.413 24.191 4.631 1.00 0.00 O ATOM 1451 OE2 GLU A 91 88.964 24.601 3.193 1.00 0.00 O ATOM 0 H GLU A 91 87.492 20.469 1.902 1.00 0.00 H new ATOM 0 HA GLU A 91 87.936 21.645 4.474 1.00 0.00 H new ATOM 0 HB2 GLU A 91 85.608 21.736 2.496 1.00 0.00 H new ATOM 0 HB3 GLU A 91 85.660 22.720 3.945 1.00 0.00 H new ATOM 0 HG2 GLU A 91 87.892 22.706 1.850 1.00 0.00 H new ATOM 0 HG3 GLU A 91 86.574 23.861 1.838 1.00 0.00 H new ATOM 1458 N GLY A 92 85.578 19.352 4.319 1.00 0.00 N ATOM 1459 CA GLY A 92 84.712 18.512 5.196 1.00 0.00 C ATOM 1460 C GLY A 92 85.547 17.913 6.329 1.00 0.00 C ATOM 1461 O GLY A 92 86.670 17.492 6.133 1.00 0.00 O ATOM 0 H GLY A 92 85.559 19.111 3.328 1.00 0.00 H new ATOM 0 HA2 GLY A 92 83.903 19.115 5.608 1.00 0.00 H new ATOM 0 HA3 GLY A 92 84.251 17.716 4.612 1.00 0.00 H new ATOM 1465 N PHE A 93 85.005 17.872 7.520 1.00 0.00 N ATOM 1466 CA PHE A 93 85.767 17.302 8.668 1.00 0.00 C ATOM 1467 C PHE A 93 85.677 15.763 8.626 1.00 0.00 C ATOM 1468 O PHE A 93 84.676 15.226 8.194 1.00 0.00 O ATOM 1469 CB PHE A 93 85.153 17.803 9.978 1.00 0.00 C ATOM 1470 CG PHE A 93 85.059 19.310 9.950 1.00 0.00 C ATOM 1471 CD1 PHE A 93 86.167 20.090 10.305 1.00 0.00 C ATOM 1472 CD2 PHE A 93 83.861 19.927 9.571 1.00 0.00 C ATOM 1473 CE1 PHE A 93 86.076 21.487 10.280 1.00 0.00 C ATOM 1474 CE2 PHE A 93 83.770 21.323 9.547 1.00 0.00 C ATOM 1475 CZ PHE A 93 84.877 22.104 9.900 1.00 0.00 C ATOM 0 H PHE A 93 84.069 18.209 7.745 1.00 0.00 H new ATOM 0 HA PHE A 93 86.810 17.612 8.605 1.00 0.00 H new ATOM 0 HB2 PHE A 93 84.163 17.369 10.116 1.00 0.00 H new ATOM 0 HB3 PHE A 93 85.762 17.482 10.823 1.00 0.00 H new ATOM 0 HD1 PHE A 93 87.091 19.614 10.598 1.00 0.00 H new ATOM 0 HD2 PHE A 93 83.007 19.325 9.297 1.00 0.00 H new ATOM 0 HE1 PHE A 93 86.930 22.089 10.554 1.00 0.00 H new ATOM 0 HE2 PHE A 93 82.845 21.798 9.256 1.00 0.00 H new ATOM 0 HZ PHE A 93 84.807 23.182 9.879 1.00 0.00 H new ATOM 1485 N PRO A 94 86.689 15.044 9.076 1.00 0.00 N ATOM 1486 CA PRO A 94 86.629 13.550 9.063 1.00 0.00 C ATOM 1487 C PRO A 94 85.679 13.006 10.145 1.00 0.00 C ATOM 1488 O PRO A 94 86.106 12.446 11.135 1.00 0.00 O ATOM 1489 CB PRO A 94 88.090 13.178 9.366 1.00 0.00 C ATOM 1490 CG PRO A 94 88.729 14.386 10.063 1.00 0.00 C ATOM 1491 CD PRO A 94 87.950 15.636 9.624 1.00 0.00 C ATOM 0 HA PRO A 94 86.246 13.136 8.130 1.00 0.00 H new ATOM 0 HB2 PRO A 94 88.138 12.296 10.004 1.00 0.00 H new ATOM 0 HB3 PRO A 94 88.624 12.937 8.447 1.00 0.00 H new ATOM 0 HG2 PRO A 94 88.689 14.270 11.146 1.00 0.00 H new ATOM 0 HG3 PRO A 94 89.781 14.474 9.791 1.00 0.00 H new ATOM 0 HD2 PRO A 94 87.755 16.309 10.459 1.00 0.00 H new ATOM 0 HD3 PRO A 94 88.491 16.210 8.872 1.00 0.00 H new ATOM 1499 N ASP A 95 84.393 13.174 9.970 1.00 0.00 N ATOM 1500 CA ASP A 95 83.424 12.673 10.993 1.00 0.00 C ATOM 1501 C ASP A 95 82.869 11.312 10.563 1.00 0.00 C ATOM 1502 O ASP A 95 82.225 11.191 9.541 1.00 0.00 O ATOM 1503 CB ASP A 95 82.266 13.666 11.116 1.00 0.00 C ATOM 1504 CG ASP A 95 82.764 14.950 11.780 1.00 0.00 C ATOM 1505 OD1 ASP A 95 83.821 14.908 12.388 1.00 0.00 O ATOM 1506 OD2 ASP A 95 82.082 15.956 11.666 1.00 0.00 O ATOM 0 H ASP A 95 83.972 13.636 9.164 1.00 0.00 H new ATOM 0 HA ASP A 95 83.934 12.570 11.951 1.00 0.00 H new ATOM 0 HB2 ASP A 95 81.857 13.889 10.130 1.00 0.00 H new ATOM 0 HB3 ASP A 95 81.459 13.229 11.704 1.00 0.00 H new ATOM 1511 N LYS A 96 83.107 10.289 11.348 1.00 0.00 N ATOM 1512 CA LYS A 96 82.587 8.924 11.013 1.00 0.00 C ATOM 1513 C LYS A 96 81.445 8.582 11.976 1.00 0.00 C ATOM 1514 O LYS A 96 80.544 7.834 11.650 1.00 0.00 O ATOM 1515 CB LYS A 96 83.723 7.897 11.163 1.00 0.00 C ATOM 1516 CG LYS A 96 84.662 8.335 12.291 1.00 0.00 C ATOM 1517 CD LYS A 96 85.630 7.195 12.625 1.00 0.00 C ATOM 1518 CE LYS A 96 86.504 6.882 11.408 1.00 0.00 C ATOM 1519 NZ LYS A 96 87.722 6.144 11.846 1.00 0.00 N ATOM 0 H LYS A 96 83.644 10.341 12.214 1.00 0.00 H new ATOM 0 HA LYS A 96 82.220 8.902 9.987 1.00 0.00 H new ATOM 0 HB2 LYS A 96 83.311 6.912 11.381 1.00 0.00 H new ATOM 0 HB3 LYS A 96 84.276 7.811 10.228 1.00 0.00 H new ATOM 0 HG2 LYS A 96 85.219 9.222 11.990 1.00 0.00 H new ATOM 0 HG3 LYS A 96 84.084 8.606 13.175 1.00 0.00 H new ATOM 0 HD2 LYS A 96 86.257 7.475 13.472 1.00 0.00 H new ATOM 0 HD3 LYS A 96 85.072 6.307 12.921 1.00 0.00 H new ATOM 0 HE2 LYS A 96 85.943 6.285 10.689 1.00 0.00 H new ATOM 0 HE3 LYS A 96 86.788 7.806 10.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 88.569 6.618 11.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 87.765 6.130 12.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 87.684 5.168 11.488 1.00 0.00 H new ATOM 1653 N ALA B 2 98.302 0.769 -11.310 1.00 0.00 N ATOM 1654 CA ALA B 2 98.130 -0.565 -10.665 1.00 0.00 C ATOM 1655 C ALA B 2 97.198 -0.419 -9.462 1.00 0.00 C ATOM 1656 O ALA B 2 97.198 -1.236 -8.562 1.00 0.00 O ATOM 1657 CB ALA B 2 99.489 -1.104 -10.208 1.00 0.00 C ATOM 0 HA ALA B 2 97.699 -1.265 -11.381 1.00 0.00 H new ATOM 0 HB1 ALA B 2 99.355 -2.078 -9.738 1.00 0.00 H new ATOM 0 HB2 ALA B 2 100.149 -1.205 -11.070 1.00 0.00 H new ATOM 0 HB3 ALA B 2 99.932 -0.413 -9.491 1.00 0.00 H new ATOM 1663 N CYS B 3 96.407 0.625 -9.437 1.00 0.00 N ATOM 1664 CA CYS B 3 95.470 0.841 -8.289 1.00 0.00 C ATOM 1665 C CYS B 3 94.106 1.309 -8.818 1.00 0.00 C ATOM 1666 O CYS B 3 93.726 2.448 -8.626 1.00 0.00 O ATOM 1667 CB CYS B 3 96.053 1.917 -7.371 1.00 0.00 C ATOM 1668 SG CYS B 3 97.665 1.376 -6.749 1.00 0.00 S ATOM 0 H CYS B 3 96.369 1.340 -10.164 1.00 0.00 H new ATOM 0 HA CYS B 3 95.342 -0.091 -7.738 1.00 0.00 H new ATOM 0 HB2 CYS B 3 96.158 2.856 -7.915 1.00 0.00 H new ATOM 0 HB3 CYS B 3 95.375 2.105 -6.538 1.00 0.00 H new ATOM 0 HG CYS B 3 98.160 2.292 -5.971 1.00 0.00 H new ATOM 1674 N PRO B 4 93.368 0.443 -9.475 1.00 0.00 N ATOM 1675 CA PRO B 4 92.031 0.821 -10.016 1.00 0.00 C ATOM 1676 C PRO B 4 90.984 1.003 -8.907 1.00 0.00 C ATOM 1677 O PRO B 4 89.975 1.652 -9.097 1.00 0.00 O ATOM 1678 CB PRO B 4 91.694 -0.372 -10.931 1.00 0.00 C ATOM 1679 CG PRO B 4 92.698 -1.509 -10.639 1.00 0.00 C ATOM 1680 CD PRO B 4 93.813 -0.957 -9.727 1.00 0.00 C ATOM 0 HA PRO B 4 92.035 1.780 -10.534 1.00 0.00 H new ATOM 0 HB2 PRO B 4 90.674 -0.711 -10.751 1.00 0.00 H new ATOM 0 HB3 PRO B 4 91.751 -0.075 -11.978 1.00 0.00 H new ATOM 0 HG2 PRO B 4 92.193 -2.345 -10.156 1.00 0.00 H new ATOM 0 HG3 PRO B 4 93.122 -1.887 -11.569 1.00 0.00 H new ATOM 0 HD2 PRO B 4 93.899 -1.527 -8.802 1.00 0.00 H new ATOM 0 HD3 PRO B 4 94.788 -0.991 -10.214 1.00 0.00 H new ATOM 1688 N LEU B 5 91.222 0.448 -7.750 1.00 0.00 N ATOM 1689 CA LEU B 5 90.245 0.614 -6.638 1.00 0.00 C ATOM 1690 C LEU B 5 90.113 2.103 -6.342 1.00 0.00 C ATOM 1691 O LEU B 5 89.054 2.596 -6.010 1.00 0.00 O ATOM 1692 CB LEU B 5 90.742 -0.123 -5.386 1.00 0.00 C ATOM 1693 CG LEU B 5 89.743 0.054 -4.228 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.381 -0.562 -4.594 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.299 -0.639 -2.979 1.00 0.00 C ATOM 0 H LEU B 5 92.046 -0.110 -7.528 1.00 0.00 H new ATOM 0 HA LEU B 5 89.279 0.197 -6.923 1.00 0.00 H new ATOM 0 HB2 LEU B 5 90.869 -1.183 -5.606 1.00 0.00 H new ATOM 0 HB3 LEU B 5 91.719 0.261 -5.094 1.00 0.00 H new ATOM 0 HG LEU B 5 89.604 1.118 -4.035 1.00 0.00 H new ATOM 0 HD11 LEU B 5 87.687 -0.428 -3.765 1.00 0.00 H new ATOM 0 HD12 LEU B 5 87.985 -0.069 -5.482 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.505 -1.626 -4.795 1.00 0.00 H new ATOM 0 HD21 LEU B 5 89.598 -0.519 -2.153 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.440 -1.700 -3.184 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.256 -0.192 -2.710 1.00 0.00 H new ATOM 1707 N GLU B 6 91.194 2.819 -6.451 1.00 0.00 N ATOM 1708 CA GLU B 6 91.159 4.275 -6.170 1.00 0.00 C ATOM 1709 C GLU B 6 90.165 4.950 -7.124 1.00 0.00 C ATOM 1710 O GLU B 6 89.396 5.804 -6.731 1.00 0.00 O ATOM 1711 CB GLU B 6 92.564 4.838 -6.394 1.00 0.00 C ATOM 1712 CG GLU B 6 92.620 6.301 -5.958 1.00 0.00 C ATOM 1713 CD GLU B 6 94.035 6.840 -6.178 1.00 0.00 C ATOM 1714 OE1 GLU B 6 94.912 6.042 -6.463 1.00 0.00 O ATOM 1715 OE2 GLU B 6 94.220 8.040 -6.051 1.00 0.00 O ATOM 0 H GLU B 6 92.106 2.454 -6.725 1.00 0.00 H new ATOM 0 HA GLU B 6 90.844 4.461 -5.143 1.00 0.00 H new ATOM 0 HB2 GLU B 6 93.292 4.255 -5.830 1.00 0.00 H new ATOM 0 HB3 GLU B 6 92.834 4.754 -7.447 1.00 0.00 H new ATOM 0 HG2 GLU B 6 91.901 6.890 -6.528 1.00 0.00 H new ATOM 0 HG3 GLU B 6 92.344 6.390 -4.907 1.00 0.00 H new ATOM 1722 N LYS B 7 90.163 4.557 -8.368 1.00 0.00 N ATOM 1723 CA LYS B 7 89.206 5.153 -9.341 1.00 0.00 C ATOM 1724 C LYS B 7 87.801 4.630 -9.055 1.00 0.00 C ATOM 1725 O LYS B 7 86.842 5.368 -9.061 1.00 0.00 O ATOM 1726 CB LYS B 7 89.622 4.784 -10.766 1.00 0.00 C ATOM 1727 CG LYS B 7 88.623 5.380 -11.759 1.00 0.00 C ATOM 1728 CD LYS B 7 89.163 5.236 -13.187 1.00 0.00 C ATOM 1729 CE LYS B 7 89.280 3.753 -13.559 1.00 0.00 C ATOM 1730 NZ LYS B 7 89.303 3.615 -15.044 1.00 0.00 N ATOM 0 H LYS B 7 90.785 3.846 -8.753 1.00 0.00 H new ATOM 0 HA LYS B 7 89.213 6.238 -9.241 1.00 0.00 H new ATOM 0 HB2 LYS B 7 90.624 5.159 -10.972 1.00 0.00 H new ATOM 0 HB3 LYS B 7 89.658 3.700 -10.877 1.00 0.00 H new ATOM 0 HG2 LYS B 7 87.662 4.873 -11.671 1.00 0.00 H new ATOM 0 HG3 LYS B 7 88.451 6.432 -11.529 1.00 0.00 H new ATOM 0 HD2 LYS B 7 88.500 5.743 -13.888 1.00 0.00 H new ATOM 0 HD3 LYS B 7 90.138 5.717 -13.266 1.00 0.00 H new ATOM 0 HE2 LYS B 7 90.188 3.329 -13.129 1.00 0.00 H new ATOM 0 HE3 LYS B 7 88.441 3.195 -13.144 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 89.382 2.610 -15.298 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 88.425 4.005 -15.442 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 90.118 4.134 -15.428 1.00 0.00 H new ATOM 1744 N ALA B 8 87.663 3.363 -8.777 1.00 0.00 N ATOM 1745 CA ALA B 8 86.311 2.837 -8.473 1.00 0.00 C ATOM 1746 C ALA B 8 85.806 3.594 -7.257 1.00 0.00 C ATOM 1747 O ALA B 8 84.662 3.988 -7.178 1.00 0.00 O ATOM 1748 CB ALA B 8 86.367 1.338 -8.199 1.00 0.00 C ATOM 0 H ALA B 8 88.420 2.680 -8.748 1.00 0.00 H new ATOM 0 HA ALA B 8 85.638 2.979 -9.319 1.00 0.00 H new ATOM 0 HB1 ALA B 8 85.365 0.971 -7.978 1.00 0.00 H new ATOM 0 HB2 ALA B 8 86.757 0.822 -9.076 1.00 0.00 H new ATOM 0 HB3 ALA B 8 87.019 1.148 -7.347 1.00 0.00 H new ATOM 1754 N LEU B 9 86.677 3.859 -6.330 1.00 0.00 N ATOM 1755 CA LEU B 9 86.265 4.659 -5.154 1.00 0.00 C ATOM 1756 C LEU B 9 85.801 5.988 -5.733 1.00 0.00 C ATOM 1757 O LEU B 9 84.747 6.505 -5.424 1.00 0.00 O ATOM 1758 CB LEU B 9 87.495 4.876 -4.264 1.00 0.00 C ATOM 1759 CG LEU B 9 87.134 5.414 -2.862 1.00 0.00 C ATOM 1760 CD1 LEU B 9 85.985 6.431 -2.897 1.00 0.00 C ATOM 1761 CD2 LEU B 9 86.744 4.254 -1.942 1.00 0.00 C ATOM 0 H LEU B 9 87.651 3.557 -6.336 1.00 0.00 H new ATOM 0 HA LEU B 9 85.487 4.183 -4.558 1.00 0.00 H new ATOM 0 HB2 LEU B 9 88.032 3.933 -4.159 1.00 0.00 H new ATOM 0 HB3 LEU B 9 88.172 5.576 -4.753 1.00 0.00 H new ATOM 0 HG LEU B 9 88.019 5.924 -2.483 1.00 0.00 H new ATOM 0 HD11 LEU B 9 85.773 6.776 -1.885 1.00 0.00 H new ATOM 0 HD12 LEU B 9 86.270 7.281 -3.518 1.00 0.00 H new ATOM 0 HD13 LEU B 9 85.095 5.960 -3.313 1.00 0.00 H new ATOM 0 HD21 LEU B 9 86.491 4.642 -0.955 1.00 0.00 H new ATOM 0 HD22 LEU B 9 85.882 3.733 -2.359 1.00 