USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 559 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: A2085 GLN : amide:sc= 0.66 K(o=2.6,f=1.1) USER MOD Set 1.2: A2086 GLN : amide:sc= 0.41 K(o=2.6,f=-0.95) USER MOD Set 1.3: A2089 ASN : amide:sc= 1.5 K(o=2.6,f=-0.8) USER MOD Single : A2064 SER OG : rot 180:sc= 0 USER MOD Single : A2066 SER OG : rot 180:sc= 0 USER MOD Single : A2069 GLN : amide:sc= -0.0301 X(o=-0.03,f=-0.23) USER MOD Single : A2074 THR OG1 : rot 82:sc= 1.21 USER MOD Single : A2076 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2077 SER OG : rot 180:sc= 0 USER MOD Single : A2079 SER OG : rot 180:sc= 0 USER MOD Single : A2080 SER OG : rot -71:sc= 0.429 USER MOD Single : A2082 GLN : amide:sc= -0.434 K(o=-0.43,f=-1.2) USER MOD Single : A2083 GLN : amide:sc= 0.891 K(o=0.89,f=0) USER MOD Single : A2084 GLN : amide:sc= 1.16 K(o=1.2,f=-2.5!) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 180:sc= 0 USER MOD Single : A2094 ASN : amide:sc= 0.49 K(o=0.49,f=-1.6) USER MOD Single : A2096 GLN : amide:sc= -2.03! C(o=-2!,f=-1.7!) USER MOD Single : A2098 MET CE :methyl 166:sc= 0 (180deg=-0.211) USER MOD Single : A2103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2106 THR OG1 : rot 180:sc= 0 USER MOD Single : A2108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 THR OG1 : rot -29:sc= 0.0416 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ -178:sc= 2.29 (180deg=2.24) USER MOD Single : B 44 MET CE :methyl -159:sc= -0.0423 (180deg=-0.435) USER MOD Single : B 46 SER OG : rot 180:sc= -0.377 USER MOD Single : B 52 GLN : amide:sc= 1.19 K(o=1.2,f=-8.1!) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 4.994 -5.000 -15.433 1.00 0.00 N ATOM 65 CA ILE A2063 5.995 -5.881 -16.062 1.00 0.00 C ATOM 66 C ILE A2063 5.432 -6.589 -17.311 1.00 0.00 C ATOM 67 O ILE A2063 4.210 -6.691 -17.478 1.00 0.00 O ATOM 68 CB ILE A2063 6.541 -6.910 -15.042 1.00 0.00 C ATOM 69 CG1 ILE A2063 5.433 -7.829 -14.472 1.00 0.00 C ATOM 70 CG2 ILE A2063 7.284 -6.167 -13.917 1.00 0.00 C ATOM 71 CD1 ILE A2063 5.959 -8.974 -13.599 1.00 0.00 C ATOM 0 HA ILE A2063 6.822 -5.252 -16.391 1.00 0.00 H new ATOM 0 HB ILE A2063 7.236 -7.567 -15.564 1.00 0.00 H new ATOM 0 HG12 ILE A2063 4.742 -7.225 -13.884 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.863 -8.250 -15.300 1.00 0.00 H new ATOM 0 HG21 ILE A2063 7.670 -6.889 -13.197 1.00 0.00 H new ATOM 0 HG22 ILE A2063 8.112 -5.599 -14.341 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.597 -5.486 -13.415 1.00 0.00 H new ATOM 0 HD11 ILE A2063 5.121 -9.571 -13.239 1.00 0.00 H new ATOM 0 HD12 ILE A2063 6.627 -9.603 -14.188 1.00 0.00 H new ATOM 0 HD13 ILE A2063 6.504 -8.563 -12.749 1.00 0.00 H new ATOM 83 N SER A2064 6.313 -7.118 -18.167 1.00 0.00 N ATOM 84 CA SER A2064 5.939 -7.839 -19.399 1.00 0.00 C ATOM 85 C SER A2064 6.616 -9.218 -19.481 1.00 0.00 C ATOM 86 O SER A2064 7.800 -9.329 -19.147 1.00 0.00 O ATOM 87 CB SER A2064 6.318 -7.018 -20.640 1.00 0.00 C ATOM 88 OG SER A2064 5.585 -5.803 -20.685 1.00 0.00 O ATOM 0 H SER A2064 7.321 -7.059 -18.026 1.00 0.00 H new ATOM 0 HA SER A2064 4.859 -7.985 -19.368 1.00 0.00 H new ATOM 0 HB2 SER A2064 7.386 -6.803 -20.627 1.00 0.00 H new ATOM 0 HB3 SER A2064 6.121 -7.600 -21.540 1.00 0.00 H new ATOM 0 HG SER A2064 5.843 -5.295 -21.482 1.00 0.00 H new ATOM 94 N PRO A2065 5.914 -10.278 -19.938 1.00 0.00 N ATOM 95 CA PRO A2065 6.480 -11.627 -20.043 1.00 0.00 C ATOM 96 C PRO A2065 7.584 -11.735 -21.103 1.00 0.00 C ATOM 97 O PRO A2065 8.459 -12.588 -20.976 1.00 0.00 O ATOM 98 CB PRO A2065 5.296 -12.548 -20.358 1.00 0.00 C ATOM 99 CG PRO A2065 4.303 -11.628 -21.066 1.00 0.00 C ATOM 100 CD PRO A2065 4.525 -10.280 -20.380 1.00 0.00 C ATOM 0 HA PRO A2065 6.975 -11.907 -19.113 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.594 -13.381 -20.994 1.00 0.00 H new ATOM 0 HB3 PRO A2065 4.869 -12.976 -19.451 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.499 -11.572 -22.137 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.277 -11.976 -20.948 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.333 -9.456 -21.067 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.847 -10.155 -19.536 1.00 0.00 H new ATOM 108 N SER A2066 7.600 -10.860 -22.114 1.00 0.00 N ATOM 109 CA SER A2066 8.643 -10.813 -23.153 1.00 0.00 C ATOM 110 C SER A2066 10.055 -10.660 -22.567 1.00 0.00 C ATOM 111 O SER A2066 11.007 -11.268 -23.063 1.00 0.00 O ATOM 112 CB SER A2066 8.349 -9.670 -24.131 1.00 0.00 C ATOM 113 OG SER A2066 8.105 -8.456 -23.430 1.00 0.00 O ATOM 0 H SER A2066 6.877 -10.151 -22.238 1.00 0.00 H new ATOM 0 HA SER A2066 8.621 -11.767 -23.679 1.00 0.00 H new ATOM 0 HB2 SER A2066 9.192 -9.540 -24.810 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.483 -9.922 -24.743 1.00 0.00 H new ATOM 0 HG SER A2066 7.921 -7.739 -24.072 1.00 0.00 H new ATOM 119 N ALA A2067 10.189 -9.908 -21.468 1.00 0.00 N ATOM 120 CA ALA A2067 11.448 -9.710 -20.753 1.00 0.00 C ATOM 121 C ALA A2067 12.051 -11.023 -20.218 1.00 0.00 C ATOM 122 O ALA A2067 13.272 -11.145 -20.132 1.00 0.00 O ATOM 123 CB ALA A2067 11.201 -8.715 -19.617 1.00 0.00 C ATOM 0 H ALA A2067 9.406 -9.411 -21.045 1.00 0.00 H new ATOM 0 HA ALA A2067 12.185 -9.316 -21.453 1.00 0.00 H new ATOM 0 HB1 ALA A2067 12.129 -8.552 -19.068 1.00 0.00 H new ATOM 0 HB2 ALA A2067 10.853 -7.769 -20.031 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.445 -9.115 -18.941 1.00 0.00 H new ATOM 129 N LEU A2068 11.220 -12.022 -19.890 1.00 0.00 N ATOM 130 CA LEU A2068 11.669 -13.330 -19.399 1.00 0.00 C ATOM 131 C LEU A2068 12.365 -14.108 -20.532 1.00 0.00 C ATOM 132 O LEU A2068 13.425 -14.698 -20.319 1.00 0.00 O ATOM 133 CB LEU A2068 10.477 -14.121 -18.821 1.00 0.00 C ATOM 134 CG LEU A2068 9.897 -13.651 -17.467 1.00 0.00 C ATOM 135 CD1 LEU A2068 9.585 -12.158 -17.345 1.00 0.00 C ATOM 136 CD2 LEU A2068 8.602 -14.417 -17.195 1.00 0.00 C ATOM 0 H LEU A2068 10.205 -11.942 -19.959 1.00 0.00 H new ATOM 0 HA LEU A2068 12.392 -13.184 -18.597 1.00 0.00 H new ATOM 0 HB2 LEU A2068 9.673 -14.102 -19.556 1.00 0.00 H new ATOM 0 HB3 LEU A2068 10.785 -15.161 -18.712 1.00 0.00 H new ATOM 0 HG LEU A2068 10.688 -13.851 -16.744 1.00 0.00 H new ATOM 0 HD11 LEU A2068 9.184 -11.950 -16.353 1.00 0.00 H new ATOM 0 HD12 LEU A2068 10.498 -11.582 -17.496 1.00 0.00 H new ATOM 0 HD13 LEU A2068 8.850 -11.877 -18.099 1.00 0.00 H new ATOM 0 HD21 LEU A2068 8.182 -14.095 -16.242 1.00 0.00 H new ATOM 0 HD22 LEU A2068 7.887 -14.217 -17.993 1.00 0.00 H new ATOM 0 HD23 LEU A2068 8.813 -15.486 -17.156 1.00 0.00 H new ATOM 148 N GLN A2069 11.814 -14.062 -21.753 1.00 0.00 N ATOM 149 CA GLN A2069 12.445 -14.676 -22.931 1.00 0.00 C ATOM 150 C GLN A2069 13.728 -13.916 -23.318 1.00 0.00 C ATOM 151 O GLN A2069 14.739 -14.540 -23.646 1.00 0.00 O ATOM 152 CB GLN A2069 11.480 -14.736 -24.129 1.00 0.00 C ATOM 153 CG GLN A2069 10.316 -15.729 -23.955 1.00 0.00 C ATOM 154 CD GLN A2069 9.138 -15.140 -23.181 1.00 0.00 C ATOM 155 OE1 GLN A2069 8.377 -14.328 -23.687 1.00 0.00 O ATOM 156 NE2 GLN A2069 8.924 -15.539 -21.946 1.00 0.00 N ATOM 0 H GLN A2069 10.926 -13.602 -21.952 1.00 0.00 H new ATOM 0 HA GLN A2069 12.707 -15.700 -22.663 1.00 0.00 H new ATOM 0 HB2 GLN A2069 11.071 -13.741 -24.301 1.00 0.00 H new ATOM 0 HB3 GLN A2069 12.044 -15.008 -25.022 1.00 0.00 H new ATOM 0 HG2 GLN A2069 9.972 -16.053 -24.937 1.00 0.00 