USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 832 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 98 SER OG : rot -135:sc= 0.493 USER MOD Set 1.2: A 101 SER OG : rot 108:sc= 0.692! USER MOD Set 2.1: A 63 HIS : no HD1:sc= -2.82 X(o=-7.9,f=-8.1) USER MOD Set 2.2: A 79 TYR OH : rot 155:sc= -5.06! USER MOD Set 3.1: A 10 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 57 GLN : amide:sc= -0.058 X(o=-0.058,f=0) USER MOD Single : A 1 VAL N :NH3+ -124:sc= -0.0028 (180deg=-0.305) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0.212 USER MOD Single : A 8 SER OG : rot 180:sc= 0.181 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 14 HIS : no HD1:sc= -12.8! C(o=-13!,f=-16!) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 30:sc= -0.382 USER MOD Single : A 22 THR OG1 : rot 16:sc= -2.16! USER MOD Single : A 25 SER OG : rot 166:sc= 0.767 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.136 USER MOD Single : A 29 TYR OH : rot 71:sc= -2.05! USER MOD Single : A 30 SER OG : rot 180:sc= 0.00557 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0.178 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -60:sc= -6.73! USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0.00271 USER MOD Single : A 46 SER OG : rot -61:sc= 0.852 USER MOD Single : A 51 SER OG : rot 180:sc= -0.0989 USER MOD Single : A 55 THR OG1 : rot -178:sc= -7.13! USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.197 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.0545 X(o=-0.054,f=0) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -34:sc= 0.989 USER MOD Single : A 73 SER OG : rot 180:sc= -0.627 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.39 USER MOD Single : A 80 SER OG : rot 15:sc= 0.688 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -2.18! C(o=-2.2!,f=-8.9!) USER MOD Single : A 84 ASN : amide:sc= -2.11 X(o=-2.1,f=-2.4!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= -0.228 USER MOD Single : A 100 SER OG : rot 57:sc= 1.11 USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.0709 USER MOD Single : A 104 SER OG : rot -153:sc= -2.6! USER MOD Single : A 107 ASN : amide:sc= -8.55! C(o=-8.5!,f=-5.1!) USER MOD Single : A 108 THR OG1 : rot 180:sc= -1.42! USER MOD Single : A 110 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.0155) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 -28.761 13.077 12.205 1.00 0.00 N ATOM 2 CA VAL A 1 -27.367 13.150 12.730 1.00 0.00 C ATOM 3 C VAL A 1 -27.383 13.376 14.245 1.00 0.00 C ATOM 4 O VAL A 1 -28.219 14.086 14.767 1.00 0.00 O ATOM 5 CB VAL A 1 -26.735 14.341 12.007 1.00 0.00 C ATOM 6 CG1 VAL A 1 -27.235 15.648 12.627 1.00 0.00 C ATOM 7 CG2 VAL A 1 -25.214 14.263 12.138 1.00 0.00 C ATOM 0 H1 VAL A 1 -28.894 12.180 11.696 1.00 0.00 H new ATOM 0 H2 VAL A 1 -29.433 13.129 12.997 1.00 0.00 H new ATOM 0 H3 VAL A 1 -28.929 13.872 11.556 1.00 0.00 H new ATOM 0 HA VAL A 1 -26.809 12.230 12.558 1.00 0.00 H new ATOM 0 HB VAL A 1 -27.014 14.314 10.954 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -26.782 16.493 12.109 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -28.320 15.704 12.533 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -26.960 15.679 13.681 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -24.761 15.110 11.624 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -24.938 14.288 13.192 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -24.857 13.335 11.692 1.00 0.00 H new ATOM 19 N LYS A 2 -26.466 12.777 14.955 1.00 0.00 N ATOM 20 CA LYS A 2 -26.434 12.958 16.436 1.00 0.00 C ATOM 21 C LYS A 2 -24.989 13.056 16.930 1.00 0.00 C ATOM 22 O LYS A 2 -24.050 12.931 16.169 1.00 0.00 O ATOM 23 CB LYS A 2 -27.107 11.709 17.002 1.00 0.00 C ATOM 24 CG LYS A 2 -26.274 10.477 16.646 1.00 0.00 C ATOM 25 CD LYS A 2 -27.203 9.333 16.239 1.00 0.00 C ATOM 26 CE LYS A 2 -27.530 9.448 14.749 1.00 0.00 C ATOM 27 NZ LYS A 2 -28.261 8.194 14.418 1.00 0.00 N ATOM 0 H LYS A 2 -25.739 12.171 14.575 1.00 0.00 H new ATOM 0 HA LYS A 2 -26.938 13.873 16.749 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -27.206 11.794 18.084 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -28.114 11.610 16.597 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -25.589 10.711 15.831 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -25.664 10.178 17.499 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -26.728 8.374 16.445 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -28.120 9.368 16.827 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -28.142 10.327 14.546 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -26.623 9.546 14.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -28.520 8.199 13.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -27.652 7.375 14.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -29.123 8.132 14.997 1.00 0.00 H new ATOM 41 N CYS A 3 -24.808 13.283 18.200 1.00 0.00 N ATOM 42 CA CYS A 3 -23.428 13.395 18.753 1.00 0.00 C ATOM 43 C CYS A 3 -23.274 12.502 19.984 1.00 0.00 C ATOM 44 O CYS A 3 -23.473 12.935 21.098 1.00 0.00 O ATOM 45 CB CYS A 3 -23.286 14.862 19.154 1.00 0.00 C ATOM 46 SG CYS A 3 -22.390 15.762 17.868 1.00 0.00 S ATOM 0 H CYS A 3 -25.558 13.396 18.882 1.00 0.00 H new ATOM 0 HA CYS A 3 -22.671 13.084 18.033 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -24.271 15.305 19.302 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -22.755 14.940 20.103 1.00 0.00 H new ATOM 51 N GLN A 4 -22.916 11.263 19.804 1.00 0.00 N ATOM 52 CA GLN A 4 -22.751 10.372 20.987 1.00 0.00 C ATOM 53 C GLN A 4 -21.508 10.780 21.777 1.00 0.00 C ATOM 54 O GLN A 4 -20.767 11.657 21.380 1.00 0.00 O ATOM 55 CB GLN A 4 -22.589 8.966 20.415 1.00 0.00 C ATOM 56 CG GLN A 4 -23.901 8.524 19.763 1.00 0.00 C ATOM 57 CD GLN A 4 -23.670 7.237 18.969 1.00 0.00 C ATOM 58 OE1 GLN A 4 -23.988 6.159 19.432 1.00 0.00 O ATOM 59 NE2 GLN A 4 -23.128 7.303 17.784 1.00 0.00 N ATOM 0 H GLN A 4 -22.732 10.830 18.899 1.00 0.00 H new ATOM 0 HA GLN A 4 -23.599 10.431 21.670 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -21.783 8.951 19.681 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -22.312 8.270 21.207 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -24.662 8.361 20.527 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -24.274 9.308 19.104 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -22.861 8.207 17.395 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -22.971 6.450 17.247 1.00 0.00 H new ATOM 68 N SER A 5 -21.277 10.154 22.893 1.00 0.00 N ATOM 69 CA SER A 5 -20.082 10.509 23.711 1.00 0.00 C ATOM 70 C SER A 5 -18.858 10.667 22.807 1.00 0.00 C ATOM 71 O SER A 5 -18.684 9.927 21.859 1.00 0.00 O ATOM 72 CB SER A 5 -19.891 9.337 24.675 1.00 0.00 C ATOM 73 OG SER A 5 -21.075 8.551 24.704 1.00 0.00 O ATOM 0 H SER A 5 -21.862 9.412 23.277 1.00 0.00 H new ATOM 0 HA SER A 5 -20.211 11.451 24.244 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.044 8.727 24.360 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.663 9.707 25.674 1.00 0.00 H new ATOM 0 HG SER A 5 -20.953 7.799 25.320 1.00 0.00 H new ATOM 79 N PRO A 6 -18.051 11.638 23.132 1.00 0.00 N ATOM 80 CA PRO A 6 -16.827 11.917 22.339 1.00 0.00 C ATOM 81 C PRO A 6 -15.783 10.816 22.543 1.00 0.00 C ATOM 82 O PRO A 6 -15.786 10.137 23.547 1.00 0.00 O ATOM 83 CB PRO A 6 -16.328 13.236 22.919 1.00 0.00 C ATOM 84 CG PRO A 6 -16.868 13.271 24.308 1.00 0.00 C ATOM 85 CD PRO A 6 -18.199 12.566 24.260 1.00 0.00 C ATOM 0 HA PRO A 6 -17.016 11.960 21.266 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -15.239 13.282 22.917 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -16.684 14.085 22.335 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -16.190 12.775 25.002 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.984 14.298 24.655 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -18.408 12.038 25.190 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -19.019 13.266 24.100 1.00 0.00 H new ATOM 93 N PRO A 7 -14.912 10.689 21.580 1.00 0.00 N ATOM 94 CA PRO A 7 -13.835 9.672 21.655 1.00 0.00 C ATOM 95 C PRO A 7 -12.750 10.126 22.636 1.00 0.00 C ATOM 96 O PRO A 7 -12.794 11.222 23.160 1.00 0.00 O ATOM 97 CB PRO A 7 -13.295 9.618 20.229 1.00 0.00 C ATOM 98 CG PRO A 7 -13.625 10.951 19.633 1.00 0.00 C ATOM 99 CD PRO A 7 -14.851 11.470 20.341 1.00 0.00 C ATOM 0 HA PRO A 7 -14.180 8.700 22.009 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -12.220 9.439 20.222 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -13.757 8.809 19.664 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -12.791 11.642 19.753 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -13.810 10.858 18.563 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -14.769 12.537 20.547 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -15.748 11.330 19.738 1.00 0.00 H new ATOM 107 N SER A 8 -11.780 9.294 22.892 1.00 0.00 N ATOM 108 CA SER A 8 -10.697 9.682 23.844 1.00 0.00 C ATOM 109 C SER A 8 -9.825 10.781 23.239 1.00 0.00 C ATOM 110 O SER A 8 -10.046 11.228 22.131 1.00 0.00 O ATOM 111 CB SER A 8 -9.872 8.414 24.059 1.00 0.00 C ATOM 112 OG SER A 8 -10.584 7.293 23.552 1.00 0.00 O ATOM 0 H SER A 8 -11.688 8.363 22.485 1.00 0.00 H new ATOM 0 HA SER A 8 -11.101 10.070 24.779 1.00 0.00 H new ATOM 0 HB2 SER A 8 -8.909 8.504 23.556 1.00 0.00 H new ATOM 0 HB3 SER A 8 -9.666 8.277 25.121 1.00 0.00 H new ATOM 0 HG SER A 8 -10.054 6.480 23.688 1.00 0.00 H new ATOM 118 N ILE A 9 -8.834 11.218 23.963 1.00 0.00 N ATOM 119 CA ILE A 9 -7.940 12.291 23.435 1.00 0.00 C ATOM 120 C ILE A 9 -6.511 12.097 23.895 1.00 0.00 C ATOM 121 O ILE A 9 -6.142 11.082 24.451 1.00 0.00 O ATOM 122 CB ILE A 9 -8.455 13.625 23.980 1.00 0.00 C ATOM 123 CG1 ILE A 9 -9.179 13.448 25.323 1.00 0.00 C ATOM 124 CG2 ILE A 9 -9.397 14.239 22.959 1.00 0.00 C ATOM 125 CD1 ILE A 9 -8.537 14.376 26.354 1.00 0.00 C ATOM 0 H ILE A 9 -8.602 10.880 24.897 1.00 0.00 H new ATOM 0 HA ILE A 9 -7.949 12.264 22.345 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.603 14.282 24.154 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -10.238 13.680 25.214 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.112 12.412 25.654 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.771 15.191 23.336 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.862 14.404 22.024 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -10.234 13.563 22.784 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -9.042 14.260 27.313 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.483 14.122 26.466 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.627 15.409 26.019 1.00 0.00 H new ATOM 137 N SER A 10 -5.706 13.082 23.651 1.00 0.00 N ATOM 138 CA SER A 10 -4.284 12.999 24.048 1.00 0.00 C ATOM 139 C SER A 10 -4.159 12.453 25.474 1.00 0.00 C ATOM 140 O SER A 10 -4.207 13.191 26.438 1.00 0.00 O ATOM 141 CB SER A 10 -3.758 14.431 23.967 1.00 0.00 C ATOM 142 OG SER A 10 -2.650 14.473 23.077 1.00 0.00 O ATOM 0 H SER A 10 -5.975 13.950 23.189 1.00 0.00 H new ATOM 0 HA SER A 10 -3.718 12.326 23.404 1.00 0.00 H new ATOM 0 HB2 SER A 10 -4.544 15.101 23.619 1.00 0.00 H new ATOM 0 HB3 SER A 10 -3.458 14.778 24.956 1.00 0.00 H new ATOM 0 HG SER A 10 -2.310 15.391 23.021 1.00 0.00 H new ATOM 148 N ASN A 11 -4.001 11.165 25.614 1.00 0.00 N ATOM 149 CA ASN A 11 -3.873 10.571 26.976 1.00 0.00 C ATOM 150 C ASN A 11 -4.888 11.208 27.928 1.00 0.00 C ATOM 151 O ASN A 11 -4.541 11.694 28.986 1.00 0.00 O ATOM 152 CB ASN A 11 -2.447 10.897 27.419 1.00 0.00 C ATOM 153 CG ASN A 11 -1.492 9.817 26.906 1.00 0.00 C ATOM 154 OD1 ASN A 11 -1.684 8.645 27.165 1.00 0.00 O ATOM 155 ND2 ASN A 11 -0.462 10.165 26.184 1.00 0.00 N ATOM 0 H ASN A 11 -3.955 10.498 24.844 1.00 0.00 H new ATOM 0 HA ASN A 11 -4.065 9.498 26.977 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -2.150 11.873 27.034 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -2.397 10.955 28.506 1.00 0.00 H new ATOM 0 HD21 ASN A 11 0.182 9.454 25.837 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -0.301 11.148 25.966 1.00 0.00 H new ATOM 162 N GLY A 12 -6.140 11.209 27.562 1.00 0.00 N ATOM 163 CA GLY A 12 -7.173 11.815 28.448 1.00 0.00 C ATOM 164 C GLY A 12 -8.539 11.202 28.138 1.00 0.00 C ATOM 165 O GLY A 12 -8.736 10.587 27.108 1.00 0.00 O ATOM 0 H GLY A 12 -6.492 10.817 26.689 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -6.915 11.644 29.493 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -7.206 12.894 28.300 1.00 0.00 H new ATOM 169 N ARG A 13 -9.487 11.367 29.020 1.00 0.00 N ATOM 170 CA ARG A 13 -10.841 10.796 28.776 1.00 0.00 C ATOM 171 C ARG A 13 -11.871 11.912 28.627 1.00 0.00 C ATOM 172 O ARG A 13 -11.552 13.084 28.674 1.00 0.00 O ATOM 173 CB ARG A 13 -11.152 9.950 30.011 1.00 0.00 C ATOM 174 CG ARG A 13 -10.798 10.740 31.272 1.00 0.00 C ATOM 175 CD ARG A 13 -11.367 10.026 32.501 1.00 0.00 C ATOM 176 NE ARG A 13 -10.486 8.841 32.698 1.00 0.00 N ATOM 177 CZ ARG A 13 -10.877 7.852 33.455 1.00 0.00 C ATOM 178 NH1 ARG A 13 -12.051 