0.00 H new ATOM 0 HD23 LEU B 9 87.581 3.561 -1.856 1.00 0.00 H new ATOM 1773 N ASP B 10 86.594 6.515 -6.620 1.00 0.00 N ATOM 1774 CA ASP B 10 86.226 7.791 -7.283 1.00 0.00 C ATOM 1775 C ASP B 10 84.908 7.593 -8.040 1.00 0.00 C ATOM 1776 O ASP B 10 84.081 8.479 -8.092 1.00 0.00 O ATOM 1777 CB ASP B 10 87.341 8.218 -8.250 1.00 0.00 C ATOM 1778 CG ASP B 10 87.185 9.700 -8.600 1.00 0.00 C ATOM 1779 OD1 ASP B 10 86.079 10.202 -8.491 1.00 0.00 O ATOM 1780 OD2 ASP B 10 88.177 10.306 -8.975 1.00 0.00 O ATOM 0 H ASP B 10 87.485 6.114 -6.915 1.00 0.00 H new ATOM 0 HA ASP B 10 86.101 8.575 -6.537 1.00 0.00 H new ATOM 0 HB2 ASP B 10 88.316 8.043 -7.795 1.00 0.00 H new ATOM 0 HB3 ASP B 10 87.299 7.614 -9.157 1.00 0.00 H new ATOM 1785 N VAL B 11 84.698 6.440 -8.629 1.00 0.00 N ATOM 1786 CA VAL B 11 83.418 6.220 -9.374 1.00 0.00 C ATOM 1787 C VAL B 11 82.244 6.379 -8.402 1.00 0.00 C ATOM 1788 O VAL B 11 81.232 6.969 -8.730 1.00 0.00 O ATOM 1789 CB VAL B 11 83.395 4.808 -9.986 1.00 0.00 C ATOM 1790 CG1 VAL B 11 82.007 4.503 -10.555 1.00 0.00 C ATOM 1791 CG2 VAL B 11 84.433 4.715 -11.111 1.00 0.00 C ATOM 0 H VAL B 11 85.346 5.653 -8.627 1.00 0.00 H new ATOM 0 HA VAL B 11 83.337 6.951 -10.179 1.00 0.00 H new ATOM 0 HB VAL B 11 83.632 4.084 -9.207 1.00 0.00 H new ATOM 0 HG11 VAL B 11 82.002 3.502 -10.985 1.00 0.00 H new ATOM 0 HG12 VAL B 11 81.266 4.559 -9.757 1.00 0.00 H new ATOM 0 HG13 VAL B 11 81.763 5.231 -11.328 1.00 0.00 H new ATOM 0 HG21 VAL B 11 84.414 3.714 -11.542 1.00 0.00 H new ATOM 0 HG22 VAL B 11 84.199 5.447 -11.884 1.00 0.00 H new ATOM 0 HG23 VAL B 11 85.425 4.918 -10.708 1.00 0.00 H new ATOM 1801 N MET B 12 82.371 5.866 -7.204 1.00 0.00 N ATOM 1802 CA MET B 12 81.261 6.004 -6.216 1.00 0.00 C ATOM 1803 C MET B 12 81.048 7.485 -5.927 1.00 0.00 C ATOM 1804 O MET B 12 79.941 7.959 -5.791 1.00 0.00 O ATOM 1805 CB MET B 12 81.633 5.298 -4.911 1.00 0.00 C ATOM 1806 CG MET B 12 80.401 5.211 -4.000 1.00 0.00 C ATOM 1807 SD MET B 12 80.931 4.996 -2.284 1.00 0.00 S ATOM 1808 CE MET B 12 82.137 3.684 -2.581 1.00 0.00 C ATOM 0 H MET B 12 83.191 5.360 -6.870 1.00 0.00 H new ATOM 0 HA MET B 12 80.354 5.557 -6.624 1.00 0.00 H new ATOM 0 HB2 MET B 12 82.012 4.298 -5.123 1.00 0.00 H new ATOM 0 HB3 MET B 12 82.432 5.842 -4.407 1.00 0.00 H new ATOM 0 HG2 MET B 12 79.801 6.116 -4.095 1.00 0.00 H new ATOM 0 HG3 MET B 12 79.770 4.376 -4.304 1.00 0.00 H new ATOM 0 HE1 MET B 12 82.346 3.163 -1.647 1.00 0.00 H new ATOM 0 HE2 MET B 12 81.735 2.978 -3.308 1.00 0.00 H new ATOM 0 HE3 MET B 12 83.059 4.118 -2.968 1.00 0.00 H new ATOM 1818 N VAL B 13 82.116 8.212 -5.813 1.00 0.00 N ATOM 1819 CA VAL B 13 82.004 9.667 -5.526 1.00 0.00 C ATOM 1820 C VAL B 13 81.654 10.433 -6.808 1.00 0.00 C ATOM 1821 O VAL B 13 80.819 11.315 -6.804 1.00 0.00 O ATOM 1822 CB VAL B 13 83.337 10.162 -4.966 1.00 0.00 C ATOM 1823 CG1 VAL B 13 83.258 11.662 -4.672 1.00 0.00 C ATOM 1824 CG2 VAL B 13 83.638 9.402 -3.673 1.00 0.00 C ATOM 0 H VAL B 13 83.069 7.862 -5.906 1.00 0.00 H new ATOM 0 HA VAL B 13 81.212 9.838 -4.797 1.00 0.00 H new ATOM 0 HB VAL B 13 84.128 9.989 -5.696 1.00 0.00 H new ATOM 0 HG11 VAL B 13 84.213 12.005 -4.273 1.00 0.00 H new ATOM 0 HG12 VAL B 13 83.034 12.202 -5.592 1.00 0.00 H new ATOM 0 HG13 VAL B 13 82.471 11.849 -3.941 1.00 0.00 H new ATOM 0 HG21 VAL B 13 84.587 9.745 -3.262 1.00 0.00 H new ATOM 0 HG22 VAL B 13 82.843 9.584 -2.950 1.00 0.00 H new ATOM 0 HG23 VAL B 13 83.699 8.334 -3.884 1.00 0.00 H new ATOM 1834 N SER B 14 82.296 10.115 -7.903 1.00 0.00 N ATOM 1835 CA SER B 14 82.007 10.841 -9.178 1.00 0.00 C ATOM 1836 C SER B 14 80.538 10.667 -9.569 1.00 0.00 C ATOM 1837 O SER B 14 79.861 11.620 -9.904 1.00 0.00 O ATOM 1838 CB SER B 14 82.893 10.283 -10.290 1.00 0.00 C ATOM 1839 OG SER B 14 84.252 10.599 -10.014 1.00 0.00 O ATOM 0 H SER B 14 83.006 9.386 -7.970 1.00 0.00 H new ATOM 0 HA SER B 14 82.212 11.902 -9.034 1.00 0.00 H new ATOM 0 HB2 SER B 14 82.767 9.203 -10.363 1.00 0.00 H new ATOM 0 HB3 SER B 14 82.598 10.704 -11.251 1.00 0.00 H new ATOM 0 HG SER B 14 84.610 9.962 -9.360 1.00 0.00 H new ATOM 1845 N THR B 15 80.033 9.464 -9.530 1.00 0.00 N ATOM 1846 CA THR B 15 78.603 9.251 -9.899 1.00 0.00 C ATOM 1847 C THR B 15 77.728 10.036 -8.923 1.00 0.00 C ATOM 1848 O THR B 15 76.755 10.664 -9.293 1.00 0.00 O ATOM 1849 CB THR B 15 78.285 7.748 -9.838 1.00 0.00 C ATOM 1850 OG1 THR B 15 77.145 7.472 -10.635 1.00 0.00 O ATOM 1851 CG2 THR B 15 78.028 7.304 -8.393 1.00 0.00 C ATOM 0 H THR B 15 80.544 8.624 -9.260 1.00 0.00 H new ATOM 0 HA THR B 15 78.407 9.602 -10.912 1.00 0.00 H new ATOM 0 HB THR B 15 79.143 7.195 -10.220 1.00 0.00 H new ATOM 0 HG1 THR B 15 76.376 7.293 -10.055 1.00 0.00 H new ATOM 0 HG21 THR B 15 77.805 6.237 -8.374 1.00 0.00 H new ATOM 0 HG22 THR B 15 78.914 7.500 -7.789 1.00 0.00 H new ATOM 0 HG23 THR B 15 77.182 7.859 -7.987 1.00 0.00 H new ATOM 1859 N PHE B 16 78.092 10.010 -7.676 1.00 0.00 N ATOM 1860 CA PHE B 16 77.318 10.754 -6.647 1.00 0.00 C ATOM 1861 C PHE B 16 77.330 12.241 -7.014 1.00 0.00 C ATOM 1862 O PHE B 16 76.339 12.933 -6.897 1.00 0.00 O ATOM 1863 CB PHE B 16 77.987 10.535 -5.285 1.00 0.00 C ATOM 1864 CG PHE B 16 77.240 11.273 -4.199 1.00 0.00 C ATOM 1865 CD1 PHE B 16 76.198 10.641 -3.510 1.00 0.00 C ATOM 1866 CD2 PHE B 16 77.605 12.581 -3.866 1.00 0.00 C ATOM 1867 CE1 PHE B 16 75.520 11.319 -2.490 1.00 0.00 C ATOM 1868 CE2 PHE B 16 76.928 13.259 -2.848 1.00 0.00 C ATOM 1869 CZ PHE B 16 75.886 12.628 -2.157 1.00 0.00 C ATOM 0 H PHE B 16 78.901 9.500 -7.321 1.00 0.00 H new ATOM 0 HA PHE B 16 76.287 10.404 -6.601 1.00 0.00 H new ATOM 0 HB2 PHE B 16 78.015 9.470 -5.055 1.00 0.00 H new ATOM 0 HB3 PHE B 16 79.020 10.880 -5.322 1.00 0.00 H new ATOM 0 HD1 PHE B 16 75.917 9.630 -3.765 1.00 0.00 H new ATOM 0 HD2 PHE B 16 78.411 13.068 -4.396 1.00 0.00 H new ATOM 0 HE1 PHE B 16 74.715 10.832 -1.960 1.00 0.00 H new ATOM 0 HE2 PHE B 16 77.209 14.270 -2.594 1.00 0.00 H new ATOM 0 HZ PHE B 16 75.366 13.151 -1.368 1.00 0.00 H new ATOM 1879 N HIS B 17 78.451 12.722 -7.476 1.00 0.00 N ATOM 1880 CA HIS B 17 78.559 14.153 -7.880 1.00 0.00 C ATOM 1881 C HIS B 17 77.760 14.381 -9.162 1.00 0.00 C ATOM 1882 O HIS B 17 77.319 15.480 -9.441 1.00 0.00 O ATOM 1883 CB HIS B 17 80.029 14.501 -8.120 1.00 0.00 C ATOM 1884 CG HIS B 17 80.150 15.947 -8.515 1.00 0.00 C ATOM 1885 ND1 HIS B 17 80.260 16.349 -9.840 1.00 0.00 N ATOM 1886 CD2 HIS B 17 80.193 17.098 -7.768 1.00 0.00 C ATOM 1887 CE1 HIS B 17 80.367 17.692 -9.848 1.00 0.00 C ATOM 1888 NE2 HIS B 17 80.333 18.194 -8.613 1.00 0.00 N ATOM 0 H HIS B 17 79.306 12.179 -7.592 1.00 0.00 H new ATOM 0 HA HIS B 17 78.160 14.789 -7.089 1.00 0.00 H new ATOM 0 HB2 HIS B 17 80.610 14.311 -7.217 1.00 0.00 H new ATOM 0 HB3 HIS B 17 80.440 13.864 -8.903 1.00 0.00 H new ATOM 0 HD2 HIS B 17 80.128 17.145 -6.691 1.00 0.00 H new ATOM 0 HE1 HIS B 17 80.468 18.288 -10.743 1.00 0.00 H new ATOM 0 HE2 HIS B 17 80.396 19.176 -8.344 1.00 0.00 H new ATOM 1897 N LYS B 18 77.558 13.354 -9.944 1.00 0.00 N ATOM 1898 CA LYS B 18 76.778 13.525 -11.198 1.00 0.00 C ATOM 1899 C LYS B 18 75.427 14.114 -10.816 1.00 0.00 C ATOM 1900 O LYS B 18 74.909 15.001 -11.466 1.00 0.00 O ATOM 1901 CB LYS B 18 76.590 12.165 -11.871 1.00 0.00 C ATOM 1902 CG LYS B 18 76.011 12.355 -13.270 1.00 0.00 C ATOM 1903 CD LYS B 18 75.846 10.990 -13.936 1.00 0.00 C ATOM 1904 CE LYS B 18 75.278 11.174 -15.341 1.00 0.00 C ATOM 1905 NZ LYS B 18 76.333 11.732 -16.237 1.00 0.00 N ATOM 0 H LYS B 18 77.899 12.409 -9.767 1.00 0.00 H new ATOM 0 HA LYS B 18 77.296 14.183 -11.895 1.00 0.00 H new ATOM 0 HB2 LYS B 18 77.545 11.644 -11.931 1.00 0.00 H new ATOM 0 HB3 LYS B 18 75.924 11.542 -11.273 1.00 0.00 H new ATOM 0 HG2 LYS B 18 75.048 12.863 -13.212 1.00 0.00 H new ATOM 0 HG3 LYS B 18 76.670 12.987 -13.866 1.00 0.00 H new ATOM 0 HD2 LYS B 18 76.807 10.479 -13.985 1.00 0.00 H new ATOM 0 HD3 LYS B 18 75.181 10.362 -13.343 1.00 0.00 H new ATOM 0 HE2 LYS B 18 74.924 10.219 -15.729 1.00 0.00 H new ATOM 0 HE3 LYS B 18 74.419 11.844 -15.312 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 76.032 11.637 -17.228 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 76.481 12.737 -16.015 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 77.222 11.211 -16.093 1.00 0.00 H new ATOM 1919 N TYR B 19 74.879 13.650 -9.731 1.00 0.00 N ATOM 1920 CA TYR B 19 73.585 14.205 -9.253 1.00 0.00 C ATOM 1921 C TYR B 19 73.809 15.671 -8.900 1.00 0.00 C ATOM 1922 O TYR B 19 72.976 16.515 -9.150 1.00 0.00 O ATOM 1923 CB TYR B 19 73.132 13.416 -8.020 1.00 0.00 C ATOM 1924 CG TYR B 19 72.724 12.025 -8.455 1.00 0.00 C ATOM 1925 CD1 TYR B 19 73.671 10.992 -8.493 1.00 0.00 C ATOM 1926 CD2 TYR B 19 71.400 11.771 -8.826 1.00 0.00 C ATOM 1927 CE1 TYR B 19 73.292 9.709 -8.908 1.00 0.00 C ATOM 1928 CE2 TYR B 19 71.019 10.487 -9.238 1.00 0.00 C ATOM 1929 CZ TYR B 19 71.965 9.457 -9.281 1.00 0.00 C ATOM 1930 OH TYR B 19 71.592 8.194 -9.693 1.00 0.00 O ATOM 0 H TYR B 19 75.273 12.908 -9.152 1.00 0.00 H new ATOM 0 HA TYR B 19 72.813 14.126 -10.018 1.00 0.00 H new ATOM 0 HB2 TYR B 19 73.939 13.362 -7.289 1.00 0.00 H new ATOM 0 HB3 TYR B 19 72.296 13.920 -7.535 1.00 0.00 H new ATOM 0 HD1 TYR B 19 74.693 11.185 -8.202 1.00 0.00 H new ATOM 0 HD2 TYR B 19 70.670 12.566 -8.795 1.00 0.00 H new ATOM 0 HE1 TYR B 19 74.022 8.914 -8.940 1.00 0.00 H new ATOM 0 HE2 TYR B 19 69.995 10.292 -9.522 1.00 0.00 H new ATOM 0 HH TYR B 19 72.392 7.667 -9.897 1.00 0.00 H new ATOM 1940 N SER B 20 74.937 15.990 -8.324 1.00 0.00 N ATOM 1941 CA SER B 20 75.211 17.409 -7.966 1.00 0.00 C ATOM 1942 C SER B 20 74.002 17.974 -7.224 1.00 0.00 C ATOM 1943 O SER B 20 73.865 19.167 -7.046 1.00 0.00 O ATOM 1944 CB SER B 20 75.448 18.215 -9.241 1.00 0.00 C ATOM 1945 OG SER B 20 75.709 19.570 -8.900 1.00 0.00 O ATOM 0 H SER B 20 75.678 15.330 -8.087 1.00 0.00 H new ATOM 0 HA SER B 20 76.095 17.468 -7.331 1.00 0.00 H new ATOM 0 HB2 SER B 20 76.289 17.800 -9.796 1.00 0.00 H new ATOM 0 HB3 SER B 20 74.575 18.153 -9.891 1.00 0.00 H new ATOM 0 HG SER B 20 75.162 19.824 -8.128 1.00 0.00 H new ATOM 1951 N GLY B 21 73.122 17.115 -6.799 1.00 0.00 N ATOM 1952 CA GLY B 21 71.911 17.587 -6.066 1.00 0.00 C ATOM 1953 C GLY B 21 71.127 18.558 -6.948 1.00 0.00 C ATOM 1954 O GLY B 21 71.000 19.726 -6.642 1.00 0.00 O ATOM 0 H GLY B 21 73.186 16.105 -6.926 1.00 0.00 H new ATOM 0 HA2 GLY B 21 71.283 16.738 -5.794 1.00 0.00 H new ATOM 0 HA3 GLY B 21 72.203 18.077 -5.137 1.00 0.00 H new ATOM 1958 N LYS B 22 70.599 18.085 -8.042 1.00 0.00 N ATOM 1959 CA LYS B 22 69.825 18.985 -8.936 1.00 0.00 C ATOM 1960 C LYS B 22 68.722 19.660 -8.116 1.00 0.00 C ATOM 1961 O LYS B 22 68.214 20.706 -8.471 1.00 0.00 O ATOM 1962 CB LYS B 22 69.206 18.160 -10.073 1.00 0.00 C ATOM 1963 CG LYS B 22 70.215 17.084 -10.561 1.00 0.00 C ATOM 1964 CD LYS B 22 70.005 15.733 -9.812 1.00 0.00 C ATOM 1965 CE LYS B 22 69.391 14.692 -10.756 1.00 0.00 C ATOM 1966 NZ LYS B 22 70.251 14.548 -11.966 1.00 0.00 N ATOM 0 H LYS B 22 70.671 17.116 -8.354 1.00 0.00 H new ATOM 0 HA LYS B 22 70.478 19.745 -9.365 1.00 0.00 H new ATOM 0 HB2 LYS B 22 68.290 17.681 -9.728 1.00 0.00 H new ATOM 0 HB3 LYS B 22 68.932 18.815 -10.900 1.00 0.00 H new ATOM 0 HG2 LYS B 22 70.096 16.930 -11.634 1.00 0.00 H new ATOM 0 HG3 LYS B 22 71.234 17.437 -10.400 1.00 0.00 H new ATOM 0 HD2 LYS B 22 70.959 15.369 -9.429 1.00 0.00 H new ATOM 0 HD3 LYS B 22 69.353 15.884 -8.952 1.00 0.00 H new ATOM 0 HE2 LYS B 22 69.299 13.733 -10.246 1.00 0.00 H new ATOM 0 HE3 LYS B 22 68.385 14.997 -11.