H new ATOM 0 HG3 GLN A2069 10.678 -16.616 -23.435 1.00 0.00 H new ATOM 0 HE21 GLN A2069 9.552 -16.216 -21.513 1.00 0.00 H new ATOM 0 HE22 GLN A2069 8.130 -15.171 -21.422 1.00 0.00 H new ATOM 165 N ASP A2070 13.723 -12.578 -23.243 1.00 0.00 N ATOM 166 CA ASP A2070 14.914 -11.764 -23.522 1.00 0.00 C ATOM 167 C ASP A2070 16.037 -12.004 -22.493 1.00 0.00 C ATOM 168 O ASP A2070 17.216 -11.987 -22.852 1.00 0.00 O ATOM 169 CB ASP A2070 14.553 -10.277 -23.654 1.00 0.00 C ATOM 170 CG ASP A2070 13.791 -9.950 -24.954 1.00 0.00 C ATOM 171 OD1 ASP A2070 14.141 -10.495 -26.031 1.00 0.00 O ATOM 172 OD2 ASP A2070 12.874 -9.095 -24.915 1.00 0.00 O ATOM 0 H ASP A2070 12.899 -12.033 -22.989 1.00 0.00 H new ATOM 0 HA ASP A2070 15.310 -12.087 -24.485 1.00 0.00 H new ATOM 0 HB2 ASP A2070 13.945 -9.980 -22.800 1.00 0.00 H new ATOM 0 HB3 ASP A2070 15.466 -9.683 -23.617 1.00 0.00 H new ATOM 177 N LEU A2071 15.704 -12.297 -21.232 1.00 0.00 N ATOM 178 CA LEU A2071 16.690 -12.669 -20.213 1.00 0.00 C ATOM 179 C LEU A2071 17.364 -13.993 -20.618 1.00 0.00 C ATOM 180 O LEU A2071 18.592 -14.066 -20.656 1.00 0.00 O ATOM 181 CB LEU A2071 15.988 -12.727 -18.843 1.00 0.00 C ATOM 182 CG LEU A2071 16.909 -12.885 -17.617 1.00 0.00 C ATOM 183 CD1 LEU A2071 16.101 -12.563 -16.359 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.481 -14.295 -17.437 1.00 0.00 C ATOM 0 H LEU A2071 14.743 -12.283 -20.889 1.00 0.00 H new ATOM 0 HA LEU A2071 17.485 -11.928 -20.134 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.403 -11.816 -18.718 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.284 -13.559 -18.853 1.00 0.00 H new ATOM 0 HG LEU A2071 17.748 -12.208 -17.778 1.00 0.00 H new ATOM 0 HD11 LEU A2071 16.737 -12.670 -15.481 1.00 0.00 H new ATOM 0 HD12 LEU A2071 15.731 -11.539 -16.417 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.258 -13.250 -16.282 1.00 0.00 H new ATOM 0 HD21 LEU A2071 18.117 -14.319 -16.552 1.00 0.00 H new ATOM 0 HD22 LEU A2071 16.664 -15.006 -17.316 1.00 0.00 H new ATOM 0 HD23 LEU A2071 18.069 -14.564 -18.314 1.00 0.00 H new ATOM 196 N LEU A2072 16.583 -15.020 -20.979 1.00 0.00 N ATOM 197 CA LEU A2072 17.107 -16.319 -21.425 1.00 0.00 C ATOM 198 C LEU A2072 17.992 -16.212 -22.680 1.00 0.00 C ATOM 199 O LEU A2072 19.084 -16.786 -22.701 1.00 0.00 O ATOM 200 CB LEU A2072 15.947 -17.303 -21.664 1.00 0.00 C ATOM 201 CG LEU A2072 15.259 -17.824 -20.388 1.00 0.00 C ATOM 202 CD1 LEU A2072 14.050 -18.668 -20.795 1.00 0.00 C ATOM 203 CD2 LEU A2072 16.185 -18.699 -19.536 1.00 0.00 C ATOM 0 H LEU A2072 15.564 -14.973 -20.970 1.00 0.00 H new ATOM 0 HA LEU A2072 17.747 -16.695 -20.627 1.00 0.00 H new ATOM 0 HB2 LEU A2072 15.199 -16.814 -22.288 1.00 0.00 H new ATOM 0 HB3 LEU A2072 16.325 -18.156 -22.229 1.00 0.00 H new ATOM 0 HG LEU A2072 14.971 -16.957 -19.793 1.00 0.00 H new ATOM 0 HD11 LEU A2072 13.552 -19.045 -19.902 1.00 0.00 H new ATOM 0 HD12 LEU A2072 13.354 -18.055 -21.367 1.00 0.00 H new ATOM 0 HD13 LEU A2072 14.381 -19.507 -21.407 1.00 0.00 H new ATOM 0 HD21 LEU A2072 15.650 -19.039 -18.649 1.00 0.00 H new ATOM 0 HD22 LEU A2072 16.508 -19.562 -20.119 1.00 0.00 H new ATOM 0 HD23 LEU A2072 17.057 -18.119 -19.233 1.00 0.00 H new ATOM 215 N ARG A2073 17.571 -15.462 -23.715 1.00 0.00 N ATOM 216 CA ARG A2073 18.381 -15.274 -24.940 1.00 0.00 C ATOM 217 C ARG A2073 19.719 -14.576 -24.645 1.00 0.00 C ATOM 218 O ARG A2073 20.711 -14.840 -25.320 1.00 0.00 O ATOM 219 CB ARG A2073 17.557 -14.599 -26.062 1.00 0.00 C ATOM 220 CG ARG A2073 17.678 -13.067 -26.119 1.00 0.00 C ATOM 221 CD ARG A2073 16.517 -12.381 -26.844 1.00 0.00 C ATOM 222 NE ARG A2073 16.534 -12.551 -28.305 1.00 0.00 N ATOM 223 CZ ARG A2073 15.673 -11.985 -29.134 1.00 0.00 C ATOM 224 NH1 ARG A2073 14.704 -11.217 -28.715 1.00 0.00 N ATOM 225 NH2 ARG A2073 15.771 -12.181 -30.419 1.00 0.00 N ATOM 0 H ARG A2073 16.675 -14.975 -23.730 1.00 0.00 H new ATOM 0 HA ARG A2073 18.652 -16.259 -25.320 1.00 0.00 H new ATOM 0 HB2 ARG A2073 17.871 -15.010 -27.021 1.00 0.00 H new ATOM 0 HB3 ARG A2073 16.507 -14.862 -25.931 1.00 0.00 H new ATOM 0 HG2 ARG A2073 17.739 -12.679 -25.102 1.00 0.00 H new ATOM 0 HG3 ARG A2073 18.611 -12.804 -26.617 1.00 0.00 H new ATOM 0 HD2 ARG A2073 15.578 -12.773 -26.455 1.00 0.00 H new ATOM 0 HD3 ARG A2073 16.538 -11.316 -26.613 1.00 0.00 H new ATOM 0 HE ARG A2073 17.259 -13.146 -28.706 1.00 0.00 H new ATOM 0 HH11 ARG A2073 14.592 -11.036 -27.717 1.00 0.00 H new ATOM 0 HH12 ARG A2073 14.059 -10.798 -29.385 1.00 0.00 H new ATOM 0 HH21 ARG A2073 16.514 -12.773 -30.789 1.00 0.00 H new ATOM 0 HH22 ARG A2073 15.104 -11.742 -31.054 1.00 0.00 H new ATOM 239 N THR A2074 19.751 -13.724 -23.614 1.00 0.00 N ATOM 240 CA THR A2074 20.957 -13.018 -23.149 1.00 0.00 C ATOM 241 C THR A2074 21.847 -13.943 -22.307 1.00 0.00 C ATOM 242 O THR A2074 23.061 -13.968 -22.501 1.00 0.00 O ATOM 243 CB THR A2074 20.577 -11.761 -22.351 1.00 0.00 C ATOM 244 OG1 THR A2074 19.751 -10.918 -23.124 1.00 0.00 O ATOM 245 CG2 THR A2074 21.797 -10.923 -21.985 1.00 0.00 C ATOM 0 H THR A2074 18.921 -13.499 -23.065 1.00 0.00 H new ATOM 0 HA THR A2074 21.525 -12.710 -24.027 1.00 0.00 H new ATOM 0 HB THR A2074 20.075 -12.119 -21.452 1.00 0.00 H new ATOM 0 HG1 THR A2074 18.825 -11.236 -23.079 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.480 -10.045 -21.422 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.478 -11.518 -21.376 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.307 -10.606 -22.895 1.00 0.00 H new ATOM 253 N LEU A2075 21.267 -14.752 -21.410 1.00 0.00 N ATOM 254 CA LEU A2075 21.983 -15.744 -20.590 1.00 0.00 C ATOM 255 C LEU A2075 22.753 -16.758 -21.463 1.00 0.00 C ATOM 256 O LEU A2075 23.851 -17.182 -21.100 1.00 0.00 O ATOM 257 CB LEU A2075 20.959 -16.432 -19.662 1.00 0.00 C ATOM 258 CG LEU A2075 21.462 -17.673 -18.898 1.00 0.00 C ATOM 259 CD1 LEU A2075 22.647 -17.392 -17.971 1.00 0.00 C ATOM 260 CD2 LEU A2075 20.322 -18.248 -18.061 1.00 0.00 C ATOM 0 H LEU A2075 20.263 -14.736 -21.229 1.00 0.00 H new ATOM 0 HA LEU A2075 22.740 -15.245 -19.984 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.609 -15.700 -18.934 1.00 0.00 H new ATOM 0 HB3 LEU A2075 20.096 -16.724 -20.260 1.00 0.00 H new ATOM 0 HG LEU A2075 21.806 -18.377 -19.656 1.00 0.00 H new ATOM 0 HD11 LEU A2075 22.943 -18.313 -17.469 1.00 0.00 H new ATOM 0 HD12 LEU A2075 23.485 -17.012 -18.556 1.00 0.00 H new ATOM 0 HD13 LEU A2075 22.359 -16.650 -17.226 1.00 0.00 H new ATOM 0 HD21 LEU A2075 20.675 -19.126 -17.520 1.00 0.00 H new ATOM 0 HD22 LEU A2075 19.978 -17.497 -17.350 1.00 0.00 H new ATOM 0 HD23 LEU A2075 19.498 -18.532 -18.715 1.00 0.00 H new ATOM 272 N LYS A2076 22.192 -17.132 -22.623 1.00 0.00 N ATOM 273 CA LYS A2076 22.811 -18.059 -23.592 1.00 0.00 C ATOM 274 C LYS A2076 24.136 -17.569 -24.212 1.00 0.00 C ATOM 275 O LYS A2076 24.872 -18.390 -24.766 1.00 0.00 O ATOM 276 CB LYS A2076 21.785 -18.421 -24.684 1.00 0.00 C ATOM 277 CG LYS A2076 20.836 -19.563 -24.270 1.00 0.00 C ATOM 278 CD LYS A2076 21.498 -20.951 -24.173 1.00 0.00 C ATOM 279 CE LYS A2076 22.056 -21.431 -25.523 1.00 0.00 C ATOM 280 NZ LYS A2076 22.707 -22.762 -25.410 1.00 0.00 N ATOM 0 H LYS A2076 21.278 -16.794 -22.923 1.00 0.00 H new ATOM 0 HA LYS A2076 23.093 -18.946 -23.025 1.00 0.00 H new ATOM 0 HB2 LYS A2076 21.195 -17.537 -24.927 1.00 0.00 H new ATOM 0 HB3 LYS A2076 22.316 -18.709 -25.591 