7.887 34.028 1.00 0.00 N ATOM 179 NH2 ARG A 13 -10.094 6.825 33.641 1.00 0.00 N ATOM 0 H ARG A 13 -9.382 11.873 29.899 1.00 0.00 H new ATOM 0 HA ARG A 13 -10.873 10.207 27.859 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -12.208 9.679 30.023 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -10.585 9.020 29.980 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -9.716 10.835 31.362 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -11.202 11.750 31.206 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -11.356 10.676 33.376 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -12.402 9.726 32.340 1.00 0.00 H new ATOM 0 HE ARG A 13 -9.575 8.802 32.240 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -12.665 8.689 33.884 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -12.353 7.113 34.619 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -9.177 6.795 33.195 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -10.399 6.052 34.232 1.00 0.00 H new ATOM 193 N HIS A 14 -13.103 11.548 28.442 1.00 0.00 N ATOM 194 CA HIS A 14 -14.174 12.571 28.280 1.00 0.00 C ATOM 195 C HIS A 14 -15.409 12.173 29.092 1.00 0.00 C ATOM 196 O HIS A 14 -15.947 11.095 28.934 1.00 0.00 O ATOM 197 CB HIS A 14 -14.481 12.567 26.790 1.00 0.00 C ATOM 198 CG HIS A 14 -15.145 11.275 26.416 1.00 0.00 C ATOM 199 ND1 HIS A 14 -16.518 11.169 26.306 1.00 0.00 N ATOM 200 CD2 HIS A 14 -14.642 10.044 26.078 1.00 0.00 C ATOM 201 CE1 HIS A 14 -16.797 9.922 25.902 1.00 0.00 C ATOM 202 NE2 HIS A 14 -15.690 9.187 25.753 1.00 0.00 N ATOM 0 H HIS A 14 -13.420 10.580 28.395 1.00 0.00 H new ATOM 0 HA HIS A 14 -13.873 13.557 28.633 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -15.130 13.407 26.540 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -13.561 12.694 26.219 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -13.595 9.780 26.066 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -17.796 9.555 25.719 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -15.627 8.211 25.464 1.00 0.00 H new ATOM 210 N ASN A 15 -15.858 13.033 29.965 1.00 0.00 N ATOM 211 CA ASN A 15 -17.054 12.698 30.789 1.00 0.00 C ATOM 212 C ASN A 15 -18.036 13.872 30.812 1.00 0.00 C ATOM 213 O ASN A 15 -17.904 14.789 31.598 1.00 0.00 O ATOM 214 CB ASN A 15 -16.504 12.434 32.190 1.00 0.00 C ATOM 215 CG ASN A 15 -16.968 11.057 32.669 1.00 0.00 C ATOM 216 OD1 ASN A 15 -17.914 10.951 33.425 1.00 0.00 O ATOM 217 ND2 ASN A 15 -16.338 9.991 32.258 1.00 0.00 N ATOM 0 H ASN A 15 -15.450 13.951 30.143 1.00 0.00 H new ATOM 0 HA ASN A 15 -17.599 11.841 30.392 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -15.415 12.479 32.179 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -16.848 13.205 32.879 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -16.639 9.068 32.571 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -15.544 10.080 31.624 1.00 0.00 H new ATOM 224 N GLY A 16 -19.023 13.846 29.959 1.00 0.00 N ATOM 225 CA GLY A 16 -20.019 14.953 29.936 1.00 0.00 C ATOM 226 C GLY A 16 -21.267 14.518 30.703 1.00 0.00 C ATOM 227 O GLY A 16 -22.324 15.104 30.577 1.00 0.00 O ATOM 0 H GLY A 16 -19.182 13.105 29.276 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -19.594 15.850 30.386 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -20.278 15.204 28.908 1.00 0.00 H new ATOM 231 N TYR A 17 -21.152 13.487 31.496 1.00 0.00 N ATOM 232 CA TYR A 17 -22.330 13.004 32.272 1.00 0.00 C ATOM 233 C TYR A 17 -23.513 12.754 31.334 1.00 0.00 C ATOM 234 O TYR A 17 -24.583 13.302 31.505 1.00 0.00 O ATOM 235 CB TYR A 17 -22.645 14.128 33.258 1.00 0.00 C ATOM 236 CG TYR A 17 -21.924 13.869 34.561 1.00 0.00 C ATOM 237 CD1 TYR A 17 -20.525 13.914 34.608 1.00 0.00 C ATOM 238 CD2 TYR A 17 -22.654 13.585 35.721 1.00 0.00 C ATOM 239 CE1 TYR A 17 -19.856 13.673 35.814 1.00 0.00 C ATOM 240 CE2 TYR A 17 -21.984 13.344 36.928 1.00 0.00 C ATOM 241 CZ TYR A 17 -20.586 13.388 36.974 1.00 0.00 C ATOM 242 OH TYR A 17 -19.926 13.151 38.163 1.00 0.00 O ATOM 0 H TYR A 17 -20.292 12.958 31.640 1.00 0.00 H new ATOM 0 HA TYR A 17 -22.131 12.063 32.785 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -22.336 15.088 32.843 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -23.720 14.186 33.430 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -19.962 14.135 33.713 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -23.733 13.552 35.686 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -18.777 13.707 35.849 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -22.547 13.124 37.823 1.00 0.00 H new ATOM 0 HH TYR A 17 -20.580 12.970 38.870 1.00 0.00 H new ATOM 252 N GLU A 18 -23.325 11.925 30.342 1.00 0.00 N ATOM 253 CA GLU A 18 -24.434 11.634 29.390 1.00 0.00 C ATOM 254 C GLU A 18 -23.965 10.641 28.324 1.00 0.00 C ATOM 255 O GLU A 18 -22.940 10.004 28.462 1.00 0.00 O ATOM 256 CB GLU A 18 -24.775 12.980 28.751 1.00 0.00 C ATOM 257 CG GLU A 18 -23.505 13.605 28.168 1.00 0.00 C ATOM 258 CD GLU A 18 -23.289 13.088 26.745 1.00 0.00 C ATOM 259 OE1 GLU A 18 -24.075 13.441 25.881 1.00 0.00 O ATOM 260 OE2 GLU A 18 -22.340 12.348 26.542 1.00 0.00 O ATOM 0 H GLU A 18 -22.450 11.437 30.150 1.00 0.00 H new ATOM 0 HA GLU A 18 -25.297 11.189 29.886 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -25.519 12.844 27.966 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -25.213 13.647 29.494 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -23.591 14.692 28.162 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -22.646 13.357 28.791 1.00 0.00 H new ATOM 267 N ASP A 19 -24.707 10.509 27.259 1.00 0.00 N ATOM 268 CA ASP A 19 -24.304 9.563 26.179 1.00 0.00 C ATOM 269 C ASP A 19 -24.551 10.202 24.811 1.00 0.00 C ATOM 270 O ASP A 19 -23.759 10.070 23.899 1.00 0.00 O ATOM 271 CB ASP A 19 -25.197 8.336 26.370 1.00 0.00 C ATOM 272 CG ASP A 19 -24.369 7.178 26.932 1.00 0.00 C ATOM 273 OD1 ASP A 19 -23.243 7.422 27.334 1.00 0.00 O ATOM 274 OD2 ASP A 19 -24.875 6.068 26.950 1.00 0.00 O ATOM 0 H ASP A 19 -25.576 11.016 27.089 1.00 0.00 H new ATOM 0 HA ASP A 19 -23.247 9.303 26.226 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -26.016 8.573 27.049 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -25.644 8.048 25.419 1.00 0.00 H new ATOM 279 N PHE A 20 -25.643 10.900 24.667 1.00 0.00 N ATOM 280 CA PHE A 20 -25.946 11.558 23.364 1.00 0.00 C ATOM 281 C PHE A 20 -25.829 13.078 23.513 1.00 0.00 C ATOM 282 O PHE A 20 -26.290 13.654 24.478 1.00 0.00 O ATOM 283 CB PHE A 20 -27.386 11.156 23.042 1.00 0.00 C ATOM 284 CG PHE A 20 -27.381 9.986 22.088 1.00 0.00 C ATOM 285 CD1 PHE A 20 -27.020 8.713 22.545 1.00 0.00 C ATOM 286 CD2 PHE A 20 -27.737 10.174 20.748 1.00 0.00 C ATOM 287 CE1 PHE A 20 -27.017 7.627 21.661 1.00 0.00 C ATOM 288 CE2 PHE A 20 -27.733 9.089 19.864 1.00 0.00 C ATOM 289 CZ PHE A 20 -27.373 7.815 20.320 1.00 0.00 C ATOM 0 H PHE A 20 -26.341 11.044 25.397 1.00 0.00 H new ATOM 0 HA PHE A 20 -25.258 11.259 22.573 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -27.914 10.890 23.958 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -27.919 11.997 22.600 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -26.744 8.569 23.579 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -28.015 11.156 20.396 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -26.740 6.644 22.014 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -28.008 9.234 18.830 1.00 0.00 H new ATOM 0 HZ PHE A 20 -27.370 6.978 19.638 1.00 0.00 H new ATOM 299 N TYR A 21 -25.209 13.730 22.569 1.00 0.00 N ATOM 300 CA TYR A 21 -25.052 15.210 22.659 1.00 0.00 C ATOM 301 C TYR A 21 -25.671 15.893 21.436 1.00 0.00 C ATOM 302 O TYR A 21 -25.767 17.102 21.367 1.00 0.00 O ATOM 303 CB TYR A 21 -23.549 15.436 22.696 1.00 0.00 C ATOM 304 CG TYR A 21 -23.138 15.732 24.119 1.00 0.00 C ATOM 305 CD1 TYR A 21 -23.852 16.674 24.864 1.00 0.00 C ATOM 306 CD2 TYR A 21 -22.049 15.067 24.694 1.00 0.00 C ATOM 307 CE1 TYR A 21 -23.479 16.958 26.182 1.00 0.00 C ATOM 308 CE2 TYR A 21 -21.674 15.350 26.013 1.00 0.00 C ATOM 309 CZ TYR A 21 -22.388 16.296 26.757 1.00 0.00 C ATOM 310 OH TYR A 21 -22.017 16.575 28.056 1.00 0.00 O ATOM 0 H TYR A 21 -24.803 13.301 21.737 1.00 0.00 H new ATOM 0 HA TYR A 21 -25.553 15.627 23.533 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -23.025 14.554 22.327 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -23.276 16.265 22.044 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -24.694 17.184 24.421 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -21.498 14.336 24.121 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -24.032 17.687 26.755 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -20.833 14.838 26.457 1.00 0.00 H new ATOM 0 HH TYR A 21 -22.807 16.840 28.572 1.00 0.00 H new ATOM 320 N THR A 22 -26.090 15.120 20.477 1.00 0.00 N ATOM 321 CA THR A 22 -26.711 15.694 19.248 1.00 0.00 C ATOM 322 C THR A 22 -25.900 16.874 18.697 1.00 0.00 C ATOM 323 O THR A 22 -24.971 16.696 17.935 1.00 0.00 O ATOM 324 CB THR A 22 -28.110 16.144 19.677 1.00 0.00 C ATOM 325 OG1 THR A 22 -28.011 16.992 20.811 1.00 0.00 O ATOM 326 CG2 THR A 22 -28.957 14.919 20.028 1.00 0.00 C ATOM 0 H THR A 22 -26.029 14.102 20.490 1.00 0.00 H new ATOM 0 HA THR A 22 -26.745 14.960 18.442 1.00 0.00 H new ATOM 0 HB THR A 22 -28.581 16.688 18.858 1.00 0.00 H new ATOM 0 HG1 THR A 22 -27.085 17.298 20.911 1.00 0.00 H new ATOM 0 HG21 THR A 22 -29.953 15.241 20.333 1.00 0.00 H new ATOM 0 HG22 THR A 22 -29.037 14.270 19.156 1.00 0.00 H new ATOM 0 HG23 THR A 22 -28.486 14.373 20.845 1.00 0.00 H new ATOM 334 N ASP A 23 -26.255 18.079 19.046 1.00 0.00 N ATOM 335 CA ASP A 23 -25.506 19.252 18.506 1.00 0.00 C ATOM 336 C ASP A 23 -25.610 20.444 19.460 1.00 0.00 C ATOM 337 O ASP A 23 -26.573 20.592 20.186 1.00 0.00 O ATOM 338 CB ASP A 23 -26.193 19.561 17.176 1.00 0.00 C ATOM 339 CG ASP A 23 -25.757 20.940 16.676 1.00 0.00 C ATOM 340 OD1 ASP A 23 -26.095 21.917 17.323 1.00 0.00 O ATOM 341 OD2 ASP A 23 -25.093 20.995 15.654 1.00 0.00 O ATOM 0 H ASP A 23 -27.025 18.303 19.677 1.00 0.00 H new ATOM 0 HA ASP A 23 -24.442 19.048 18.386 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -25.938 18.799 16.439 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -27.276 19.535 17.300 1.00 0.00 H new ATOM 346 N GLY A 24 -24.619 21.294 19.467 1.00 0.00 N ATOM 347 CA GLY A 24 -24.654 22.473 20.376 1.00 0.00 C ATOM 348 C GLY A 24 -24.302 22.023 21.793 1.00 0.00 C ATOM 349 O GLY A 24 -24.755 22.591 22.767 1.00 0.00 O ATOM 0 H GLY A 24 -23.787 21.222 18.882 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -23.948 23.231 20.036 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -25.644 22.930 20.361 1.00 0.00 H new ATOM 353 N SER A 25 -23.499 21.001 21.915 1.00 0.00 N ATOM 354 CA SER A 25 -23.120 20.509 23.271 1.00 0.00 C ATOM 355 C SER A 25 -21.607 20.546 23.450 1.00 0.00 C ATOM 356 O SER A 25 -20.866 20.764 22.513 1.00 0.00 O ATOM 357 CB SER A 25 -23.628 19.076 23.328 1.00 0.00 C ATOM 358 OG SER A 25 -24.629 18.891 22.337 1.00 0.00 O ATOM 0 H SER A 25 -23.089 20.486 21.136 1.00 0.00 H new ATOM 0 HA SER A 25 -23.545 21.126 24.063 1.00 0.00 H new ATOM 0 HB2 SER A 25 -22.805 18.380 23.164 1.00 0.00 H new ATOM 0 HB3 SER A 25 -24.035 18.862 24.316 1.00 0.00 H new ATOM 0 HG SER A 25 -24.796 17.933 22.216 1.00 0.00 H new ATOM 364 N VAL A 26 -21.140 20.342 24.649 1.00 0.00 N ATOM 365 CA VAL A 26 -19.673 20.378 24.877 1.00 0.00 C ATOM 366 C VAL A 26 -19.256 19.325 25.892 1.00 0.00 C ATOM 367 O VAL A 26 -20.042 18.869 26.699 1.00 0.00 O ATOM 368 CB VAL A 26 -19.396 21.786 25.402 1.00 0.00 C ATOM 369 CG1 VAL A 26 -18.014 21.840 26.057 1.00 0.00 C ATOM 370 CG2 VAL A 26 -19.447 22.775 24.239 1.00 0.00 C ATOM 0 H VAL A 26 -21.708 20.153 25.475 1.00 0.00 H new ATOM 0 HA VAL A 26 -19.110 20.161 23.969 1.00 0.00 H new ATOM 0 HB VAL A 26 -20.150 22.048 26.144 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -17.826 22.848 26.428 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -17.977 21.135 26.887 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -17.253 21.576 25.323 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -19.250 23.781 24.608 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -18.693 22.506 23.499 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -20.434 22.744 23.778 1.00 0.00 H new ATOM 380 N VAL A 27 -18.019 18.921 25.839 1.00 0.00 N ATOM 381 CA VAL A 27 -17.546 17.878 26.785 1.00 0.00 C ATOM 382 C VAL A 27 -16.244 18.284 27.453 1.00 0.00 C ATOM 383 O VAL A 27 -15.255 18.551 26.806 1.00 0.00 O ATOM 384 CB VAL A 27 -17.329 16.648 25.913 1.00 0.00 C ATOM 385 CG1 VAL A 27 -16.411 15.647 26.619 1.00 0.00 C ATOM 386 CG2 VAL A 27 -18.673 16.004 25.661 1.00 0.00 C ATOM 0 H VAL A 27 -17.318 19.267 25.184 1.00 0.00 H new ATOM 0 HA VAL A 27 -18.260 17.708 27.591 1.00 0.00 H new ATOM 0 HB VAL A 27 -16.861 16.943 24.974 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -16.266 14.774 25.982 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -15.447 16.115 26.818 