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 70.239 13.558 -12.285 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 69.888 15.160 -12.724 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 71.226 14.825 -11.734 1.00 0.00 H new ATOM 1980 N GLU B 23 68.355 19.062 -7.016 1.00 0.00 N ATOM 1981 CA GLU B 23 67.290 19.652 -6.154 1.00 0.00 C ATOM 1982 C GLU B 23 67.899 20.756 -5.279 1.00 0.00 C ATOM 1983 O GLU B 23 67.194 21.511 -4.640 1.00 0.00 O ATOM 1984 CB GLU B 23 66.698 18.552 -5.265 1.00 0.00 C ATOM 1985 CG GLU B 23 65.459 19.080 -4.533 1.00 0.00 C ATOM 1986 CD GLU B 23 64.803 17.942 -3.749 1.00 0.00 C ATOM 1987 OE1 GLU B 23 65.298 16.829 -3.829 1.00 0.00 O ATOM 1988 OE2 GLU B 23 63.816 18.203 -3.079 1.00 0.00 O ATOM 0 H GLU B 23 68.749 18.185 -6.675 1.00 0.00 H new ATOM 0 HA GLU B 23 66.503 20.079 -6.775 1.00 0.00 H new ATOM 0 HB2 GLU B 23 66.431 17.687 -5.872 1.00 0.00 H new ATOM 0 HB3 GLU B 23 67.442 18.217 -4.543 1.00 0.00 H new ATOM 0 HG2 GLU B 23 65.740 19.887 -3.856 1.00 0.00 H new ATOM 0 HG3 GLU B 23 64.751 19.497 -5.249 1.00 0.00 H new ATOM 1995 N GLY B 24 69.209 20.866 -5.261 1.00 0.00 N ATOM 1996 CA GLY B 24 69.882 21.930 -4.443 1.00 0.00 C ATOM 1997 C GLY B 24 70.791 21.293 -3.383 1.00 0.00 C ATOM 1998 O GLY B 24 71.810 21.847 -3.021 1.00 0.00 O ATOM 0 H GLY B 24 69.844 20.261 -5.781 1.00 0.00 H new ATOM 0 HA2 GLY B 24 70.469 22.580 -5.092 1.00 0.00 H new ATOM 0 HA3 GLY B 24 69.132 22.556 -3.960 1.00 0.00 H new ATOM 2002 N ASP B 25 70.437 20.138 -2.879 1.00 0.00 N ATOM 2003 CA ASP B 25 71.294 19.480 -1.840 1.00 0.00 C ATOM 2004 C ASP B 25 72.245 18.489 -2.514 1.00 0.00 C ATOM 2005 O ASP B 25 71.851 17.411 -2.916 1.00 0.00 O ATOM 2006 CB ASP B 25 70.402 18.728 -0.851 1.00 0.00 C ATOM 2007 CG ASP B 25 69.599 17.665 -1.600 1.00 0.00 C ATOM 2008 OD1 ASP B 25 69.387 17.840 -2.788 1.00 0.00 O ATOM 2009 OD2 ASP B 25 69.212 16.691 -0.974 1.00 0.00 O ATOM 0 H ASP B 25 69.596 19.622 -3.139 1.00 0.00 H new ATOM 0 HA ASP B 25 71.872 20.239 -1.312 1.00 0.00 H new ATOM 0 HB2 ASP B 25 71.011 18.261 -0.077 1.00 0.00 H new ATOM 0 HB3 ASP B 25 69.728 19.423 -0.350 1.00 0.00 H new ATOM 2014 N LYS B 26 73.498 18.848 -2.645 1.00 0.00 N ATOM 2015 CA LYS B 26 74.490 17.936 -3.299 1.00 0.00 C ATOM 2016 C LYS B 26 75.322 17.203 -2.250 1.00 0.00 C ATOM 2017 O LYS B 26 75.953 16.209 -2.542 1.00 0.00 O ATOM 2018 CB LYS B 26 75.415 18.761 -4.195 1.00 0.00 C ATOM 2019 CG LYS B 26 76.156 19.798 -3.350 1.00 0.00 C ATOM 2020 CD LYS B 26 76.941 20.738 -4.268 1.00 0.00 C ATOM 2021 CE LYS B 26 77.752 21.719 -3.422 1.00 0.00 C ATOM 2022 NZ LYS B 26 76.828 22.682 -2.759 1.00 0.00 N ATOM 0 H LYS B 26 73.879 19.738 -2.326 1.00 0.00 H new ATOM 0 HA LYS B 26 73.951 17.198 -3.893 1.00 0.00 H new ATOM 0 HB2 LYS B 26 76.129 18.108 -4.697 1.00 0.00 H new ATOM 0 HB3 LYS B 26 74.836 19.258 -4.973 1.00 0.00 H new ATOM 0 HG2 LYS B 26 75.447 20.367 -2.750 1.00 0.00 H new ATOM 0 HG3 LYS B 26 76.834 19.300 -2.656 1.00 0.00 H new ATOM 0 HD2 LYS B 26 77.605 20.163 -4.913 1.00 0.00 H new ATOM 0 HD3 LYS B 26 76.257 21.282 -4.919 1.00 0.00 H new ATOM 0 HE2 LYS B 26 78.330 21.178 -2.673 1.00 0.00 H new ATOM 0 HE3 LYS B 26 78.464 22.255 -4.049 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 77.375 23.475 -2.367 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 76.145 23.044 -3.455 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 76.317 22.201 -1.991 1.00 0.00 H new ATOM 2036 N PHE B 27 75.345 17.679 -1.040 1.00 0.00 N ATOM 2037 CA PHE B 27 76.157 16.998 0.010 1.00 0.00 C ATOM 2038 C PHE B 27 75.336 15.879 0.645 1.00 0.00 C ATOM 2039 O PHE B 27 75.820 15.136 1.474 1.00 0.00 O ATOM 2040 CB PHE B 27 76.553 18.008 1.088 1.00 0.00 C ATOM 2041 CG PHE B 27 77.504 17.354 2.061 1.00 0.00 C ATOM 2042 CD1 PHE B 27 78.880 17.410 1.824 1.00 0.00 C ATOM 2043 CD2 PHE B 27 77.014 16.698 3.199 1.00 0.00 C ATOM 2044 CE1 PHE B 27 79.771 16.813 2.721 1.00 0.00 C ATOM 2045 CE2 PHE B 27 77.907 16.099 4.098 1.00 0.00 C ATOM 2046 CZ PHE B 27 79.285 16.157 3.858 1.00 0.00 C ATOM 0 H PHE B 27 74.839 18.508 -0.730 1.00 0.00 H new ATOM 0 HA PHE B 27 77.055 16.580 -0.445 1.00 0.00 H new ATOM 0 HB2 PHE B 27 77.024 18.878 0.631 1.00 0.00 H new ATOM 0 HB3 PHE B 27 75.666 18.364 1.612 1.00 0.00 H new ATOM 0 HD1 PHE B 27 79.256 17.915 0.947 1.00 0.00 H new ATOM 0 HD2 PHE B 27 75.951 16.654 3.383 1.00 0.00 H new ATOM 0 HE1 PHE B 27 80.834 16.858 2.537 1.00 0.00 H new ATOM 0 HE2 PHE B 27 77.532 15.593 4.975 1.00 0.00 H new ATOM 0 HZ PHE B 27 79.973 15.695 4.550 1.00 0.00 H new ATOM 2056 N LYS B 28 74.093 15.758 0.275 1.00 0.00 N ATOM 2057 CA LYS B 28 73.245 14.691 0.879 1.00 0.00 C ATOM 2058 C LYS B 28 72.057 14.397 -0.032 1.00 0.00 C ATOM 2059 O LYS B 28 71.681 15.213 -0.850 1.00 0.00 O ATOM 2060 CB LYS B 28 72.734 15.182 2.236 1.00 0.00 C ATOM 2061 CG LYS B 28 72.055 16.545 2.061 1.00 0.00 C ATOM 2062 CD LYS B 28 71.728 17.145 3.428 1.00 0.00 C ATOM 2063 CE LYS B 28 71.086 18.518 3.236 1.00 0.00 C ATOM 2064 NZ LYS B 28 72.024 19.402 2.489 1.00 0.00 N ATOM 0 H LYS B 28 73.628 16.347 -0.416 1.00 0.00 H new ATOM 0 HA LYS B 28 73.831 13.781 1.004 1.00 0.00 H new ATOM 0 HB2 LYS B 28 72.029 14.463 2.653 1.00 0.00 H new ATOM 0 HB3 LYS B 28 73.561 15.263 2.941 1.00 0.00 H new ATOM 0 HG2 LYS B 28 72.709 17.218 1.506 1.00 0.00 H new ATOM 0 HG3 LYS B 28 71.142 16.433 1.476 1.00 0.00 H new ATOM 0 HD2 LYS B 28 71.051 16.488 3.974 1.00 0.00 H new ATOM 0 HD3 LYS B 28 72.636 17.235 4.025 1.00 0.00 H new ATOM 0 HE2 LYS B 28 70.148 18.420 2.690 1.00 0.00 H new ATOM 0 HE3 LYS B 28 70.847 18.958 4.204 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 72.031 20.347 2.924 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 72.982 18.998 2.522 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 71.715 19.479 1.499 1.00 0.00 H new ATOM 2078 N LEU B 29 71.451 13.240 0.115 1.00 0.00 N ATOM 2079 CA LEU B 29 70.269 12.883 -0.732 1.00 0.00 C ATOM 2080 C LEU B 29 69.131 12.434 0.178 1.00 0.00 C ATOM 2081 O LEU B 29 69.326 12.148 1.343 1.00 0.00 O ATOM 2082 CB LEU B 29 70.600 11.721 -1.683 1.00 0.00 C ATOM 2083 CG LEU B 29 71.991 11.875 -2.304 1.00 0.00 C ATOM 2084 CD1 LEU B 29 72.345 10.571 -3.027 1.00 0.00 C ATOM 2085 CD2 LEU B 29 71.991 13.026 -3.315 1.00 0.00 C ATOM 0 H LEU B 29 71.727 12.526 0.789 1.00 0.00 H new ATOM 0 HA LEU B 29 69.990 13.758 -1.319 1.00 0.00 H new ATOM 0 HB2 LEU B 29 70.547 10.779 -1.138 1.00 0.00 H new ATOM 0 HB3 LEU B 29 69.852 11.674 -2.474 1.00 0.00 H new ATOM 0 HG LEU B 29 72.720 12.090 -1.523 1.00 0.00 H new ATOM 0 HD11 LEU B 29 73.334 10.661 -3.477 1.00 0.00 H new ATOM 0 HD12 LEU B 29 72.345 9.747 -2.313 1.00 0.00 H new ATOM 0 HD13 LEU B 29 71.609 10.376 -3.806 1.00 0.00 H new ATOM 0 HD21 LEU B 29 72.985 13.127 -3.751 1.00 0.00 H new ATOM 0 HD22 LEU B 29 71.268 12.817 -4.104 1.00 0.00 H new ATOM 0 HD23 LEU B 29 71.720 13.953 -2.811 1.00 0.00 H new ATOM 2097 N ASN B 30 67.950 12.341 -0.359 1.00 0.00 N ATOM 2098 CA ASN B 30 66.793 11.867 0.444 1.00 0.00 C ATOM 2099 C ASN B 30 66.626 10.372 0.162 1.00 0.00 C ATOM 2100 O ASN B 30 66.758 9.936 -0.961 1.00 0.00 O ATOM 2101 CB ASN B 30 65.528 12.615 0.013 1.00 0.00 C ATOM 2102 CG ASN B 30 65.720 14.116 0.236 1.00 0.00 C ATOM 2103 OD1 ASN B 30 65.782 14.878 -0.709 1.00 0.00 O ATOM 2104 ND2 ASN B 30 65.814 14.579 1.453 1.00 0.00 N ATOM 0 H ASN B 30 67.735 12.575 -1.328 1.00 0.00 H new ATOM 0 HA ASN B 30 66.958 12.046 1.506 1.00 0.00 H new ATOM 0 HB2 ASN B 30 65.316 12.417 -1.038 1.00 0.00 H new ATOM 0 HB3 ASN B 30 64.670 12.259 0.584 1.00 0.00 H new ATOM 0 HD21 ASN B 30 65.939 15.579 1.610 1.00 0.00 H new ATOM 0 HD22 ASN B 30 65.762 13.941 2.247 1.00 0.00 H new ATOM 2111 N LYS B 31 66.357 9.584 1.163 1.00 0.00 N ATOM 2112 CA LYS B 31 66.199 8.115 0.953 1.00 0.00 C ATOM 2113 C LYS B 31 65.387 7.846 -0.310 1.00 0.00 C ATOM 2114 O LYS B 31 65.597 6.879 -0.996 1.00 0.00 O ATOM 2115 CB LYS B 31 65.471 7.503 2.150 1.00 0.00 C ATOM 2116 CG LYS B 31 64.087 8.144 2.293 1.00 0.00 C ATOM 2117 CD LYS B 31 63.417 7.645 3.574 1.00 0.00 C ATOM 2118 CE LYS B 31 61.937 8.025 3.552 1.00 0.00 C ATOM 2119 NZ LYS B 31 61.317 7.686 4.864 1.00 0.00 N ATOM 0 H LYS B 31 66.238 9.895 2.127 1.00 0.00 H new ATOM 0 HA LYS B 31 67.188 7.668 0.848 1.00 0.00 H new ATOM 0 HB2 LYS B 31 65.372 6.426 2.016 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.051 7.659 3.060 1.00 0.00 H new ATOM 0 HG2 LYS B 31 64.180 9.230 2.319 1.00 0.00 H new ATOM 0 HG3 LYS B 31 63.470 7.897 1.429 1.00 0.00 H new ATOM 0 HD2 LYS B 31 63.525 6.564 3.657 1.00 0.00 H new ATOM 0 HD3 LYS B 31 63.903 8.082 4.446 1.00 0.00 H new ATOM 0 HE2 LYS B 31 61.827 9.091 3.350 1.00 0.00 H new ATOM 0 HE3 LYS B 31 61.426 7.494 2.748 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 60.397 8.164 4.947 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 61.179 6.657 4.927 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 61.941 8.000 5.634 1.00 0.00 H new ATOM 2133 N SER B 32 64.473 8.692 -0.642 1.00 0.00 N ATOM 2134 CA SER B 32 63.693 8.445 -1.877 1.00 0.00 C ATOM 2135 C SER B 32 64.669 8.422 -3.037 1.00 0.00 C ATOM 2136 O SER B 32 64.555 7.630 -3.951 1.00 0.00 O ATOM 2137 CB SER B 32 62.655 9.531 -2.097 1.00 0.00 C ATOM 2138 OG SER B 32 63.295 10.800 -2.137 1.00 0.00 O ATOM 0 H SER B 32 64.230 9.536 -0.123 1.00 0.00 H new ATOM 0 HA SER B 32 63.161 7.497 -1.794 1.00 0.00 H new ATOM 0 HB2 SER B 32 62.119 9.353 -3.029 1.00 0.00 H new ATOM 0 HB3 SER B 32 61.916 9.510 -1.296 1.00 0.00 H new ATOM 0 HG SER B 32 62.625 11.500 -2.281 1.00 0.00 H new ATOM 2144 N GLU B 33 65.658 9.268 -2.984 1.00 0.00 N ATOM 2145 CA GLU B 33 66.672 9.274 -4.060 1.00 0.00 C ATOM 2146 C GLU B 33 67.299 7.908 -4.072 1.00 0.00 C ATOM 2147 O GLU B 33 67.785 7.461 -5.078 1.00 0.00 O ATOM 2148 CB GLU B 33 67.736 10.338 -3.791 1.00 0.00 C ATOM 2149 CG GLU B 33 67.104 11.729 -3.880 1.00 0.00 C ATOM 2150 CD GLU B 33 66.700 12.019 -5.326 1.00 0.00 C ATOM 2151 OE1 GLU B 33 67.300 11.439 -6.217 1.00 0.00 O ATOM 2152 OE2 GLU B 33 65.794 12.813 -5.518 1.00 0.00 O ATOM 0 H GLU B 33 65.804 9.952 -2.242 1.00 0.00 H new ATOM 0 HA GLU B 33 66.213 9.507 -5.021 1.00 0.00 H new ATOM 0 HB2 GLU B 33 68.173 10.188 -2.804 1.00 0.00 H new ATOM 0 HB3 GLU B 33 68.546 10.248 -4.515 1.00 0.00 H new ATOM 0 HG2 GLU B 33 66.231 11.785 -3.230 1.00 0.00 H new ATOM 0 HG3 GLU B 33 67.810 12.483 -3.531 1.00 0.00 H new ATOM 2159 N LEU B 34 67.259 7.202 -2.977 1.00 0.00 N ATOM 2160 CA LEU B 34 67.836 5.837 -3.030 1.00 0.00 C ATOM 2161 C LEU B 34 67.049 5.077 -4.083 1.00 0.00 C ATOM 2162 O LEU B 34 67.612 4.396 -4.905 1.00 0.00 O ATOM 2163 CB LEU B 34 67.739 5.112 -1.671 1.00 0.00 C ATOM 2164 CG LEU B 34 68.308 3.663 -1.779 1.00 0.00 C ATOM 2165 CD1 LEU B 34 69.109 3.311 -0.518 1.00 0.00 C ATOM 2166 CD2 LEU B 34 67.152 2.645 -1.923 1.00 0.00 C ATOM 0 H LEU B 34 66.868 7.497 -2.082 1.00 0.00 H new ATOM 0 HA LEU B 34 68.897 5.891 -3.274 1.00 0.00 H new ATOM 0 HB2 LEU B 34 68.291 5.670 -0.915 1.00 0.00 H new ATOM 0 HB3 LEU B 34 66.699 5.077 -1.345 1.00 0.00 H new ATOM 0 HG LEU B 34 68.956 3.618 -2.655 1.00 0.00 H new ATOM 0 HD11 LEU B 34 69.500 2.297 -0.607 1.00 0.00 H new ATOM 0 HD12 LEU B 34 69.937 4.011 -0.406 1.00 0.00 H new ATOM 0 HD13 LEU B 34 68.459 3.374 0.355 1.00 0.00 H new ATOM 0 HD21 LEU B 34 67.561 1.638 -1.998 1.00 0.00 H new ATOM 0 HD22 LEU B 34 66.501 2.708 -1.051 1.00 0.00 H new ATOM 0 HD23 LEU B 34 66.578 2.871 -2.822 1.00 0.00 H new ATOM 2178 N LYS B 35 65.748 5.210 -4.097 1.00 0.00 N ATOM 2179 CA LYS B 35 64.974 4.488 -5.140 1.00 0.00 C ATOM 2180 C LYS B 35 65.388 4.976 -6.527 1.00 0.00 C ATOM 2181 O LYS B 35 65.697 4.194 -7.403 1.00 0.00 O ATOM 2182 CB LYS B 35 63.485 4.760 -4.951 1.00 0.00 C ATOM 2183 CG LYS B 35 62.674 3.872 -5.896 1.00 0.00 C ATOM 2184 CD LYS B 35 61.185 4.151 -5.699 1.00 0.00 C ATOM 2185 CE LYS B 35 60.369 3.265 -6.643 1.00 0.00 C ATOM 2186 NZ LYS B 35 58.915 3.482 -6.402 1.00 0.00 N ATOM 0 H LYS B 35 65.202 5.774 -3.446 1.00 0.00 H new ATOM 0 HA LYS B 35 65.174 3.420 -5.051 1.00 0.00 H new ATOM 0 HB2 LYS B 35 63.198 4.565 -3.918 1.00 0.00 H new ATOM 0 HB3 LYS B 35 63.269 5.810 -5.149 1.00 0.00 H new ATOM 0 HG2 LYS B 35 62.958 4.067 -6.930 1.00 0.00 H new ATOM 0 HG3 LYS B 35 62.888 2.821 -5.699 1.00 0.00 H new ATOM 0 HD2 LYS B 35 60.902 3.956 -4.665 1.00 0.00 H new ATOM 0 HD3 LYS B 35 60.972 5.202 -5.895 1.00 0.00 H new ATOM 0 HE2 LYS B 35 60.615 3.498 -7.679 1.00 0.00 H new ATOM 0 HE3 LYS B 35 60.622 2.217 -6.483 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 58.363 2.879 -7.045 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 58.686 3.239 -5.