1.00 0.00 H new ATOM 0 HG2 LYS A2076 20.395 -19.318 -23.304 1.00 0.00 H new ATOM 0 HG3 LYS A2076 20.018 -19.616 -24.989 1.00 0.00 H new ATOM 0 HD2 LYS A2076 22.305 -20.915 -23.442 1.00 0.00 H new ATOM 0 HD3 LYS A2076 20.768 -21.674 -23.807 1.00 0.00 H new ATOM 0 HE2 LYS A2076 21.248 -21.483 -26.253 1.00 0.00 H new ATOM 0 HE3 LYS A2076 22.777 -20.704 -25.897 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 23.070 -23.051 -26.341 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 23.494 -22.707 -24.733 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 22.013 -23.461 -25.077 1.00 0.00 H new ATOM 294 N SER A2077 24.464 -16.280 -24.113 1.00 0.00 N ATOM 295 CA SER A2077 25.735 -15.699 -24.586 1.00 0.00 C ATOM 296 C SER A2077 26.944 -16.216 -23.771 1.00 0.00 C ATOM 297 O SER A2077 26.757 -16.728 -22.662 1.00 0.00 O ATOM 298 CB SER A2077 25.653 -14.171 -24.456 1.00 0.00 C ATOM 299 OG SER A2077 24.695 -13.653 -25.365 1.00 0.00 O ATOM 0 H SER A2077 23.843 -15.589 -23.693 1.00 0.00 H new ATOM 0 HA SER A2077 25.884 -15.996 -25.624 1.00 0.00 H new ATOM 0 HB2 SER A2077 25.381 -13.900 -23.436 1.00 0.00 H new ATOM 0 HB3 SER A2077 26.629 -13.729 -24.654 1.00 0.00 H new ATOM 0 HG SER A2077 24.650 -12.678 -25.272 1.00 0.00 H new ATOM 305 N PRO A2078 28.196 -16.082 -24.258 1.00 0.00 N ATOM 306 CA PRO A2078 29.382 -16.489 -23.495 1.00 0.00 C ATOM 307 C PRO A2078 29.595 -15.601 -22.255 1.00 0.00 C ATOM 308 O PRO A2078 29.059 -14.489 -22.168 1.00 0.00 O ATOM 309 CB PRO A2078 30.553 -16.383 -24.479 1.00 0.00 C ATOM 310 CG PRO A2078 30.101 -15.299 -25.455 1.00 0.00 C ATOM 311 CD PRO A2078 28.593 -15.527 -25.548 1.00 0.00 C ATOM 0 HA PRO A2078 29.279 -17.501 -23.104 1.00 0.00 H new ATOM 0 HB2 PRO A2078 31.478 -16.107 -23.973 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.737 -17.329 -24.987 1.00 0.00 H new ATOM 0 HG2 PRO A2078 30.336 -14.301 -25.086 1.00 0.00 H new ATOM 0 HG3 PRO A2078 30.585 -15.403 -26.426 1.00 0.00 H new ATOM 0 HD2 PRO A2078 28.068 -14.594 -25.751 1.00 0.00 H new ATOM 0 HD3 PRO A2078 28.350 -16.212 -26.360 1.00 0.00 H new ATOM 319 N SER A2079 30.383 -16.081 -21.288 1.00 0.00 N ATOM 320 CA SER A2079 30.722 -15.373 -20.039 1.00 0.00 C ATOM 321 C SER A2079 31.418 -14.036 -20.339 1.00 0.00 C ATOM 322 O SER A2079 32.591 -14.011 -20.722 1.00 0.00 O ATOM 323 CB SER A2079 31.615 -16.250 -19.151 1.00 0.00 C ATOM 324 OG SER A2079 30.965 -17.478 -18.859 1.00 0.00 O ATOM 0 H SER A2079 30.819 -17.001 -21.350 1.00 0.00 H new ATOM 0 HA SER A2079 29.795 -15.164 -19.505 1.00 0.00 H new ATOM 0 HB2 SER A2079 32.563 -16.443 -19.654 1.00 0.00 H new ATOM 0 HB3 SER A2079 31.847 -15.724 -18.225 1.00 0.00 H new ATOM 0 HG SER A2079 31.546 -18.029 -18.293 1.00 0.00 H new ATOM 330 N SER A2080 30.684 -12.923 -20.223 1.00 0.00 N ATOM 331 CA SER A2080 31.165 -11.582 -20.586 1.00 0.00 C ATOM 332 C SER A2080 30.376 -10.441 -19.917 1.00 0.00 C ATOM 333 O SER A2080 29.205 -10.623 -19.563 1.00 0.00 O ATOM 334 CB SER A2080 31.031 -11.428 -22.113 1.00 0.00 C ATOM 335 OG SER A2080 29.678 -11.558 -22.529 1.00 0.00 O ATOM 0 H SER A2080 29.727 -12.927 -19.870 1.00 0.00 H new ATOM 0 HA SER A2080 32.196 -11.503 -20.241 1.00 0.00 H new ATOM 0 HB2 SER A2080 31.415 -10.454 -22.417 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.641 -12.181 -22.611 1.00 0.00 H new ATOM 0 HG SER A2080 29.398 -12.493 -22.442 1.00 0.00 H new ATOM 341 N PRO A2081 30.966 -9.234 -19.775 1.00 0.00 N ATOM 342 CA PRO A2081 30.261 -8.068 -19.235 1.00 0.00 C ATOM 343 C PRO A2081 29.123 -7.588 -20.157 1.00 0.00 C ATOM 344 O PRO A2081 28.220 -6.883 -19.706 1.00 0.00 O ATOM 345 CB PRO A2081 31.335 -6.999 -19.013 1.00 0.00 C ATOM 346 CG PRO A2081 32.422 -7.355 -20.024 1.00 0.00 C ATOM 347 CD PRO A2081 32.337 -8.878 -20.129 1.00 0.00 C ATOM 0 HA PRO A2081 29.756 -8.311 -18.300 1.00 0.00 H new ATOM 0 HB2 PRO A2081 30.943 -5.997 -19.185 1.00 0.00 H new ATOM 0 HB3 PRO A2081 31.716 -7.022 -17.992 1.00 0.00 H new ATOM 0 HG2 PRO A2081 32.244 -6.877 -20.987 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.406 -7.032 -19.684 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.578 -9.213 -21.138 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.049 -9.355 -19.456 1.00 0.00 H new ATOM 355 N GLN A2082 29.116 -7.986 -21.438 1.00 0.00 N ATOM 356 CA GLN A2082 28.057 -7.650 -22.397 1.00 0.00 C ATOM 357 C GLN A2082 26.716 -8.280 -21.980 1.00 0.00 C ATOM 358 O GLN A2082 25.711 -7.569 -21.897 1.00 0.00 O ATOM 359 CB GLN A2082 28.460 -8.096 -23.817 1.00 0.00 C ATOM 360 CG GLN A2082 29.485 -7.162 -24.487 1.00 0.00 C ATOM 361 CD GLN A2082 30.837 -7.104 -23.775 1.00 0.00 C ATOM 362 OE1 GLN A2082 31.465 -8.111 -23.482 1.00 0.00 O ATOM 363 NE2 GLN A2082 31.330 -5.930 -23.441 1.00 0.00 N ATOM 0 H GLN A2082 29.858 -8.559 -21.841 1.00 0.00 H new ATOM 0 HA GLN A2082 27.927 -6.568 -22.401 1.00 0.00 H new ATOM 0 HB2 GLN A2082 28.875 -9.103 -23.769 1.00 0.00 H new ATOM 0 HB3 GLN A2082 27.567 -8.149 -24.440 1.00 0.00 H new ATOM 0 HG2 GLN A2082 29.642 -7.490 -25.515 1.00 0.00 H new ATOM 0 HG3 GLN A2082 29.068 -6.156 -24.533 1.00 0.00 H new ATOM 0 HE21 GLN A2082 30.822 -5.078 -23.676 1.00 0.00 H new ATOM 0 HE22 GLN A2082 32.221 -5.873 -22.947 1.00 0.00 H new ATOM 372 N GLN A2083 26.686 -9.583 -21.657 1.00 0.00 N ATOM 373 CA GLN A2083 25.451 -10.229 -21.180 1.00 0.00 C ATOM 374 C GLN A2083 25.021 -9.698 -19.802 1.00 0.00 C ATOM 375 O GLN A2083 23.830 -9.526 -19.543 1.00 0.00 O ATOM 376 CB GLN A2083 25.558 -11.765 -21.184 1.00 0.00 C ATOM 377 CG GLN A2083 26.579 -12.402 -20.225 1.00 0.00 C ATOM 378 CD GLN A2083 26.169 -13.824 -19.852 1.00 0.00 C ATOM 379 OE1 GLN A2083 25.270 -14.052 -19.054 1.00 0.00 O ATOM 380 NE2 GLN A2083 26.810 -14.827 -20.400 1.00 0.00 N ATOM 0 H GLN A2083 27.493 -10.205 -21.716 1.00 0.00 H new ATOM 0 HA GLN A2083 24.668 -9.962 -21.890 1.00 0.00 H new ATOM 0 HB2 GLN A2083 24.575 -12.173 -20.950 1.00 0.00 H new ATOM 0 HB3 GLN A2083 25.802 -12.084 -22.197 1.00 0.00 H new ATOM 0 HG2 GLN A2083 27.563 -12.415 -20.693 1.00 0.00 H new ATOM 0 HG3 GLN A2083 26.663 -11.796 -19.323 1.00 0.00 H new ATOM 0 HE21 GLN A2083 27.561 -14.649 -21.067 1.00 0.00 H new ATOM 0 HE22 GLN A2083 26.558 -15.786 -20.160 1.00 0.00 H new ATOM 389 N GLN A2084 25.996 -9.392 -18.938 1.00 0.00 N ATOM 390 CA GLN A2084 25.789 -8.836 -17.600 1.00 0.00 C ATOM 391 C GLN A2084 25.039 -7.497 -17.701 1.00 0.00 C ATOM 392 O GLN A2084 24.001 -7.314 -17.065 1.00 0.00 O ATOM 393 CB GLN A2084 27.178 -8.703 -16.951 1.00 0.00 C ATOM 394 CG GLN A2084 27.199 -8.385 -15.450 1.00 0.00 C ATOM 395 CD GLN A2084 28.635 -8.247 -14.924 1.00 0.00 C ATOM 396 OE1 GLN A2084 29.611 -8.137 -15.656 1.00 0.00 O ATOM 397 NE2 GLN A2084 28.840 -8.252 -13.629 1.00 0.00 N ATOM 0 H GLN A2084 26.982 -9.530 -19.160 1.00 0.00 H new ATOM 0 HA GLN A2084 25.168 -9.480 -16.977 1.00 0.00 H new ATOM 0 HB2 GLN A2084 27.721 -9.634 -17.111 1.00 0.00 H new ATOM 0 HB3 GLN A2084 27.727 -7.920 -17.474 1.00 0.00 H new ATOM 0 HG2 GLN A2084 26.652 -7.460 -15.265 1.00 0.00 H new ATOM 0 HG3 GLN A2084 26.684 -9.174 -14.903 1.00 0.00 H new ATOM 0 HE21 GLN A2084 28.052 -8.342 -12.988 1.00 0.00 H new ATOM 0 HE22 GLN A2084 29.788 -8.166 -13.262 1.00 0.00 H new ATOM 406 N GLN A2085 25.520 -6.585 -18.555 1.00 0.00 N ATOM 407 CA GLN A2085 24.877 -5.297 -18.810 1.00 0.00 C ATOM 408 C GLN A2085 23.506 -5.465 -19.483 