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -16.865 15.338 27.560 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -18.542 15.120 25.037 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -19.122 15.715 26.611 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -19.326 16.713 25.152 1.00 0.00 H new ATOM 396 N THR A 28 -16.216 18.292 28.748 1.00 0.00 N ATOM 397 CA THR A 28 -14.951 18.634 29.423 1.00 0.00 C ATOM 398 C THR A 28 -14.069 17.391 29.407 1.00 0.00 C ATOM 399 O THR A 28 -14.271 16.462 30.164 1.00 0.00 O ATOM 400 CB THR A 28 -15.326 19.039 30.848 1.00 0.00 C ATOM 401 OG1 THR A 28 -16.741 19.042 30.986 1.00 0.00 O ATOM 402 CG2 THR A 28 -14.782 20.438 31.131 1.00 0.00 C ATOM 0 H THR A 28 -17.004 18.079 29.360 1.00 0.00 H new ATOM 0 HA THR A 28 -14.406 19.446 28.941 1.00 0.00 H new ATOM 0 HB THR A 28 -14.898 18.329 31.555 1.00 0.00 H new ATOM 0 HG1 THR A 28 -16.980 19.300 31.901 1.00 0.00 H new ATOM 0 HG21 THR A 28 -15.046 20.733 32.147 1.00 0.00 H new ATOM 0 HG22 THR A 28 -13.697 20.435 31.025 1.00 0.00 H new ATOM 0 HG23 THR A 28 -15.214 21.146 30.424 1.00 0.00 H new ATOM 410 N TYR A 29 -13.114 17.352 28.526 1.00 0.00 N ATOM 411 CA TYR A 29 -12.246 16.148 28.435 1.00 0.00 C ATOM 412 C TYR A 29 -11.372 16.036 29.687 1.00 0.00 C ATOM 413 O TYR A 29 -10.608 16.926 30.003 1.00 0.00 O ATOM 414 CB TYR A 29 -11.354 16.384 27.210 1.00 0.00 C ATOM 415 CG TYR A 29 -11.991 15.865 25.934 1.00 0.00 C ATOM 416 CD1 TYR A 29 -13.167 15.094 25.954 1.00 0.00 C ATOM 417 CD2 TYR A 29 -11.378 16.162 24.710 1.00 0.00 C ATOM 418 CE1 TYR A 29 -13.716 14.628 24.753 1.00 0.00 C ATOM 419 CE2 TYR A 29 -11.930 15.698 23.513 1.00 0.00 C ATOM 420 CZ TYR A 29 -13.097 14.929 23.533 1.00 0.00 C ATOM 421 OH TYR A 29 -13.640 14.468 22.351 1.00 0.00 O ATOM 0 H TYR A 29 -12.896 18.099 27.866 1.00 0.00 H new ATOM 0 HA TYR A 29 -12.831 15.232 28.352 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -11.154 17.451 27.107 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -10.393 15.892 27.361 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -13.646 14.862 26.894 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -10.474 16.753 24.691 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -14.619 14.035 24.767 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -11.455 15.934 22.572 1.00 0.00 H new ATOM 0 HH TYR A 29 -14.470 14.953 22.161 1.00 0.00 H new ATOM 431 N SER A 30 -11.467 14.945 30.396 1.00 0.00 N ATOM 432 CA SER A 30 -10.628 14.780 31.618 1.00 0.00 C ATOM 433 C SER A 30 -9.268 14.194 31.231 1.00 0.00 C ATOM 434 O SER A 30 -9.166 13.390 30.326 1.00 0.00 O ATOM 435 CB SER A 30 -11.397 13.809 32.516 1.00 0.00 C ATOM 436 OG SER A 30 -12.672 13.541 31.945 1.00 0.00 O ATOM 0 H SER A 30 -12.087 14.163 30.184 1.00 0.00 H new ATOM 0 HA SER A 30 -10.443 15.727 32.125 1.00 0.00 H new ATOM 0 HB2 SER A 30 -10.836 12.881 32.631 1.00 0.00 H new ATOM 0 HB3 SER A 30 -11.515 14.235 33.512 1.00 0.00 H new ATOM 0 HG SER A 30 -13.163 12.918 32.520 1.00 0.00 H new ATOM 442 N CYS A 31 -8.222 14.595 31.898 1.00 0.00 N ATOM 443 CA CYS A 31 -6.872 14.062 31.553 1.00 0.00 C ATOM 444 C CYS A 31 -6.440 12.997 32.564 1.00 0.00 C ATOM 445 O CYS A 31 -7.076 12.793 33.579 1.00 0.00 O ATOM 446 CB CYS A 31 -5.943 15.273 31.623 1.00 0.00 C ATOM 447 SG CYS A 31 -6.641 16.625 30.644 1.00 0.00 S ATOM 0 H CYS A 31 -8.242 15.267 32.665 1.00 0.00 H new ATOM 0 HA CYS A 31 -6.857 13.587 30.572 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -5.816 15.588 32.659 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -4.955 15.009 31.246 1.00 0.00 H new ATOM 452 N ASN A 32 -5.357 12.319 32.295 1.00 0.00 N ATOM 453 CA ASN A 32 -4.880 11.271 33.240 1.00 0.00 C ATOM 454 C ASN A 32 -4.305 11.922 34.501 1.00 0.00 C ATOM 455 O ASN A 32 -4.015 13.101 34.527 1.00 0.00 O ATOM 456 CB ASN A 32 -3.790 10.513 32.480 1.00 0.00 C ATOM 457 CG ASN A 32 -4.283 9.100 32.161 1.00 0.00 C ATOM 458 OD1 ASN A 32 -4.321 8.247 33.025 1.00 0.00 O ATOM 459 ND2 ASN A 32 -4.665 8.816 30.946 1.00 0.00 N ATOM 0 H ASN A 32 -4.783 12.446 31.462 1.00 0.00 H new ATOM 0 HA ASN A 32 -5.683 10.608 33.562 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -3.540 11.040 31.559 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -2.880 10.466 33.078 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -4.996 7.878 30.722 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -4.633 9.532 30.221 1.00 0.00 H new ATOM 466 N SER A 33 -4.144 11.162 35.549 1.00 0.00 N ATOM 467 CA SER A 33 -3.595 11.735 36.811 1.00 0.00 C ATOM 468 C SER A 33 -2.232 12.388 36.561 1.00 0.00 C ATOM 469 O SER A 33 -1.217 11.724 36.499 1.00 0.00 O ATOM 470 CB SER A 33 -3.449 10.542 37.753 1.00 0.00 C ATOM 471 OG SER A 33 -4.378 9.533 37.379 1.00 0.00 O ATOM 0 H SER A 33 -4.369 10.168 35.586 1.00 0.00 H new ATOM 0 HA SER A 33 -4.242 12.510 37.223 1.00 0.00 H new ATOM 0 HB2 SER A 33 -2.432 10.151 37.709 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.627 10.853 38.783 1.00 0.00 H new ATOM 0 HG SER A 33 -4.286 8.765 37.980 1.00 0.00 H new ATOM 477 N GLY A 34 -2.200 13.687 36.428 1.00 0.00 N ATOM 478 CA GLY A 34 -0.900 14.380 36.195 1.00 0.00 C ATOM 479 C GLY A 34 -0.822 14.881 34.752 1.00 0.00 C ATOM 480 O GLY A 34 0.244 15.159 34.241 1.00 0.00 O ATOM 0 H GLY A 34 -3.016 14.297 36.471 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -0.797 15.218 36.885 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -0.074 13.698 36.396 1.00 0.00 H new ATOM 484 N TYR A 35 -1.939 15.003 34.088 1.00 0.00 N ATOM 485 CA TYR A 35 -1.914 15.491 32.679 1.00 0.00 C ATOM 486 C TYR A 35 -2.674 16.816 32.565 1.00 0.00 C ATOM 487 O TYR A 35 -3.826 16.920 32.939 1.00 0.00 O ATOM 488 CB TYR A 35 -2.600 14.396 31.862 1.00 0.00 C ATOM 489 CG TYR A 35 -1.556 13.439 31.339 1.00 0.00 C ATOM 490 CD1 TYR A 35 -0.855 13.741 30.165 1.00 0.00 C ATOM 491 CD2 TYR A 35 -1.288 12.251 32.028 1.00 0.00 C ATOM 492 CE1 TYR A 35 0.115 12.855 29.681 1.00 0.00 C ATOM 493 CE2 TYR A 35 -0.319 11.365 31.545 1.00 0.00 C ATOM 494 CZ TYR A 35 0.383 11.666 30.372 1.00 0.00 C ATOM 495 OH TYR A 35 1.337 10.792 29.895 1.00 0.00 O ATOM 0 H TYR A 35 -2.865 14.787 34.458 1.00 0.00 H new ATOM 0 HA TYR A 35 -0.900 15.679 32.325 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -3.322 13.863 32.480 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -3.154 14.837 31.033 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -1.063 14.658 29.633 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -1.829 12.018 32.933 1.00 0.00 H new ATOM 0 HE1 TYR A 35 0.656 13.088 28.776 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -0.112 10.448 32.077 1.00 0.00 H new ATOM 0 HH TYR A 35 1.399 10.018 30.493 1.00 0.00 H new ATOM 505 N SER A 36 -2.031 17.831 32.058 1.00 0.00 N ATOM 506 CA SER A 36 -2.699 19.158 31.923 1.00 0.00 C ATOM 507 C SER A 36 -3.696 19.161 30.766 1.00 0.00 C ATOM 508 O SER A 36 -3.444 18.611 29.711 1.00 0.00 O ATOM 509 CB SER A 36 -1.565 20.141 31.647 1.00 0.00 C ATOM 510 OG SER A 36 -1.480 21.055 32.731 1.00 0.00 O ATOM 0 H SER A 36 -1.066 17.799 31.729 1.00 0.00 H new ATOM 0 HA SER A 36 -3.267 19.415 32.817 1.00 0.00 H new ATOM 0 HB2 SER A 36 -0.622 19.607 31.529 1.00 0.00 H new ATOM 0 HB3 SER A 36 -1.747 20.676 30.715 1.00 0.00 H new ATOM 0 HG SER A 36 -2.326 21.542 32.816 1.00 0.00 H new ATOM 516 N LEU A 37 -4.821 19.795 30.953 1.00 0.00 N ATOM 517 CA LEU A 37 -5.830 19.857 29.863 1.00 0.00 C ATOM 518 C LEU A 37 -5.611 21.127 29.042 1.00 0.00 C ATOM 519 O LEU A 37 -5.908 22.219 29.483 1.00 0.00 O ATOM 520 CB LEU A 37 -7.189 19.909 30.559 1.00 0.00 C ATOM 521 CG LEU A 37 -8.284 20.098 29.507 1.00 0.00 C ATOM 522 CD1 LEU A 37 -8.886 18.741 29.145 1.00 0.00 C ATOM 523 CD2 LEU A 37 -9.381 21.006 30.065 1.00 0.00 C ATOM 0 H LEU A 37 -5.083 20.273 31.815 1.00 0.00 H new ATOM 0 HA LEU A 37 -5.760 19.004 29.188 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.360 18.989 31.119 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.212 20.728 31.277 1.00 0.00 H new ATOM 0 HG LEU A 37 -7.852 20.554 28.616 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.666 18.877 28.396 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.107 18.093 28.744 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.315 18.284 30.037 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.160 21.139 29.314 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.811 20.551 30.957 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.955 21.976 30.322 1.00 0.00 H new ATOM 535 N ILE A 38 -5.097 20.998 27.853 1.00 0.00 N ATOM 536 CA ILE A 38 -4.867 22.211 27.016 1.00 0.00 C ATOM 537 C ILE A 38 -6.020 22.370 26.025 1.00 0.00 C ATOM 538 O ILE A 38 -6.692 21.418 25.686 1.00 0.00 O ATOM 539 CB ILE A 38 -3.540 21.998 26.263 1.00 0.00 C ATOM 540 CG1 ILE A 38 -2.698 20.881 26.902 1.00 0.00 C ATOM 541 CG2 ILE A 38 -2.734 23.288 26.304 1.00 0.00 C ATOM 542 CD1 ILE A 38 -2.452 21.204 28.377 1.00 0.00 C ATOM 0 H ILE A 38 -4.827 20.113 27.425 1.00 0.00 H new ATOM 0 HA ILE A 38 -4.817 23.112 27.628 1.00 0.00 H new ATOM 0 HB ILE A 38 -3.777 21.712 25.238 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -3.213 19.925 26.810 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -1.748 20.783 26.377 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -1.793 23.146 25.773 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -3.302 24.087 25.828 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.529 23.556 27.340 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -1.855 20.411 28.828 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -1.918 22.151 28.458 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -3.407 21.280 28.897 1.00 0.00 H new ATOM 554 N GLY A 39 -6.260 23.562 25.560 1.00 0.00 N ATOM 555 CA GLY A 39 -7.375 23.766 24.595 1.00 0.00 C ATOM 556 C GLY A 39 -8.632 24.195 25.350 1.00 0.00 C ATOM 557 O GLY A 39 -8.650 24.251 26.563 1.00 0.00 O ATOM 0 H GLY A 39 -5.735 24.402 25.805 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.101 24.525 23.862 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -7.566 22.845 24.044 1.00 0.00 H new ATOM 561 N ASN A 40 -9.686 24.497 24.643 1.00 0.00 N ATOM 562 CA ASN A 40 -10.941 24.919 25.327 1.00 0.00 C ATOM 563 C ASN A 40 -11.305 23.908 26.416 1.00 0.00 C ATOM 564 O ASN A 40 -11.107 22.720 26.262 1.00 0.00 O ATOM 565 CB ASN A 40 -12.008 24.936 24.232 1.00 0.00 C ATOM 566 CG ASN A 40 -12.123 26.346 23.650 1.00 0.00 C ATOM 567 OD1 ASN A 40 -11.431 26.686 22.711 1.00 0.00 O ATOM 568 ND2 ASN A 40 -12.975 27.188 24.170 1.00 0.00 N ATOM 0 H ASN A 40 -9.733 24.470 23.624 1.00 0.00 H new ATOM 0 HA ASN A 40 -10.843 25.891 25.810 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -11.748 24.227 23.446 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -12.968 24.621 24.641 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -13.059 28.130 23.788 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -13.556 26.904 24.958 1.00 0.00 H new ATOM 575 N SER A 41 -11.835 24.367 27.515 1.00 0.00 N ATOM 576 CA SER A 41 -12.208 23.427 28.610 1.00 0.00 C ATOM 577 C SER A 41 -13.550 22.761 28.299 1.00 0.00 C ATOM 578 O SER A 41 -14.457 22.767 29.107 1.00 0.00 O ATOM 579 CB SER A 41 -12.322 24.298 29.858 1.00 0.00 C ATOM 580 OG SER A 41 -13.295 25.310 29.636 1.00 0.00 O ATOM 0 H SER A 41 -12.026 25.351 27.703 1.00 0.00 H new ATOM 0 HA SER A 41 -11.477 22.628 28.735 1.00 0.00 H new ATOM 0 HB2 SER A 41 -12.604 23.688 30.717 1.00 0.00 H new ATOM 0 HB3 SER A 41 -11.357 24.749 30.090 1.00 0.00 H new ATOM 0 HG SER A 41 -13.372 25.871 30.436 1.00 0.00 H new ATOM 586 N GLY A 42 -13.685 22.189 27.135 1.00 0.00 N ATOM 587 CA GLY A 42 -14.970 21.528 26.778 1.00 0.00 C ATOM 588 C GLY A 42 -15.055 21.357 25.262 1.00 0.00 C ATOM 589 O GLY A 42 -14.983 22.315 24.519 1.00 0.00 O ATOM 0 H GLY A 42 -12.962 22.151 26.417 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -15.039 20.557 27.268 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -15.809 22.125 27.134 1.00 0.00 H new ATOM 593 N VAL A 43 -15.225 20.149 24.792 1.00 0.00 N ATOM 594 CA VAL A 43 -15.331 19.952 23.313 1.00 0.00 C ATOM 595 C VAL A 43 -16.605 20.631 22.827 1.00 0.00 C ATOM 596 O VAL A 43 -17.366 21.153 23.614 1.00 0.00 O ATOM 597 CB VAL A 43 -15.428 18.447 23.044 1.00 0.00 C ATOM 598 CG1 VAL A 43 -14.826 18.154 21.669 1.00 0.00 C ATOM 599 CG2 VAL A 43 -14.658 17.650 24.090 1.00 0.00 C ATOM 0 H VAL A 43 -15.294 19.302 25.356 1.00 0.00 H new ATOM 0 HA VAL A 43 -14.468 20.374 22.798 1.00 0.00 H new ATOM 0 HB VAL A 43 -16.477 18.155 23.084 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -14.889 17.085 21.465 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -15.378 18.702 20.906 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -13.782 18.465 21.655 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -14.745 16.585 23.873 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.608 17.940 24.068 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -15.070 17.854 25.078 