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 58.679 4.480 -6.576 1.00 0.00 H new ATOM 2200 N GLU B 36 65.386 6.262 -6.737 1.00 0.00 N ATOM 2201 CA GLU B 36 65.769 6.791 -8.076 1.00 0.00 C ATOM 2202 C GLU B 36 67.258 6.597 -8.319 1.00 0.00 C ATOM 2203 O GLU B 36 67.673 6.158 -9.370 1.00 0.00 O ATOM 2204 CB GLU B 36 65.422 8.281 -8.151 1.00 0.00 C ATOM 2205 CG GLU B 36 65.840 8.850 -9.510 1.00 0.00 C ATOM 2206 CD GLU B 36 65.361 10.299 -9.626 1.00 0.00 C ATOM 2207 OE1 GLU B 36 64.629 10.733 -8.751 1.00 0.00 O ATOM 2208 OE2 GLU B 36 65.731 10.951 -10.588 1.00 0.00 O ATOM 0 H GLU B 36 65.137 6.967 -6.043 1.00 0.00 H new ATOM 0 HA GLU B 36 65.219 6.246 -8.843 1.00 0.00 H new ATOM 0 HB2 GLU B 36 64.351 8.421 -8.003 1.00 0.00 H new ATOM 0 HB3 GLU B 36 65.928 8.821 -7.351 1.00 0.00 H new ATOM 0 HG2 GLU B 36 66.924 8.804 -9.617 1.00 0.00 H new ATOM 0 HG3 GLU B 36 65.414 8.250 -10.314 1.00 0.00 H new ATOM 2215 N LEU B 37 68.064 6.914 -7.361 1.00 0.00 N ATOM 2216 CA LEU B 37 69.517 6.745 -7.547 1.00 0.00 C ATOM 2217 C LEU B 37 69.832 5.260 -7.620 1.00 0.00 C ATOM 2218 O LEU B 37 70.743 4.848 -8.311 1.00 0.00 O ATOM 2219 CB LEU B 37 70.271 7.393 -6.374 1.00 0.00 C ATOM 2220 CG LEU B 37 71.810 7.284 -6.587 1.00 0.00 C ATOM 2221 CD1 LEU B 37 72.505 8.570 -6.121 1.00 0.00 C ATOM 2222 CD2 LEU B 37 72.373 6.108 -5.774 1.00 0.00 C ATOM 0 H LEU B 37 67.779 7.284 -6.454 1.00 0.00 H new ATOM 0 HA LEU B 37 69.833 7.230 -8.471 1.00 0.00 H new ATOM 0 HB2 LEU B 37 69.984 8.441 -6.284 1.00 0.00 H new ATOM 0 HB3 LEU B 37 69.992 6.905 -5.440 1.00 0.00 H new ATOM 0 HG LEU B 37 71.995 7.127 -7.650 1.00 0.00 H new ATOM 0 HD11 LEU B 37 73.580 8.479 -6.276 1.00 0.00 H new ATOM 0 HD12 LEU B 37 72.126 9.416 -6.694 1.00 0.00 H new ATOM 0 HD13 LEU B 37 72.303 8.729 -5.062 1.00 0.00 H new ATOM 0 HD21 LEU B 37 73.450 6.040 -5.930 1.00 0.00 H new ATOM 0 HD22 LEU B 37 72.169 6.267 -4.715 1.00 0.00 H new ATOM 0 HD23 LEU B 37 71.900 5.181 -6.100 1.00 0.00 H new ATOM 2234 N LEU B 38 69.114 4.442 -6.897 1.00 0.00 N ATOM 2235 CA LEU B 38 69.446 2.982 -6.948 1.00 0.00 C ATOM 2236 C LEU B 38 69.083 2.370 -8.305 1.00 0.00 C ATOM 2237 O LEU B 38 69.811 1.557 -8.838 1.00 0.00 O ATOM 2238 CB LEU B 38 68.717 2.213 -5.838 1.00 0.00 C ATOM 2239 CG LEU B 38 69.022 0.708 -5.942 1.00 0.00 C ATOM 2240 CD1 LEU B 38 70.539 0.467 -5.977 1.00 0.00 C ATOM 2241 CD2 LEU B 38 68.423 -0.009 -4.727 1.00 0.00 C ATOM 0 H LEU B 38 68.337 4.705 -6.291 1.00 0.00 H new ATOM 0 HA LEU B 38 70.523 2.897 -6.800 1.00 0.00 H new ATOM 0 HB2 LEU B 38 69.028 2.587 -4.863 1.00 0.00 H new ATOM 0 HB3 LEU B 38 67.643 2.380 -5.916 1.00 0.00 H new ATOM 0 HG LEU B 38 68.584 0.320 -6.862 1.00 0.00 H new ATOM 0 HD11 LEU B 38 70.736 -0.603 -6.051 1.00 0.00 H new ATOM 0 HD12 LEU B 38 70.968 0.975 -6.840 1.00 0.00 H new ATOM 0 HD13 LEU B 38 70.991 0.857 -5.065 1.00 0.00 H new ATOM 0 HD21 LEU B 38 68.635 -1.076 -4.793 1.00 0.00 H new ATOM 0 HD22 LEU B 38 68.863 0.392 -3.814 1.00 0.00 H new ATOM 0 HD23 LEU B 38 67.344 0.146 -4.708 1.00 0.00 H new ATOM 2253 N THR B 39 67.957 2.721 -8.862 1.00 0.00 N ATOM 2254 CA THR B 39 67.563 2.113 -10.168 1.00 0.00 C ATOM 2255 C THR B 39 68.302 2.792 -11.323 1.00 0.00 C ATOM 2256 O THR B 39 68.496 2.213 -12.373 1.00 0.00 O ATOM 2257 CB THR B 39 66.055 2.266 -10.365 1.00 0.00 C ATOM 2258 OG1 THR B 39 65.384 1.922 -9.160 1.00 0.00 O ATOM 2259 CG2 THR B 39 65.596 1.338 -11.486 1.00 0.00 C ATOM 0 H THR B 39 67.297 3.396 -8.475 1.00 0.00 H new ATOM 0 HA THR B 39 67.830 1.056 -10.158 1.00 0.00 H new ATOM 0 HB THR B 39 65.823 3.298 -10.628 1.00 0.00 H new ATOM 0 HG1 THR B 39 65.446 2.668 -8.527 1.00 0.00 H new ATOM 0 HG21 THR B 39 64.521 1.445 -11.629 1.00 0.00 H new ATOM 0 HG22 THR B 39 66.113 1.600 -12.409 1.00 0.00 H new ATOM 0 HG23 THR B 39 65.826 0.306 -11.221 1.00 0.00 H new ATOM 2267 N ARG B 40 68.708 4.011 -11.140 1.00 0.00 N ATOM 2268 CA ARG B 40 69.428 4.734 -12.224 1.00 0.00 C ATOM 2269 C ARG B 40 70.828 4.159 -12.393 1.00 0.00 C ATOM 2270 O ARG B 40 71.374 4.150 -13.480 1.00 0.00 O ATOM 2271 CB ARG B 40 69.523 6.224 -11.879 1.00 0.00 C ATOM 2272 CG ARG B 40 68.142 6.896 -12.004 1.00 0.00 C ATOM 2273 CD ARG B 40 67.873 7.294 -13.462 1.00 0.00 C ATOM 2274 NE ARG B 40 66.582 8.030 -13.544 1.00 0.00 N ATOM 2275 CZ ARG B 40 66.298 8.738 -14.605 1.00 0.00 C ATOM 2276 NH1 ARG B 40 67.158 8.826 -15.583 1.00 0.00 N ATOM 2277 NH2 ARG B 40 65.155 9.362 -14.683 1.00 0.00 N ATOM 0 H ARG B 40 68.573 4.544 -10.281 1.00 0.00 H new ATOM 0 HA ARG B 40 68.877 4.613 -13.157 1.00 0.00 H new ATOM 0 HB2 ARG B 40 69.902 6.345 -10.864 1.00 0.00 H new ATOM 0 HB3 ARG B 40 70.234 6.713 -12.545 1.00 0.00 H new ATOM 0 HG2 ARG B 40 67.366 6.214 -11.657 1.00 0.00 H new ATOM 0 HG3 ARG B 40 68.100 7.778 -11.365 1.00 0.00 H new ATOM 0 HD2 ARG B 40 68.685 7.918 -13.836 1.00 0.00 H new ATOM 0 HD3 ARG B 40 67.838 6.406 -14.092 1.00 0.00 H new ATOM 0 HE ARG B 40 65.918 7.982 -12.771 1.00 0.00 H new ATOM 0 HH11 ARG B 40 68.053 8.342 -15.520 1.00 0.00 H new ATOM 0 HH12 ARG B 40 66.935 9.379 -16.410 1.00 0.00 H new ATOM 0 HH21 ARG B 40 64.485 9.297 -13.917 1.00 0.00 H new ATOM 0 HH22 ARG B 40 64.931 9.915 -15.510 1.00 0.00 H new ATOM 2291 N GLU B 41 71.427 3.697 -11.327 1.00 0.00 N ATOM 2292 CA GLU B 41 72.811 3.143 -11.428 1.00 0.00 C ATOM 2293 C GLU B 41 72.763 1.633 -11.447 1.00 0.00 C ATOM 2294 O GLU B 41 73.660 0.993 -11.955 1.00 0.00 O ATOM 2295 CB GLU B 41 73.631 3.602 -10.224 1.00 0.00 C ATOM 2296 CG GLU B 41 73.862 5.112 -10.304 1.00 0.00 C ATOM 2297 CD GLU B 41 74.532 5.596 -9.017 1.00 0.00 C ATOM 2298 OE1 GLU B 41 74.459 4.882 -8.031 1.00 0.00 O ATOM 2299 OE2 GLU B 41 75.097 6.678 -9.036 1.00 0.00 O ATOM 0 H GLU B 41 71.019 3.679 -10.392 1.00 0.00 H new ATOM 0 HA GLU B 41 73.271 3.501 -12.349 1.00 0.00 H new ATOM 0 HB2 GLU B 41 73.109 3.352 -9.300 1.00 0.00 H new ATOM 0 HB3 GLU B 41 74.587 3.079 -10.202 1.00 0.00 H new ATOM 0 HG2 GLU B 41 74.488 5.349 -11.164 1.00 0.00 H new ATOM 0 HG3 GLU B 41 72.913 5.628 -10.449 1.00 0.00 H new ATOM 2306 N LEU B 42 71.726 1.047 -10.913 1.00 0.00 N ATOM 2307 CA LEU B 42 71.638 -0.447 -10.923 1.00 0.00 C ATOM 2308 C LEU B 42 70.190 -0.860 -11.231 1.00 0.00 C ATOM 2309 O LEU B 42 69.443 -1.197 -10.334 1.00 0.00 O ATOM 2310 CB LEU B 42 72.040 -1.019 -9.551 1.00 0.00 C ATOM 2311 CG LEU B 42 73.455 -0.568 -9.146 1.00 0.00 C ATOM 2312 CD1 LEU B 42 73.682 -0.876 -7.662 1.00 0.00 C ATOM 2313 CD2 LEU B 42 74.507 -1.319 -9.975 1.00 0.00 C ATOM 0 H LEU B 42 70.942 1.529 -10.474 1.00 0.00 H new ATOM 0 HA LEU B 42 72.316 -0.837 -11.682 1.00 0.00 H new ATOM 0 HB2 LEU B 42 71.323 -0.695 -8.796 1.00 0.00 H new ATOM 0 HB3 LEU B 42 71.999 -2.108 -9.583 1.00 0.00 H new ATOM 0 HG LEU B 42 73.549 0.503 -9.326 1.00 0.00 H new ATOM 0 HD11 LEU B 42 74.684 -0.557 -7.373 1.00 0.00 H new ATOM 0 HD12 LEU B 42 72.945 -0.342 -7.063 1.00 0.00 H new ATOM 0 HD13 LEU B 42 73.580 -1.948 -7.493 1.00 0.00 H new ATOM 0 HD21 LEU B 42 75.504 -0.992 -9.680 1.00 0.00 H new ATOM 0 HD22 LEU B 42 74.410 -2.391 -9.801 1.00 0.00 H new ATOM 0 HD23 LEU B 42 74.354 -1.108 -11.033 1.00 0.00 H new ATOM 2325 N PRO B 43 69.779 -0.821 -12.480 1.00 0.00 N ATOM 2326 CA PRO B 43 68.380 -1.190 -12.844 1.00 0.00 C ATOM 2327 C PRO B 43 68.155 -2.721 -12.885 1.00 0.00 C ATOM 2328 O PRO B 43 68.033 -3.356 -11.857 1.00 0.00 O ATOM 2329 CB PRO B 43 68.242 -0.530 -14.228 1.00 0.00 C ATOM 2330 CG PRO B 43 69.662 -0.318 -14.788 1.00 0.00 C ATOM 2331 CD PRO B 43 70.657 -0.410 -13.612 1.00 0.00 C ATOM 0 HA PRO B 43 67.635 -0.858 -12.121 1.00 0.00 H new ATOM 0 HB2 PRO B 43 67.657 -1.162 -14.897 1.00 0.00 H new ATOM 0 HB3 PRO B 43 67.716 0.421 -14.148 1.00 0.00 H new ATOM 0 HG2 PRO B 43 69.891 -1.072 -15.541 1.00 0.00 H new ATOM 0 HG3 PRO B 43 69.738 0.654 -15.276 1.00 0.00 H new ATOM 0 HD2 PRO B 43 71.444 -1.140 -13.802 1.00 0.00 H new ATOM 0 HD3 PRO B 43 71.148 0.544 -13.420 1.00 0.00 H new ATOM 2339 N SER B 44 68.092 -3.317 -14.052 1.00 0.00 N ATOM 2340 CA SER B 44 67.869 -4.794 -14.129 1.00 0.00 C ATOM 2341 C SER B 44 69.008 -5.526 -13.420 1.00 0.00 C ATOM 2342 O SER B 44 68.795 -6.496 -12.728 1.00 0.00 O ATOM 2343 CB SER B 44 67.812 -5.233 -15.593 1.00 0.00 C ATOM 2344 OG SER B 44 66.707 -4.604 -16.228 1.00 0.00 O ATOM 0 H SER B 44 68.185 -2.845 -14.952 1.00 0.00 H new ATOM 0 HA SER B 44 66.925 -5.038 -13.642 1.00 0.00 H new ATOM 0 HB2 SER B 44 68.739 -4.966 -16.101 1.00 0.00 H new ATOM 0 HB3 SER B 44 67.714 -6.317 -15.656 1.00 0.00 H new ATOM 0 HG SER B 44 66.668 -4.881 -17.167 1.00 0.00 H new ATOM 2350 N PHE B 45 70.211 -5.053 -13.591 1.00 0.00 N ATOM 2351 CA PHE B 45 71.405 -5.687 -12.944 1.00 0.00 C ATOM 2352 C PHE B 45 71.201 -5.817 -11.430 1.00 0.00 C ATOM 2353 O PHE B 45 72.068 -6.269 -10.709 1.00 0.00 O ATOM 2354 CB PHE B 45 72.591 -4.778 -13.175 1.00 0.00 C ATOM 2355 CG PHE B 45 72.954 -4.783 -14.642 1.00 0.00 C ATOM 2356 CD1 PHE B 45 73.818 -5.765 -15.141 1.00 0.00 C ATOM 2357 CD2 PHE B 45 72.425 -3.813 -15.502 1.00 0.00 C ATOM 2358 CE1 PHE B 45 74.154 -5.777 -16.500 1.00 0.00 C ATOM 2359 CE2 PHE B 45 72.762 -3.824 -16.860 1.00 0.00 C ATOM 2360 CZ PHE B 45 73.627 -4.806 -17.360 1.00 0.00 C ATOM 0 H PHE B 45 70.426 -4.236 -14.163 1.00 0.00 H new ATOM 0 HA PHE B 45 71.558 -6.679 -13.369 1.00 0.00 H new ATOM 0 HB2 PHE B 45 72.354 -3.764 -12.852 1.00 0.00 H new ATOM 0 HB3 PHE B 45 73.440 -5.112 -12.579 1.00 0.00 H new ATOM 0 HD1 PHE B 45 74.225 -6.513 -14.477 1.00 0.00 H new ATOM 0 HD2 PHE B 45 71.757 -3.057 -15.117 1.00 0.00 H new ATOM 0 HE1 PHE B 45 74.820 -6.535 -16.885 1.00 