1.00 0.00 C ATOM 409 O GLN A2085 22.562 -4.787 -19.086 1.00 0.00 O ATOM 410 CB GLN A2085 25.811 -4.412 -19.654 1.00 0.00 C ATOM 411 CG GLN A2085 25.297 -2.970 -19.807 1.00 0.00 C ATOM 412 CD GLN A2085 25.186 -2.233 -18.471 1.00 0.00 C ATOM 413 OE1 GLN A2085 26.163 -2.026 -17.761 1.00 0.00 O ATOM 414 NE2 GLN A2085 24.007 -1.813 -18.067 1.00 0.00 N ATOM 0 H GLN A2085 26.376 -6.725 -19.092 1.00 0.00 H new ATOM 0 HA GLN A2085 24.695 -4.808 -17.853 1.00 0.00 H new ATOM 0 HB2 GLN A2085 26.799 -4.393 -19.193 1.00 0.00 H new ATOM 0 HB3 GLN A2085 25.929 -4.857 -20.642 1.00 0.00 H new ATOM 0 HG2 GLN A2085 25.968 -2.418 -20.466 1.00 0.00 H new ATOM 0 HG3 GLN A2085 24.320 -2.987 -20.289 1.00 0.00 H new ATOM 0 HE21 GLN A2085 23.182 -1.976 -18.644 1.00 0.00 H new ATOM 0 HE22 GLN A2085 23.917 -1.324 -17.176 1.00 0.00 H new ATOM 423 N GLN A2086 23.355 -6.355 -20.472 1.00 0.00 N ATOM 424 CA GLN A2086 22.059 -6.557 -21.136 1.00 0.00 C ATOM 425 C GLN A2086 20.972 -7.086 -20.194 1.00 0.00 C ATOM 426 O GLN A2086 19.859 -6.563 -20.229 1.00 0.00 O ATOM 427 CB GLN A2086 22.187 -7.440 -22.388 1.00 0.00 C ATOM 428 CG GLN A2086 22.469 -6.623 -23.657 1.00 0.00 C ATOM 429 CD GLN A2086 21.325 -5.663 -23.992 1.00 0.00 C ATOM 430 OE1 GLN A2086 21.382 -4.466 -23.736 1.00 0.00 O ATOM 431 NE2 GLN A2086 20.230 -6.144 -24.539 1.00 0.00 N ATOM 0 H GLN A2086 24.108 -6.943 -20.829 1.00 0.00 H new ATOM 0 HA GLN A2086 21.735 -5.566 -21.455 1.00 0.00 H new ATOM 0 HB2 GLN A2086 22.990 -8.162 -22.239 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.267 -8.009 -22.523 1.00 0.00 H new ATOM 0 HG2 GLN A2086 23.390 -6.056 -23.525 1.00 0.00 H new ATOM 0 HG3 GLN A2086 22.630 -7.301 -24.495 1.00 0.00 H new ATOM 0 HE21 GLN A2086 20.164 -7.138 -24.759 1.00 0.00 H new ATOM 0 HE22 GLN A2086 19.447 -5.523 -24.743 1.00 0.00 H new ATOM 440 N VAL A2087 21.258 -8.057 -19.315 1.00 0.00 N ATOM 441 CA VAL A2087 20.255 -8.518 -18.334 1.00 0.00 C ATOM 442 C VAL A2087 19.859 -7.365 -17.408 1.00 0.00 C ATOM 443 O VAL A2087 18.671 -7.160 -17.168 1.00 0.00 O ATOM 444 CB VAL A2087 20.728 -9.759 -17.554 1.00 0.00 C ATOM 445 CG1 VAL A2087 19.821 -10.104 -16.364 1.00 0.00 C ATOM 446 CG2 VAL A2087 20.733 -10.969 -18.499 1.00 0.00 C ATOM 0 H VAL A2087 22.158 -8.534 -19.259 1.00 0.00 H new ATOM 0 HA VAL A2087 19.366 -8.835 -18.880 1.00 0.00 H new ATOM 0 HB VAL A2087 21.721 -9.529 -17.169 1.00 0.00 H new ATOM 0 HG11 VAL A2087 20.208 -10.987 -15.856 1.00 0.00 H new ATOM 0 HG12 VAL A2087 19.799 -9.265 -15.668 1.00 0.00 H new ATOM 0 HG13 VAL A2087 18.811 -10.305 -16.722 1.00 0.00 H new ATOM 0 HG21 VAL A2087 21.067 -11.853 -17.956 1.00 0.00 H new ATOM 0 HG22 VAL A2087 19.726 -11.136 -18.881 1.00 0.00 H new ATOM 0 HG23 VAL A2087 21.410 -10.778 -19.332 1.00 0.00 H new ATOM 456 N LEU A2088 20.819 -6.554 -16.949 1.00 0.00 N ATOM 457 CA LEU A2088 20.529 -5.365 -16.139 1.00 0.00 C ATOM 458 C LEU A2088 19.678 -4.342 -16.916 1.00 0.00 C ATOM 459 O LEU A2088 18.753 -3.769 -16.345 1.00 0.00 O ATOM 460 CB LEU A2088 21.847 -4.752 -15.633 1.00 0.00 C ATOM 461 CG LEU A2088 22.560 -5.627 -14.583 1.00 0.00 C ATOM 462 CD1 LEU A2088 23.996 -5.144 -14.409 1.00 0.00 C ATOM 463 CD2 LEU A2088 21.866 -5.572 -13.220 1.00 0.00 C ATOM 0 H LEU A2088 21.812 -6.702 -17.127 1.00 0.00 H new ATOM 0 HA LEU A2088 19.934 -5.664 -15.276 1.00 0.00 H new ATOM 0 HB2 LEU A2088 22.515 -4.594 -16.479 1.00 0.00 H new ATOM 0 HB3 LEU A2088 21.642 -3.772 -15.202 1.00 0.00 H new ATOM 0 HG LEU A2088 22.531 -6.655 -14.944 1.00 0.00 H new ATOM 0 HD11 LEU A2088 24.500 -5.762 -13.667 1.00 0.00 H new ATOM 0 HD12 LEU A2088 24.522 -5.217 -15.361 1.00 0.00 H new ATOM 0 HD13 LEU A2088 23.993 -4.106 -14.075 1.00 0.00 H new ATOM 0 HD21 LEU A2088 22.403 -6.203 -12.512 1.00 0.00 H new ATOM 0 HD22 LEU A2088 21.859 -4.544 -12.857 1.00 0.00 H new ATOM 0 HD23 LEU A2088 20.841 -5.929 -13.319 1.00 0.00 H new ATOM 475 N ASN A2089 19.928 -4.144 -18.217 1.00 0.00 N ATOM 476 CA ASN A2089 19.132 -3.252 -19.073 1.00 0.00 C ATOM 477 C ASN A2089 17.673 -3.748 -19.179 1.00 0.00 C ATOM 478 O ASN A2089 16.734 -2.967 -19.024 1.00 0.00 O ATOM 479 CB ASN A2089 19.768 -3.135 -20.475 1.00 0.00 C ATOM 480 CG ASN A2089 21.114 -2.425 -20.523 1.00 0.00 C ATOM 481 OD1 ASN A2089 21.547 -1.748 -19.600 1.00 0.00 O ATOM 482 ND2 ASN A2089 21.831 -2.553 -21.617 1.00 0.00 N ATOM 0 H ASN A2089 20.695 -4.602 -18.710 1.00 0.00 H new ATOM 0 HA ASN A2089 19.122 -2.263 -18.615 1.00 0.00 H new ATOM 0 HB2 ASN A2089 19.890 -4.138 -20.885 1.00 0.00 H new ATOM 0 HB3 ASN A2089 19.074 -2.606 -21.128 1.00 0.00 H new ATOM 0 HD21 ASN A2089 22.737 -2.091 -21.690 1.00 0.00 H new ATOM 0 HD22 ASN A2089 21.481 -3.115 -22.393 1.00 0.00 H new ATOM 489 N ILE A2090 17.478 -5.053 -19.410 1.00 0.00 N ATOM 490 CA ILE A2090 16.162 -5.712 -19.498 1.00 0.00 C ATOM 491 C ILE A2090 15.409 -5.603 -18.156 1.00 0.00 C ATOM 492 O ILE A2090 14.215 -5.282 -18.125 1.00 0.00 O ATOM 493 CB ILE A2090 16.362 -7.179 -19.961 1.00 0.00 C ATOM 494 CG1 ILE A2090 16.882 -7.220 -21.422 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.067 -8.006 -19.855 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.594 -8.529 -21.789 1.00 0.00 C ATOM 0 H ILE A2090 18.253 -5.702 -19.545 1.00 0.00 H new ATOM 0 HA ILE A2090 15.537 -5.211 -20.237 1.00 0.00 H new ATOM 0 HB ILE A2090 17.100 -7.624 -19.293 1.00 0.00 H new ATOM 0 HG12 ILE A2090 16.042 -7.071 -22.101 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.569 -6.388 -21.577 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.258 -9.025 -20.190 1.00 0.00 H new ATOM 0 HG22 ILE A2090 14.729 -8.022 -18.819 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.296 -7.557 -20.481 1.00 0.00 H new ATOM 0 HD11 ILE A2090 17.929 -8.483 -22.825 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.455 -8.671 -21.135 1.00 0.00 H new ATOM 0 HD13 ILE A2090 16.905 -9.365 -21.668 1.00 0.00 H new ATOM 508 N LEU A2091 16.103 -5.822 -17.033 1.00 0.00 N ATOM 509 CA LEU A2091 15.539 -5.706 -15.684 1.00 0.00 C ATOM 510 C LEU A2091 15.225 -4.251 -15.292 1.00 0.00 C ATOM 511 O LEU A2091 14.239 -4.018 -14.594 1.00 0.00 O ATOM 512 CB LEU A2091 16.481 -6.365 -14.666 1.00 0.00 C ATOM 513 CG LEU A2091 16.568 -7.902 -14.752 1.00 0.00 C ATOM 514 CD1 LEU A2091 17.620 -8.399 -13.760 1.00 0.00 C ATOM 515 CD2 LEU A2091 15.242 -8.586 -14.414 1.00 0.00 C ATOM 0 H LEU A2091 17.087 -6.089 -17.037 1.00 0.00 H new ATOM 0 HA LEU A2091 14.584 -6.232 -15.681 1.00 0.00 H new ATOM 0 HB2 LEU A2091 17.481 -5.952 -14.800 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.155 -6.091 -13.663 1.00 0.00 H new ATOM 0 HG LEU A2091 16.829 -8.152 -15.780 1.00 0.00 H new ATOM 0 HD11 LEU A2091 17.687 -9.486 -13.815 1.00 0.00 H new ATOM 0 HD12 LEU A2091 18.588 -7.963 -14.007 1.00 0.00 H new ATOM 0 HD13 LEU A2091 17.336 -8.104 -12.750 1.00 0.00 H new ATOM 0 HD21 LEU A2091 15.360 -9.667 -14.490 1.00 0.00 H new ATOM 0 HD22 LEU A2091 14.946 -8.324 -13.398 1.00 0.00 H new ATOM 0 HD23 LEU A2091 14.473 -8.255 -15.112 1.00 0.00 H new ATOM 527 N LYS A2092 15.991 -3.254 -15.764 1.00 0.00 N ATOM 528 CA LYS A2092 15.712 -1.821 -15.525 1.00 0.00 C ATOM 529 C LYS A2092 14.366 -1.376 -16.118 1.00 0.00 C ATOM 530 O LYS A2092 13.764 -0.436 -15.602 1.00 0.00 O ATOM 531 CB LYS A2092 16.873 -0.949 -16.043 1.00 0.00 C ATOM 532 CG LYS A2092 18.047 -0.864 -15.049 1.00 0.00 C ATOM 533 CD LYS A2092 