1.00 0.00 H new ATOM 609 N LEU A 44 -16.858 20.618 21.549 1.00 0.00 N ATOM 610 CA LEU A 44 -18.104 21.260 21.043 1.00 0.00 C ATOM 611 C LEU A 44 -18.709 20.431 19.912 1.00 0.00 C ATOM 612 O LEU A 44 -18.369 20.604 18.759 1.00 0.00 O ATOM 613 CB LEU A 44 -17.669 22.633 20.513 1.00 0.00 C ATOM 614 CG LEU A 44 -18.883 23.562 20.275 1.00 0.00 C ATOM 615 CD1 LEU A 44 -18.693 24.315 18.958 1.00 0.00 C ATOM 616 CD2 LEU A 44 -20.196 22.770 20.197 1.00 0.00 C ATOM 0 H LEU A 44 -16.262 20.195 20.837 1.00 0.00 H new ATOM 0 HA LEU A 44 -18.860 21.343 21.823 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -16.987 23.099 21.225 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -17.119 22.506 19.581 1.00 0.00 H new ATOM 0 HG LEU A 44 -18.943 24.253 21.116 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -19.547 24.971 18.787 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.782 24.911 19.008 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -18.615 23.601 18.138 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -21.026 23.457 20.029 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -20.143 22.057 19.374 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -20.353 22.233 21.132 1.00 0.00 H new ATOM 628 N CYS A 45 -19.619 19.550 20.218 1.00 0.00 N ATOM 629 CA CYS A 45 -20.243 18.752 19.129 1.00 0.00 C ATOM 630 C CYS A 45 -21.343 19.578 18.472 1.00 0.00 C ATOM 631 O CYS A 45 -22.372 19.850 19.064 1.00 0.00 O ATOM 632 CB CYS A 45 -20.829 17.507 19.787 1.00 0.00 C ATOM 633 SG CYS A 45 -20.575 16.091 18.687 1.00 0.00 S ATOM 0 H CYS A 45 -19.954 19.350 21.161 1.00 0.00 H new ATOM 0 HA CYS A 45 -19.522 18.477 18.359 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -20.350 17.328 20.750 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -21.892 17.648 19.981 1.00 0.00 H new ATOM 638 N SER A 46 -21.128 19.988 17.257 1.00 0.00 N ATOM 639 CA SER A 46 -22.153 20.807 16.556 1.00 0.00 C ATOM 640 C SER A 46 -22.268 20.365 15.095 1.00 0.00 C ATOM 641 O SER A 46 -21.496 20.772 14.250 1.00 0.00 O ATOM 642 CB SER A 46 -21.641 22.245 16.651 1.00 0.00 C ATOM 643 OG SER A 46 -21.985 22.946 15.463 1.00 0.00 O ATOM 0 H SER A 46 -20.285 19.792 16.717 1.00 0.00 H new ATOM 0 HA SER A 46 -23.145 20.702 16.996 1.00 0.00 H new ATOM 0 HB2 SER A 46 -22.076 22.741 17.519 1.00 0.00 H new ATOM 0 HB3 SER A 46 -20.560 22.250 16.790 1.00 0.00 H new ATOM 0 HG SER A 46 -21.556 22.516 14.694 1.00 0.00 H new ATOM 649 N GLY A 47 -23.224 19.530 14.793 1.00 0.00 N ATOM 650 CA GLY A 47 -23.387 19.058 13.389 1.00 0.00 C ATOM 651 C GLY A 47 -22.971 17.589 13.295 1.00 0.00 C ATOM 652 O GLY A 47 -22.347 17.170 12.341 1.00 0.00 O ATOM 0 H GLY A 47 -23.900 19.154 15.458 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -24.423 19.175 13.073 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.778 19.663 12.717 1.00 0.00 H new ATOM 656 N GLY A 48 -23.311 16.803 14.280 1.00 0.00 N ATOM 657 CA GLY A 48 -22.936 15.362 14.248 1.00 0.00 C ATOM 658 C GLY A 48 -21.413 15.229 14.203 1.00 0.00 C ATOM 659 O GLY A 48 -20.881 14.265 13.688 1.00 0.00 O ATOM 0 H GLY A 48 -23.833 17.097 15.106 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -23.330 14.854 15.128 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -23.379 14.880 13.377 1.00 0.00 H new ATOM 663 N GLU A 49 -20.705 16.188 14.735 1.00 0.00 N ATOM 664 CA GLU A 49 -19.216 16.110 14.717 1.00 0.00 C ATOM 665 C GLU A 49 -18.626 16.915 15.876 1.00 0.00 C ATOM 666 O GLU A 49 -18.995 18.049 16.108 1.00 0.00 O ATOM 667 CB GLU A 49 -18.799 16.727 13.382 1.00 0.00 C ATOM 668 CG GLU A 49 -18.896 15.674 12.275 1.00 0.00 C ATOM 669 CD GLU A 49 -17.622 15.701 11.428 1.00 0.00 C ATOM 670 OE1 GLU A 49 -17.115 16.785 11.188 1.00 0.00 O ATOM 671 OE2 GLU A 49 -17.174 14.637 11.032 1.00 0.00 O ATOM 0 H GLU A 49 -21.092 17.020 15.180 1.00 0.00 H new ATOM 0 HA GLU A 49 -18.861 15.085 14.825 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -19.440 17.576 13.147 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -17.779 17.106 13.448 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -19.034 14.685 12.711 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -19.766 15.870 11.648 1.00 0.00 H new ATOM 678 N TRP A 50 -17.705 16.342 16.598 1.00 0.00 N ATOM 679 CA TRP A 50 -17.082 17.080 17.733 1.00 0.00 C ATOM 680 C TRP A 50 -15.972 17.993 17.203 1.00 0.00 C ATOM 681 O TRP A 50 -15.263 17.644 16.280 1.00 0.00 O ATOM 682 CB TRP A 50 -16.498 15.991 18.635 1.00 0.00 C ATOM 683 CG TRP A 50 -17.591 15.352 19.430 1.00 0.00 C ATOM 684 CD1 TRP A 50 -18.163 14.156 19.152 1.00 0.00 C ATOM 685 CD2 TRP A 50 -18.248 15.850 20.629 1.00 0.00 C ATOM 686 NE1 TRP A 50 -19.130 13.891 20.105 1.00 0.00 N ATOM 687 CE2 TRP A 50 -19.219 14.906 21.037 1.00 0.00 C ATOM 688 CE3 TRP A 50 -18.097 17.019 21.394 1.00 0.00 C ATOM 689 CZ2 TRP A 50 -20.012 15.114 22.163 1.00 0.00 C ATOM 690 CZ3 TRP A 50 -18.892 17.233 22.530 1.00 0.00 C ATOM 691 CH2 TRP A 50 -19.848 16.283 22.913 1.00 0.00 C ATOM 0 H TRP A 50 -17.356 15.395 16.452 1.00 0.00 H new ATOM 0 HA TRP A 50 -17.792 17.711 18.268 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -15.989 15.240 18.031 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -15.753 16.421 19.304 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -17.906 13.514 18.322 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -19.706 13.050 20.118 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -17.364 17.758 21.105 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -20.747 14.379 22.454 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -18.767 18.134 23.112 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -20.458 16.453 23.788 1.00 0.00 H new ATOM 702 N SER A 51 -15.816 19.163 17.764 1.00 0.00 N ATOM 703 CA SER A 51 -14.751 20.080 17.261 1.00 0.00 C ATOM 704 C SER A 51 -14.022 20.782 18.415 1.00 0.00 C ATOM 705 O SER A 51 -14.471 20.786 19.545 1.00 0.00 O ATOM 706 CB SER A 51 -15.489 21.103 16.397 1.00 0.00 C ATOM 707 OG SER A 51 -15.022 22.410 16.710 1.00 0.00 O ATOM 0 H SER A 51 -16.373 19.521 18.540 1.00 0.00 H new ATOM 0 HA SER A 51 -13.986 19.537 16.706 1.00 0.00 H new ATOM 0 HB2 SER A 51 -15.325 20.889 15.341 1.00 0.00 H new ATOM 0 HB3 SER A 51 -16.563 21.037 16.573 1.00 0.00 H new ATOM 0 HG SER A 51 -15.493 23.067 16.156 1.00 0.00 H new ATOM 713 N ASP A 52 -12.901 21.383 18.115 1.00 0.00 N ATOM 714 CA ASP A 52 -12.109 22.111 19.154 1.00 0.00 C ATOM 715 C ASP A 52 -11.991 21.297 20.443 1.00 0.00 C ATOM 716 O ASP A 52 -12.492 21.685 21.479 1.00 0.00 O ATOM 717 CB ASP A 52 -12.870 23.413 19.401 1.00 0.00 C ATOM 718 CG ASP A 52 -12.130 24.572 18.731 1.00 0.00 C ATOM 719 OD1 ASP A 52 -11.028 24.873 19.160 1.00 0.00 O ATOM 720 OD2 ASP A 52 -12.677 25.139 17.799 1.00 0.00 O ATOM 0 H ASP A 52 -12.493 21.401 17.180 1.00 0.00 H new ATOM 0 HA ASP A 52 -11.087 22.291 18.821 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.882 23.336 19.004 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -12.961 23.596 20.472 1.00 0.00 H new ATOM 725 N PRO A 53 -11.303 20.201 20.327 1.00 0.00 N ATOM 726 CA PRO A 53 -11.065 19.308 21.473 1.00 0.00 C ATOM 727 C PRO A 53 -9.758 19.698 22.169 1.00 0.00 C ATOM 728 O PRO A 53 -8.742 19.863 21.524 1.00 0.00 O ATOM 729 CB PRO A 53 -10.931 17.941 20.816 1.00 0.00 C ATOM 730 CG PRO A 53 -10.482 18.212 19.402 1.00 0.00 C ATOM 731 CD PRO A 53 -10.690 19.684 19.112 1.00 0.00 C ATOM 0 HA PRO A 53 -11.848 19.345 22.231 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.207 17.321 21.345 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.880 17.405 20.830 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -9.432 17.945 19.279 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -11.050 17.602 18.700 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.746 20.185 18.897 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.335 19.833 18.246 1.00 0.00 H new ATOM 739 N PRO A 54 -9.824 19.834 23.463 1.00 0.00 N ATOM 740 CA PRO A 54 -8.624 20.209 24.243 1.00 0.00 C ATOM 741 C PRO A 54 -7.706 18.994 24.418 1.00 0.00 C ATOM 742 O PRO A 54 -8.127 17.862 24.289 1.00 0.00 O ATOM 743 CB PRO A 54 -9.196 20.672 25.577 1.00 0.00 C ATOM 744 CG PRO A 54 -10.520 19.979 25.704 1.00 0.00 C ATOM 745 CD PRO A 54 -11.006 19.654 24.311 1.00 0.00 C ATOM 0 HA PRO A 54 -8.016 20.977 23.764 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -8.534 20.408 26.401 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -9.316 21.755 25.599 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -10.420 19.069 26.296 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.237 20.617 26.220 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.387 18.635 24.251 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -11.817 20.316 24.008 1.00 0.00 H new ATOM 753 N THR A 55 -6.452 19.222 24.696 1.00 0.00 N ATOM 754 CA THR A 55 -5.503 18.082 24.862 1.00 0.00 C ATOM 755 C THR A 55 -5.275 17.765 26.336 1.00 0.00 C ATOM 756 O THR A 55 -5.548 18.563 27.208 1.00 0.00 O ATOM 757 CB THR A 55 -4.190 18.568 24.251 1.00 0.00 C ATOM 758 OG1 THR A 55 -3.837 19.803 24.841 1.00 0.00 O ATOM 759 CG2 THR A 55 -4.355 18.755 22.745 1.00 0.00 C ATOM 0 H THR A 55 -6.042 20.148 24.816 1.00 0.00 H new ATOM 0 HA THR A 55 -5.889 17.178 24.391 1.00 0.00 H new ATOM 0 HB THR A 55 -3.409 17.830 24.435 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.011 20.137 24.432 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.415 19.102 22.316 1.00 0.00 H new ATOM 0 HG22 THR A 55 -4.633 17.805 22.289 1.00 0.00 H new ATOM 0 HG23 THR A 55 -5.135 19.492 22.553 1.00 0.00 H new ATOM 767 N CYS A 56 -4.733 16.614 26.606 1.00 0.00 N ATOM 768 CA CYS A 56 -4.427 16.235 28.010 1.00 0.00 C ATOM 769 C CYS A 56 -2.982 15.773 28.062 1.00 0.00 C ATOM 770 O CYS A 56 -2.684 14.598 28.133 1.00 0.00 O ATOM 771 CB CYS A 56 -5.392 15.100 28.357 1.00 0.00 C ATOM 772 SG CYS A 56 -6.991 15.797 28.836 1.00 0.00 S ATOM 0 H CYS A 56 -4.486 15.913 25.907 1.00 0.00 H new ATOM 0 HA CYS A 56 -4.546 17.055 28.718 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -5.514 14.437 27.501 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -4.986 14.499 29.171 1.00 0.00 H new ATOM 777 N GLN A 57 -2.082 16.706 27.987 1.00 0.00 N ATOM 778 CA GLN A 57 -0.641 16.353 27.985 1.00 0.00 C ATOM 779 C GLN A 57 0.023 16.790 29.286 1.00 0.00 C ATOM 780 O GLN A 57 -0.617 17.279 30.192 1.00 0.00 O ATOM 781 CB GLN A 57 -0.014 17.105 26.797 1.00 0.00 C ATOM 782 CG GLN A 57 -1.070 17.852 25.967 1.00 0.00 C ATOM 783 CD GLN A 57 -0.529 18.090 24.558 1.00 0.00 C ATOM 784 OE1 GLN A 57 -0.302 19.217 24.163 1.00 0.00 O ATOM 785 NE2 GLN A 57 -0.312 17.067 23.777 1.00 0.00 N ATOM 0 H GLN A 57 -2.283 17.704 27.927 1.00 0.00 H new ATOM 0 HA GLN A 57 -0.504 15.275 27.897 1.00 0.00 H new ATOM 0 HB2 GLN A 57 0.725 17.815 27.167 1.00 0.00 H new ATOM 0 HB3 GLN A 57 0.515 16.398 26.159 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -1.991 17.271 25.922 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -1.315 18.803 26.440 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -0.503 16.122 24.110 1.00 0.00 H new ATOM 0 HE22 GLN A 57 0.048 17.213 22.834 1.00 0.00 H new ATOM 794 N ILE A 58 1.310 16.622 29.378 1.00 0.00 N ATOM 795 CA ILE A 58 2.025 17.033 30.615 1.00 0.00 C ATOM 796 C ILE A 58 2.608 18.428 30.405 1.00 0.00 C ATOM 797 O ILE A 58 3.267 18.692 29.419 1.00 0.00 O ATOM 798 CB ILE A 58 3.148 16.006 30.845 1.00 0.00 C ATOM 799 CG1 ILE A 58 2.904 14.716 30.042 1.00 0.00 C ATOM 800 CG2 ILE A 58 3.188 15.653 32.328 1.00 0.00 C ATOM 801 CD1 ILE A 58 3.629 14.802 28.697 1.00 0.00 C ATOM 0 H ILE A 58 1.898 16.218 28.650 1.00 0.00 H new ATOM 0 HA ILE A 58 1.361 17.064 31.479 1.00 0.00 H new ATOM 0 HB ILE A 58 4.090 16.446 30.516 1.00 0.00 H new ATOM 0 HG12 ILE A 58 3.261 13.853 30.604 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.835 14.572 29.882 1.00 0.00 H new ATOM 0 HG21 ILE A 58 3.979 14.925 32.508 1.00 0.00 H new ATOM 0 HG22 ILE A 58 3.383 16.553 32.911 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.230 15.228 32.627 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.455 13.887 28.130 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.251 15.655 28.134 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.699 14.925 28.867 1.00 0.00 H new ATOM 813 N VAL A 59 2.355 19.333 31.306 1.00 0.00 N ATOM 814 CA VAL A 59 2.884 20.712 31.123 1.00 0.00 C ATOM 815 C VAL A 59 3.823 21.089 32.240 1.00 0.00 C ATOM 816 O VAL A 59 3.799 22.197 32.728 1.00 0.00 O ATOM 817 CB VAL A 59 1.669 21.615 31.183 1.00 0.00 C ATOM 818 CG1 VAL A 59 0.672 21.233 30.086 1.00 0.00 C ATOM 819 CG2 VAL A 59 1.026 21.458 32.555 1.00 0.00 C ATOM 0 H VAL A 59 1.810 19.181 32.154 1.00 0.00 H new ATOM 0 HA VAL A 59 3.437 20.795 30.188 1.00 0.00 H new ATOM 0 HB VAL A 59 1.966 22.652 31.025 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.197 21.889 30.139 1.00 0.00 H new ATOM 0 HG12 VAL A 59 1.147 21.338 29.110 1.00 0.00 H new ATOM 0 HG13 VAL A 59 0.355 20.199 30.226 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.148 22.100 32.621 1.00 0.00 H new ATOM 0 HG22 VAL A 59 0.728 20.420 32.701 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.742 21.742 33.327 1.00 0.00 H new ATOM 829 N LYS A 60 4.656 20.200 32.641 1.00 0.00 N ATOM 830 CA LYS A 60 5.594 20.555 33.735 1.00 0.00 C ATOM 831 C LYS A 60 6.314 21.838 33.349 1.00 0.00 C ATOM 832 O LYS A 60 6.058 22.397 32.308 1.00 0.00 O ATOM 833 CB LYS A 60 6.565 19.380 33.855 1.00 0.00 C ATOM 834 CG LYS A 60 5.909 18.257 34.660 1.00 0.00 C ATOM 835 CD LYS A 60 6.124 16.923 33.942 1.00 0.00 C ATOM 836 CE LYS A 60 6.769 15.922 34.903 1.00 0.00 C ATOM 837 NZ LYS A 60 8.218 16.266 34.901 1.00 0.00 N ATOM 0 H LYS A 60 4.737 19.252 32.272 1.00 0.00 H new ATOM 0 HA LYS A 60 5.096 20.727 34.689 1.00 0.00 H new ATOM 0 HB2 LYS A 60 6.840 19.019 32.864 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.485 19.703 34.343 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.336 18.216 35.662 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.843 18.453 34.775 1.00 0.00 H new ATOM 0 HD2 LYS A 60 5.171 16.535 33.582 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.761 17.067 33.069 1.00 0.00 H new ATOM 0 HE2 LYS A 60 6.345 16.006 35.904 1.00 0.00 H new ATOM 0 HE3 LYS A 60 6.606 14.896 34.