0.00 H new ATOM 0 HE2 PHE B 45 72.355 -3.075 -17.523 1.00 0.00 H new ATOM 0 HZ PHE B 45 73.887 -4.814 -18.408 1.00 0.00 H new ATOM 2370 N LEU B 46 70.065 -5.409 -10.958 1.00 0.00 N ATOM 2371 CA LEU B 46 69.751 -5.467 -9.494 1.00 0.00 C ATOM 2372 C LEU B 46 68.538 -6.355 -9.325 1.00 0.00 C ATOM 2373 O LEU B 46 68.568 -7.362 -8.646 1.00 0.00 O ATOM 2374 CB LEU B 46 69.413 -4.057 -8.998 1.00 0.00 C ATOM 2375 CG LEU B 46 69.253 -4.041 -7.467 1.00 0.00 C ATOM 2376 CD1 LEU B 46 70.627 -4.115 -6.775 1.00 0.00 C ATOM 2377 CD2 LEU B 46 68.553 -2.743 -7.040 1.00 0.00 C ATOM 0 H LEU B 46 69.315 -5.026 -11.534 1.00 0.00 H new ATOM 0 HA LEU B 46 70.599 -5.855 -8.929 1.00 0.00 H new ATOM 0 HB2 LEU B 46 70.201 -3.364 -9.293 1.00 0.00 H new ATOM 0 HB3 LEU B 46 68.492 -3.712 -9.468 1.00 0.00 H new ATOM 0 HG LEU B 46 68.659 -4.906 -7.173 1.00 0.00 H new ATOM 0 HD11 LEU B 46 70.491 -4.102 -5.694 1.00 0.00 H new ATOM 0 HD12 LEU B 46 71.132 -5.036 -7.066 1.00 0.00 H new ATOM 0 HD13 LEU B 46 71.232 -3.259 -7.075 1.00 0.00 H new ATOM 0 HD21 LEU B 46 68.439 -2.731 -5.956 1.00 0.00 H new ATOM 0 HD22 LEU B 46 69.152 -1.887 -7.352 1.00 0.00 H new ATOM 0 HD23 LEU B 46 67.570 -2.688 -7.509 1.00 0.00 H new ATOM 2389 N GLY B 47 67.476 -5.998 -9.982 1.00 0.00 N ATOM 2390 CA GLY B 47 66.252 -6.824 -9.922 1.00 0.00 C ATOM 2391 C GLY B 47 66.461 -7.995 -10.870 1.00 0.00 C ATOM 2392 O GLY B 47 65.524 -8.535 -11.424 1.00 0.00 O ATOM 0 H GLY B 47 67.406 -5.162 -10.562 1.00 0.00 H new ATOM 0 HA2 GLY B 47 66.074 -7.177 -8.906 1.00 0.00 H new ATOM 0 HA3 GLY B 47 65.379 -6.241 -10.215 1.00 0.00 H new ATOM 2396 N LYS B 48 67.705 -8.371 -11.082 1.00 0.00 N ATOM 2397 CA LYS B 48 68.005 -9.491 -12.020 1.00 0.00 C ATOM 2398 C LYS B 48 66.989 -10.628 -11.804 1.00 0.00 C ATOM 2399 O LYS B 48 66.439 -11.170 -12.744 1.00 0.00 O ATOM 2400 CB LYS B 48 69.429 -10.042 -11.746 1.00 0.00 C ATOM 2401 CG LYS B 48 70.475 -9.304 -12.594 1.00 0.00 C ATOM 2402 CD LYS B 48 70.520 -9.881 -14.026 1.00 0.00 C ATOM 2403 CE LYS B 48 71.486 -11.072 -14.091 1.00 0.00 C ATOM 2404 NZ LYS B 48 72.892 -10.580 -14.044 1.00 0.00 N ATOM 0 H LYS B 48 68.521 -7.946 -10.642 1.00 0.00 H new ATOM 0 HA LYS B 48 67.943 -9.120 -13.043 1.00 0.00 H new ATOM 0 HB2 LYS B 48 69.669 -9.931 -10.688 1.00 0.00 H new ATOM 0 HB3 LYS B 48 69.460 -11.108 -11.970 1.00 0.00 H new ATOM 0 HG2 LYS B 48 70.236 -8.241 -12.632 1.00 0.00 H new ATOM 0 HG3 LYS B 48 71.457 -9.394 -12.129 1.00 0.00 H new ATOM 0 HD2 LYS B 48 69.522 -10.197 -14.330 1.00 0.00 H new ATOM 0 HD3 LYS B 48 70.837 -9.109 -14.727 1.00 0.00 H new ATOM 0 HE2 LYS B 48 71.300 -11.750 -13.258 1.00 0.00 H new ATOM 0 HE3 LYS B 48 71.319 -11.639 -15.007 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 73.529 -11.312 -14.420 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 72.978 -9.718 -14.620 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 73.152 -10.366 -13.060 1.00 0.00 H new ATOM 2418 N ARG B 49 66.741 -10.986 -10.572 1.00 0.00 N ATOM 2419 CA ARG B 49 65.767 -12.080 -10.289 1.00 0.00 C ATOM 2420 C ARG B 49 64.340 -11.536 -10.373 1.00 0.00 C ATOM 2421 O ARG B 49 64.104 -10.351 -10.235 1.00 0.00 O ATOM 2422 CB ARG B 49 66.003 -12.643 -8.886 1.00 0.00 C ATOM 2423 CG ARG B 49 67.320 -13.419 -8.855 1.00 0.00 C ATOM 2424 CD ARG B 49 67.543 -13.990 -7.452 1.00 0.00 C ATOM 2425 NE ARG B 49 67.403 -12.903 -6.423 1.00 0.00 N ATOM 2426 CZ ARG B 49 68.126 -11.815 -6.462 1.00 0.00 C ATOM 2427 NH1 ARG B 49 69.135 -11.714 -7.283 1.00 0.00 N ATOM 2428 NH2 ARG B 49 67.873 -10.843 -5.627 1.00 0.00 N ATOM 0 H ARG B 49 67.172 -10.567 -9.748 1.00 0.00 H new ATOM 0 HA ARG B 49 65.905 -12.871 -11.026 1.00 0.00 H new ATOM 0 HB2 ARG B 49 66.031 -11.832 -8.158 1.00 0.00 H new ATOM 0 HB3 ARG B 49 65.178 -13.297 -8.603 1.00 0.00 H new ATOM 0 HG2 ARG B 49 67.297 -14.225 -9.588 1.00 0.00 H new ATOM 0 HG3 ARG B 49 68.147 -12.764 -9.128 1.00 0.00 H new ATOM 0 HD2 ARG B 49 66.822 -14.783 -7.255 1.00 0.00 H new ATOM 0 HD3 ARG B 49 68.535 -14.438 -7.387 1.00 0.00 H new ATOM 0 HE ARG B 49 66.723 -13.018 -5.671 1.00 0.00 H new ATOM 0 HH11 ARG B 49 69.367 -12.489 -7.904 1.00 0.00 H new ATOM 0 HH12 ARG B 49 69.692 -10.860 -7.304 1.00 0.00 H new ATOM 0 HH21 ARG B 49 67.115 -10.936 -4.950 1.00 0.00 H new ATOM 0 HH22 ARG B 49 68.433 -9.991 -5.652 1.00 0.00 H new ATOM 2442 N THR B 50 63.383 -12.399 -10.596 1.00 0.00 N ATOM 2443 CA THR B 50 61.962 -11.949 -10.688 1.00 0.00 C ATOM 2444 C THR B 50 61.303 -12.050 -9.307 1.00 0.00 C ATOM 2445 O THR B 50 60.149 -11.712 -9.136 1.00 0.00 O ATOM 2446 CB THR B 50 61.208 -12.847 -11.674 1.00 0.00 C ATOM 2447 OG1 THR B 50 61.189 -14.180 -11.180 1.00 0.00 O ATOM 2448 CG2 THR B 50 61.906 -12.818 -13.036 1.00 0.00 C ATOM 0 H THR B 50 63.526 -13.401 -10.719 1.00 0.00 H new ATOM 0 HA THR B 50 61.930 -10.916 -11.033 1.00 0.00 H new ATOM 0 HB THR B 50 60.186 -12.484 -11.785 1.00 0.00 H new ATOM 0 HG1 THR B 50 60.705 -14.755 -11.809 1.00 0.00 H new ATOM 0 HG21 THR B 50 61.367 -13.458 -13.735 1.00 0.00 H new ATOM 0 HG22 THR B 50 61.920 -11.796 -13.416 1.00 0.00 H new ATOM 0 HG23 THR B 50 62.929 -13.179 -12.928 1.00 0.00 H new ATOM 2456 N ASP B 51 62.025 -12.519 -8.321 1.00 0.00 N ATOM 2457 CA ASP B 51 61.436 -12.649 -6.951 1.00 0.00 C ATOM 2458 C ASP B 51 61.693 -11.372 -6.150 1.00 0.00 C ATOM 2459 O ASP B 51 61.352 -11.292 -4.987 1.00 0.00 O ATOM 2460 CB ASP B 51 62.070 -13.841 -6.227 1.00 0.00 C ATOM 2461 CG ASP B 51 63.545 -13.552 -5.943 1.00 0.00 C ATOM 2462 OD1 ASP B 51 63.813 -12.732 -5.081 1.00 0.00 O ATOM 2463 OD2 ASP B 51 64.381 -14.158 -6.592 1.00 0.00 O ATOM 0 H ASP B 51 62.997 -12.818 -8.404 1.00 0.00 H new ATOM 0 HA ASP B 51 60.361 -12.808 -7.040 1.00 0.00 H new ATOM 0 HB2 ASP B 51 61.542 -14.034 -5.293 1.00 0.00 H new ATOM 0 HB3 ASP B 51 61.977 -14.740 -6.837 1.00 0.00 H new ATOM 2468 N GLU B 52 62.283 -10.377 -6.773 1.00 0.00 N ATOM 2469 CA GLU B 52 62.580 -9.075 -6.081 1.00 0.00 C ATOM 2470 C GLU B 52 62.828 -9.291 -4.577 1.00 0.00 C ATOM 2471 O GLU B 52 63.931 -9.579 -4.163 1.00 0.00 O ATOM 2472 CB GLU B 52 61.395 -8.108 -6.290 1.00 0.00 C ATOM 2473 CG GLU B 52 60.085 -8.897 -6.410 1.00 0.00 C ATOM 2474 CD GLU B 52 58.919 -7.922 -6.570 1.00 0.00 C ATOM 2475 OE1 GLU B 52 58.851 -6.979 -5.800 1.00 0.00 O ATOM 2476 OE2 GLU B 52 58.118 -8.131 -7.465 1.00 0.00 O ATOM 0 H GLU B 52 62.577 -10.411 -7.749 1.00 0.00 H new ATOM 0 HA GLU B 52 63.486 -8.647 -6.511 1.00 0.00 H new ATOM 0 HB2 GLU B 52 61.333 -7.410 -5.455 1.00 0.00 H new ATOM 0 HB3 GLU B 52 61.555 -7.514 -7.190 1.00 0.00 H new ATOM 0 HG2 GLU B 52 60.130 -9.571 -7.266 1.00 0.00 H new ATOM 0 HG3 GLU B 52 59.938 -9.516 -5.525 1.00 0.00 H new ATOM 2483 N ALA B 53 61.809 -9.154 -3.769 1.00 0.00 N ATOM 2484 CA ALA B 53 61.974 -9.347 -2.293 1.00 0.00 C ATOM 2485 C ALA B 53 63.079 -8.428 -1.760 1.00 0.00 C ATOM 2486 O ALA B 53 62.808 -7.413 -1.160 1.00 0.00 O ATOM 2487 CB ALA B 53 62.318 -10.814 -1.997 1.00 0.00 C ATOM 0 H ALA B 53 60.863 -8.915 -4.068 1.00 0.00 H new ATOM 0 HA ALA B 53 61.039 -9.093 -1.794 1.00 0.00 H new ATOM 0 HB1 ALA B 53 62.437 -10.950 -0.922 1.00 0.00 H new ATOM 0 HB2 ALA B 53 61.514 -11.456 -2.357 1.00 0.00 H new ATOM 0 HB3 ALA B 53 63.247 -11.079 -2.501 1.00 0.00 H new ATOM 2493 N ALA B 54 64.321 -8.756 -1.961 1.00 0.00 N ATOM 2494 CA ALA B 54 65.381 -7.852 -1.443 1.00 0.00 C ATOM 2495 C ALA B 54 65.204 -6.488 -2.098 1.00 0.00 C ATOM 2496 O ALA B 54 65.373 -5.460 -1.483 1.00 0.00 O ATOM 2497 CB ALA B 54 66.764 -8.400 -1.748 1.00 0.00 C ATOM 0 H ALA B 54 64.644 -9.591 -2.450 1.00 0.00 H new ATOM 0 HA ALA B 54 65.291 -7.770 -0.360 1.00 0.00 H new ATOM 0 HB1 ALA B 54 67.520 -7.718 -1.358 1.00 0.00 H new ATOM 0 HB2 ALA B 54 66.880 -9.377 -1.279 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.887 -8.498 -2.827 1.00 0.00 H new ATOM 2503 N PHE B 55 64.819 -6.455 -3.338 1.00 0.00 N ATOM 2504 CA PHE B 55 64.596 -5.140 -3.981 1.00 0.00 C ATOM 2505 C PHE B 55 63.589 -4.398 -3.115 1.00 0.00 C ATOM 2506 O PHE B 55 63.707 -3.216 -2.859 1.00 0.00 O ATOM 2507 CB PHE B 55 64.003 -5.335 -5.369 1.00 0.00 C ATOM 2508 CG PHE B 55 63.785 -3.984 -6.004 1.00 0.00 C ATOM 2509 CD1 PHE B 55 62.566 -3.319 -5.825 1.00 0.00 C ATOM 2510 CD2 PHE B 55 64.799 -3.395 -6.768 1.00 0.00 C ATOM 2511 CE1 PHE B 55 62.361 -2.064 -6.408 1.00 0.00 C ATOM 2512 CE2 PHE B 55 64.594 -2.140 -7.351 1.00 0.00 C ATOM 2513 CZ PHE B 55 63.375 -1.473 -7.172 1.00 0.00 C ATOM 0 H PHE B 55 64.651 -7.271 -3.927 1.00 0.00 H new ATOM 0 HA PHE B 55 65.533 -4.591 -4.076 1.00 0.00 H new ATOM 0 HB2 PHE B 55 64.673 -5.936 -5.984 1.00 0.00 H new ATOM 0 HB3 PHE B 55 63.059 -5.877 -5.303 1.00 0.00 H new ATOM 0 HD1 PHE B 55 61.784 -3.775 -5.237 1.00 0.00 H new ATOM 0 HD2 PHE B 55 65.739 -3.909 -6.907 1.00 0.00 H new ATOM 0 HE1 PHE B 55 61.421 -1.551 -6.269 1.00 0.00 H new ATOM 0 HE2 PHE B 55 65.376 -1.685 -7.940 1.00 0.00 H new ATOM 0 HZ PHE B 55 63.218 -0.504 -7.623 1.00 0.00 H new ATOM 2523 N GLN B 56 62.613 -5.116 -2.633 1.00 0.00 N ATOM 2524 CA GLN B 56 61.600 -4.497 -1.744 1.00 0.00 C ATOM 2525 C GLN B 56 62.277 -4.176 -0.416 1.00 0.00 C ATOM 2526 O GLN B 56 61.866 -3.295 0.307 1.00 0.00 O ATOM 2527 CB GLN B 56 60.420 -5.453 -1.523 1.00 0.00 C ATOM 2528 CG GLN B 56 59.682 -5.678 -2.846 1.00 0.00 C ATOM 2529 CD GLN B 56 59.006 -4.381 -3.292 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.469 -3.651 -2.484 1.00 0.00 O ATOM 2531 NE2 GLN B 56 58.997 -4.073 -4.560 1.00 0.00 N ATOM 0 H GLN B 56 62.476 -6.109 -2.820 1.00 0.00 H new ATOM 0 HA GLN B 56 61.208 -3.588 -2.199 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.779 -6.404 -1.130 1.00 0.00 H new ATOM 0 HB3 GLN B 56 59.738 -5.038 -0.781 1.00 0.00 H new ATOM 0 HG2 GLN B 56 60.382 -6.015 -3.610 1.00 0.00 H new ATOM 0 HG3 GLN B 56 58.937 -6.465 -2.728 1.00 0.00 H new ATOM 0 HE21 GLN B 56 59.449 -4.688 -5.237 1.00 0.00 H new ATOM 0 HE22 GLN B 56 58.538 -3.218 -4.874 1.00 0.00 H new ATOM 2540 N LYS B 57 63.333 -4.876 -0.104 1.00 0.00 N ATOM 2541 CA LYS B 57 64.060 -4.589 1.168 1.00 0.00 C ATOM 2542 C LYS B 57 64.745 -3.237 1.023 1.00 0.00 C ATOM 2543 O LYS B 57 64.730 -2.423 1.924 1.00 0.00 O ATOM 2544 CB LYS B 57 65.086 -5.695 1.480 1.00 0.00 C ATOM 2545 CG LYS B 57 65.818 -5.365 2.785 1.00 0.00 C ATOM 2546 CD LYS B 57 66.487 -6.621 3.354 1.00 0.00 C ATOM 2547 CE LYS B 57 67.537 -7.140 2.367 1.00 0.00 C ATOM 2548 NZ LYS B 57 68.469 -8.066 3.074 1.00 0.00 N ATOM 0 H LYS B 57 63.723 -5.630 -0.670 1.00 0.00 H new ATOM 0 HA LYS B 57 63.357 -4.564 2.001 1.00 0.00 H new ATOM 0 HB2 LYS B 57 64.582 -6.658 1.567 1.00 0.00 H new ATOM 0 HB3 LYS B 57 65.801 -5.782 0.662 1.00 0.00 H new ATOM 0 HG2 LYS B 57 66.569 -4.596 2.604 1.00 0.00 H new ATOM 0 HG3 LYS B 57 65.114 -4.959 3.512 1.00 0.00 H new ATOM 0 HD2 LYS B 57 66.955 -6.393 4.311 1.00 0.00 H new ATOM 0 HD3 LYS B 57 65.738 -7.391 3.541 1.00 0.00 H new ATOM 0 HE2 LYS B 57 67.050 -7.658 1.541 1.00 0.00 H new ATOM 0 HE3 LYS B 57 68.092 -6.306 1.938 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 69.182 -8.419 2.404 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 68.942 -7.558 3.848 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 67.933 -8.868 3.463 1.00 0.00 H new ATOM 2562 N LEU B 58 65.298 -2.960 -0.127 1.00 0.00 N ATOM 2563 CA LEU B 58 65.913 -1.626 -0.330 1.00 0.00 C ATOM 2564 C LEU B 58 64.752 -0.652 -0.334 1.00 0.00 C ATOM 2565 O LEU B 58 64.800 0.413 0.238 1.00 0.00 O ATOM 2566 CB LEU B 58 66.652 -1.560 -1.677 1.00 0.00 C ATOM 2567 CG LEU B 58 68.087 -2.094 -1.544 1.00 0.00 C ATOM 2568 CD1 LEU B 58 68.941 -1.165 -0.657 1.00 0.00 C ATOM 2569 CD2 LEU B 58 68.066 -3.509 -0.952 1.00 0.00 C ATOM 0 H LEU B 58 65.348 -3.595 -0.924 1.00 0.00 H new ATOM 0 HA LEU B 58 66.645 -1.402 0.446 1.00 0.00 H new ATOM 0 HB2 LEU B 58 66.111 -2.143 -2.422 1.00 0.00 H new ATOM 0 HB3 LEU B 58 66.675 -0.530 -2.033 1.00 0.00 H new ATOM 0 HG LEU B 58 68.534 -2.125 -2.537 1.00 0.00 H new ATOM 0 HD11 LEU B 58 69.952 -1.565 -0.579 1.00 0.00 H new ATOM 0 HD12 LEU B 58 68.978 -0.170 -1.101 1.00 0.00 H new ATOM 0 HD13 LEU B 58 68.498 -1.102 0.337 1.00 0.00 H new ATOM 0 HD21 LEU B 58 69.087 -3.880 -0.861 1.00 0.00 H new ATOM 0 HD22 LEU B 58 67.600 -3.484 0.033 1.00 0.00 H new ATOM 0 HD23 LEU B 58 67.497 -4.169 -1.607 1.00 0.00 H new ATOM 2581 N MET B 59 63.682 -1.046 -0.952 1.00 0.00 N ATOM 2582 CA MET B 59 62.486 -0.177 -0.959 1.00 0.00 C ATOM 2583 C MET B 59 62.054 -0.025 0.488 1.00 0.00 C ATOM 2584 O MET B 59 61.674 1.038 0.936 1.00 0.00 O ATOM 2585 CB MET B 59 61.360 -0.814 -1.785 1.00 0.00 C ATOM 2586 CG MET B 59 60.336 0.249 -2.185 1.00 0.00 C ATOM 2587 SD MET B 59 58.974 -0.540 -3.080 1.00 0.00 S ATOM 2588 CE MET B 59 57.985 0.950 -3.355 1.00 0.00 C ATOM 0 H MET B 59 63.585 -1.930 -1.451 1.00 0.00 H new ATOM 0 HA MET B 59 62.710 0.790 -1.409 1.00 0.00 H new ATOM 0 HB2 MET B 59 61.774 -1.285 -2.677 1.00 0.00 H new ATOM 0 HB3 MET B 59 60.874 -1.599 -1.206 1.00 0.00 H new ATOM 0 HG2 MET B 59 59.958 0.758 -1.298 1.00 0.00 H new ATOM 0 HG3 MET B 59 60.807 1.007 -2.811 1.00 0.00 H new ATOM 0 HE1 MET B 59 57.079 0.690 -3.902 1.00 0.00 H new ATOM 0 HE2 MET B 59 57.715 1.390 -2.395 1.00 0.00 H new ATOM 0 HE3 MET B 59 58.564 1.669 -3.934 1.00 0.00 H new ATOM 2598 N SER B 60 62.130 -1.096 1.224 1.00 0.00 N ATOM 2599 CA SER B 60 61.747 -1.034 2.659 1.00 0.00 C ATOM 2600 C SER B 60 62.679 -0.058 3.368 1.00 0.00 C ATOM 2601 O SER B 60 62.329 0.523 4.376 1.00 0.00 O ATOM 2602 CB SER B 60 61.871 -2.419 3.294 1.00 0.00 C ATOM 2603 OG SER B 60 61.234 -2.409 4.564 1.00 0.00 O ATOM 0 H SER B 60 62.440 -2.010 0.895 1.00 0.00 H new ATOM 0 HA SER B 60 60.714 -0.700 2.751 1.00 0.00 H new ATOM 0 HB2 SER B 60 61.413 -3.170 2.650 1.00 0.00 H new ATOM 0 HB3 SER B 60 62.921 -2.690 3.403 1.00 0.00 H new ATOM 0 HG SER B 60 61.309 -3.296 4.975 1.00 0.00 H new ATOM 2609 N ASN B 61 63.861 0.148 2.845 1.00 0.00 N ATOM 2610 CA ASN B 61 64.782 1.118 3.512 1.00 0.00 C ATOM 2611 C ASN B 61 64.168 2.498 3.355 1.00 0.00 C ATOM 2612 O ASN B 61 64.262 3.340 4.224 1.00 0.00 O ATOM 2613 CB ASN B 61 66.182 1.086 2.887 1.00 0.00 C ATOM 2614 CG ASN B 61 66.786 -0.310 3.067 1.00 0.00 C ATOM 2615 OD1 ASN B 61 67.734 -0.665 2.398 1.00 0.00 O ATOM 2616 ND2 ASN B 61 66.272 -1.118 3.953 1.00 0.00 N ATOM 0 H ASN B 61 64.223 -0.302 2.004 1.00 0.00 H new ATOM 0 HA ASN B 61 64.900 0.856 4.563 1.00 0.00 H new ATOM 0 HB2 ASN B 61 66.125 1.336 1.828 1.00 0.00 H new ATOM 0 HB3 ASN B 61 66.820 1.834 3.358 1.00 0.00 H new ATOM 0 HD21 ASN B 61 66.667 -2.049 4.084 1.00 0.00 H new ATOM 0 HD22 ASN B 61 65.475 -0.818 4.515 1.00 0.00 H new ATOM 2623 N LEU B 62 63.494 2.719 2.260 1.00 0.00 N ATOM 2624 CA LEU B 62 62.822 4.026 2.057 1.00 0.00 C ATOM 2625 C LEU B 62 61.839 4.152 3.211 1.00 0.00 C ATOM 2626 O LEU B 62 61.576 5.220 3.726 1.00 0.00 O ATOM 2627 CB LEU B 62 62.062 4.013 0.727 1.00 0.00 C ATOM 2628 CG LEU B 62 62.993 3.552 -0.397 1.00 0.00 C ATOM 2629 CD1 LEU B 62 62.180 3.370 -1.679 1.00 0.00 C ATOM 2630 CD2 LEU B 62 64.097 4.593 -0.631 1.00 0.00 C ATOM 0 H LEU B 62 63.382 2.049 1.499 1.00 0.00 H new ATOM 0 HA LEU B 62 63.530 4.854 2.029 1.00 0.00 H new ATOM 0 HB2 LEU B 62 61.202 3.347 0.796 1.00 0.00 H new ATOM 0 HB3 LEU B 62 61.677 5.009 0.508 1.00 0.00 H new ATOM 0 HG LEU B 62 63.456 2.606 -0.115 1.00 0.00 H new ATOM 0 HD11 LEU B 62 62.838 3.042 -2.484 1.00 0.00 H new ATOM 0 HD12 LEU B 62 61.405 2.621 -1.515 1.00 0.00 H new ATOM 0 HD13 LEU B 62 61.716 4.318 -1.953 1.00 0.00 H new ATOM 0 HD21 LEU B 62 64.753 4.254 -1.433 1.00 0.00 H new ATOM 0 HD22 LEU B 62 63.646 5.545 -0.910 1.00 0.00 H new ATOM 0 HD23 LEU B 62 64.677 4.720 0.283 1.00 0.00 H new ATOM 2642 N ASP B 63 61.334 3.024 3.637 1.00 0.00 N ATOM 2643 CA ASP B 63 60.398 2.982 4.787 1.00 0.00 C ATOM 2644 C ASP B 63 61.235 2.803 6.057 1.00 0.00 C ATOM 2645 O ASP B 63 60.830 2.158 7.003 1.00 0.00 O ATOM 2646 CB ASP B 63 59.452 1.789 4.627 1.00 0.00 C ATOM 2647 CG ASP B 63 58.351 1.858 5.687 1.00 0.00 C ATOM 2648 OD1 ASP B 63 58.527 2.583 6.652 1.00 0.00 O ATOM 2649 OD2 ASP B 63 57.348 1.184 5.516 1.00 0.00 O ATOM 0 H ASP B 63 61.539 2.114 3.224 1.00 0.00 H new ATOM 0 HA ASP B 63 59.808 3.897 4.840 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.011 1.793 3.630 1.00 0.00 H new ATOM 0 HB3 ASP B 63 60.007 0.856 4.726 1.00 0.00 H new ATOM 2654 N SER B 64 62.419 3.362 6.066 1.00 0.00 N ATOM 2655 CA SER B 64 63.313 3.222 7.251 1.00 0.00 C ATOM 2656 C SER B 64 62.616 3.784 8.494 1.00 0.00 C ATOM 2657 O SER B 64 61.755 4.638 8.405 1.00 0.00 O ATOM 2658 CB SER B 64 64.615 3.986 7.001 1.00 0.00 C ATOM 2659 OG SER B 64 64.318 5.240 6.399 1.00 0.00 O ATOM 0 H SER B 64 62.805 3.912 5.298 1.00 0.00 H new ATOM 0 HA SER B 64 63.537 2.167 7.412 1.00 0.00 H new ATOM 0 HB2 SER B 64 65.147 4.138 7.940 1.00 0.00 H new ATOM 0 HB3 SER B 64 65.272 3.405 6.353 1.00 0.00 H new ATOM 0 HG SER B 64 64.682 5.963 6.952 1.00 0.00 H new ATOM 2665 N ASN B 65 62.966 3.292 9.651 1.00 0.00 N ATOM 2666 CA ASN B 65 62.314 3.774 10.900 1.00 0.00 C ATOM 2667 C ASN B 65 62.668 5.241 11.182 1.00 0.00 C ATOM 2668 O ASN B 65 61.828 6.009 11.609 1.00 0.00 O ATOM 2669 CB ASN B 65 62.786 2.918 12.077 1.00 0.00 C ATOM 2670 CG ASN B 65 62.197 1.512 11.959 1.00 0.00 C ATOM 2671 OD1 ASN B 65 61.182 1.318 11.321 1.00 0.00 O ATOM 2672 ND2 ASN B 65 62.794 0.514 12.553 1.00 0.00 N ATOM 0 H ASN B 65 63.678 2.574 9.785 1.00 0.00 H new ATOM 0 HA ASN B 65 61.234 3.694 10.774 1.00 0.00 H new ATOM 0 HB2 ASN B 65 63.875 2.867 12.089 1.00 0.00 H new ATOM 0 HB3 ASN B 65 62.478 3.374 13.018 1.00 0.00 H new ATOM 0 HD21 ASN B 65 62.408 -0.427 12.481 1.00 0.00 H new ATOM 0 HD22 ASN B 65 63.647 0.676 13.089 1.00 0.00 H new ATOM 2679 N ARG B 66 63.901 5.640 10.974 1.00 0.00 N ATOM 2680 CA ARG B 66 64.286 7.062 11.265 1.00 0.00 C ATOM 2681 C ARG B 66 65.300 7.593 10.243 1.00 0.00 C ATOM 2682 O ARG B 66 65.754 8.714 10.349 1.00 0.00 O ATOM 2683 CB ARG B 66 64.899 7.140 12.667 1.00 0.00 C ATOM 2684 CG ARG B 66 63.809 6.923 13.717 1.00 0.00 C ATOM 2685 CD ARG B 66 64.422 7.001 15.117 1.00 0.00 C ATOM 2686 NE ARG B 66 65.041 8.341 15.316 1.00 0.00 N ATOM 2687 CZ ARG B 66 65.367 8.737 16.517 1.00 0.00 C ATOM 2688 NH1 ARG B 66 65.148 7.957 17.540 1.00 0.00 N ATOM 2689 NH2 ARG B 66 65.912 9.910 16.693 1.00 0.00 N ATOM 0 H ARG B 66 64.653 5.050 10.618 1.00 0.00 H new ATOM 0 HA ARG B 66 63.388 7.676 11.203 1.00 0.00 H new ATOM 0 HB2 ARG B 66 65.678 6.386 12.776 1.00 0.00 H new ATOM 0 HB3 ARG B 66 65.372 8.111 12.815 1.00 0.00 H new ATOM 0 HG2 ARG B 66 63.030 7.677 13.608 1.00 0.00 H new ATOM 0 HG3 ARG B 66 63.336 5.952 13.570 1.00 0.00 H new ATOM 0 HD2 ARG B 66 63.655 6.828 15.871 1.00 0.00 H new ATOM 0 HD3 ARG B 66 65.173 6.220 15.241 1.00 0.00 H new ATOM 0 HE ARG B 66 65.210 8.949 14.515 1.00 0.00 H new ATOM 0 HH11 ARG B 66 64.723 7.040 17.401 1.00 0.00 H new ATOM 0 HH12 ARG B 66 65.402 8.264 18.479 1.00 0.00 H new ATOM 0 HH21 ARG B 66 66.083 10.518 15.892 1.00 0.00 H new ATOM 0 HH22 ARG B 66 66.166 10.219 17.631 1.00 0.00 H new ATOM 2703 N ASP B 67 65.665 6.820 9.255 1.00 0.00 N ATOM 2704 CA ASP B 67 66.648 7.334 8.252 1.00 0.00 C ATOM 2705 C ASP B 67 65.907 8.182 7.217 1.00 0.00 C ATOM 2706 O ASP B 67 65.190 7.666 6.383 1.00 0.00 O ATOM 2707 CB ASP B 67 67.331 6.157 7.556 1.00 0.00 C ATOM 2708 CG ASP B 67 68.505 6.668 6.718 1.00 0.00 C ATOM 2709 OD1 ASP B 67 68.498 7.839 6.376 1.00 0.00 O ATOM 2710 OD2 ASP B 67 69.389 5.879 6.429 1.00 0.00 O ATOM 0 H ASP B 67 65.332 5.869 9.098 1.00 0.00 H new ATOM 0 HA ASP B 67 67.402 7.941 8.753 1.00 0.00 H new ATOM 0 HB2 ASP B 67 67.685 5.439 8.296 1.00 0.00 H new ATOM 0 HB3 ASP B 67 66.617 5.634 6.920 1.00 0.00 H new ATOM 2715 N ASN B 68 66.060 9.484 7.276 1.00 0.00 N ATOM 2716 CA ASN B 68 65.349 10.382 6.307 1.00 0.00 C ATOM 2717 C ASN B 68 66.314 10.919 5.246 1.00 0.00 C ATOM 2718 O ASN B 68 65.911 11.249 4.147 1.00 0.00 O ATOM 2719 CB ASN B 68 64.754 11.563 7.073 1.00 0.00 C ATOM 2720 CG ASN B 68 63.815 12.345 6.154 1.00 0.00 C ATOM 2721 OD1 ASN B 68 63.299 11.807 5.194 1.00 0.00 O ATOM 2722 ND2 ASN B 68 63.572 13.600 6.408 1.00 0.00 N ATOM 0 H ASN B 68 66.649 9.966 7.956 1.00 0.00 H new ATOM 0 HA ASN B 68 64.567 9.808 5.810 1.00 0.00 H new ATOM 0 HB2 ASN B 68 64.210 11.206 7.948 1.00 0.00 H new ATOM 0 HB3 ASN B 68 65.550 12.213 7.436 1.00 0.00 H new ATOM 0 HD21 ASN B 68 62.948 14.132 5.801 1.00 0.00 H new ATOM 0 HD22 ASN B 68 64.006 14.050 7.214 1.00 0.00 H new ATOM 2729 N GLU B 69 67.577 11.035 5.572 1.00 0.00 N ATOM 2730 CA GLU B 69 68.578 11.583 4.596 1.00 0.00 C ATOM 2731 C GLU B 69 69.683 10.561 4.340 1.00 0.00 C ATOM 2732 O GLU B 69 70.051 9.798 5.208 1.00 0.00 O ATOM 2733 CB GLU B 69 69.205 12.845 5.186 1.00 0.00 C ATOM 2734 CG GLU B 69 70.062 13.544 4.132 1.00 0.00 C ATOM 2735 CD GLU B 69 69.163 14.140 3.046 1.00 0.00 C ATOM 2736 OE1 GLU B 69 67.988 14.328 3.314 1.00 0.00 O ATOM 2737 OE2 GLU B 69 69.668 14.405 1.967 1.00 0.00 O ATOM 0 H GLU B 69 67.964 10.772 6.479 1.00 0.00 H new ATOM 0 HA GLU B 69 68.072 11.808 3.657 1.00 0.00 H new ATOM 0 HB2 GLU B 69 68.424 13.519 5.537 1.00 0.00 H new ATOM 0 HB3 GLU B 69 69.816 12.587 6.051 1.00 0.00 H new ATOM 0 HG2 GLU B 69 70.657 14.330 4.597 1.00 0.00 H new ATOM 0 HG3 GLU B 69 70.761 12.835 3.689 1.00 0.00 H new ATOM 2744 N VAL B 70 70.223 10.559 3.152 1.00 0.00 N ATOM 2745 CA VAL B 70 71.321 9.606 2.816 1.00 0.00 C ATOM 2746 C VAL B 70 72.648 10.338 2.886 1.00 0.00 C ATOM 2747 O VAL B 70 72.993 11.115 2.018 1.00 0.00 O ATOM 2748 CB VAL B 70 71.118 9.085 1.388 1.00 0.00 C ATOM 2749 CG1 VAL B 70 71.817 7.744 1.229 1.00 0.00 C ATOM 2750 CG2 VAL B 70 69.631 8.914 1.109 1.00 0.00 C ATOM 0 H VAL B 70 69.949 11.182 2.393 1.00 0.00 H new ATOM 0 HA VAL B 70 71.314 8.773 3.519 1.00 0.00 H new ATOM 0 HB VAL B 70 71.539 9.802 0.683 1.00 0.00 H new ATOM 0 HG11 VAL B 70 71.671 7.376 0.213 1.00 0.00 H new ATOM 0 HG12 VAL B 70 72.883 7.864 1.422 1.00 0.00 H new ATOM 0 HG13 VAL B 70 71.398 7.029 1.938 1.00 0.00 H new ATOM 0 HG21 VAL B 70 69.492 8.544 0.093 1.00 0.00 H new ATOM 0 HG22 VAL B 70 69.208 8.201 1.816 1.00 0.00 H new ATOM 0 HG23 VAL B 70 69.128 9.875 1.217 1.00 0.00 H new ATOM 2760 N ASP B 71 73.408 10.062 3.890 1.00 0.00 N ATOM 2761 CA ASP B 71 74.738 10.699 4.002 1.00 0.00 C ATOM 2762 C ASP B 71 75.662 9.909 3.084 1.00 0.00 C ATOM 2763 O ASP B 71 75.294 8.856 2.604 1.00 0.00 O ATOM 2764 CB ASP B 71 75.233 10.606 5.447 1.00 0.00 C ATOM 2765 CG ASP B 71 76.462 11.497 5.633 1.00 0.00 C ATOM 2766 OD1 ASP B 71 