18.010 0.375 -14.136 1.00 0.00 C ATOM 534 CE LYS A2092 16.739 0.478 -13.280 1.00 0.00 C ATOM 535 NZ LYS A2092 16.765 1.681 -12.406 1.00 0.00 N ATOM 0 H LYS A2092 16.827 -3.416 -16.326 1.00 0.00 H new ATOM 0 HA LYS A2092 15.632 -1.683 -14.447 1.00 0.00 H new ATOM 0 HB2 LYS A2092 17.232 -1.355 -16.988 1.00 0.00 H new ATOM 0 HB3 LYS A2092 16.503 0.056 -16.248 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.048 -1.760 -14.428 1.00 0.00 H new ATOM 0 HG3 LYS A2092 18.983 -0.862 -15.608 1.00 0.00 H new ATOM 0 HD2 LYS A2092 18.879 0.356 -13.478 1.00 0.00 H new ATOM 0 HD3 LYS A2092 18.096 1.271 -14.751 1.00 0.00 H new ATOM 0 HE2 LYS A2092 15.864 0.518 -13.929 1.00 0.00 H new ATOM 0 HE3 LYS A2092 16.640 -0.417 -12.666 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 15.892 1.719 -11.842 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 17.586 1.630 -11.770 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 16.835 2.536 -12.994 1.00 0.00 H new ATOM 549 N SER A2093 13.865 -2.077 -17.138 1.00 0.00 N ATOM 550 CA SER A2093 12.532 -1.858 -17.734 1.00 0.00 C ATOM 551 C SER A2093 11.418 -2.624 -16.988 1.00 0.00 C ATOM 552 O SER A2093 10.239 -2.470 -17.308 1.00 0.00 O ATOM 553 CB SER A2093 12.536 -2.261 -19.214 1.00 0.00 C ATOM 554 OG SER A2093 13.446 -1.446 -19.940 1.00 0.00 O ATOM 0 H SER A2093 14.382 -2.832 -17.588 1.00 0.00 H new ATOM 0 HA SER A2093 12.316 -0.794 -17.642 1.00 0.00 H new ATOM 0 HB2 SER A2093 12.817 -3.310 -19.313 1.00 0.00 H new ATOM 0 HB3 SER A2093 11.533 -2.159 -19.629 1.00 0.00 H new ATOM 0 HG SER A2093 13.443 -1.712 -20.883 1.00 0.00 H new ATOM 560 N ASN A2094 11.776 -3.431 -15.978 1.00 0.00 N ATOM 561 CA ASN A2094 10.886 -4.229 -15.124 1.00 0.00 C ATOM 562 C ASN A2094 11.335 -4.173 -13.633 1.00 0.00 C ATOM 563 O ASN A2094 11.575 -5.227 -13.032 1.00 0.00 O ATOM 564 CB ASN A2094 10.869 -5.676 -15.678 1.00 0.00 C ATOM 565 CG ASN A2094 10.353 -5.797 -17.103 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.167 -5.980 -17.344 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.219 -5.723 -18.091 1.00 0.00 N ATOM 0 H ASN A2094 12.756 -3.551 -15.721 1.00 0.00 H new ATOM 0 HA ASN A2094 9.875 -3.823 -15.145 1.00 0.00 H new ATOM 0 HB2 ASN A2094 11.880 -6.080 -15.635 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.251 -6.294 -15.027 1.00 0.00 H new ATOM 0 HD21 ASN A2094 10.902 -5.818 -19.056 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.208 -5.571 -17.892 1.00 0.00 H new ATOM 574 N PRO A2095 11.493 -2.981 -13.005 1.00 0.00 N ATOM 575 CA PRO A2095 12.011 -2.858 -11.632 1.00 0.00 C ATOM 576 C PRO A2095 11.281 -3.667 -10.556 1.00 0.00 C ATOM 577 O PRO A2095 11.907 -4.106 -9.595 1.00 0.00 O ATOM 578 CB PRO A2095 11.953 -1.366 -11.284 1.00 0.00 C ATOM 579 CG PRO A2095 11.982 -0.677 -12.640 1.00 0.00 C ATOM 580 CD PRO A2095 11.221 -1.646 -13.534 1.00 0.00 C ATOM 0 HA PRO A2095 13.017 -3.278 -11.629 1.00 0.00 H new ATOM 0 HB2 PRO A2095 11.048 -1.119 -10.729 1.00 0.00 H new ATOM 0 HB3 PRO A2095 12.798 -1.066 -10.665 1.00 0.00 H new ATOM 0 HG2 PRO A2095 11.503 0.301 -12.606 1.00 0.00 H new ATOM 0 HG3 PRO A2095 13.002 -0.520 -12.991 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.152 -1.432 -13.521 1.00 0.00 H new ATOM 0 HD3 PRO A2095 11.550 -1.562 -14.570 1.00 0.00 H new ATOM 588 N GLN A2096 9.966 -3.858 -10.704 1.00 0.00 N ATOM 589 CA GLN A2096 9.086 -4.543 -9.745 1.00 0.00 C ATOM 590 C GLN A2096 9.629 -5.902 -9.272 1.00 0.00 C ATOM 591 O GLN A2096 9.679 -6.166 -8.069 1.00 0.00 O ATOM 592 CB GLN A2096 7.689 -4.735 -10.371 1.00 0.00 C ATOM 593 CG GLN A2096 6.860 -3.457 -10.595 1.00 0.00 C ATOM 594 CD GLN A2096 7.472 -2.463 -11.581 1.00 0.00 C ATOM 595 OE1 GLN A2096 8.045 -1.451 -11.211 1.00 0.00 O ATOM 596 NE2 GLN A2096 7.438 -2.734 -12.868 1.00 0.00 N ATOM 0 H GLN A2096 9.463 -3.527 -11.527 1.00 0.00 H new ATOM 0 HA GLN A2096 9.032 -3.905 -8.863 1.00 0.00 H new ATOM 0 HB2 GLN A2096 7.810 -5.237 -11.331 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.117 -5.406 -9.731 1.00 0.00 H new ATOM 0 HG2 GLN A2096 5.870 -3.740 -10.953 1.00 0.00 H new ATOM 0 HG3 GLN A2096 6.721 -2.958 -9.636 1.00 0.00 H new ATOM 0 HE21 GLN A2096 6.965 -3.574 -13.200 1.00 0.00 H new ATOM 0 HE22 GLN A2096 7.885 -2.104 -13.534 1.00 0.00 H new ATOM 605 N LEU A2097 10.050 -6.758 -10.212 1.00 0.00 N ATOM 606 CA LEU A2097 10.584 -8.092 -9.912 1.00 0.00 C ATOM 607 C LEU A2097 12.078 -8.095 -9.541 1.00 0.00 C ATOM 608 O LEU A2097 12.502 -8.901 -8.711 1.00 0.00 O ATOM 609 CB LEU A2097 10.201 -9.088 -11.031 1.00 0.00 C ATOM 610 CG LEU A2097 10.441 -8.710 -12.511 1.00 0.00 C ATOM 611 CD1 LEU A2097 11.909 -8.627 -12.924 1.00 0.00 C ATOM 612 CD2 LEU A2097 9.789 -9.767 -13.405 1.00 0.00 C ATOM 0 H LEU A2097 10.029 -6.542 -11.209 1.00 0.00 H new ATOM 0 HA LEU A2097 10.106 -8.442 -8.997 1.00 0.00 H new ATOM 0 HB2 LEU A2097 10.742 -10.015 -10.840 1.00 0.00 H new ATOM 0 HB3 LEU A2097 9.140 -9.310 -10.920 1.00 0.00 H new ATOM 0 HG LEU A2097 10.012 -7.715 -12.627 1.00 0.00 H new ATOM 0 HD11 LEU A2097 11.976 -8.356 -13.978 1.00 0.00 H new ATOM 0 HD12 LEU A2097 12.414 -7.871 -12.322 1.00 0.00 H new ATOM 0 HD13 LEU A2097 12.386 -9.594 -12.767 1.00 0.00 H new ATOM 0 HD21 LEU A2097 9.953 -9.510 -14.451 1.00 0.00 H new ATOM 0 HD22 LEU A2097 10.231 -10.742 -13.198 1.00 0.00 H new ATOM 0 HD23 LEU A2097 8.718 -9.804 -13.204 1.00 0.00 H new ATOM 624 N MET A2098 12.872 -7.171 -10.093 1.00 0.00 N ATOM 625 CA MET A2098 14.305 -7.057 -9.799 1.00 0.00 C ATOM 626 C MET A2098 14.552 -6.534 -8.379 1.00 0.00 C ATOM 627 O MET A2098 15.382 -7.079 -7.652 1.00 0.00 O ATOM 628 CB MET A2098 14.958 -6.113 -10.821 1.00 0.00 C ATOM 629 CG MET A2098 16.482 -6.024 -10.629 1.00 0.00 C ATOM 630 SD MET A2098 17.301 -4.694 -11.550 1.00 0.00 S ATOM 631 CE MET A2098 16.720 -3.281 -10.578 1.00 0.00 C ATOM 0 H MET A2098 12.536 -6.477 -10.761 1.00 0.00 H new ATOM 0 HA MET A2098 14.747 -8.051 -9.868 1.00 0.00 H new ATOM 0 HB2 MET A2098 14.739 -6.463 -11.830 1.00 0.00 H new ATOM 0 HB3 MET A2098 14.522 -5.119 -10.727 1.00 0.00 H new ATOM 0 HG2 MET A2098 16.691 -5.891 -9.568 1.00 0.00 H new ATOM 0 HG3 MET A2098 16.925 -6.975 -10.924 1.00 0.00 H new ATOM 0 HE1 MET A2098 17.308 -2.399 -10.831 1.00 0.00 H new ATOM 0 HE2 MET A2098 15.670 -3.093 -10.801 1.00 0.00 H new ATOM 0 HE3 MET A2098 16.832 -3.499 -9.516 1.00 0.00 H new ATOM 641 N ALA A2099 13.839 -5.479 -7.980 1.00 0.00 N ATOM 642 CA ALA A2099 13.984 -4.838 -6.678 1.00 0.00 C ATOM 643 C ALA A2099 13.653 -5.780 -5.505 1.00 0.00 C ATOM 644 O ALA A2099 14.387 -5.823 -4.515 1.00 0.00 O ATOM 645 CB ALA A2099 13.127 -3.578 -6.679 1.00 0.00 C ATOM 0 H ALA A2099 13.131 -5.040 -8.568 1.00 0.00 H new ATOM 0 HA ALA A2099 15.029 -4.571 -6.521 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.216 -3.077 -5.715 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.466 -2.908 -7.469 1.00 0.00 H new ATOM 0 HB3 ALA A2099 12.085 -3.847 -6.853 1.00 0.00 H new ATOM 651 N ALA A2100 12.588 -6.580 -5.632 1.00 0.00 N ATOM 652 CA ALA A2100 12.211 -7.573 -4.624 1.00 0.00 C ATOM 653 C ALA A2100 13.302 -8.656 -4.462 1.00 0.00 C ATOM 654 O ALA A2100 13.604 -9.075 -3.345 1.00 0.00 O ATOM 655 CB ALA A2100 10.852 -8.168 -5.018 1.00 0.00 C ATOM 0 H ALA A2100 11.964 -6.556 -6.438 1.00 0.00 H new ATOM 0 HA ALA A2100 12.121 -7.097 -3.648 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.552 -8.911 -4.279 1.00 0.00 H new ATOM 0 HB2 ALA A2100 10.105 -7.375 -5.058 1.00 0.00 H new ATOM 0 HB3 ALA A2100 10.932 -8.641 -5.997 1.00 0.00 H new ATOM 661 N PHE A2101 13.923 -9.074 -5.571 1.00 0.00 N ATOM 662 CA PHE A2101 15.020 -10.046 -5.600 1.00 0.00 C ATOM 663 C PHE A2101 16.324 -9.492 -5.001 1.00 0.00 C ATOM 664 O PHE A2101 16.896 -10.116 -4.099 1.00 0.00 O ATOM 665 CB PHE A2101 15.214 -10.513 -7.056 1.00 0.00 C ATOM 666 CG PHE A2101 16.604 -11.026 -7.384 1.00 0.00 C ATOM 667 CD1 PHE A2101 17.050 -12.258 -6.867 1.00 0.00 C ATOM 668 CD2 PHE A2101 17.472 -10.240 -8.168 1.00 0.00 C ATOM 669 CE1 PHE A2101 18.358 -12.702 -7.132 1.00 0.00 C ATOM 670 CE2 PHE A2101 18.775 -10.690 -8.440 1.00 0.00 C ATOM 671 CZ PHE A2101 19.221 -11.918 -7.918 1.00 0.00 C ATOM 0 H PHE A2101 13.668 -8.735 -6.499 1.00 0.00 H new ATOM 0 HA PHE A2101 14.755 -10.894 -4.969 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.492 -11.302 -7.268 1.00 0.00 H new ATOM 0 HB3 PHE A2101 14.983 -9.682 -7.722 1.00 0.00 H new ATOM 0 HD1 PHE A2101 16.387 -12.863 -6.266 1.00 0.00 H new ATOM 0 HD2 PHE A2101 17.136 -9.291 -8.560 1.00 0.00 H new ATOM 0 HE1 PHE A2101 18.700 -13.645 -6.732 1.00 0.00 H new ATOM 0 HE2 PHE A2101 19.435 -10.092 -9.051 1.00 0.00 H new ATOM 0 HZ PHE A2101 20.226 -12.258 -8.121 1.00 0.00 H new ATOM 681 N ILE A2102 16.802 -8.329 -5.462 1.00 0.00 N ATOM 682 CA ILE A2102 18.064 -7.756 -4.970 1.00 0.00 C ATOM 683 C ILE A2102 18.020 -7.460 -3.468 1.00 0.00 C ATOM 684 O ILE A2102 19.019 -7.681 -2.783 1.00 0.00 O ATOM 685 CB ILE A2102 18.542 -6.568 -5.838 1.00 0.00 C ATOM 686 CG1 ILE A2102 20.055 -6.296 -5.656 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.688 -5.303 -5.668 1.00 0.00 C ATOM 688 CD1 ILE A2102 20.474 -5.386 -4.490 1.00 0.00 C ATOM 0 H ILE A2102 16.336 -7.766 -6.174 1.00 0.00 H new ATOM 0 HA ILE A2102 18.835 -8.518 -5.084 1.00 0.00 H new ATOM 0 HB ILE A2102 18.395 -6.872 -6.874 1.00 0.00 H new ATOM 0 HG12 ILE A2102 20.557 -7.255 -5.532 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.432 -5.856 -6.579 1.00 0.00 H new ATOM 0 HG21 ILE A2102 18.080 -4.511 -6.306 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.658 -5.519 -5.950 1.00 0.00 H new ATOM 0 HG23 ILE A2102 17.719 -4.980 -4.627 1.00 0.00 H new ATOM 0 HD11 ILE A2102 21.559 -5.282 -4.481 1.00 0.00 H new ATOM 0 HD12 ILE A2102 20.016 -4.404 -4.612 1.00 0.00 H new ATOM 0 HD13 ILE A2102 20.144 -5.826 -3.549 1.00 0.00 H new ATOM 700 N LYS A2103 16.868 -7.043 -2.919 1.00 0.00 N ATOM 701 CA LYS A2103 16.711 -6.788 -1.475 1.00 0.00 C ATOM 702 C LYS A2103 17.098 -8.001 -0.605 1.00 0.00 C ATOM 703 O LYS A2103 17.608 -7.821 0.499 1.00 0.00 O ATOM 704 CB LYS A2103 15.278 -6.290 -1.191 1.00 0.00 C ATOM 705 CG LYS A2103 15.117 -5.783 0.253 1.00 0.00 C ATOM 706 CD LYS A2103 13.711 -5.267 0.593 1.00 0.00 C ATOM 707 CE LYS A2103 13.298 -4.035 -0.223 1.00 0.00 C ATOM 708 NZ LYS A2103 12.111 -3.377 0.381 1.00 0.00 N ATOM 0 H LYS A2103 16.020 -6.873 -3.460 1.00 0.00 H new ATOM 0 HA LYS A2103 17.414 -6.005 -1.191 1.00 0.00 H new ATOM 0 HB2 LYS A2103 15.029 -5.488 -1.886 1.00 0.00 H new ATOM 0 HB3 LYS A2103 14.571 -7.100 -1.371 1.00 0.00 H new ATOM 0 HG2 LYS A2103 15.369 -6.592 0.939 1.00 0.00 H new ATOM 0 HG3 LYS A2103 15.836 -4.982 0.426 1.00 0.00 H new ATOM 0 HD2 LYS A2103 12.988 -6.065 0.422 1.00 0.00 H new ATOM 0 HD3 LYS A2103 13.669 -5.021 1.654 1.00 0.00 H new ATOM 0 HE2 LYS A2103 14.127 -3.329 -0.269 1.00 0.00 H new ATOM 0 HE3 LYS A2103 13.074 -4.330 -1.248 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 11.848 -2.546 -0.187 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 11.316 -4.047 0.402 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 12.337 -3.077 1.351 1.00 0.00 H new ATOM 722 N GLN A2104 16.922 -9.227 -1.112 1.00 0.00 N ATOM 723 CA GLN A2104 17.361 -10.456 -0.435 1.00 0.00 C ATOM 724 C GLN A2104 18.819 -10.793 -0.801 1.00 0.00 C ATOM 725 O GLN A2104 19.605 -11.168 0.070 1.00 0.00 O ATOM 726 CB GLN A2104 16.409 -11.607 -0.810 1.00 0.00 C ATOM 727 CG GLN A2104 16.689 -12.886 -0.003 1.00 0.00 C ATOM 728 CD GLN A2104 15.736 -14.021 -0.376 1.00 0.00 C ATOM 729 OE1 GLN A2104 15.879 -14.675 -1.401 1.00 0.00 O ATOM 730 NE2 GLN A2104 14.739 -14.309 0.435 1.00 0.00 N ATOM 0 H GLN A2104 16.468 -9.397 -2.010 1.00 0.00 H new ATOM 0 HA GLN A2104 17.327 -10.307 0.644 1.00 0.00 H new ATOM 0 HB2 GLN A2104 15.379 -11.293 -0.641 1.00 0.00 H new ATOM 0 HB3 GLN A2104 16.506 -11.823 -1.874 1.00 0.00 H new ATOM 0 HG2 GLN A2104 17.717 -13.205 -0.175 1.00 0.00 H new ATOM 0 HG3 GLN A2104 16.596 -12.670 1.061 1.00 0.00 H new ATOM 0 HE21 GLN A2104 14.608 -13.772 1.292 1.00 0.00 H new ATOM 0 HE22 GLN A2104 14.098 -15.069 0.206 1.00 0.00 H new ATOM 739 N ARG A2105 19.205 -10.651 -2.080 1.00 0.00 N ATOM 740 CA ARG A2105 20.563 -10.953 -2.576 1.00 0.00 C ATOM 741 C ARG A2105 21.665 -10.058 -1.993 1.00 0.00 C ATOM 742 O ARG A2105 22.774 -10.539 -1.771 1.00 0.00 O ATOM 743 CB ARG A2105 20.544 -10.932 -4.119 1.00 0.00 C ATOM 744 CG ARG A2105 21.779 -11.542 -4.811 1.00 0.00 C ATOM 745 CD ARG A2105 22.189 -12.937 -4.313 1.00 0.00 C ATOM 746 NE ARG A2105 21.054 -13.884 -4.255 1.00 0.00 N ATOM 747 CZ ARG A2105 20.890 -14.994 -4.954 1.00 0.00 C ATOM 748 NH1 ARG A2105 21.665 -15.357 -5.929 1.00 0.00 N ATOM 749 NH2 ARG A2105 19.908 -15.803 -4.685 1.00 0.00 N ATOM 0 H ARG A2105 18.575 -10.319 -2.811 1.00 0.00 H new ATOM 0 HA ARG A2105 20.829 -11.949 -2.223 1.00 0.00 H new ATOM 0 HB2 ARG A2105 19.658 -11.467 -4.460 1.00 0.00 H new ATOM 0 HB3 ARG A2105 20.439 -9.898 -4.449 1.00 0.00 H new ATOM 0 HG2 ARG A2105 21.584 -11.600 -5.882 1.00 0.00 H new ATOM 0 HG3 ARG A2105 22.622 -10.864 -4.677 1.00 0.00 H new ATOM 0 HD2 ARG A2105 22.959 -13.340 -4.971 1.00 0.00 H new ATOM 0 HD3 ARG A2105 22.632 -12.847 -3.321 1.00 0.00 H new ATOM 0 HE ARG A2105 20.309 -13.653 -3.597 1.00 0.00 H new ATOM 0 HH11 ARG A2105 22.457 -14.772 -6.196 1.00 0.00 H new ATOM 0 HH12 ARG A2105 21.483 -16.227 -6.429 1.00 0.00 H new ATOM 0 HH21 ARG A2105 19.258 -15.583 -3.930 1.00 0.00 H new ATOM 0 HH22 ARG A2105 19.788 -16.658 -5.229 1.00 0.00 H new ATOM 763 N THR A2106 21.380 -8.787 -1.695 1.00 0.00 N ATOM 764 CA THR A2106 22.352 -7.848 -1.092 1.00 0.00 C ATOM 765 C THR A2106 22.888 -8.339 0.263 1.00 0.00 C ATOM 766 O THR A2106 24.061 -8.140 0.584 1.00 0.00 O ATOM 767 CB THR A2106 21.778 -6.424 -1.003 1.00 0.00 C ATOM 768 OG1 THR A2106 22.818 -5.505 -0.761 1.00 0.00 O ATOM 769 CG2 THR A2106 20.722 -6.230 0.084 1.00 0.00 C ATOM 0 H THR A2106 20.464 -8.370 -1.864 1.00 0.00 H new ATOM 0 HA THR A2106 23.211 -7.813 -1.762 1.00 0.00 H new ATOM 0 HB THR A2106 21.289 -6.254 -1.962 1.00 0.00 H new ATOM 0 HG1 THR A2106 22.448 -4.599 -0.707 1.00 0.00 H new ATOM 0 HG21 THR A2106 20.374 -5.197 0.073 1.00 0.00 H new ATOM 0 HG22 THR A2106 19.881 -6.898 -0.102 1.00 0.00 H new ATOM 0 HG23 THR A2106 21.156 -6.456 1.058 1.00 0.00 H new ATOM 777 N ALA A2107 22.071 -9.073 1.033 1.00 0.00 N ATOM 778 CA ALA A2107 22.463 -9.687 2.308 1.00 0.00 C ATOM 779 C ALA A2107 23.523 -10.809 2.158 1.00 0.00 C ATOM 780 O ALA A2107 24.078 -11.275 3.156 1.00 0.00 O ATOM 781 CB ALA A2107 21.193 -10.197 3.001 1.00 0.00 C ATOM 0 H ALA A2107 21.100 -9.259 0.781 1.00 0.00 H new ATOM 0 HA ALA A2107 22.952 -8.928 2.919 1.00 0.00 H new ATOM 0 HB1 ALA A2107 21.458 -10.658 3.952 1.00 0.00 H new ATOM 0 