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 8.729 15.622 35.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 8.596 16.171 33.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 8.343 17.246 35.227 1.00 0.00 H new ATOM 851 N CYS A 61 7.181 22.341 34.174 1.00 0.00 N ATOM 852 CA CYS A 61 7.847 23.623 33.804 1.00 0.00 C ATOM 853 C CYS A 61 9.324 23.683 34.197 1.00 0.00 C ATOM 854 O CYS A 61 9.827 22.848 34.921 1.00 0.00 O ATOM 855 CB CYS A 61 7.067 24.678 34.565 1.00 0.00 C ATOM 856 SG CYS A 61 5.936 25.502 33.429 1.00 0.00 S ATOM 0 H CYS A 61 7.456 21.936 35.069 1.00 0.00 H new ATOM 0 HA CYS A 61 7.842 23.757 32.722 1.00 0.00 H new ATOM 0 HB2 CYS A 61 6.512 24.219 35.383 1.00 0.00 H new ATOM 0 HB3 CYS A 61 7.749 25.403 35.010 1.00 0.00 H new ATOM 861 N PRO A 62 9.956 24.711 33.684 1.00 0.00 N ATOM 862 CA PRO A 62 11.386 24.967 33.939 1.00 0.00 C ATOM 863 C PRO A 62 11.565 25.851 35.176 1.00 0.00 C ATOM 864 O PRO A 62 11.948 25.395 36.235 1.00 0.00 O ATOM 865 CB PRO A 62 11.823 25.727 32.690 1.00 0.00 C ATOM 866 CG PRO A 62 10.581 26.371 32.141 1.00 0.00 C ATOM 867 CD PRO A 62 9.384 25.731 32.804 1.00 0.00 C ATOM 0 HA PRO A 62 11.957 24.057 34.124 1.00 0.00 H new ATOM 0 HB2 PRO A 62 12.576 26.476 32.933 1.00 0.00 H new ATOM 0 HB3 PRO A 62 12.269 25.053 31.959 1.00 0.00 H new ATOM 0 HG2 PRO A 62 10.593 27.444 32.333 1.00 0.00 H new ATOM 0 HG3 PRO A 62 10.531 26.241 31.060 1.00 0.00 H new ATOM 0 HD2 PRO A 62 8.804 26.462 33.368 1.00 0.00 H new ATOM 0 HD3 PRO A 62 8.712 25.289 32.069 1.00 0.00 H new ATOM 875 N HIS A 63 11.304 27.121 35.031 1.00 0.00 N ATOM 876 CA HIS A 63 11.466 28.067 36.169 1.00 0.00 C ATOM 877 C HIS A 63 11.330 29.500 35.662 1.00 0.00 C ATOM 878 O HIS A 63 12.024 29.898 34.748 1.00 0.00 O ATOM 879 CB HIS A 63 12.884 27.836 36.663 1.00 0.00 C ATOM 880 CG HIS A 63 12.863 27.348 38.084 1.00 0.00 C ATOM 881 ND1 HIS A 63 13.935 26.678 38.647 1.00 0.00 N ATOM 882 CD2 HIS A 63 11.915 27.438 39.071 1.00 0.00 C ATOM 883 CE1 HIS A 63 13.612 26.393 39.921 1.00 0.00 C ATOM 884 NE2 HIS A 63 12.389 26.834 40.232 1.00 0.00 N ATOM 0 H HIS A 63 10.982 27.547 34.162 1.00 0.00 H new ATOM 0 HA HIS A 63 10.721 27.914 36.950 1.00 0.00 H new ATOM 0 HB2 HIS A 63 13.384 27.106 36.027 1.00 0.00 H new ATOM 0 HB3 HIS A 63 13.456 28.762 36.597 1.00 0.00 H new ATOM 0 HD2 HIS A 63 10.948 27.906 38.964 1.00 0.00 H new ATOM 0 HE1 HIS A 63 14.261 25.872 40.609 1.00 0.00 H new ATOM 0 HE2 HIS A 63 11.907 26.747 41.127 1.00 0.00 H new ATOM 892 N PRO A 64 10.439 30.230 36.262 1.00 0.00 N ATOM 893 CA PRO A 64 10.222 31.627 35.844 1.00 0.00 C ATOM 894 C PRO A 64 11.326 32.523 36.406 1.00 0.00 C ATOM 895 O PRO A 64 11.086 33.389 37.224 1.00 0.00 O ATOM 896 CB PRO A 64 8.875 31.974 36.455 1.00 0.00 C ATOM 897 CG PRO A 64 8.730 31.065 37.636 1.00 0.00 C ATOM 898 CD PRO A 64 9.559 29.834 37.367 1.00 0.00 C ATOM 0 HA PRO A 64 10.240 31.764 34.763 1.00 0.00 H new ATOM 0 HB2 PRO A 64 8.838 33.021 36.758 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.067 31.821 35.739 1.00 0.00 H new ATOM 0 HG2 PRO A 64 9.066 31.562 38.546 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.684 30.797 37.787 1.00 0.00 H new ATOM 0 HD2 PRO A 64 10.131 29.539 38.246 1.00 0.00 H new ATOM 0 HD3 PRO A 64 8.934 28.984 37.094 1.00 0.00 H new ATOM 906 N THR A 65 12.535 32.323 35.965 1.00 0.00 N ATOM 907 CA THR A 65 13.660 33.165 36.459 1.00 0.00 C ATOM 908 C THR A 65 13.718 34.466 35.658 1.00 0.00 C ATOM 909 O THR A 65 12.912 34.697 34.780 1.00 0.00 O ATOM 910 CB THR A 65 14.921 32.333 36.224 1.00 0.00 C ATOM 911 OG1 THR A 65 14.621 31.250 35.354 1.00 0.00 O ATOM 912 CG2 THR A 65 15.427 31.792 37.560 1.00 0.00 C ATOM 0 H THR A 65 12.794 31.611 35.282 1.00 0.00 H new ATOM 0 HA THR A 65 13.548 33.434 37.509 1.00 0.00 H new ATOM 0 HB THR A 65 15.690 32.957 35.770 1.00 0.00 H new ATOM 0 HG1 THR A 65 15.430 30.718 35.203 1.00 0.00 H new ATOM 0 HG21 THR A 65 16.326 31.198 37.395 1.00 0.00 H new ATOM 0 HG22 THR A 65 15.658 32.624 38.225 1.00 0.00 H new ATOM 0 HG23 THR A 65 14.658 31.167 38.014 1.00 0.00 H new ATOM 920 N ILE A 66 14.660 35.319 35.947 1.00 0.00 N ATOM 921 CA ILE A 66 14.747 36.599 35.185 1.00 0.00 C ATOM 922 C ILE A 66 15.930 37.444 35.680 1.00 0.00 C ATOM 923 O ILE A 66 16.544 37.150 36.686 1.00 0.00 O ATOM 924 CB ILE A 66 13.397 37.320 35.414 1.00 0.00 C ATOM 925 CG1 ILE A 66 13.601 38.840 35.430 1.00 0.00 C ATOM 926 CG2 ILE A 66 12.762 36.884 36.736 1.00 0.00 C ATOM 927 CD1 ILE A 66 12.262 39.525 35.686 1.00 0.00 C ATOM 0 H ILE A 66 15.368 35.189 36.670 1.00 0.00 H new ATOM 0 HA ILE A 66 14.921 36.428 34.123 1.00 0.00 H new ATOM 0 HB ILE A 66 12.731 37.049 34.595 1.00 0.00 H new ATOM 0 HG12 ILE A 66 14.317 39.114 36.205 1.00 0.00 H new ATOM 0 HG13 ILE A 66 14.017 39.173 34.479 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.814 37.405 36.874 1.00 0.00 H new ATOM 0 HG22 ILE A 66 12.586 35.809 36.718 1.00 0.00 H new ATOM 0 HG23 ILE A 66 13.433 37.128 37.560 1.00 0.00 H new ATOM 0 HD11 ILE A 66 12.403 40.606 35.698 1.00 0.00 H new ATOM 0 HD12 ILE A 66 11.560 39.259 34.895 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.865 39.200 36.648 1.00 0.00 H new ATOM 939 N SER A 67 16.251 38.489 34.963 1.00 0.00 N ATOM 940 CA SER A 67 17.391 39.361 35.364 1.00 0.00 C ATOM 941 C SER A 67 17.020 40.232 36.569 1.00 0.00 C ATOM 942 O SER A 67 16.291 41.198 36.451 1.00 0.00 O ATOM 943 CB SER A 67 17.669 40.232 34.138 1.00 0.00 C ATOM 944 OG SER A 67 19.064 40.231 33.868 1.00 0.00 O ATOM 0 H SER A 67 15.768 38.776 34.112 1.00 0.00 H new ATOM 0 HA SER A 67 18.262 38.778 35.664 1.00 0.00 H new ATOM 0 HB2 SER A 67 17.120 39.853 33.276 1.00 0.00 H new ATOM 0 HB3 SER A 67 17.322 41.250 34.315 1.00 0.00 H new ATOM 0 HG SER A 67 19.245 40.787 33.082 1.00 0.00 H new ATOM 950 N ASN A 68 17.533 39.899 37.723 1.00 0.00 N ATOM 951 CA ASN A 68 17.239 40.701 38.947 1.00 0.00 C ATOM 952 C ASN A 68 15.782 41.173 38.961 1.00 0.00 C ATOM 953 O ASN A 68 15.484 42.272 39.377 1.00 0.00 O ATOM 954 CB ASN A 68 18.188 41.899 38.868 1.00 0.00 C ATOM 955 CG ASN A 68 19.631 41.421 39.038 1.00 0.00 C ATOM 956 OD1 ASN A 68 20.402 41.432 38.099 1.00 0.00 O ATOM 957 ND2 ASN A 68 20.032 41.000 40.206 1.00 0.00 N ATOM 0 H ASN A 68 18.148 39.099 37.872 1.00 0.00 H new ATOM 0 HA ASN A 68 17.381 40.117 39.857 1.00 0.00 H new ATOM 0 HB2 ASN A 68 18.072 42.405 37.910 1.00 0.00 H new ATOM 0 HB3 ASN A 68 17.940 42.624 39.643 1.00 0.00 H new ATOM 0 HD21 ASN A 68 20.993 40.680 40.331 1.00 0.00 H new ATOM 0 HD22 ASN A 68 19.385 40.991 40.994 1.00 0.00 H new ATOM 964 N GLY A 69 14.871 40.355 38.522 1.00 0.00 N ATOM 965 CA GLY A 69 13.441 40.771 38.528 1.00 0.00 C ATOM 966 C GLY A 69 12.569 39.558 38.840 1.00 0.00 C ATOM 967 O GLY A 69 11.434 39.469 38.419 1.00 0.00 O ATOM 0 H GLY A 69 15.052 39.419 38.160 1.00 0.00 H new ATOM 0 HA2 GLY A 69 13.280 41.551 39.272 1.00 0.00 H new ATOM 0 HA3 GLY A 69 13.168 41.192 37.560 1.00 0.00 H new ATOM 971 N TYR A 70 13.115 38.616 39.561 1.00 0.00 N ATOM 972 CA TYR A 70 12.359 37.377 39.915 1.00 0.00 C ATOM 973 C TYR A 70 10.938 37.669 40.347 1.00 0.00 C ATOM 974 O TYR A 70 10.470 38.784 40.340 1.00 0.00 O ATOM 975 CB TYR A 70 13.106 36.754 41.091 1.00 0.00 C ATOM 976 CG TYR A 70 12.917 37.611 42.329 1.00 0.00 C ATOM 977 CD1 TYR A 70 13.537 38.865 42.422 1.00 0.00 C ATOM 978 CD2 TYR A 70 12.116 37.151 43.383 1.00 0.00 C ATOM 979 CE1 TYR A 70 13.357 39.654 43.564 1.00 0.00 C ATOM 980 CE2 TYR A 70 11.937 37.943 44.525 1.00 0.00 C ATOM 981 CZ TYR A 70 12.557 39.193 44.615 1.00 0.00 C ATOM 982 OH TYR A 70 12.380 39.974 45.740 1.00 0.00 O ATOM 0 H TYR A 70 14.067 38.652 39.926 1.00 0.00 H new ATOM 0 HA TYR A 70 12.299 36.724 39.044 1.00 0.00 H new ATOM 0 HB2 TYR A 70 12.737 35.745 41.275 1.00 0.00 H new ATOM 0 HB3 TYR A 70 14.167 36.667 40.856 1.00 0.00 H new ATOM 0 HD1 TYR A 70 14.154 39.223 41.611 1.00 0.00 H new ATOM 0 HD2 TYR A 70 11.636 36.186 43.315 1.00 0.00 H new ATOM 0 HE1 TYR A 70 13.836 40.619 43.634 1.00 0.00 H new ATOM 0 HE2 TYR A 70 11.319 37.588 45.337 1.00 0.00 H new ATOM 0 HH TYR A 70 11.796 39.507 46.374 1.00 0.00 H new ATOM 992 N LEU A 71 10.266 36.643 40.750 1.00 0.00 N ATOM 993 CA LEU A 71 8.862 36.804 41.217 1.00 0.00 C ATOM 994 C LEU A 71 8.758 36.519 42.717 1.00 0.00 C ATOM 995 O LEU A 71 9.591 35.859 43.300 1.00 0.00 O ATOM 996 CB LEU A 71 8.007 35.825 40.381 1.00 0.00 C ATOM 997 CG LEU A 71 8.623 34.416 40.298 1.00 0.00 C ATOM 998 CD1 LEU A 71 9.693 34.389 39.213 1.00 0.00 C ATOM 999 CD2 LEU A 71 9.234 33.991 41.639 1.00 0.00 C ATOM 0 H LEU A 71 10.625 35.689 40.779 1.00 0.00 H new ATOM 0 HA LEU A 71 8.507 37.825 41.079 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.011 35.756 40.818 1.00 0.00 H new ATOM 0 HB3 LEU A 71 7.887 36.224 39.374 1.00 0.00 H new ATOM 0 HG LEU A 71 7.828 33.712 40.052 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.128 33.391 39.156 1.00 0.00 H new ATOM 0 HD12 LEU A 71 9.244 34.645 38.253 1.00 0.00 H new ATOM 0 HD13 LEU A 71 10.473 35.111 39.453 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.660 32.992 41.545 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.018 34.694 41.921 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.459 33.984 42.406 1.00 0.00 H new ATOM 1011 N SER A 72 7.747 37.032 43.353 1.00 0.00 N ATOM 1012 CA SER A 72 7.603 36.798 44.814 1.00 0.00 C ATOM 1013 C SER A 72 6.135 36.520 45.153 1.00 0.00 C ATOM 1014 O SER A 72 5.694 36.720 46.267 1.00 0.00 O ATOM 1015 CB SER A 72 8.069 38.097 45.471 1.00 0.00 C ATOM 1016 OG SER A 72 7.947 37.979 46.882 1.00 0.00 O ATOM 0 H SER A 72 7.016 37.602 42.927 1.00 0.00 H new ATOM 0 HA SER A 72 8.181 35.940 45.158 1.00 0.00 H new ATOM 0 HB2 SER A 72 9.104 38.304 45.200 1.00 0.00 H new ATOM 0 HB3 SER A 72 7.471 38.935 45.111 1.00 0.00 H new ATOM 0 HG SER A 72 7.171 37.421 47.098 1.00 0.00 H new ATOM 1022 N SER A 73 5.373 36.074 44.189 1.00 0.00 N ATOM 1023 CA SER A 73 3.929 35.798 44.440 1.00 0.00 C ATOM 1024 C SER A 73 3.682 34.299 44.636 1.00 0.00 C ATOM 1025 O SER A 73 3.528 33.826 45.744 1.00 0.00 O ATOM 1026 CB SER A 73 3.214 36.294 43.185 1.00 0.00 C ATOM 1027 OG SER A 73 2.070 35.486 42.945 1.00 0.00 O ATOM 0 H SER A 73 5.690 35.889 43.237 1.00 0.00 H new ATOM 0 HA SER A 73 3.573 36.290 45.345 1.00 0.00 H new ATOM 0 HB2 SER A 73 2.918 37.336 43.309 1.00 0.00 H new ATOM 0 HB3 SER A 73 3.888 36.254 42.329 1.00 0.00 H new ATOM 0 HG SER A 73 1.608 35.803 42.141 1.00 0.00 H new ATOM 1033 N GLY A 74 3.628 33.553 43.567 1.00 0.00 N ATOM 1034 CA GLY A 74 3.375 32.089 43.692 1.00 0.00 C ATOM 1035 C GLY A 74 4.394 31.306 42.866 1.00 0.00 C ATOM 1036 O GLY A 74 4.103 30.834 41.785 1.00 0.00 O ATOM 0 H GLY A 74 3.748 33.893 42.613 1.00 0.00 H new ATOM 0 HA2 GLY A 74 3.437 31.790 44.738 1.00 0.00 H new ATOM 0 HA3 GLY A 74 2.365 31.857 43.353 1.00 0.00 H new ATOM 1040 N PHE A 75 5.583 31.157 43.373 1.00 0.00 N ATOM 1041 CA PHE A 75 6.625 30.395 42.627 1.00 0.00 C ATOM 1042 C PHE A 75 6.770 28.993 43.231 1.00 0.00 C ATOM 1043 O PHE A 75 6.232 28.701 44.281 1.00 0.00 O ATOM 1044 CB PHE A 75 7.910 31.214 42.800 1.00 0.00 C ATOM 1045 CG PHE A 75 9.125 30.317 42.691 1.00 0.00 C ATOM 1046 CD1 PHE A 75 9.481 29.494 43.765 1.00 0.00 C ATOM 1047 CD2 PHE A 75 9.891 30.308 41.519 1.00 0.00 C ATOM 1048 CE1 PHE A 75 10.602 28.660 43.669 1.00 0.00 C ATOM 1049 CE2 PHE A 75 11.012 29.474 41.422 1.00 0.00 C ATOM 1050 CZ PHE A 75 11.367 28.650 42.497 1.00 0.00 C ATOM 0 H PHE A 75 5.881 31.530 44.274 1.00 0.00 H new ATOM 0 HA PHE A 75 6.381 30.258 41.574 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.957 31.994 42.040 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.904 31.713 43.769 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.891 29.502 44.669 1.00 0.00 H new ATOM 0 HD2 PHE A 75 9.618 30.944 40.690 1.00 0.00 H new ATOM 0 HE1 PHE A 75 10.876 28.025 44.499 1.00 0.00 H new ATOM 0 HE2 PHE A 75 11.603 29.466 40.518 1.00 0.00 H new ATOM 0 HZ PHE A 75 12.231 28.007 42.422 1.00 0.00 H new ATOM 1060 N LYS A 76 7.493 28.127 42.576 1.00 0.00 N ATOM 1061 CA LYS A 76 7.669 26.748 43.115 1.00 0.00 C ATOM 1062 C LYS A 76 8.752 26.007 42.329 1.00 0.00 C ATOM 1063 O LYS A 76 9.074 26.359 41.212 1.00 0.00 O ATOM 1064 CB LYS A 76 6.311 26.074 42.922 1.00 0.00 C ATOM 1065 CG LYS A 76 6.177 24.905 43.899 1.00 0.00 C ATOM 1066 CD LYS A 76 5.626 23.684 43.159 1.00 0.00 C ATOM 1067 CE LYS A 76 5.044 22.693 44.169 1.00 0.00 C ATOM 1068 NZ LYS A 76 6.220 21.951 44.701 1.00 0.00 N ATOM 0 H LYS A 76 7.969 28.313 41.693 1.00 0.00 H new ATOM 0 HA LYS A 76 7.980 26.749 44.160 1.00 0.00 H new ATOM 0 HB2 LYS A 76 5.509 26.794 43.088 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.213 25.718 41.897 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.147 24.671 44.338 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.513 25.177 44.720 1.00 0.00 H new ATOM 0 HD2 LYS A 76 4.857 23.992 42.451 1.00 0.00 H new ATOM 0 HD3 LYS A 76 6.418 23.208 42.582 1.00 0.00 H new ATOM 0 HE2 LYS A 76 4.510 23.210 44.966 1.00 0.00 H new ATOM 0 HE3 LYS A 76 4.333 22.017 43.