76.979 11.977 4.637 1.00 0.00 O ATOM 2767 OD2 ASP B 71 76.864 11.688 6.770 1.00 0.00 O ATOM 0 H ASP B 71 73.168 9.419 4.645 1.00 0.00 H new ATOM 0 HA ASP B 71 74.706 11.753 3.725 1.00 0.00 H new ATOM 0 HB2 ASP B 71 74.443 10.913 6.132 1.00 0.00 H new ATOM 0 HB3 ASP B 71 75.482 9.573 5.690 1.00 0.00 H new ATOM 2772 N PHE B 72 76.849 10.364 2.830 1.00 0.00 N ATOM 2773 CA PHE B 72 77.729 9.569 1.949 1.00 0.00 C ATOM 2774 C PHE B 72 77.882 8.194 2.593 1.00 0.00 C ATOM 2775 O PHE B 72 77.950 7.177 1.929 1.00 0.00 O ATOM 2776 CB PHE B 72 79.090 10.250 1.832 1.00 0.00 C ATOM 2777 CG PHE B 72 79.933 9.477 0.859 1.00 0.00 C ATOM 2778 CD1 PHE B 72 79.876 9.792 -0.499 1.00 0.00 C ATOM 2779 CD2 PHE B 72 80.754 8.437 1.306 1.00 0.00 C ATOM 2780 CE1 PHE B 72 80.640 9.071 -1.416 1.00 0.00 C ATOM 2781 CE2 PHE B 72 81.520 7.712 0.389 1.00 0.00 C ATOM 2782 CZ PHE B 72 81.465 8.029 -0.975 1.00 0.00 C ATOM 0 H PHE B 72 77.242 11.235 3.187 1.00 0.00 H new ATOM 0 HA PHE B 72 77.308 9.480 0.948 1.00 0.00 H new ATOM 0 HB2 PHE B 72 78.970 11.279 1.493 1.00 0.00 H new ATOM 0 HB3 PHE B 72 79.578 10.290 2.806 1.00 0.00 H new ATOM 0 HD1 PHE B 72 79.240 10.595 -0.840 1.00 0.00 H new ATOM 0 HD2 PHE B 72 80.796 8.195 2.358 1.00 0.00 H new ATOM 0 HE1 PHE B 72 80.595 9.316 -2.467 1.00 0.00 H new ATOM 0 HE2 PHE B 72 82.154 6.908 0.731 1.00 0.00 H new ATOM 0 HZ PHE B 72 82.058 7.471 -1.685 1.00 0.00 H new ATOM 2792 N GLN B 73 77.931 8.171 3.896 1.00 0.00 N ATOM 2793 CA GLN B 73 78.072 6.888 4.630 1.00 0.00 C ATOM 2794 C GLN B 73 76.788 6.047 4.522 1.00 0.00 C ATOM 2795 O GLN B 73 76.860 4.844 4.380 1.00 0.00 O ATOM 2796 CB GLN B 73 78.369 7.182 6.105 1.00 0.00 C ATOM 2797 CG GLN B 73 78.547 5.870 6.874 1.00 0.00 C ATOM 2798 CD GLN B 73 78.923 6.177 8.325 1.00 0.00 C ATOM 2799 OE1 GLN B 73 79.214 7.308 8.661 1.00 0.00 O ATOM 2800 NE2 GLN B 73 78.940 5.211 9.202 1.00 0.00 N ATOM 0 H GLN B 73 77.878 8.999 4.489 1.00 0.00 H new ATOM 0 HA GLN B 73 78.891 6.321 4.187 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.271 7.788 6.189 1.00 0.00 H new ATOM 0 HB3 GLN B 73 77.554 7.761 6.540 1.00 0.00 H new ATOM 0 HG2 GLN B 73 77.626 5.289 6.841 1.00 0.00 H new ATOM 0 HG3 GLN B 73 79.323 5.264 6.406 1.00 0.00 H new ATOM 0 HE21 GLN B 73 78.696 4.262 8.920 1.00 0.00 H new ATOM 0 HE22 GLN B 73 79.198 5.405 10.170 1.00 0.00 H new ATOM 2809 N GLU B 74 75.610 6.634 4.597 1.00 0.00 N ATOM 2810 CA GLU B 74 74.388 5.793 4.509 1.00 0.00 C ATOM 2811 C GLU B 74 74.262 5.222 3.108 1.00 0.00 C ATOM 2812 O GLU B 74 73.896 4.078 2.929 1.00 0.00 O ATOM 2813 CB GLU B 74 73.149 6.615 4.859 1.00 0.00 C ATOM 2814 CG GLU B 74 73.158 6.944 6.352 1.00 0.00 C ATOM 2815 CD GLU B 74 71.893 7.722 6.710 1.00 0.00 C ATOM 2816 OE1 GLU B 74 70.998 7.764 5.883 1.00 0.00 O ATOM 2817 OE2 GLU B 74 71.840 8.262 7.803 1.00 0.00 O ATOM 0 H GLU B 74 75.453 7.635 4.713 1.00 0.00 H new ATOM 0 HA GLU B 74 74.469 4.974 5.223 1.00 0.00 H new ATOM 0 HB2 GLU B 74 73.133 7.534 4.274 1.00 0.00 H new ATOM 0 HB3 GLU B 74 72.247 6.059 4.604 1.00 0.00 H new ATOM 0 HG2 GLU B 74 73.211 6.026 6.937 1.00 0.00 H new ATOM 0 HG3 GLU B 74 74.042 7.532 6.600 1.00 0.00 H new ATOM 2824 N TYR B 75 74.569 5.991 2.109 1.00 0.00 N ATOM 2825 CA TYR B 75 74.465 5.445 0.739 1.00 0.00 C ATOM 2826 C TYR B 75 75.404 4.242 0.640 1.00 0.00 C ATOM 2827 O TYR B 75 75.084 3.233 0.044 1.00 0.00 O ATOM 2828 CB TYR B 75 74.877 6.500 -0.295 1.00 0.00 C ATOM 2829 CG TYR B 75 74.942 5.851 -1.660 1.00 0.00 C ATOM 2830 CD1 TYR B 75 73.786 5.297 -2.224 1.00 0.00 C ATOM 2831 CD2 TYR B 75 76.159 5.779 -2.352 1.00 0.00 C ATOM 2832 CE1 TYR B 75 73.843 4.677 -3.477 1.00 0.00 C ATOM 2833 CE2 TYR B 75 76.216 5.156 -3.604 1.00 0.00 C ATOM 2834 CZ TYR B 75 75.059 4.606 -4.167 1.00 0.00 C ATOM 2835 OH TYR B 75 75.116 3.991 -5.402 1.00 0.00 O ATOM 0 H TYR B 75 74.883 6.959 2.180 1.00 0.00 H new ATOM 0 HA TYR B 75 73.435 5.152 0.536 1.00 0.00 H new ATOM 0 HB2 TYR B 75 74.160 7.321 -0.302 1.00 0.00 H new ATOM 0 HB3 TYR B 75 75.846 6.925 -0.034 1.00 0.00 H new ATOM 0 HD1 TYR B 75 72.848 5.348 -1.691 1.00 0.00 H new ATOM 0 HD2 TYR B 75 77.052 6.204 -1.919 1.00 0.00 H new ATOM 0 HE1 TYR B 75 72.950 4.254 -3.912 1.00 0.00 H new ATOM 0 HE2 TYR B 75 77.154 5.100 -4.136 1.00 0.00 H new ATOM 0 HH TYR B 75 74.960 4.655 -6.106 1.00 0.00 H new ATOM 2845 N CYS B 76 76.562 4.349 1.230 1.00 0.00 N ATOM 2846 CA CYS B 76 77.533 3.229 1.188 1.00 0.00 C ATOM 2847 C CYS B 76 76.981 2.063 2.000 1.00 0.00 C ATOM 2848 O CYS B 76 77.084 0.919 1.604 1.00 0.00 O ATOM 2849 CB CYS B 76 78.861 3.682 1.797 1.00 0.00 C ATOM 2850 SG CYS B 76 80.097 2.376 1.596 1.00 0.00 S ATOM 0 H CYS B 76 76.876 5.173 1.743 1.00 0.00 H new ATOM 0 HA CYS B 76 77.693 2.920 0.155 1.00 0.00 H new ATOM 0 HB2 CYS B 76 79.202 4.597 1.312 1.00 0.00 H new ATOM 0 HB3 CYS B 76 78.728 3.912 2.854 1.00 0.00 H new ATOM 0 HG CYS B 76 79.652 1.273 2.120 1.00 0.00 H new ATOM 2856 N VAL B 77 76.377 2.336 3.130 1.00 0.00 N ATOM 2857 CA VAL B 77 75.817 1.216 3.924 1.00 0.00 C ATOM 2858 C VAL B 77 74.786 0.518 3.054 1.00 0.00 C ATOM 2859 O VAL B 77 74.724 -0.694 2.987 1.00 0.00 O ATOM 2860 CB VAL B 77 75.160 1.756 5.197 1.00 0.00 C ATOM 2861 CG1 VAL B 77 74.370 0.637 5.886 1.00 0.00 C ATOM 2862 CG2 VAL B 77 76.245 2.275 6.144 1.00 0.00 C ATOM 0 H VAL B 77 76.252 3.268 3.525 1.00 0.00 H new ATOM 0 HA VAL B 77 76.601 0.520 4.221 1.00 0.00 H new ATOM 0 HB VAL B 77 74.480 2.568 4.939 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.904 1.025 6.792 1.00 0.00 H new ATOM 0 HG12 VAL B 77 73.598 0.267 5.211 1.00 0.00 H new ATOM 0 HG13 VAL B 77 75.045 -0.178 6.146 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.781 2.661 7.052 1.00 0.00 H new ATOM 0 HG22 VAL B 77 76.924 1.462 6.400 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.804 3.073 5.655 1.00 0.00 H new ATOM 2872 N PHE B 78 73.986 1.281 2.361 1.00 0.00 N ATOM 2873 CA PHE B 78 72.978 0.665 1.470 1.00 0.00 C ATOM 2874 C PHE B 78 73.698 0.022 0.284 1.00 0.00 C ATOM 2875 O PHE B 78 73.345 -1.048 -0.157 1.00 0.00 O ATOM 2876 CB PHE B 78 71.990 1.724 0.967 1.00 0.00 C ATOM 2877 CG PHE B 78 71.107 2.199 2.106 1.00 0.00 C ATOM 2878 CD1 PHE B 78 70.271 1.296 2.784 1.00 0.00 C ATOM 2879 CD2 PHE B 78 71.121 3.550 2.487 1.00 0.00 C ATOM 2880 CE1 PHE B 78 69.459 1.744 3.836 1.00 0.00 C ATOM 2881 CE2 PHE B 78 70.308 3.993 3.536 1.00 0.00 C ATOM 2882 CZ PHE B 78 69.479 3.092 4.209 1.00 0.00 C ATOM 0 H PHE B 78 73.991 2.301 2.377 1.00 0.00 H new ATOM 0 HA PHE B 78 72.419 -0.091 2.022 1.00 0.00 H new ATOM 0 HB2 PHE B 78 72.534 2.568 0.543 1.00 0.00 H new ATOM 0 HB3 PHE B 78 71.375 1.308 0.169 1.00 0.00 H new ATOM 0 HD1 PHE B 78 70.254 0.256 2.495 1.00 0.00 H new ATOM 0 HD2 PHE B 78 71.761 4.249 1.969 1.00 0.00 H new ATOM 0 HE1 PHE B 78 68.818 1.049 4.358 1.00 0.00 H new ATOM 0 HE2 PHE B 78 70.321 5.033 3.826 1.00 0.00 H new ATOM 0 HZ PHE B 78 68.853 3.437 5.018 1.00 0.00 H new ATOM 2892 N LEU B 79 74.712 0.657 -0.246 1.00 0.00 N ATOM 2893 CA LEU B 79 75.425 0.040 -1.401 1.00 0.00 C ATOM 2894 C LEU B 79 76.152 -1.221 -0.918 1.00 0.00 C ATOM 2895 O LEU B 79 76.212 -2.222 -1.603 1.00 0.00 O ATOM 2896 CB LEU B 79 76.436 1.028 -1.987 1.00 0.00 C ATOM 2897 CG LEU B 79 77.058 0.449 -3.267 1.00 0.00 C ATOM 2898 CD1 LEU B 79 75.990 0.317 -4.374 1.00 0.00 C ATOM 2899 CD2 LEU B 79 78.182 1.385 -3.737 1.00 0.00 C ATOM 0 H LEU B 79 75.071 1.560 0.065 1.00 0.00 H new ATOM 0 HA LEU B 79 74.705 -0.220 -2.176 1.00 0.00 H new ATOM 0 HB2 LEU B 79 75.944 1.975 -2.208 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.217 1.238 -1.256 1.00 0.00 H new ATOM 0 HG LEU B 79 77.460 -0.542 -3.058 1.00 0.00 H new ATOM 0 HD11 LEU B 79 76.447 -0.095 -5.274 1.00 0.00 H new ATOM 0 HD12 LEU B 79 75.195 -0.347 -4.035 1.00 0.00 H new ATOM 0 HD13 LEU B 79 75.573 1.299 -4.596 1.00 0.00 H new ATOM 0 HD21 LEU B 79 78.632 0.985 -4.646 1.00 0.00 H new ATOM 0 HD22 LEU B 79 77.771 2.374 -3.940 1.00 0.00 H new ATOM 0 HD23 LEU B 79 78.941 1.461 -2.959 1.00 0.00 H new ATOM 2911 N SER B 80 76.705 -1.168 0.265 1.00 0.00 N ATOM 2912 CA SER B 80 77.432 -2.347 0.818 1.00 0.00 C ATOM 2913 C SER B 80 76.430 -3.465 1.057 1.00 0.00 C ATOM 2914 O SER B 80 76.666 -4.609 0.720 1.00 0.00 O ATOM 2915 CB SER B 80 78.105 -1.962 2.139 1.00 0.00 C ATOM 2916 OG SER B 80 78.980 -3.007 2.542 1.00 0.00 O ATOM 0 H SER B 80 76.684 -0.352 0.876 1.00 0.00 H new ATOM 0 HA SER B 80 78.197 -2.679 0.116 1.00 0.00 H new ATOM 0 HB2 SER B 80 78.661 -1.032 2.020 1.00 0.00 H new ATOM 0 HB3 SER B 80 77.351 -1.787 2.907 1.00 0.00 H new ATOM 0 HG SER B 80 79.414 -2.763 3.386 1.00 0.00 H new ATOM 2922 N CYS B 81 75.295 -3.139 1.607 1.00 0.00 N ATOM 2923 CA CYS B 81 74.266 -4.181 1.828 1.00 0.00 C ATOM 2924 C CYS B 81 73.907 -4.749 0.461 1.00 0.00 C ATOM 2925 O CYS B 81 73.664 -5.928 0.304 1.00 0.00 O ATOM 2926 CB CYS B 81 73.025 -3.576 2.510 1.00 0.00 C ATOM 2927 SG CYS B 81 71.937 -2.790 1.293 1.00 0.00 S ATOM 0 H CYS B 81 75.039 -2.199 1.911 1.00 0.00 H new ATOM 0 HA CYS B 81 74.642 -4.966 2.483 1.00 0.00 H new ATOM 0 HB2 CYS B 81 72.480 -4.357 3.041 1.00 0.00 H new ATOM 0 HB3 CYS B 81 73.335 -2.842 3.254 1.00 0.00 H new ATOM 0 HG CYS B 81 72.620 -1.940 0.586 1.00 0.00 H new ATOM 2933 N ILE B 82 73.896 -3.907 -0.542 1.00 0.00 N ATOM 2934 CA ILE B 82 73.575 -4.403 -1.911 1.00 0.00 C ATOM 2935 C ILE B 82 74.726 -5.285 -2.394 1.00 0.00 C ATOM 2936 O ILE B 82 74.522 -6.317 -3.000 1.00 0.00 O ATOM 2937 CB ILE B 82 73.363 -3.222 -2.867 1.00 0.00 C ATOM 2938 CG1 ILE B 82 72.038 -2.525 -2.525 1.00 0.00 C ATOM 2939 CG2 ILE B 82 73.310 -3.721 -4.315 1.00 0.00 C ATOM 2940 CD1 ILE B 82 71.954 -1.168 -3.235 1.00 0.00 C ATOM 0 H ILE B 82 74.093 -2.909 -0.472 1.00 0.00 H new ATOM 0 HA ILE B 82 72.654 -4.986 -1.888 1.00 0.00 H new ATOM 0 HB ILE B 82 74.191 -2.522 -2.759 1.00 0.00 H new ATOM 0 HG12 ILE B 82 71.200 -3.154 -2.826 1.00 0.00 H new ATOM 0 HG13 ILE B 82 71.960 -2.385 -1.447 1.00 0.00 H new ATOM 0 HG21 ILE B 82 73.159 -2.875 -4.986 1.00 0.00 H new ATOM 0 HG22 ILE B 82 74.248 -4.218 -4.563 1.00 0.00 H new ATOM 0 HG23 ILE B 82 72.485 -4.425 -4.427 1.00 0.00 H new ATOM 0 HD11 ILE B 82 71.010 -0.684 -2.984 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.782 -0.537 -2.913 1.00 0.00 H new ATOM 0 HD13 ILE B 82 72.010 -1.317 -4.313 1.00 0.00 H new ATOM 2952 N ALA B 83 75.938 -4.899 -2.118 1.00 0.00 N ATOM 2953 CA ALA B 83 77.084 -5.740 -2.550 1.00 0.00 C ATOM 2954 C ALA B 83 76.970 -7.108 -1.888 1.00 0.00 C ATOM 2955 O ALA B 83 77.053 -8.125 -2.534 1.00 0.00 O ATOM 2956 CB ALA B 83 78.392 -5.089 -2.123 1.00 0.00 C ATOM 0 H ALA B 83 76.183 -4.045 -1.616 1.00 0.00 H new ATOM 0 HA ALA B 83 77.070 -5.844 -3.635 1.00 0.00 H new ATOM 0 HB1 ALA B 83 79.229 -5.710 -2.442 1.00 0.00 H new ATOM 0 HB2 ALA B 83 78.475 -4.104 -2.582 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.410 -4.986 -1.038 1.00 0.00 H new ATOM 2962 N MET B 84 76.770 -7.139 -0.601 1.00 0.00 N ATOM 2963 CA MET B 84 76.639 -8.446 0.101 1.00 0.00 C ATOM 2964 C MET B 84 75.367 -9.128 -0.371 1.00 0.00 C ATOM 2965 O MET B 84 75.294 -10.338 -0.452 1.00 0.00 O ATOM 2966 CB MET B 84 76.595 -8.216 1.610 1.00 0.00 C ATOM 2967 CG MET B 84 77.973 -7.761 2.089 1.00 0.00 C ATOM 2968 SD MET B 84 77.920 -7.464 3.874 1.00 0.00 S ATOM 2969 CE MET B 84 76.795 -6.046 3.836 1.00 0.00 C ATOM 0 H MET B 84 76.691 -6.316 -0.004 1.00 0.00 H new ATOM 0 HA MET B 84 77.495 -9.082 -0.125 1.00 0.00 H new ATOM 0 HB2 MET B 84 75.845 -7.463 1.854 1.00 0.00 H new ATOM 0 HB3 MET B 84 76.304 -9.133 2.121 1.00 0.00 H new ATOM 0 HG2 MET B 84 78.720 -8.520 1.857 1.00 0.00 H new ATOM 0 HG3 MET B 84 78.270 -6.852 1.566 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.967 -5.422 4.713 1.00 0.00 H new ATOM 0 HE2 MET B 84 76.976 -5.462 2.934 1.00 0.00 H new ATOM 0 HE3 MET B 84 75.764 -6.399 3.839 1.00 0.00 H new ATOM 2979 N MET B 85 74.371 -8.366 -0.717 1.00 0.00 N ATOM 2980 CA MET B 85 73.127 -8.991 -1.217 1.00 0.00 C ATOM 2981 C MET B 85 73.512 -9.793 -2.453 1.00 0.00 C ATOM 2982 O MET B 85 72.950 -10.832 -2.736 1.00 0.00 O ATOM 2983 CB MET B 85 72.106 -7.911 -1.591 1.00 0.00 C ATOM 2984 CG MET B 85 70.823 -8.571 -2.105 1.00 0.00 C ATOM 2985 SD MET B 85 69.629 -7.289 -2.570 1.00 0.00 S ATOM 2986 CE MET B 85 70.258 -6.961 -4.237 1.00 0.00 C ATOM 0 H MET B 85 74.367 -7.347 -0.675 1.00 0.00 H new ATOM 0 HA MET B 85 72.674 -9.627 -0.457 1.00 0.00 H new ATOM 0 HB2 MET B 85 71.885 -7.290 -0.723 1.00 0.00 H new ATOM 0 HB3 MET B 85 72.520 -7.254 -2.356 1.00 0.00 H new ATOM 0 HG2 MET B 85 71.046 -9.204 -2.964 1.00 0.00 H new ATOM 0 HG3 MET B 85 70.399 -9.216 -1.335 1.00 0.00 H new ATOM 0 HE1 MET B 85 69.582 -6.280 -4.754 1.00 0.00 H new ATOM 0 HE2 MET B 85 71.247 -6.508 -4.170 1.00 0.00 H new ATOM 0 HE3 MET B 85 70.324 -7.897 -4.792 1.00 0.00 H new ATOM 2996 N CYS B 86 74.493 -9.325 -3.184 1.00 0.00 N ATOM 2997 CA CYS B 86 74.931 -10.080 -4.388 1.00 0.00 C ATOM 2998 C CYS B 86 76.342 -9.650 -4.784 1.00 0.00 C ATOM 2999 O CYS B 86 76.552 -9.044 -5.816 1.00 0.00 O ATOM 3000 CB CYS B 86 73.964 -9.820 -5.546 1.00 0.00 C ATOM 3001 SG CYS B 86 73.659 -8.041 -5.697 1.00 0.00 S ATOM 0 H CYS B 86 75.002 -8.461 -2.998 1.00 0.00 H new ATOM 0 HA CYS B 86 74.934 -11.146 -4.159 1.00 0.00 H new ATOM 0 HB2 CYS B 86 74.381 -10.208 -6.475 1.00 0.00 H new ATOM 0 HB3 CYS B 86 73.025 -10.347 -5.374 1.00 0.00 H new ATOM 0 HG CYS B 86 74.174 -7.424 -4.675 1.00 0.00 H new ATOM 3007 N ASN B 87 77.310 -9.962 -3.967 1.00 0.00 N ATOM 3008 CA ASN B 87 78.709 -9.577 -4.292 1.00 0.00 C ATOM 3009 C ASN B 87 79.229 -10.467 -5.421 1.00 0.00 C ATOM 3010 O ASN B 87 79.906 -10.012 -6.323 1.00 0.00 O ATOM 3011 CB ASN B 87 79.583 -9.748 -3.045 1.00 0.00 C ATOM 3012 CG ASN B 87 79.511 -11.196 -2.556 1.00 0.00 C ATOM 3013 OD1 ASN B 87 78.596 -11.920 -2.896 1.00 0.00 O ATOM 3014 ND2 ASN B 87 80.441 -11.651 -1.759 1.00 0.00 N ATOM 0 H ASN B 87 77.191 -10.467 -3.089 1.00 0.00 H new ATOM 0 HA ASN B 87 78.742 -8.536 -4.613 1.00 0.00 H new ATOM 0 HB2 ASN B 87 80.615 -9.483 -3.274 1.00 0.00 H new ATOM 0 HB3 ASN B 87 79.247 -9.072 -2.259 1.00 0.00 H new ATOM 0 HD21 ASN B 87 80.399 -12.613 -1.423 1.00 0.00 H new ATOM 0 HD22 ASN B 87 81.209 -11.044 -1.473 1.00 0.00 H new ATOM 3021 N GLU B 88 78.902 -11.732 -5.383 1.00 0.00 N ATOM 3022 CA GLU B 88 79.360 -12.664 -6.454 1.00 0.00 C ATOM 3023 C GLU B 88 78.707 -14.029 -6.229 1.00 0.00 C ATOM 3024 O GLU B 88 77.953 -14.513 -7.051 1.00 0.00 O ATOM 3025 CB GLU B 88 80.886 -12.810 -6.399 1.00 0.00 C ATOM 3026 CG GLU B 88 81.374 -13.729 -7.527 1.00 0.00 C ATOM 3027 CD GLU B 88 81.028 -13.116 -8.887 1.00 0.00 C ATOM 3028 OE1 GLU B 88 80.818 -11.915 -8.939 1.00 0.00 O ATOM 3029 OE2 GLU B 88 80.975 -13.860 -9.853 1.00 0.00 O ATOM 0 H GLU B 88 78.334 -12.161 -4.652 1.00 0.00 H new ATOM 0 HA GLU B 88 79.077 -12.271 -7.430 1.00 0.00 H new ATOM 0 HB2 GLU B 88 81.355 -11.830 -6.490 1.00 0.00 H new ATOM 0 HB3 GLU B 88 81.185 -13.218 -5.433 1.00 0.00 H new ATOM 0 HG2 GLU B 88 82.451 -13.875 -7.448 1.00 0.00 H new ATOM 0 HG3 GLU B 88 80.911 -14.711 -7.433 1.00 0.00 H new ATOM 3036 N PHE B 89 78.987 -14.651 -5.115 1.00 0.00 N ATOM 3037 CA PHE B 89 78.378 -15.981 -4.829 1.00 0.00 C ATOM 3038 C PHE B 89 76.938 -15.784 -4.353 1.00 0.00 C ATOM 3039 O PHE B 89 76.661 -14.938 -3.527 1.00 0.00 O ATOM 3040 CB PHE B 89 79.177 -16.687 -3.730 1.00 0.00 C ATOM 3041 CG PHE B 89 80.551 -17.044 -4.244 1.00 0.00 C ATOM 3042 CD1 PHE B 89 80.746 -18.240 -4.944 1.00 0.00 C ATOM 3043 CD2 PHE B 89 81.632 -16.182 -4.016 1.00 0.00 C ATOM 3044 CE1 PHE B 89 82.019 -18.577 -5.417 1.00 0.00 C ATOM 3045 CE2 PHE B 89 82.907 -16.520 -4.488 1.00 0.00 C ATOM 3046 CZ PHE B 89 83.101 -17.717 -5.188 1.00 0.00 C ATOM 0 H PHE B 89 79.611 -14.295 -4.391 1.00 0.00 H new ATOM 0 HA PHE B 89 78.390 -16.587 -5.735 1.00 0.00 H new ATOM 0 HB2 PHE B 89 79.262 -16.040 -2.857 1.00 0.00 H new ATOM 0 HB3 PHE B 89 78.654 -17.588 -3.409 1.00 0.00 H new ATOM 0 HD1 PHE B 89 79.913 -18.904 -5.119 1.00 0.00 H new ATOM 0 HD2 PHE B 89 81.482 -15.258 -3.477 1.00 0.00 H new ATOM 0 HE1 PHE B 89 82.167 -19.500 -5.958 1.00 0.00 H new ATOM 0 HE2 PHE B 89 83.741 -15.857 -4.312 1.00 0.00 H new ATOM 0 HZ PHE B 89 84.084 -17.977 -5.551 1.00 0.00 H new ATOM 3056 N PHE B 90 76.016 -16.559 -4.862 1.00 0.00 N ATOM 3057 CA PHE B 90 74.594 -16.415 -4.427 1.00 0.00 C ATOM 3058 C PHE B 90 74.344 -17.334 -3.230 1.00 0.00 C ATOM 3059 O PHE B 90 73.349 -17.222 -2.542 1.00 0.00 O ATOM 3060 CB PHE B 90 73.672 -16.820 -5.580 1.00 0.00 C ATOM 3061 CG PHE B 90 74.041 -16.029 -6.811 1.00 0.00 C ATOM 3062 CD1 PHE B 90 73.496 -14.757 -7.023 1.00 0.00 C ATOM 3063 CD2 PHE B 90 74.938 -16.570 -7.738 1.00 0.00 C ATOM 3064 CE1 PHE B 90 73.849 -14.028 -8.164 1.00 0.00 C ATOM 3065 CE2 PHE B 90 75.291 -15.843 -8.878 1.00 0.00 C ATOM 3066 CZ PHE B 90 74.747 -14.571 -9.093 1.00 0.00 C ATOM 0 H PHE B 90 76.185 -17.284 -5.559 1.00 0.00 H new ATOM 0 HA PHE B 90 74.394 -15.381 -4.146 1.00 0.00 H new ATOM 0 HB2 PHE B 90 73.765 -17.888 -5.778 1.00 0.00 H new ATOM 0 HB3 PHE B 90 72.632 -16.635 -5.312 1.00 0.00 H new ATOM 0 HD1 PHE B 90 72.804 -14.339 -6.307 1.00 0.00 H new ATOM 0 HD2 PHE B 90 75.358 -17.551 -7.572 1.00 0.00 H new ATOM 0 HE1 PHE B 90 73.429 -13.047 -8.329 1.00 0.00 H new ATOM 0 HE2 PHE B 90 75.983 -16.262 -9.593 1.00 0.00 H new ATOM 0 HZ PHE B 90 75.019 -14.009 -9.974 1.00 0.00 H new ATOM 3076 N GLU B 91 75.246 -18.244 -2.979 1.00 0.00 N ATOM 3077 CA GLU B 91 75.075 -19.180 -1.827 1.00 0.00 C ATOM 3078 C GLU B 91 75.100 -18.407 -0.504 1.00 0.00 C ATOM 3079 O GLU B 91 74.352 -18.703 0.407 1.00 0.00 O ATOM 3080 CB GLU B 91 76.206 -20.213 -1.839 1.00 0.00 C ATOM 3081 CG GLU B 91 76.021 -21.165 -3.021 1.00 0.00 C ATOM 3082 CD GLU B 91 74.807 -22.060 -2.763 1.00 0.00 C ATOM 3083 OE1 GLU B 91 74.469 -22.243 -1.605 1.00 0.00 O ATOM 3084 OE2 GLU B 91 74.237 -22.547 -3.725 1.00 0.00 O ATOM 0 H GLU B 91 76.098 -18.381 -3.523 1.00 0.00 H new ATOM 0 HA GLU B 91 74.114 -19.685 -1.920 1.00 0.00 H new ATOM 0 HB2 GLU B 91 77.170 -19.710 -1.912 1.00 0.00 H new ATOM 0 HB3 GLU B 91 76.209 -20.774 -0.905 1.00 0.00 H new ATOM 0 HG2 GLU B 91 75.880 -20.598 -3.941 1.00 0.00 H new ATOM 0 HG3 GLU B 91 76.915 -21.774 -3.156 1.00 0.00 H new ATOM 3091 N GLY B 92 75.958 -17.431 -0.382 1.00 0.00 N ATOM 3092 CA GLY B 92 76.028 -16.657 0.892 1.00 0.00 C ATOM 3093 C GLY B 92 74.643 -16.107 1.240 1.00 0.00 C ATOM 3094 O GLY B 92 73.907 -15.661 0.382 1.00 0.00 O ATOM 0 H GLY B 92 76.612 -17.136 -1.107 1.00 0.00 H new ATOM 0 HA2 GLY B 92 76.389 -17.297 1.698 1.00 0.00 H new ATOM 0 HA3 GLY B 92 76.740 -15.838 0.792 1.00 0.00 H new ATOM 3098 N PHE B 93 74.280 -16.138 2.495 1.00 0.00 N ATOM 3099 CA PHE B 93 72.941 -15.622 2.901 1.00 0.00 C ATOM 3100 C PHE B 93 73.001 -14.084 3.010 1.00 0.00 C ATOM 3101 O PHE B 93 74.030 -13.540 3.358 1.00 0.00 O ATOM 3102 CB PHE B 93 72.572 -16.207 4.266 1.00 0.00 C ATOM 3103 CG PHE B 93 72.689 -17.712 4.222 1.00 0.00 C ATOM 3104 CD1 PHE B 93 71.633 -18.485 3.723 1.00 0.00 C ATOM 3105 CD2 PHE B 93 73.855 -18.335 4.684 1.00 0.00 C ATOM 3106 CE1 PHE B 93 71.745 -19.881 3.687 1.00 0.00 C ATOM 3107 CE2 PHE B 93 73.967 -19.728 4.647 1.00 0.00 C ATOM 3108 CZ PHE B 93 72.911 -20.502 4.148 1.00 0.00 C ATOM 0 H PHE B 93 74.854 -16.499 3.257 1.00 0.00 H new ATOM 0 HA PHE B 93 72.195 -15.910 2.160 1.00 0.00 H new ATOM 0 HB2 PHE B 93 73.230 -15.804 5.035 1.00 0.00 H new ATOM 0 HB3 PHE B 93 71.555 -15.919 4.533 1.00 0.00 H new ATOM 0 HD1 PHE B 93 70.733 -18.005 3.366 1.00 0.00 H new ATOM 0 HD2 PHE B 93 74.669 -17.739 5.069 1.00 0.00 H new ATOM 0 HE1 PHE B 93 70.931 -20.478 3.303 1.00 0.00 H new ATOM 0 HE2 PHE B 93 74.867 -20.207 5.003 1.00 0.00 H new ATOM 0 HZ PHE B 93 72.997 -21.578 4.119 1.00 0.00 H new ATOM 3118 N PRO B 94 71.923 -13.373 2.735 1.00 0.00 N ATOM 3119 CA PRO B 94 71.944 -11.881 2.845 1.00 0.00 C ATOM 3120 C PRO B 94 71.953 -11.419 4.313 1.00 0.00 C ATOM 3121 O PRO B 94 70.972 -10.908 4.816 1.00 0.00 O ATOM 3122 CB PRO B 94 70.628 -11.499 2.147 1.00 0.00 C ATOM 3123 CG PRO B 94 69.717 -12.733 2.185 1.00 0.00 C ATOM 3124 CD PRO B 94 70.622 -13.971 2.300 1.00 0.00 C ATOM 0 HA PRO B 94 72.830 -11.421 2.408 1.00 0.00 H new ATOM 0 HB2 PRO B 94 70.155 -10.657 2.652 1.00 0.00 H new ATOM 0 HB3 PRO B 94 70.814 -11.190 1.118 1.00 0.00 H new ATOM 0 HG2 PRO B 94 69.032 -12.678 3.031 1.00 0.00 H new ATOM 0 HG3 PRO B 94 69.106 -12.787 1.284 1.00 0.00 H new ATOM 0 HD2 PRO B 94 70.240 -14.688 3.027 1.00 0.00 H new ATOM 0 HD3 PRO B 94 70.714 -14.498 1.350 1.00 0.00 H new ATOM 3132 N ASP B 95 73.049 -11.601 5.004 1.00 0.00 N ATOM 3133 CA ASP B 95 73.109 -11.179 6.440 1.00 0.00 C ATOM 3134 C ASP B 95 73.779 -9.807 6.551 1.00 0.00 C ATOM 3135 O ASP B 95 74.929 -9.639 6.199 1.00 0.00 O ATOM 3136 CB ASP B 95 73.928 -12.198 7.234 1.00 0.00 C ATOM 3137 CG ASP B 95 73.147 -13.508 7.343 1.00 0.00 C ATOM 3138 OD1 ASP B 95 71.949 -13.480 7.119 1.00 0.00 O ATOM 3139 OD2 ASP B 95 73.761 -14.518 7.645 1.00 0.00 O ATOM 0 H ASP B 95 73.904 -12.022 4.639 1.00 0.00 H new ATOM 0 HA ASP B 95 72.096 -11.123 6.838 1.00 0.00 H new ATOM 0 HB2 ASP B 95 74.885 -12.373 6.743 1.00 0.00 H new ATOM 0 HB3 ASP B 95 74.147 -11.809 8.228 1.00 0.00 H new ATOM 3144 N LYS B 96 73.067 -8.827 7.054 1.00 0.00 N ATOM 3145 CA LYS B 96 73.649 -7.455 7.213 1.00 0.00 C ATOM 3146 C LYS B 96 73.885 -7.192 8.705 1.00 0.00 C ATOM 3147 O LYS B 96 74.767 -6.446 9.084 1.00 0.00 O ATOM 3148 CB LYS B 96 72.666 -6.416 6.646 1.00 0.00 C ATOM 3149 CG LYS B 96 71.230 -6.907 6.844 1.00 0.00 C ATOM 3150 CD LYS B 96 70.248 -5.770 6.543 1.00 0.00 C ATOM 3151 CE LYS B 96 70.385 -5.338 5.078 1.00 0.00 C ATOM 3152 NZ LYS B 96 69.155 -4.608 4.654 1.00 0.00 N ATOM 0 H LYS B 96 72.100 -8.919 7.364 1.00 0.00 H new ATOM 0 HA LYS B 96 74.593 -7.381 6.674 1.00 0.00 H new ATOM 0 HB2 LYS B 96 72.806 -5.458 7.146 1.00 0.00 H new ATOM 0 HB3 LYS B 96 72.863 -6.254 5.586 1.00 0.00 H new ATOM 0 HG2 LYS B 96 71.032 -7.755 6.188 1.00 0.00 H new ATOM 0 HG3 LYS B 96 71.093 -7.257 7.867 1.00 0.00 H new ATOM 0 HD2 LYS B 96 69.227 -6.097 6.741 1.00 0.00 H new ATOM 0 HD3 LYS B 96 70.445 -4.924 7.201 1.00 0.00 H new ATOM 0 HE2 LYS B 96 71.259 -4.698 4.957 1.00 0.00 H new ATOM 0 HE3 LYS B 96 70.539 -6.211 4.444 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 68.843 -4.962 3.727 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 68.402 -4.761 5.354 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 69.361 -3.591 4.585 1.00 0.00 H new