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.901 21.251 45.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.705 21.464 43.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.876 22.619 45.153 1.00 0.00 H new ATOM 1082 N ARG A 77 9.316 24.983 42.907 1.00 0.00 N ATOM 1083 CA ARG A 77 10.377 24.217 42.195 1.00 0.00 C ATOM 1084 C ARG A 77 9.939 23.922 40.762 1.00 0.00 C ATOM 1085 O ARG A 77 10.719 23.991 39.834 1.00 0.00 O ATOM 1086 CB ARG A 77 10.523 22.917 42.985 1.00 0.00 C ATOM 1087 CG ARG A 77 11.954 22.795 43.508 1.00 0.00 C ATOM 1088 CD ARG A 77 12.250 21.330 43.836 1.00 0.00 C ATOM 1089 NE ARG A 77 13.679 21.310 44.252 1.00 0.00 N ATOM 1090 CZ ARG A 77 14.535 20.567 43.605 1.00 0.00 C ATOM 1091 NH1 ARG A 77 14.710 19.321 43.952 1.00 0.00 N ATOM 1092 NH2 ARG A 77 15.213 21.071 42.610 1.00 0.00 N ATOM 0 H ARG A 77 9.088 24.643 43.841 1.00 0.00 H new ATOM 0 HA ARG A 77 11.316 24.767 42.136 1.00 0.00 H new ATOM 0 HB2 ARG A 77 9.818 22.903 43.817 1.00 0.00 H new ATOM 0 HB3 ARG A 77 10.283 22.064 42.350 1.00 0.00 H new ATOM 0 HG2 ARG A 77 12.659 23.162 42.762 1.00 0.00 H new ATOM 0 HG3 ARG A 77 12.082 23.412 44.398 1.00 0.00 H new ATOM 0 HD2 ARG A 77 11.602 20.965 44.633 1.00 0.00 H new ATOM 0 HD3 ARG A 77 12.082 20.690 42.970 1.00 0.00 H new ATOM 0 HE ARG A 77 13.989 21.876 45.042 1.00 0.00 H new ATOM 0 HH11 ARG A 77 14.178 18.928 44.729 1.00 0.00 H new ATOM 0 HH12 ARG A 77 15.379 18.740 43.447 1.00 0.00 H new ATOM 0 HH21 ARG A 77 15.074 22.044 42.339 1.00 0.00 H new ATOM 0 HH22 ARG A 77 15.882 20.491 42.104 1.00 0.00 H new ATOM 1106 N SER A 78 8.695 23.591 40.580 1.00 0.00 N ATOM 1107 CA SER A 78 8.194 23.287 39.211 1.00 0.00 C ATOM 1108 C SER A 78 6.779 23.842 39.035 1.00 0.00 C ATOM 1109 O SER A 78 6.166 24.312 39.973 1.00 0.00 O ATOM 1110 CB SER A 78 8.190 21.762 39.124 1.00 0.00 C ATOM 1111 OG SER A 78 7.065 21.337 38.368 1.00 0.00 O ATOM 0 H SER A 78 7.999 23.517 41.322 1.00 0.00 H new ATOM 0 HA SER A 78 8.810 23.737 38.432 1.00 0.00 H new ATOM 0 HB2 SER A 78 9.110 21.411 38.657 1.00 0.00 H new ATOM 0 HB3 SER A 78 8.155 21.329 40.124 1.00 0.00 H new ATOM 0 HG SER A 78 7.061 20.359 38.309 1.00 0.00 H new ATOM 1117 N TYR A 79 6.258 23.793 37.841 1.00 0.00 N ATOM 1118 CA TYR A 79 4.883 24.322 37.604 1.00 0.00 C ATOM 1119 C TYR A 79 4.140 23.421 36.612 1.00 0.00 C ATOM 1120 O TYR A 79 4.458 22.258 36.463 1.00 0.00 O ATOM 1121 CB TYR A 79 5.092 25.715 37.011 1.00 0.00 C ATOM 1122 CG TYR A 79 6.166 26.444 37.787 1.00 0.00 C ATOM 1123 CD1 TYR A 79 7.517 26.153 37.558 1.00 0.00 C ATOM 1124 CD2 TYR A 79 5.810 27.411 38.736 1.00 0.00 C ATOM 1125 CE1 TYR A 79 8.509 26.827 38.277 1.00 0.00 C ATOM 1126 CE2 TYR A 79 6.804 28.085 39.454 1.00 0.00 C ATOM 1127 CZ TYR A 79 8.153 27.793 39.224 1.00 0.00 C ATOM 1128 OH TYR A 79 9.133 28.455 39.931 1.00 0.00 O ATOM 0 H TYR A 79 6.723 23.410 37.018 1.00 0.00 H new ATOM 0 HA TYR A 79 4.287 24.354 38.516 1.00 0.00 H new ATOM 0 HB2 TYR A 79 5.379 25.635 35.962 1.00 0.00 H new ATOM 0 HB3 TYR A 79 4.160 26.279 37.045 1.00 0.00 H new ATOM 0 HD1 TYR A 79 7.792 25.408 36.826 1.00 0.00 H new ATOM 0 HD2 TYR A 79 4.769 27.636 38.913 1.00 0.00 H new ATOM 0 HE1 TYR A 79 9.550 26.602 38.101 1.00 0.00 H new ATOM 0 HE2 TYR A 79 6.530 28.831 40.186 1.00 0.00 H new ATOM 0 HH TYR A 79 8.790 29.323 40.231 1.00 0.00 H new ATOM 1138 N SER A 80 3.153 23.941 35.930 1.00 0.00 N ATOM 1139 CA SER A 80 2.409 23.092 34.956 1.00 0.00 C ATOM 1140 C SER A 80 1.848 23.945 33.796 1.00 0.00 C ATOM 1141 O SER A 80 2.593 24.445 32.976 1.00 0.00 O ATOM 1142 CB SER A 80 1.292 22.448 35.771 1.00 0.00 C ATOM 1143 OG SER A 80 1.817 21.339 36.488 1.00 0.00 O ATOM 0 H SER A 80 2.833 24.907 36.004 1.00 0.00 H new ATOM 0 HA SER A 80 3.048 22.343 34.488 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.865 23.174 36.463 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.486 22.123 35.113 1.00 0.00 H new ATOM 0 HG SER A 80 2.796 21.386 36.492 1.00 0.00 H new ATOM 1149 N TYR A 81 0.545 24.106 33.706 1.00 0.00 N ATOM 1150 CA TYR A 81 -0.041 24.910 32.585 1.00 0.00 C ATOM 1151 C TYR A 81 -0.628 26.236 33.119 1.00 0.00 C ATOM 1152 O TYR A 81 -1.411 26.891 32.460 1.00 0.00 O ATOM 1153 CB TYR A 81 -1.117 23.982 31.980 1.00 0.00 C ATOM 1154 CG TYR A 81 -2.445 24.689 31.819 1.00 0.00 C ATOM 1155 CD1 TYR A 81 -3.220 24.990 32.944 1.00 0.00 C ATOM 1156 CD2 TYR A 81 -2.897 25.040 30.543 1.00 0.00 C ATOM 1157 CE1 TYR A 81 -4.449 25.643 32.793 1.00 0.00 C ATOM 1158 CE2 TYR A 81 -4.126 25.693 30.390 1.00 0.00 C ATOM 1159 CZ TYR A 81 -4.902 25.995 31.515 1.00 0.00 C ATOM 1160 OH TYR A 81 -6.114 26.638 31.365 1.00 0.00 O ATOM 0 H TYR A 81 -0.134 23.716 34.359 1.00 0.00 H new ATOM 0 HA TYR A 81 0.692 25.208 31.835 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -0.779 23.619 31.010 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -1.245 23.109 32.620 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -2.870 24.719 33.929 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -2.298 24.807 29.675 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -5.048 25.875 33.661 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -4.475 25.964 29.404 1.00 0.00 H new ATOM 0 HH TYR A 81 -6.277 26.811 30.414 1.00 0.00 H new ATOM 1170 N ASN A 82 -0.235 26.648 34.295 1.00 0.00 N ATOM 1171 CA ASN A 82 -0.759 27.933 34.847 1.00 0.00 C ATOM 1172 C ASN A 82 0.193 28.482 35.915 1.00 0.00 C ATOM 1173 O ASN A 82 1.309 28.859 35.619 1.00 0.00 O ATOM 1174 CB ASN A 82 -2.126 27.590 35.443 1.00 0.00 C ATOM 1175 CG ASN A 82 -2.007 26.356 36.343 1.00 0.00 C ATOM 1176 OD1 ASN A 82 -0.962 25.742 36.421 1.00 0.00 O ATOM 1177 ND2 ASN A 82 -3.043 25.969 37.036 1.00 0.00 N ATOM 0 H ASN A 82 0.424 26.153 34.896 1.00 0.00 H new ATOM 0 HA ASN A 82 -0.843 28.706 34.084 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -2.504 28.435 36.018 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -2.844 27.401 34.645 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -2.975 25.152 37.642 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -3.921 26.484 36.971 1.00 0.00 H new ATOM 1184 N ASP A 83 -0.228 28.546 37.151 1.00 0.00 N ATOM 1185 CA ASP A 83 0.677 29.088 38.199 1.00 0.00 C ATOM 1186 C ASP A 83 1.251 30.423 37.726 1.00 0.00 C ATOM 1187 O ASP A 83 2.404 30.517 37.354 1.00 0.00 O ATOM 1188 CB ASP A 83 1.783 28.043 38.346 1.00 0.00 C ATOM 1189 CG ASP A 83 2.206 27.946 39.812 1.00 0.00 C ATOM 1190 OD1 ASP A 83 1.908 28.866 40.556 1.00 0.00 O ATOM 1191 OD2 ASP A 83 2.820 26.954 40.167 1.00 0.00 O ATOM 0 H ASP A 83 -1.149 28.250 37.475 1.00 0.00 H new ATOM 0 HA ASP A 83 0.170 29.268 39.147 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.430 27.074 37.994 1.00 0.00 H new ATOM 0 HB3 ASP A 83 2.638 28.315 37.727 1.00 0.00 H new ATOM 1196 N ASN A 84 0.452 31.454 37.724 1.00 0.00 N ATOM 1197 CA ASN A 84 0.951 32.777 37.258 1.00 0.00 C ATOM 1198 C ASN A 84 1.966 33.343 38.257 1.00 0.00 C ATOM 1199 O ASN A 84 1.656 33.555 39.412 1.00 0.00 O ATOM 1200 CB ASN A 84 -0.287 33.670 37.198 1.00 0.00 C ATOM 1201 CG ASN A 84 -0.877 33.816 38.600 1.00 0.00 C ATOM 1202 OD1 ASN A 84 -0.499 34.700 39.343 1.00 0.00 O ATOM 1203 ND2 ASN A 84 -1.796 32.978 38.998 1.00 0.00 N ATOM 0 H ASN A 84 -0.523 31.437 38.024 1.00 0.00 H new ATOM 0 HA ASN A 84 1.454 32.709 36.294 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -0.023 34.649 36.799 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -1.027 33.240 36.523 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -2.196 33.066 39.932 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -2.114 32.236 38.375 1.00 0.00 H new ATOM 1210 N VAL A 85 3.172 33.596 37.826 1.00 0.00 N ATOM 1211 CA VAL A 85 4.187 34.153 38.764 1.00 0.00 C ATOM 1212 C VAL A 85 4.346 35.660 38.549 1.00 0.00 C ATOM 1213 O VAL A 85 4.707 36.115 37.483 1.00 0.00 O ATOM 1214 CB VAL A 85 5.493 33.427 38.450 1.00 0.00 C ATOM 1215 CG1 VAL A 85 5.379 31.968 38.891 1.00 0.00 C ATOM 1216 CG2 VAL A 85 5.780 33.481 36.949 1.00 0.00 C ATOM 0 H VAL A 85 3.497 33.442 36.871 1.00 0.00 H new ATOM 0 HA VAL A 85 3.891 34.009 39.803 1.00 0.00 H new ATOM 0 HB VAL A 85 6.308 33.914 38.985 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.310 31.447 38.668 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.187 31.926 39.963 1.00 0.00 H new ATOM 0 HG13 VAL A 85 4.558 31.489 38.357 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.714 32.960 36.738 1.00 0.00 H new ATOM 0 HG22 VAL A 85 4.966 33.001 36.405 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.865 34.520 36.632 1.00 0.00 H new ATOM 1226 N ASP A 86 4.092 36.436 39.563 1.00 0.00 N ATOM 1227 CA ASP A 86 4.246 37.911 39.428 1.00 0.00 C ATOM 1228 C ASP A 86 5.713 38.267 39.644 1.00 0.00 C ATOM 1229 O ASP A 86 6.314 37.887 40.630 1.00 0.00 O ATOM 1230 CB ASP A 86 3.368 38.508 40.529 1.00 0.00 C ATOM 1231 CG ASP A 86 2.629 39.733 39.988 1.00 0.00 C ATOM 1232 OD1 ASP A 86 1.906 39.584 39.018 1.00 0.00 O ATOM 1233 OD2 ASP A 86 2.800 40.800 40.554 1.00 0.00 O ATOM 0 H ASP A 86 3.784 36.113 40.480 1.00 0.00 H new ATOM 0 HA ASP A 86 3.953 38.288 38.448 1.00 0.00 H new ATOM 0 HB2 ASP A 86 2.652 37.765 40.880 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.981 38.789 41.385 1.00 0.00 H new ATOM 1238 N PHE A 87 6.308 38.961 38.721 1.00 0.00 N ATOM 1239 CA PHE A 87 7.747 39.296 38.873 1.00 0.00 C ATOM 1240 C PHE A 87 7.949 40.581 39.669 1.00 0.00 C ATOM 1241 O PHE A 87 7.233 41.551 39.524 1.00 0.00 O ATOM 1242 CB PHE A 87 8.273 39.413 37.450 1.00 0.00 C ATOM 1243 CG PHE A 87 8.365 38.018 36.897 1.00 0.00 C ATOM 1244 CD1 PHE A 87 9.508 37.249 37.135 1.00 0.00 C ATOM 1245 CD2 PHE A 87 7.293 37.479 36.178 1.00 0.00 C ATOM 1246 CE1 PHE A 87 9.582 35.942 36.649 1.00 0.00 C ATOM 1247 CE2 PHE A 87 7.365 36.169 35.698 1.00 0.00 C ATOM 1248 CZ PHE A 87 8.510 35.401 35.933 1.00 0.00 C ATOM 0 H PHE A 87 5.864 39.310 37.872 1.00 0.00 H new ATOM 0 HA PHE A 87 8.285 38.535 39.438 1.00 0.00 H new ATOM 0 HB2 PHE A 87 7.607 40.025 36.842 1.00 0.00 H new ATOM 0 HB3 PHE A 87 9.250 39.897 37.439 1.00 0.00 H new ATOM 0 HD1 PHE A 87 10.333 37.665 37.694 1.00 0.00 H new ATOM 0 HD2 PHE A 87 6.411 38.075 35.994 1.00 0.00 H new ATOM 0 HE1 PHE A 87 10.467 35.349 36.826 1.00 0.00 H new ATOM 0 HE2 PHE A 87 6.537 35.750 35.146 1.00 0.00 H new ATOM 0 HZ PHE A 87 8.566 34.389 35.561 1.00 0.00 H new ATOM 1258 N LYS A 88 8.928 40.565 40.523 1.00 0.00 N ATOM 1259 CA LYS A 88 9.229 41.741 41.373 1.00 0.00 C ATOM 1260 C LYS A 88 10.594 42.313 41.000 1.00 0.00 C ATOM 1261 O LYS A 88 11.606 41.900 41.530 1.00 0.00 O ATOM 1262 CB LYS A 88 9.273 41.167 42.787 1.00 0.00 C ATOM 1263 CG LYS A 88 8.369 41.991 43.708 1.00 0.00 C ATOM 1264 CD LYS A 88 9.148 42.402 44.961 1.00 0.00 C ATOM 1265 CE LYS A 88 8.628 41.618 46.169 1.00 0.00 C ATOM 1266 NZ LYS A 88 9.283 42.251 47.348 1.00 0.00 N ATOM 0 H LYS A 88 9.546 39.767 40.670 1.00 0.00 H new ATOM 0 HA LYS A 88 8.501 42.545 41.264 1.00 0.00 H new ATOM 0 HB2 LYS A 88 8.947 40.127 42.778 1.00 0.00 H new ATOM 0 HB3 LYS A 88 10.296 41.177 43.162 1.00 0.00 H new ATOM 0 HG2 LYS A 88 8.010 42.877 43.184 1.00 0.00 H new ATOM 0 HG3 LYS A 88 7.491 41.409 43.988 1.00 0.00 H new ATOM 0 HD2 LYS A 88 10.211 42.209 44.820 1.00 0.00 H new ATOM 0 HD3 LYS A 88 9.038 43.472 45.135 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.542 41.678 46.241 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.885 40.561 46.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 8.976 41.768 48.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 10.316 42.173 47.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.015 43.255 47.397 1.00 0.00 H new ATOM 1280 N CYS A 89 10.638 43.253 40.097 1.00 0.00 N ATOM 1281 CA CYS A 89 11.954 43.833 39.712 1.00 0.00 C ATOM 1282 C CYS A 89 12.785 44.077 40.971 1.00 0.00 C ATOM 1283 O CYS A 89 12.324 44.695 41.910 1.00 0.00 O ATOM 1284 CB CYS A 89 11.625 45.152 39.017 1.00 0.00 C ATOM 1285 SG CYS A 89 12.694 45.354 37.572 1.00 0.00 S ATOM 0 H CYS A 89 9.828 43.641 39.613 1.00 0.00 H new ATOM 0 HA CYS A 89 12.530 43.175 39.061 1.00 0.00 H new ATOM 0 HB2 CYS A 89 10.578 45.164 38.713 1.00 0.00 H new ATOM 0 HB3 CYS A 89 11.766 45.984 39.707 1.00 0.00 H new ATOM 1290 N LYS A 90 13.993 43.574 41.006 1.00 0.00 N ATOM 1291 CA LYS A 90 14.849 43.759 42.223 1.00 0.00 C ATOM 1292 C LYS A 90 14.604 45.134 42.853 1.00 0.00 C ATOM 1293 O LYS A 90 13.921 45.259 43.850 1.00 0.00 O ATOM 1294 CB LYS A 90 16.292 43.662 41.730 1.00 0.00 C ATOM 1295 CG LYS A 90 16.924 42.370 42.253 1.00 0.00 C ATOM 1296 CD LYS A 90 17.763 42.678 43.496 1.00 0.00 C ATOM 1297 CE LYS A 90 18.644 41.471 43.827 1.00 0.00 C ATOM 1298 NZ LYS A 90 19.232 41.774 45.162 1.00 0.00 N ATOM 0 H LYS A 90 14.425 43.045 40.249 1.00 0.00 H new ATOM 0 HA LYS A 90 14.624 43.011 42.984 1.00 0.00 H new ATOM 0 HB2 LYS A 90 16.317 43.677 40.640 1.00 0.00 H new ATOM 0 HB3 LYS A 90 16.864 44.524 42.074 1.00 0.00 H new ATOM 0 HG2 LYS A 90 16.147 41.645 42.496 1.00 0.00 H new ATOM 0 HG3 LYS A 90 17.549 41.920 41.482 1.00 0.00 H new ATOM 0 HD2 LYS A 90 18.383 43.557 43.321 1.00 0.00 H new ATOM 0 HD3 LYS A 90 17.112 42.909 44.339 1.00 0.00 H new ATOM 0 HE2 LYS A 90 18.059 40.552 43.853 1.00 0.00 H new ATOM 0 HE3 LYS A 90 19.422 41.333 43.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 19.849 40.990 45.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 19.789 42.650 45.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 18.469 41.893 45.858 1.00 0.00 H new ATOM 1312 N TYR A 91 15.154 46.164 42.274 1.00 0.00 N ATOM 1313 CA TYR A 91 14.951 47.533 42.832 1.00 0.00 C ATOM 1314 C TYR A 91 15.420 48.589 41.825 1.00 0.00 C ATOM 1315 O TYR A 91 16.467 48.462 41.223 1.00 0.00 O ATOM 1316 CB TYR A 91 15.807 47.576 44.099 1.00 0.00 C ATOM 1317 CG TYR A 91 14.909 47.707 45.307 1.00 0.00 C ATOM 1318 CD1 TYR A 91 14.346 48.948 45.627 1.00 0.00 C ATOM 1319 CD2 TYR A 91 14.641 46.589 46.107 1.00 0.00 C ATOM 1320 CE1 TYR A 91 13.515 49.072 46.745 1.00 0.00 C ATOM 1321 CE2 TYR A 91 13.809 46.714 47.227 1.00 0.00 C ATOM 1322 CZ TYR A 91 13.246 47.955 47.546 1.00 0.00 C ATOM 1323 OH TYR A 91 12.426 48.078 48.649 1.00 0.00 O ATOM 0 H TYR A 91 15.736 46.119 41.438 1.00 0.00 H new ATOM 0 HA TYR A 91 13.903 47.743 43.044 1.00 0.00 H new ATOM 0 HB2 TYR A 91 16.408 46.670 44.176 1.00 0.00 H new ATOM 0 HB3 TYR A 91 16.500 48.416 44.055 1.00 0.00 H new ATOM 0 HD1 TYR A 91 14.553 49.810 45.010 1.00 0.00 H new ATOM 0 HD2 TYR A 91 15.075 45.631 45.861 1.00 0.00 H new ATOM 0 HE1 TYR A 91 13.080 50.030 46.991 1.00 0.00 H new ATOM 0 HE2 TYR A 91 13.602 45.852 47.845 1.00 0.00 H new ATOM 0 HH TYR A 91 12.343 47.209 49.093 1.00 0.00 H new ATOM 1333 N GLY A 92 14.650 49.626 41.631 1.00 0.00 N ATOM 1334 CA GLY A 92 15.052 50.681 40.656 1.00 0.00 C ATOM 1335 C GLY A 92 15.186 50.052 39.268 1.00 0.00 C ATOM 1336 O GLY A 92 16.163 50.251 38.576 1.00 0.00 O ATOM 0 H GLY A 92 13.761 49.788 42.105 1.00 0.00 H new ATOM 0 HA2 GLY A 92 14.310 51.479 40.638 1.00 0.00 H new ATOM 0 HA3 GLY A 92 15.997 51.132 40.958 1.00 0.00 H new ATOM 1340 N TYR A 93 14.212 49.284 38.867 1.00 0.00 N ATOM 1341 CA TYR A 93 14.270 48.620 37.533 1.00 0.00 C ATOM 1342 C TYR A 93 12.852 48.337 37.034 1.00 0.00 C ATOM 1343 O TYR A 93 11.918 48.254 37.807 1.00 0.00 O ATOM 1344 CB TYR A 93 15.016 47.315 37.790 1.00 0.00 C ATOM 1345 CG TYR A 93 16.479 47.597 38.041 1.00 0.00 C ATOM 1346 CD1 TYR A 93 17.209 48.396 37.151 1.00 0.00 C ATOM 1347 CD2 TYR A 93 17.108 47.055 39.169 1.00 0.00 C ATOM 1348 CE1 TYR A 93 18.566 48.651 37.391 1.00 0.00 C ATOM 1349 CE2 TYR A 93 18.464 47.311 39.408 1.00 0.00 C ATOM 1350 CZ TYR A 93 19.192 48.109 38.519 1.00 0.00 C ATOM 1351 OH TYR A 93 20.528 48.361 38.754 1.00 0.00 O ATOM 0 H TYR A 93 13.371 49.086 39.410 1.00 0.00 H new ATOM 0 HA TYR A 93 14.760 49.232 36.776 1.00 0.00 H new ATOM 0 HB2 TYR A 93 14.583 46.802 38.649 1.00 0.00 H new ATOM 0 HB3 TYR A 93 14.907 46.650 36.934 1.00 0.00 H new ATOM 0 HD1 TYR A 93 16.726 48.815 36.281 1.00 0.00 H new ATOM 0 HD2 TYR A 93 16.546 46.439 39.856 1.00 0.00 H new ATOM 0 HE1 TYR A 93 19.129 49.266 36.705 1.00 0.00 H new ATOM 0 HE2 TYR A 93 18.948 46.892 40.278 1.00 0.00 H new ATOM 0 HH TYR A 93 20.806 47.911 39.579 1.00 0.00 H new ATOM 1361 N LYS A 94 12.682 48.189 35.752 1.00 0.00 N ATOM 1362 CA LYS A 94 11.322 47.912 35.211 1.00 0.00 C ATOM 1363 C LYS A 94 11.305 46.556 34.503 1.00 0.00 C ATOM 1364 O LYS A 94 12.056 46.316 33.582 1.00 0.00 O ATOM 1365 CB LYS A 94 11.054 49.048 34.222 1.00 0.00 C ATOM 1366 CG LYS A 94 10.939 50.368 34.988 1.00 0.00 C ATOM 1367 CD LYS A 94 11.231 51.536 34.043 1.00 0.00 C ATOM 1368 CE LYS A 94 10.385 51.393 32.775 1.00 0.00 C ATOM 1369 NZ LYS A 94 10.350 52.757 32.173 1.00 0.00 N ATOM 0 H LYS A 94 13.424 48.248 35.055 1.00 0.00 H new ATOM 0 HA LYS A 94 10.562 47.868 35.991 1.00 0.00 H new ATOM 0 HB2 LYS A 94 11.861 49.107 33.491 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.135 48.854 33.668 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.939 50.469 35.410 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.640 50.378 35.823 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.007 52.482 34.537 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.290 51.553 33.786 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.825 50.670 32.088 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.381 51.040 33.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.787 52.736 31.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 9.920 53.423 32.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 11.319 53.064 31.953 1.00 0.00 H new ATOM 1383 N LEU A 95 10.456 45.665 34.930 1.00 0.00 N ATOM 1384 CA LEU A 95 10.400 44.325 34.282 1.00 0.00 C ATOM 1385 C LEU A 95 10.049 44.463 32.800 1.00 0.00 C ATOM 1386 O LEU A 95 8.913 44.704 32.441 1.00 0.00 O ATOM 1387 CB LEU A 95 9.294 43.571 35.021 1.00 0.00 C ATOM 1388 CG LEU A 95 9.802 43.136 36.395 1.00 0.00 C ATOM 1389 CD1 LEU A 95 8.631 43.079 37.378 1.00 0.00 C ATOM 1390 CD2 LEU A 95 10.443 41.752 36.283 1.00 0.00 C ATOM 0 H LEU A 95 9.799 45.805 35.698 1.00 0.00 H new ATOM 0 HA LEU A 95 11.357 43.806 34.335 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.416 44.208 35.131 1.00 0.00 H new ATOM 0 HB3 LEU A 95 8.985 42.700 34.443 1.00 0.00 H new ATOM 0 HG LEU A 95 10.541 43.852 36.754 1.00 0.00 H new ATOM 0 HD11 LEU A 95 8.993 42.769 38.358 1.00 0.00 H new ATOM 0 HD12 LEU A 95 8.173 44.065 37.456 1.00 0.00 H new ATOM 0 HD13 LEU A 95 7.891 42.363 37.021 1.00 0.00 H new ATOM 0 HD21 LEU A 95 10.806 41.439 37.262 1.00 0.00 H new ATOM 0 HD22 LEU A 95 9.703 41.036 35.925 1.00 0.00 H new ATOM 0 HD23 LEU A 95 11.277 41.793 35.582 1.00 0.00 H new ATOM 1402 N SER A 96 11.013 44.303 31.938 1.00 0.00 N ATOM 1403 CA SER A 96 10.731 44.416 30.481 1.00 0.00 C ATOM 1404 C SER A 96 10.414 43.033 29.904 1.00 0.00 C ATOM 1405 O SER A 96 11.298 42.235 29.666 1.00 0.00 O ATOM 1406 CB SER A 96 12.015 44.975 29.869 1.00 0.00 C ATOM 1407 OG SER A 96 11.964 44.826 28.456 1.00 0.00 O ATOM 0 H SER A 96 11.983 44.099 32.179 1.00 0.00 H new ATOM 0 HA SER A 96 9.873 45.055 30.271 1.00 0.00 H new ATOM 0 HB2 SER A 96 12.129 46.027 30.132 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.882 44.450 30.271 1.00 0.00 H new ATOM 0 HG SER A 96 12.785 45.185 28.059 1.00 0.00 H new ATOM 1413 N GLY A 97 9.158 42.739 29.682 1.00 0.00 N ATOM 1414 CA GLY A 97 8.797 41.403 29.124 1.00 0.00 C ATOM 1415 C GLY A 97 7.447 40.946 29.678 1.00 0.00 C ATOM 1416 O GLY A 97 6.531 40.646 28.938 1.00 0.00 O ATOM 0 H GLY A 97 8.372 43.363 29.862 1.00 0.00 H new ATOM 0 HA2 GLY A 97 8.753 41.455 28.036 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.568 40.675 29.377 1.00 0.00 H new ATOM 1420 N SER A 98 7.320 40.880 30.973 1.00 0.00 N ATOM 1421 CA SER A 98 6.029 40.427 31.576 1.00 0.00 C ATOM 1422 C SER A 98 6.114 40.416 33.106 1.00 0.00 C ATOM 1423 O SER A 98 6.624 39.487 33.698 1.00 0.00 O ATOM 1424 CB SER A 98 5.837 39.005 31.054 1.00 0.00 C ATOM 1425 OG SER A 98 6.975 38.225 31.391 1.00 0.00 O ATOM 0 H SER A 98 8.051 41.119 31.642 1.00 0.00 H new ATOM 0 HA SER A 98 5.204 41.088 31.312 1.00 0.00 H new ATOM 0 HB2 SER A 98 4.939 38.565 31.486 1.00 0.00 H new ATOM 0 HB3 SER A 98 5.697 39.018 29.973 1.00 0.00 H new ATOM 0 HG SER A 98 7.253 37.698 30.613 1.00 0.00 H new ATOM 1431 N SER A 99 5.610 41.433 33.752 1.00 0.00 N ATOM 1432 CA SER A 99 5.660 41.468 35.245 1.00 0.00 C ATOM 1433 C SER A 99 4.801 40.344 35.834 1.00 0.00 C ATOM 1434 O SER A 99 4.956 39.969 36.979 1.00 0.00 O ATOM 1435 CB SER A 99 5.102 42.838 35.628 1.00 0.00 C ATOM 1436 OG SER A 99 6.035 43.843 35.251 1.00 0.00 O ATOM 0 H SER A 99 5.167 42.240 33.313 1.00 0.00 H new ATOM 0 HA SER A 99 6.670 41.321 35.628 1.00 0.00 H new ATOM 0 HB2 SER A 99 4.146 43.007 35.132 1.00 0.00 H new ATOM 0 HB3 SER A 99 4.916 42.881 36.701 1.00 0.00 H new ATOM 0 HG SER A 99 5.682 44.725 35.493 1.00 0.00 H new ATOM 1442 N SER A 100 3.907 39.797 35.061 1.00 0.00 N ATOM 1443 CA SER A 100 3.054 38.689 35.579 1.00 0.00 C ATOM 1444 C SER A 100 2.936 37.593 34.519 1.00 0.00 C ATOM 1445 O SER A 100 2.189 37.712 33.568 1.00 0.00 O ATOM 1446 CB SER A 100 1.693 39.322 35.861 1.00 0.00 C ATOM 1447 OG SER A 100 1.063 39.654 34.631 1.00 0.00 O ATOM 0 H SER A 100 3.729 40.067 34.094 1.00 0.00 H new ATOM 0 HA SER A 100 3.469 38.227 36.475 1.00 0.00 H new ATOM 0 HB2 SER A 100 1.069 38.631 36.427 1.00 0.00 H new ATOM 0 HB3 SER A 100 1.815 40.216 36.473 1.00 0.00 H new ATOM 0 HG SER A 100 0.991 38.851 34.073 1.00 0.00 H new ATOM 1453 N SER A 101 3.682 36.533 34.668 1.00 0.00 N ATOM 1454 CA SER A 101 3.628 35.435 33.659 1.00 0.00 C ATOM 1455 C SER A 101 3.036 34.167 34.261 1.00 0.00 C ATOM 1456 O SER A 101 2.875 34.044 35.458 1.00 0.00 O ATOM 1457 CB SER A 101 5.081 35.195 33.258 1.00 0.00 C ATOM 1458 OG SER A 101 5.739 36.445 33.098 1.00 0.00 O ATOM 0 H SER A 101 4.326 36.379 35.444 1.00 0.00 H new ATOM 0 HA SER A 101 2.999 35.701 32.810 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.586 34.600 34.019 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.124 34.627 32.329 1.00 0.00 H new ATOM 0 HG SER A 101 6.360 36.586 33.843 1.00 0.00 H new ATOM 1464 N THR A 102 2.718 33.218 33.427 1.00 0.00 N ATOM 1465 CA THR A 102 2.143 31.947 33.930 1.00 0.00 C ATOM 1466 C THR A 102 2.729 30.767 33.162 1.00 0.00 C ATOM 1467 O THR A 102 2.967 30.837 31.973 1.00 0.00 O ATOM 1468 CB THR A 102 0.640 32.060 33.685 1.00 0.00 C ATOM 1469 OG1 THR A 102 0.261 33.430 33.700 1.00 0.00 O ATOM 1470 CG2 THR A 102 -0.108 31.307 34.782 1.00 0.00 C ATOM 0 H THR A 102 2.833 33.271 32.415 1.00 0.00 H new ATOM 0 HA THR A 102 2.366 31.782 34.984 1.00 0.00 H new ATOM 0 HB THR A 102 0.392 31.628 32.715 1.00 0.00 H new ATOM 0 HG1 THR A 102 -0.703 33.504 33.541 1.00 0.00 H new ATOM 0 HG21 THR A 102 -1.182 31.386 34.610 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.186 30.257 34.768 1.00 0.00 H new ATOM 0 HG23 THR A 102 0.137 31.740 35.752 1.00 0.00 H new ATOM 1478 N CYS A 103 2.971 29.687 33.841 1.00 0.00 N ATOM 1479 CA CYS A 103 3.552 28.497 33.169 1.00 0.00 C ATOM 1480 C CYS A 103 2.510 27.813 32.290 1.00 0.00 C ATOM 1481 O CYS A 103 1.739 27.002 32.748 1.00 0.00 O ATOM 1482 CB CYS A 103 3.970 27.585 34.310 1.00 0.00 C ATOM 1483 SG CYS A 103 5.750 27.339 34.225 1.00 0.00 S ATOM 0 H CYS A 103 2.791 29.576 34.839 1.00 0.00 H new ATOM 0 HA CYS A 103 4.385 28.755 32.515 1.00 0.00 H new ATOM 0 HB2 CYS A 103 3.694 28.027 35.268 1.00 0.00 H new ATOM 0 HB3 CYS A 103 3.452 26.629 34.239 1.00 0.00 H new ATOM 1488 N SER A 104 2.484 28.136 31.030 1.00 0.00 N ATOM 1489 CA SER A 104 1.485 27.507 30.119 1.00 0.00 C ATOM 1490 C SER A 104 1.800 26.029 29.900 1.00 0.00 C ATOM 1491 O SER A 104 2.703 25.483 30.503 1.00 0.00 O ATOM 1492 CB SER A 104 1.606 28.281 28.808 1.00 0.00 C ATOM 1493 OG SER A 104 0.309 28.633 28.345 1.00 0.00 O ATOM 0 H SER A 104 3.111 28.809 30.589 1.00 0.00 H new ATOM 0 HA SER A 104 0.477 27.548 30.531 1.00 0.00 H new ATOM 0 HB2 SER A 104 2.207 29.178 28.957 1.00 0.00 H new ATOM 0 HB3 SER A 104 2.118 27.675 28.061 1.00 0.00 H new ATOM 0 HG SER A 104 0.324 28.726 27.370 1.00 0.00 H new ATOM 1499 N PRO A 105 1.024 25.432 29.039 1.00 0.00 N ATOM 1500 CA PRO A 105 1.192 24.004 28.725 1.00 0.00 C ATOM 1501 C PRO A 105 2.312 23.802 27.708 1.00 0.00 C ATOM 1502 O PRO A 105 2.353 24.432 26.670 1.00 0.00 O ATOM 1503 CB PRO A 105 -0.162 23.603 28.160 1.00 0.00 C ATOM 1504 CG PRO A 105 -0.775 24.866 27.634 1.00 0.00 C ATOM 1505 CD PRO A 105 -0.072 26.036 28.280 1.00 0.00 C ATOM 0 HA PRO A 105 1.475 23.402 29.589 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -0.051 22.863 27.368 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -0.790 23.155 28.930 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.675 24.914 26.550 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -1.842 24.893 27.857 1.00 0.00 H new ATOM 0 HD2 PRO A 105 0.301 26.736 27.533 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -0.746 26.593 28.931 1.00 0.00 H new ATOM 1513 N GLY A 106 3.230 22.931 28.014 1.00 0.00 N ATOM 1514 CA GLY A 106 4.366 22.681 27.090 1.00 0.00 C ATOM 1515 C GLY A 106 5.682 22.920 27.839 1.00 0.00 C ATOM 1516 O GLY A 106 6.750 22.645 27.332 1.00 0.00 O ATOM 0 H GLY A 106 3.241 22.378 28.871 1.00 0.00 H new ATOM 0 HA2 GLY A 106 4.327 21.659 26.714 1.00 0.00 H new ATOM 0 HA3 GLY A 106 4.300 23.341 26.225 1.00 0.00 H new ATOM 1520 N ASN A 107 5.596 23.432 29.047 1.00 0.00 N ATOM 1521 CA ASN A 107 6.816 23.703 29.877 1.00 0.00 C ATOM 1522 C ASN A 107 7.474 25.017 29.473 1.00 0.00 C ATOM 1523 O ASN A 107 8.262 25.078 28.550 1.00 0.00 O ATOM 1524 CB ASN A 107 7.770 22.525 29.654 1.00 0.00 C ATOM 1525 CG ASN A 107 6.983 21.212 29.643 1.00 0.00 C ATOM 1526 OD1 ASN A 107 7.434 20.226 29.096 1.00 0.00 O ATOM 1527 ND2 ASN A 107 5.818 21.157 30.229 1.00 0.00 N ATOM 0 H ASN A 107 4.716 23.677 29.500 1.00 0.00 H new ATOM 0 HA ASN A 107 6.552 23.798 30.930 1.00 0.00 H new ATOM 0 HB2 ASN A 107 8.300 22.649 28.710 1.00 0.00 H new ATOM 0 HB3 ASN A 107 8.523 22.501 30.442 1.00 0.00 H new ATOM 0 HD21 ASN A 107 5.287 20.286 30.227 1.00 0.00 H new ATOM 0 HD22 ASN A 107 5.439 21.985 30.689 1.00 0.00 H new ATOM 1534 N THR A 108 7.163 26.073 30.175 1.00 0.00 N ATOM 1535 CA THR A 108 7.773 27.392 29.855 1.00 0.00 C ATOM 1536 C THR A 108 7.190 28.485 30.746 1.00 0.00 C ATOM 1537 O THR A 108 6.656 28.222 31.803 1.00 0.00 O ATOM 1538 CB THR A 108 7.435 27.656 28.390 1.00 0.00 C ATOM 1539 OG1 THR A 108 6.425 26.756 27.954 1.00 0.00 O ATOM 1540 CG2 THR A 108 8.697 27.464 27.559 1.00 0.00 C ATOM 0 H THR A 108 6.510 26.077 30.959 1.00 0.00 H new ATOM 0 HA THR A 108 8.850 27.389 30.026 1.00 0.00 H new ATOM 0 HB THR A 108 7.064 28.674 28.273 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.213 26.933 27.014 1.00 0.00 H new ATOM 0 HG21 THR A 108 8.473 27.649 26.509 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.464 28.162 27.895 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.059 26.443 27.678 1.00 0.00 H new ATOM 1548 N TRP A 109 7.298 29.713 30.328 1.00 0.00 N ATOM 1549 CA TRP A 109 6.763 30.830 31.149 1.00 0.00 C ATOM 1550 C TRP A 109 6.224 31.940 30.243 1.00 0.00 C ATOM 1551 O TRP A 109 6.936 32.846 29.857 1.00 0.00 O ATOM 1552 CB TRP A 109 7.960 31.300 31.967 1.00 0.00 C ATOM 1553 CG TRP A 109 8.014 30.492 33.223 1.00 0.00 C ATOM 1554 CD1 TRP A 109 9.040 29.692 33.610 1.00 0.00 C ATOM 1555 CD2 TRP A 109 6.997 30.383 34.255 1.00 0.00 C ATOM 1556 NE1 TRP A 109 8.708 29.102 34.817 1.00 0.00 N ATOM 1557 CE2 TRP A 109 7.462 29.502 35.258 1.00 0.00 C ATOM 1558 CE3 TRP A 109 5.726 30.962 34.417 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 6.693 29.207 36.384 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 4.949 30.668 35.547 1.00 0.00 C ATOM 1561 CH2 TRP A 109 5.430 29.793 36.530 1.00 0.00 C ATOM 0 H TRP A 109 7.735 29.992 29.450 1.00 0.00 H new ATOM 0 HA TRP A 109 5.930 30.534 31.787 1.00 0.00 H new ATOM 0 HB2 TRP A 109 8.881 31.178 31.397 1.00 0.00 H new ATOM 0 HB3 TRP A 109 7.868 32.361 32.201 1.00 0.00 H new ATOM 0 HD1 TRP A 109 9.961 29.541 33.067 1.00 0.00 H new ATOM 0 HE1 TRP A 109 9.311 28.451 35.320 1.00 0.00 H new ATOM 0 HE3 TRP A 109 5.345 31.638 33.666 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 7.069 28.531 37.138 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 3.974 31.119 35.660 1.00 0.00 H new ATOM 0 HH2 TRP A 109 4.828 29.571 37.399 1.00 0.00 H new ATOM 1572 N LYS A 110 4.966 31.863 29.896 1.00 0.00 N ATOM 1573 CA LYS A 110 4.366 32.899 29.007 1.00 0.00 C ATOM 1574 C LYS A 110 3.556 33.913 29.831 1.00 0.00 C ATOM 1575 O LYS A 110 2.900 33.542 30.784 1.00 0.00 O ATOM 1576 CB LYS A 110 3.442 32.121 28.070 1.00 0.00 C ATOM 1577 CG LYS A 110 4.275 31.403 27.006 1.00 0.00 C ATOM 1578 CD LYS A 110 3.608 31.568 25.638 1.00 0.00 C ATOM 1579 CE LYS A 110 4.509 30.975 24.553 1.00 0.00 C ATOM 1580 NZ LYS A 110 5.466 32.064 24.211 1.00 0.00 N ATOM 0 H LYS A 110 4.327 31.125 30.191 1.00 0.00 H new ATOM 0 HA LYS A 110 5.125 33.465 28.467 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.857 31.397 28.638 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.734 32.800 27.595 1.00 0.00 H new ATOM 0 HG2 LYS A 110 5.285 31.813 26.982 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.366 30.345 27.253 1.00 0.00 H new ATOM 0 HD2 LYS A 110 2.639 31.070 25.632 1.00 0.00 H new ATOM 0 HD3 LYS A 110 3.425 32.623 25.436 1.00 0.00 H new ATOM 0 HE2 LYS A 110 5.031 30.089 24.914 1.00 0.00 H new ATOM 0 HE3 LYS A 110 3.930 30.670 23.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 6.385 31.650 23.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 5.096 32.612 23.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 5.586 32.691 25.032 1.00 0.00 H new ATOM 1594 N PRO A 111 3.615 35.164 29.433 1.00 0.00 N ATOM 1595 CA PRO A 111 4.431 35.572 28.261 1.00 0.00 C ATOM 1596 C PRO A 111 5.921 35.559 28.621 1.00 0.00 C ATOM 1597 O PRO A 111 6.291 35.364 29.762 1.00 0.00 O ATOM 1598 CB PRO A 111 3.945 36.985 27.958 1.00 0.00 C ATOM 1599 CG PRO A 111 3.395 37.496 29.250 1.00 0.00 C ATOM 1600 CD PRO A 111 2.918 36.304 30.039 1.00 0.00 C ATOM 0 HA PRO A 111 4.323 34.905 27.406 1.00 0.00 H new ATOM 0 HB2 PRO A 111 4.761 37.614 27.601 1.00 0.00 H new ATOM 0 HB3 PRO A 111 3.182 36.980 27.180 1.00 0.00 H new ATOM 0 HG2 PRO A 111 4.159 38.042 29.803 1.00 0.00 H new ATOM 0 HG3 PRO A 111 2.574 38.191 29.070 1.00 0.00 H new ATOM 0 HD2 PRO A 111 3.163 36.403 31.096 1.00 0.00 H new ATOM 0 HD3 PRO A 111 1.836 36.190 29.972 1.00 0.00 H new ATOM 1608 N GLU A 112 6.774 35.749 27.651 1.00 0.00 N ATOM 1609 CA GLU A 112 8.245 35.732 27.917 1.00 0.00 C ATOM 1610 C GLU A 112 8.579 36.385 29.266 1.00 0.00 C ATOM 1611 O GLU A 112 8.196 37.504 29.542 1.00 0.00 O ATOM 1612 CB GLU A 112 8.858 36.536 26.770 1.00 0.00 C ATOM 1613 CG GLU A 112 9.198 35.597 25.611 1.00 0.00 C ATOM 1614 CD GLU A 112 8.137 35.729 24.517 1.00 0.00 C ATOM 1615 OE1 GLU A 112 8.039 36.800 23.940 1.00 0.00 O ATOM 1616 OE2 GLU A 112 7.440 34.758 24.275 1.00 0.00 O ATOM 0 H GLU A 112 6.515 35.917 26.679 1.00 0.00 H new ATOM 0 HA GLU A 112 8.632 34.714 27.969 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.160 37.304 26.437 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.757 37.049 27.112 1.00 0.00 H new ATOM 0 HG2 GLU A 112 10.182 35.840 25.209 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.244 34.567 25.965 1.00 0.00 H new ATOM 1623 N LEU A 113 9.311 35.689 30.097 1.00 0.00 N ATOM 1624 CA LEU A 113 9.702 36.252 31.425 1.00 0.00 C ATOM 1625 C LEU A 113 10.077 37.727 31.283 1.00 0.00 C ATOM 1626 O LEU A 113 10.547 38.158 30.249 1.00 0.00 O ATOM 1627 CB LEU A 113 10.921 35.425 31.843 1.00 0.00 C ATOM 1628 CG LEU A 113 10.601 34.553 33.069 1.00 0.00 C ATOM 1629 CD1 LEU A 113 9.151 34.058 33.024 1.00 0.00 C ATOM 1630 CD2 LEU A 113 11.540 33.345 33.078 1.00 0.00 C ATOM 0 H LEU A 113 9.657 34.748 29.911 1.00 0.00 H new ATOM 0 HA LEU A 113 8.896 36.202 32.157 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.237 34.792 31.014 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.754 36.089 32.072 1.00 0.00 H new ATOM 0 HG LEU A 113 10.737 35.152 33.970 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.949 33.444 33.901 1.00 0.00 H new ATOM 0 HD12 LEU A 113 8.475 34.913 33.016 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.997 33.465 32.123 1.00 0.00 H new ATOM 0 HD21 LEU A 113 11.321 32.720 33.944 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.396 32.765 32.166 1.00 0.00 H new ATOM 0 HD23 LEU A 113 12.573 33.688 33.130 1.00 0.00 H new ATOM 1642 N PRO A 114 9.849 38.451 32.340 1.00 0.00 N ATOM 1643 CA PRO A 114 10.159 39.897 32.358 1.00 0.00 C ATOM 1644 C PRO A 114 11.665 40.132 32.506 1.00 0.00 C ATOM 1645 O PRO A 114 12.414 39.237 32.844 1.00 0.00 O ATOM 1646 CB PRO A 114 9.402 40.407 33.581 1.00 0.00 C ATOM 1647 CG PRO A 114 9.223 39.220 34.474 1.00 0.00 C ATOM 1648 CD PRO A 114 9.284 37.985 33.610 1.00 0.00 C ATOM 0 HA PRO A 114 9.871 40.406 31.438 1.00 0.00 H new ATOM 0 HB2 PRO A 114 9.960 41.195 34.086 1.00 0.00 H new ATOM 0 HB3 PRO A 114 8.439 40.831 33.296 1.00 0.00 H new ATOM 0 HG2 PRO A 114 10.002 39.193 35.236 1.00 0.00 H new ATOM 0 HG3 PRO A 114 8.268 39.275 34.997 1.00 0.00 H new ATOM 0 HD2 PRO A 114 9.908 37.215 34.063 1.00 0.00 H new ATOM 0 HD3 PRO A 114 8.294 37.551 33.468 1.00 0.00 H new ATOM 1656 N LYS A 115 12.113 41.333 32.257 1.00 0.00 N ATOM 1657 CA LYS A 115 13.569 41.632 32.389 1.00 0.00 C ATOM 1658 C LYS A 115 13.771 42.883 33.241 1.00 0.00 C ATOM 1659 O LYS A 115 13.602 43.988 32.777 1.00 0.00 O ATOM 1660 CB LYS A 115 14.060 41.863 30.959 1.00 0.00 C ATOM 1661 CG LYS A 115 15.590 41.936 30.948 1.00 0.00 C ATOM 1662 CD LYS A 115 16.126 41.286 29.670 1.00 0.00 C ATOM 1663 CE LYS A 115 16.267 42.347 28.576 1.00 0.00 C ATOM 1664 NZ LYS A 115 17.230 41.766 27.600 1.00 0.00 N ATOM 0 H LYS A 115 11.533 42.121 31.968 1.00 0.00 H new ATOM 0 HA LYS A 115 14.116 40.825 32.877 1.00 0.00 H new ATOM 0 HB2 LYS A 115 13.720 41.055 30.312 1.00 0.00 H new ATOM 0 HB3 LYS A 115 13.639 42.787 30.564 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.915 42.975 31.003 1.00 0.00 H new ATOM 0 HG3 LYS A 115 15.995 41.428 31.824 1.00 0.00 H new ATOM 0 HD2 LYS A 115 17.091 40.819 29.865 1.00 0.00 H new ATOM 0 HD3 LYS A 115 15.451 40.496 29.340 1.00 0.00 H new ATOM 0 HE2 LYS A 115 15.307 42.559 28.105 1.00 0.00 H new ATOM 0 HE3 LYS A 115 16.637 43.288 28.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 17.379 42.436 26.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 18.137 41.581 28.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.848 40.875 27.224 1.00 0.00 H new ATOM 1678 N CYS A 116 14.133 42.722 34.486 1.00 0.00 N ATOM 1679 CA CYS A 116 14.342 43.917 35.352 1.00 0.00 C ATOM 1680 C CYS A 116 15.360 44.846 34.696 1.00 0.00 C ATOM 1681 O CYS A 116 16.553 44.722 34.886 1.00 0.00 O ATOM 1682 CB CYS A 116 14.865 43.352 36.677 1.00 0.00 C ATOM 1683 SG CYS A 116 14.423 44.428 38.077 1.00 0.00 S ATOM 0 H CYS A 116 14.292 41.821 34.938 1.00 0.00 H new ATOM 0 HA CYS A 116 13.436 44.503 35.505 1.00 0.00 H new ATOM 0 HB2 CYS A 116 14.453 42.356 36.837 1.00 0.00 H new ATOM 0 HB3 CYS A 116 15.949 43.245 36.626 1.00 0.00 H new ATOM 1688 N VAL A 117 14.884 45.774 33.915 1.00 0.00 N ATOM 1689 CA VAL A 117 15.806 46.722 33.226 1.00 0.00 C ATOM 1690 C VAL A 117 15.770 48.078 33.891 1.00 0.00 C ATOM 1691 O VAL A 117 15.089 48.289 34.875 1.00 0.00 O ATOM 1692 CB VAL A 117 15.300 46.847 31.789 1.00 0.00 C ATOM 1693 CG1 VAL A 117 15.823 45.679 30.985 1.00 0.00 C ATOM 1694 CG2 VAL A 117 13.772 46.836 31.748 1.00 0.00 C ATOM 0 H VAL A 117 13.893 45.918 33.723 1.00 0.00 H new ATOM 0 HA VAL A 117 16.833 46.359 33.266 1.00 0.00 H new ATOM 0 HB VAL A 117 15.653 47.790 31.372 1.00 0.00 H new ATOM 0 HG11 VAL A 117 15.469 45.757 29.957 1.00 0.00 H new ATOM 0 HG12 VAL A 117 16.913 45.690 30.995 1.00 0.00 H new ATOM 0 HG13 VAL A 117 15.465 44.747 31.422 1.00 0.00 H new ATOM 0 HG21 VAL A 117 13.435 46.926 30.715 1.00 0.00 H new ATOM 0 HG22 VAL A 117 13.403 45.901 32.170 1.00 0.00 H new ATOM 0 HG23 VAL A 117 13.386 47.673 32.330 1.00 0.00 H new ATOM 1704 N ARG A 118 16.498 49.006 33.356 1.00 0.00 N ATOM 1705 CA ARG A 118 16.498 50.352 33.959 1.00 0.00 C ATOM 1706 C ARG A 118 16.207 51.416 32.898 1.00 0.00 C ATOM 1707 O ARG A 118 15.700 51.054 31.848 1.00 0.00 O ATOM 1708 CB ARG A 118 17.899 50.530 34.542 1.00 0.00 C ATOM 1709 CG ARG A 118 18.940 50.094 33.508 1.00 0.00 C ATOM 1710 CD ARG A 118 20.346 50.277 34.084 1.00 0.00 C ATOM 1711 NE ARG A 118 21.196 49.310 33.335 1.00 0.00 N ATOM 1712 CZ ARG A 118 21.724 48.291 33.957 1.00 0.00 C ATOM 1713 NH1 ARG A 118 20.985 47.261 34.263 1.00 0.00 N ATOM 1714 NH2 ARG A 118 22.990 48.302 34.275 1.00 0.00 N ATOM 1715 OXT ARG A 118 16.497 52.572 33.152 1.00 0.00 O ATOM 0 H ARG A 118 17.089 48.891 32.533 1.00 0.00 H new ATOM 0 HA ARG A 118 15.728 50.459 34.723 1.00 0.00 H new ATOM 0 HB2 ARG A 118 18.060 51.572 34.819 1.00 0.00 H new ATOM 0 HB3 ARG A 118 18.004 49.939 35.452 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.781 49.051 33.235 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.830 50.682 32.597 1.00 0.00 H new ATOM 0 HD2 ARG A 118 20.698 51.300 33.949 1.00 0.00 H new ATOM 0 HD3 ARG A 118 20.364 50.072 35.154 1.00 0.00 H new ATOM 0 HE ARG A 118 21.365 49.444 32.338 1.00 0.00 H new ATOM 0 HH11 ARG A 118 19.995 47.252 34.016 1.00 0.00 H new ATOM 0 HH12 ARG A 118 21.397 46.464 34.749 1.00 0.00 H new ATOM 0 HH21 ARG A 118 23.569 49.108 34.037 1.00 0.00 H new ATOM 0 HH22 ARG A 118 23.401 47.505 34.761 1.00 0.00 H new TER 1729 ARG A 118