HB2 ALA A2107 20.515 -9.362 3.179 1.00 0.00 H new ATOM 0 HB3 ALA A2107 20.702 -10.933 2.365 1.00 0.00 H new ATOM 787 N LYS A2108 23.809 -11.235 0.917 1.00 0.00 N ATOM 788 CA LYS A2108 24.780 -12.276 0.525 1.00 0.00 C ATOM 789 C LYS A2108 25.901 -11.723 -0.379 1.00 0.00 C ATOM 790 O LYS A2108 26.704 -12.484 -0.915 1.00 0.00 O ATOM 791 CB LYS A2108 24.030 -13.419 -0.188 1.00 0.00 C ATOM 792 CG LYS A2108 22.843 -14.028 0.581 1.00 0.00 C ATOM 793 CD LYS A2108 23.251 -14.666 1.919 1.00 0.00 C ATOM 794 CE LYS A2108 22.073 -15.370 2.610 1.00 0.00 C ATOM 795 NZ LYS A2108 21.050 -14.412 3.110 1.00 0.00 N ATOM 0 H LYS A2108 23.338 -10.836 0.105 1.00 0.00 H new ATOM 0 HA LYS A2108 25.262 -12.648 1.429 1.00 0.00 H new ATOM 0 HB2 LYS A2108 23.665 -13.046 -1.145 1.00 0.00 H new ATOM 0 HB3 LYS A2108 24.743 -14.214 -0.406 1.00 0.00 H new ATOM 0 HG2 LYS A2108 22.102 -13.251 0.768 1.00 0.00 H new ATOM 0 HG3 LYS A2108 22.363 -14.782 -0.042 1.00 0.00 H new ATOM 0 HD2 LYS A2108 24.052 -15.385 1.747 1.00 0.00 H new ATOM 0 HD3 LYS A2108 23.650 -13.896 2.580 1.00 0.00 H new ATOM 0 HE2 LYS A2108 21.606 -16.062 1.909 1.00 0.00 H new ATOM 0 HE3 LYS A2108 22.447 -15.964 3.443 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 20.277 -14.937 3.567 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 21.486 -13.767 3.799 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 20.671 -13.862 2.313 1.00 0.00 H new ATOM 1019 N THR B 18 11.348 -22.651 -11.737 1.00 0.00 N ATOM 1020 CA THR B 18 12.355 -21.840 -12.448 1.00 0.00 C ATOM 1021 C THR B 18 12.148 -20.329 -12.234 1.00 0.00 C ATOM 1022 O THR B 18 11.162 -19.896 -11.635 1.00 0.00 O ATOM 1023 CB THR B 18 12.365 -22.165 -13.955 1.00 0.00 C ATOM 1024 OG1 THR B 18 11.109 -21.925 -14.551 1.00 0.00 O ATOM 1025 CG2 THR B 18 12.770 -23.610 -14.248 1.00 0.00 C ATOM 0 HA THR B 18 13.323 -22.104 -12.022 1.00 0.00 H new ATOM 0 HB THR B 18 13.112 -21.498 -14.385 1.00 0.00 H new ATOM 0 HG1 THR B 18 10.401 -22.060 -13.887 1.00 0.00 H new ATOM 0 HG21 THR B 18 12.759 -23.780 -15.325 1.00 0.00 H new ATOM 0 HG22 THR B 18 13.773 -23.792 -13.862 1.00 0.00 H new ATOM 0 HG23 THR B 18 12.067 -24.290 -13.766 1.00 0.00 H new ATOM 1033 N PHE B 19 13.096 -19.513 -12.712 1.00 0.00 N ATOM 1034 CA PHE B 19 13.150 -18.046 -12.593 1.00 0.00 C ATOM 1035 C PHE B 19 11.802 -17.309 -12.695 1.00 0.00 C ATOM 1036 O PHE B 19 11.521 -16.441 -11.868 1.00 0.00 O ATOM 1037 CB PHE B 19 14.187 -17.484 -13.584 1.00 0.00 C ATOM 1038 CG PHE B 19 13.737 -17.346 -15.028 1.00 0.00 C ATOM 1039 CD1 PHE B 19 13.406 -18.487 -15.785 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.647 -16.071 -15.616 1.00 0.00 C ATOM 1041 CE1 PHE B 19 12.953 -18.351 -17.109 1.00 0.00 C ATOM 1042 CE2 PHE B 19 13.216 -15.937 -16.947 1.00 0.00 C ATOM 1043 CZ PHE B 19 12.858 -17.074 -17.690 1.00 0.00 C ATOM 0 H PHE B 19 13.897 -19.881 -13.225 1.00 0.00 H new ATOM 0 HA PHE B 19 13.460 -17.848 -11.567 1.00 0.00 H new ATOM 0 HB2 PHE B 19 14.501 -16.503 -13.229 1.00 0.00 H new ATOM 0 HB3 PHE B 19 15.066 -18.128 -13.560 1.00 0.00 H new ATOM 0 HD1 PHE B 19 13.501 -19.470 -15.347 1.00 0.00 H new ATOM 0 HD2 PHE B 19 13.910 -15.194 -15.044 1.00 0.00 H new ATOM 0 HE1 PHE B 19 12.678 -19.226 -17.679 1.00 0.00 H new ATOM 0 HE2 PHE B 19 13.160 -14.958 -17.399 1.00 0.00 H new ATOM 0 HZ PHE B 19 12.510 -16.968 -18.707 1.00 0.00 H new ATOM 1053 N SER B 20 10.948 -17.680 -13.657 1.00 0.00 N ATOM 1054 CA SER B 20 9.614 -17.091 -13.853 1.00 0.00 C ATOM 1055 C SER B 20 8.718 -17.180 -12.614 1.00 0.00 C ATOM 1056 O SER B 20 7.950 -16.258 -12.330 1.00 0.00 O ATOM 1057 CB SER B 20 8.934 -17.764 -15.051 1.00 0.00 C ATOM 1058 OG SER B 20 7.634 -17.241 -15.267 1.00 0.00 O ATOM 0 H SER B 20 11.167 -18.411 -14.334 1.00 0.00 H new ATOM 0 HA SER B 20 9.758 -16.028 -14.044 1.00 0.00 H new ATOM 0 HB2 SER B 20 9.540 -17.618 -15.945 1.00 0.00 H new ATOM 0 HB3 SER B 20 8.872 -18.839 -14.880 1.00 0.00 H new ATOM 0 HG SER B 20 7.226 -17.688 -16.038 1.00 0.00 H new ATOM 1064 N ASP B 21 8.831 -18.256 -11.836 1.00 0.00 N ATOM 1065 CA ASP B 21 8.081 -18.447 -10.594 1.00 0.00 C ATOM 1066 C ASP B 21 8.857 -17.954 -9.371 1.00 0.00 C ATOM 1067 O ASP B 21 8.240 -17.522 -8.399 1.00 0.00 O ATOM 1068 CB ASP B 21 7.638 -19.908 -10.472 1.00 0.00 C ATOM 1069 CG ASP B 21 6.615 -20.241 -11.570 1.00 0.00 C ATOM 1070 OD1 ASP B 21 5.570 -19.548 -11.640 1.00 0.00 O ATOM 1071 OD2 ASP B 21 6.863 -21.160 -12.382 1.00 0.00 O ATOM 0 H ASP B 21 9.456 -19.032 -12.054 1.00 0.00 H new ATOM 0 HA ASP B 21 7.183 -17.831 -10.631 1.00 0.00 H new ATOM 0 HB2 ASP B 21 8.502 -20.567 -10.557 1.00 0.00 H new ATOM 0 HB3 ASP B 21 7.199 -20.083 -9.490 1.00 0.00 H new ATOM 1076 N LEU B 22 10.193 -17.910 -9.433 1.00 0.00 N ATOM 1077 CA LEU B 22 11.008 -17.321 -8.364 1.00 0.00 C ATOM 1078 C LEU B 22 10.702 -15.819 -8.218 1.00 0.00 C ATOM 1079 O LEU B 22 10.643 -15.330 -7.088 1.00 0.00 O ATOM 1080 CB LEU B 22 12.509 -17.591 -8.581 1.00 0.00 C ATOM 1081 CG LEU B 22 12.915 -19.076 -8.475 1.00 0.00 C ATOM 1082 CD1 LEU B 22 14.418 -19.225 -8.716 1.00 0.00 C ATOM 1083 CD2 LEU B 22 12.603 -19.681 -7.103 1.00 0.00 C ATOM 0 H LEU B 22 10.734 -18.277 -10.216 1.00 0.00 H new ATOM 0 HA LEU B 22 10.741 -17.805 -7.425 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.793 -17.219 -9.565 1.00 0.00 H new ATOM 0 HB3 LEU B 22 13.078 -17.019 -7.848 1.00 0.00 H new ATOM 0 HG LEU B 22 12.334 -19.606 -9.230 1.00 0.00 H new ATOM 0 HD11 LEU B 22 14.696 -20.276 -8.639 1.00 0.00 H new ATOM 0 HD12 LEU B 22 14.665 -18.856 -9.711 1.00 0.00 H new ATOM 0 HD13 LEU B 22 14.965 -18.649 -7.969 1.00 0.00 H new ATOM 0 HD21 LEU B 22 12.910 -20.727 -7.088 1.00 0.00 H new ATOM 0 HD22 LEU B 22 13.144 -19.133 -6.332 1.00 0.00 H new ATOM 0 HD23 LEU B 22 11.532 -19.615 -6.911 1.00 0.00 H new ATOM 1095 N TRP B 23 10.415 -15.098 -9.316 1.00 0.00 N ATOM 1096 CA TRP B 23 9.995 -13.687 -9.245 1.00 0.00 C ATOM 1097 C TRP B 23 8.725 -13.482 -8.393 1.00 0.00 C ATOM 1098 O TRP B 23 8.544 -12.421 -7.793 1.00 0.00 O ATOM 1099 CB TRP B 23 9.707 -13.136 -10.647 1.00 0.00 C ATOM 1100 CG TRP B 23 10.830 -13.095 -11.638 1.00 0.00 C ATOM 1101 CD1 TRP B 23 10.749 -13.590 -12.890 1.00 0.00 C ATOM 1102 CD2 TRP B 23 12.150 -12.467 -11.542 1.00 0.00 C ATOM 1103 NE1 TRP B 23 11.918 -13.331 -13.578 1.00 0.00 N ATOM 1104 CE2 TRP B 23 12.810 -12.623 -12.801 1.00 0.00 C ATOM 1105 CE3 TRP B 23 12.847 -11.752 -10.540 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 14.083 -12.093 -13.054 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 14.124 -11.212 -10.787 1.00 0.00 C ATOM 1108 CH2 TRP B 23 14.740 -11.377 -12.040 1.00 0.00 C ATOM 0 H TRP B 23 10.466 -15.470 -10.264 1.00 0.00 H new ATOM 0 HA TRP B 23 10.824 -13.156 -8.777 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.903 -13.732 -11.080 1.00 0.00 H new ATOM 0 HB3 TRP B 23 9.326 -12.121 -10.534 1.00 0.00 H new ATOM 0 HD1 TRP B 23 9.895 -14.112 -13.295 1.00 0.00 H new ATOM 0 HE1 TRP B 23 12.098 -13.626 -14.538 1.00 0.00 H new ATOM 0 HE3 TRP B 23 12.392 -11.618 -9.570 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 14.552 -12.234 -14.016 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 14.635 -10.666 -10.007 1.00 0.00 H new ATOM 0 HH2 TRP B 23 15.717 -10.954 -12.222 1.00 0.00 H new ATOM 1119 N LYS B 24 7.842 -14.492 -8.340 1.00 0.00 N ATOM 1120 CA LYS B 24 6.562 -14.468 -7.612 1.00 0.00 C ATOM 1121 C LYS B 24 6.683 -14.762 -6.108 1.00 0.00 C ATOM 1122 O LYS B 24 5.757 -14.442 -5.361 1.00 0.00 O ATOM 1123 CB LYS B 24 5.575 -15.471 -8.248 1.00 0.00 C ATOM 1124 CG LYS B 24 5.407 -15.329 -9.773 1.00 0.00 C ATOM 1125 CD LYS B 24 4.324 -16.290 -10.288 1.00 0.00 C ATOM 1126 CE LYS B 24 4.131 -16.222 -11.810 1.00 0.00 C ATOM 1127 NZ LYS B 24 5.204 -16.934 -12.551 1.00 0.00 N ATOM 0 H LYS B 24 8.004 -15.378 -8.819 1.00 0.00 H new ATOM 0 HA LYS B 24 6.194 -13.446 -7.698 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.913 -16.483 -8.026 1.00 0.00 H new ATOM 0 HB3 LYS B 24 4.600 -15.350 -7.776 1.00 0.00 H new ATOM 0 HG2 LYS B 24 5.138 -14.302 -10.021 1.00 0.00 H new ATOM 0 HG3 LYS B 24 6.354 -15.539 -10.270 1.00 0.00 H new ATOM 0 HD2 LYS B 24 4.588 -17.309 -10.007 1.00 0.00 H new ATOM 0 HD3 LYS B 24 3.379 -16.059 -9.797 1.00 0.00 H new ATOM 0 HE2 LYS B 24 3.165 -16.655 -12.070 1.00 0.00 H new ATOM 0 HE3 LYS B 24 4.108 -15.178 -12.124 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 5.047 -16.830 -13.574 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 6.128 -16.528 -12.299 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 5.189 -17.943 -12.299 1.00 0.00 H new ATOM 1141 N LEU B 25 7.785 -15.370 -5.652 1.00 0.00 N ATOM 1142 CA LEU B 25 7.988 -15.736 -4.239 1.00 0.00 C ATOM 1143 C LEU B 25 8.487 -14.580 -3.355 1.00 0.00 C ATOM 1144 O LEU B 25 8.081 -14.469 -2.200 1.00 0.00 O ATOM 1145 CB LEU B 25 8.985 -16.909 -4.135 1.00 0.00 C ATOM 1146 CG LEU B 25 8.579 -18.209 -4.853 1.00 0.00 C ATOM 1147 CD1 LEU B 25 9.610 -19.296 -4.551 1.00 0.00 C ATOM 1148 CD2 LEU B 25 7.201 -18.727 -4.434 1.00 0.00 C ATOM 0 H LEU B 25 8.568 -15.625 -6.254 1.00 0.00 H new ATOM 0 HA LEU B 25 7.004 -16.019 -3.865 1.00 0.00 H new ATOM 0 HB2 LEU B 25 9.944 -16.581 -4.536 1.00 0.00 H new ATOM 0 HB3 LEU B 25 9.141 -17.134 -3.080 1.00 0.00 H new ATOM 0 HG LEU B 25 8.536 -17.976 -5.917 1.00 0.00 H new ATOM 0 HD11 LEU B 25 9.326 -20.218 -5.058 1.00 0.00 H new ATOM 0 HD12 LEU B 25 10.590 -18.976 -4.904 1.00 0.00 H new ATOM 0 HD13 LEU B 25 9.650 -19.471 -3.476 1.00 0.00 H new ATOM 0 HD21 LEU B 25 6.977 -19.645 -4.977 1.00 0.00 H new ATOM 0 HD22 LEU B 25 7.199 -18.929 -3.363 1.00 0.00 H new ATOM 0 HD23 LEU B 25 6.445 -17.976 -4.663 1.00 0.00 H new ATOM 1408 N LEU B 43 27.120 -1.574 -6.034 1.00 0.00 N ATOM 1409 CA LEU B 43 27.058 -3.037 -6.137 1.00 0.00 C ATOM 1410 C LEU B 43 26.415 -3.449 -7.474 1.00 0.00 C ATOM 1411 O LEU B 43 25.623 -2.688 -8.034 1.00 0.00 O ATOM 1412 CB LEU B 43 26.330 -3.576 -4.887 1.00 0.00 C ATOM 1413 CG LEU B 43 24.809 -3.332 -4.852 1.00 0.00 C ATOM 1414 CD1 LEU B 43 24.035 -4.524 -5.421 1.00 0.00 C ATOM 1415 CD2 LEU B 43 24.325 -3.115 -3.418 1.00 0.00 C ATOM 0 HA LEU B 43 28.052 -3.483 -6.151 1.00 0.00 H new ATOM 0 HB2 LEU B 43 26.511 -4.649 -4.816 1.00 0.00 H new ATOM 0 HB3 LEU B 43 26.775 -3.119 -4.003 1.00 0.00 H new ATOM 0 HG LEU B 43 24.625 -2.445 -5.458 1.00 0.00 H new ATOM 0 HD11 LEU B 43 22.966 -4.316 -5.380 1.00 0.00 H new ATOM 0 HD12 LEU B 43 24.333 -4.691 -6.456 1.00 0.00 H new ATOM 0 HD13 LEU B 43 24.254 -5.415 -4.832 1.00 0.00 H new ATOM 0 HD21 LEU B 43 23.248 -2.945 -3.419 1.00 0.00 H new ATOM 0 HD22 LEU B 43 24.552 -3.997 -2.820 1.00 0.00 H new ATOM 0 HD23 LEU B 43 24.829 -2.248 -2.991 1.00 0.00 H new ATOM 1427 N MET B 44 26.751 -4.633 -7.997 1.00 0.00 N ATOM 1428 CA MET B 44 26.270 -5.119 -9.301 1.00 0.00 C ATOM 1429 C MET B 44 26.162 -6.655 -9.353 1.00 0.00 C ATOM 1430 O MET B 44 27.016 -7.361 -8.813 1.00 0.00 O ATOM 1431 CB MET B 44 27.262 -4.623 -10.373 1.00 0.00 C ATOM 1432 CG MET B 44 26.710 -4.618 -11.804 1.00 0.00 C ATOM 1433 SD MET B 44 26.048 -3.024 -12.383 1.00 0.00 S ATOM 1434 CE MET B 44 24.510 -2.874 -11.432 1.00 0.00 C ATOM 0 H MET B 44 27.371 -5.290 -7.524 1.00 0.00 H new ATOM 0 HA MET B 44 25.266 -4.733 -9.476 1.00 0.00 H new ATOM 0 HB2 MET B 44 27.578 -3.612 -10.116 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.152 -5.252 -10.344 1.00 0.00 H new ATOM 0 HG2 MET B 44 27.504 -4.930 -12.482 1.00 0.00 H new ATOM 0 HG3 MET B 44 25.920 -5.366 -11.873 1.00 0.00 H new ATOM 0 HE1 MET B 44 23.840 -2.175 -11.932 1.00 0.00 H new ATOM 0 HE2 MET B 44 24.030 -3.850 -11.361 1.00 0.00 H new ATOM 0 HE3 MET B 44 24.736 -2.507 -10.431 1.00 0.00 H new ATOM 1444 N LEU B 45 25.126 -7.184 -10.018 1.00 0.00 N ATOM 1445 CA LEU B 45 24.919 -8.631 -10.181 1.00 0.00 C ATOM 1446 C LEU B 45 26.018 -9.275 -11.046 1.00 0.00 C ATOM 1447 O LEU B 45 26.684 -8.608 -11.844 1.00 0.00 O ATOM 1448 CB LEU B 45 23.519 -8.915 -10.779 1.00 0.00 C ATOM 1449 CG LEU B 45 22.311 -8.864 -9.819 1.00 0.00 C ATOM 1450 CD1 LEU B 45 22.419 -9.896 -8.695 1.00 0.00 C ATOM 1451 CD2 LEU B 45 22.082 -7.491 -9.191 1.00 0.00 C ATOM 0 H LEU B 45 24.403 -6.617 -10.461 1.00 0.00 H new ATOM 0 HA LEU B 45 24.978 -9.083 -9.191 1.00 0.00 H new ATOM 0 HB2 LEU B 45 23.343 -8.197 -11.580 1.00 0.00 H new ATOM 0 HB3 LEU B 45 23.543 -9.904 -11.237 1.00 0.00 H new ATOM 0 HG LEU B 45 21.457 -9.096 -10.456 1.00 0.00 H new ATOM 0 HD11 LEU B 45 21.546 -9.821 -8.047 1.00 0.00 H new ATOM 0 HD12 LEU B 45 22.467 -10.897 -9.124 1.00 0.00 H new ATOM 0 HD13 LEU B 45 23.321 -9.707 -8.113 1.00 0.00 H new ATOM 0 HD21 LEU B 45 21.217 -7.533 -8.529 1.00 0.00 H new ATOM 0 HD22 LEU B 45 22.963 -7.201 -8.618 1.00 0.00 H new ATOM 0 HD23 LEU B 45 21.902 -6.757 -9.977 1.00 0.00 H new ATOM 1463 N SER B 46 26.176 -10.591 -10.911 1.00 0.00 N ATOM 1464 CA SER B 46 27.155 -11.426 -11.622 1.00 0.00 C ATOM 1465 C SER B 46 26.442 -12.497 -12.462 1.00 0.00 C ATOM 1466 O SER B 46 25.351 -12.927 -12.073 1.00 0.00 O ATOM 1467 CB SER B 46 28.037 -12.102 -10.560 1.00 0.00 C ATOM 1468 OG SER B 46 29.109 -12.839 -11.118 1.00 0.00 O ATOM 0 H SER B 46 25.597 -11.135 -10.271 1.00 0.00 H new ATOM 0 HA SER B 46 27.753 -10.814 -12.297 1.00 0.00 H new ATOM 0 HB2 SER B 46 28.437 -11.341 -9.890 1.00 0.00 H new ATOM 0 HB3 SER B 46 27.422 -12.768 -9.955 1.00 0.00 H new ATOM 0 HG SER B 46 29.636 -13.245 -10.399 1.00 0.00 H new ATOM 1474 N PRO B 47 27.017 -12.984 -13.584 1.00 0.00 N ATOM 1475 CA PRO B 47 26.418 -14.057 -14.390 1.00 0.00 C ATOM 1476 C PRO B 47 26.084 -15.322 -13.579 1.00 0.00 C ATOM 1477 O PRO B 47 25.161 -16.049 -13.941 1.00 0.00 O ATOM 1478 CB PRO B 47 27.406 -14.337 -15.529 1.00 0.00 C ATOM 1479 CG PRO B 47 28.728 -13.789 -14.993 1.00 0.00 C ATOM 1480 CD PRO B 47 28.280 -12.579 -14.184 1.00 0.00 C ATOM 0 HA PRO B 47 25.449 -13.739 -14.776 1.00 0.00 H new ATOM 0 HB2 PRO B 47 27.473 -15.402 -15.750 1.00 0.00 H new ATOM 0 HB3 PRO B 47 27.108 -13.838 -16.451 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.249 -14.520 -14.375 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.408 -13.510 -15.798 1.00 0.00 H new ATOM 0 HD2 PRO B 47 29.015 -12.318 -13.422 1.00 0.00 H new ATOM 0 HD3 PRO B 47 28.154 -11.702 -14.819 1.00 0.00 H new ATOM 1488 N ASP B 48 26.772 -15.557 -12.455 1.00 0.00 N ATOM 1489 CA ASP B 48 26.499 -16.664 -11.531 1.00 0.00 C ATOM 1490 C ASP B 48 25.059 -16.635 -10.970 1.00 0.00 C ATOM 1491 O ASP B 48 24.437 -17.682 -10.796 1.00 0.00 O ATOM 1492 CB ASP B 48 27.520 -16.603 -10.390 1.00 0.00 C ATOM 1493 CG ASP B 48 27.400 -17.812 -9.445 1.00 0.00 C ATOM 1494 OD1 ASP B 48 27.788 -18.934 -9.847 1.00 0.00 O ATOM 1495 OD2 ASP B 48 26.949 -17.635 -8.288 1.00 0.00 O ATOM 0 H ASP B 48 27.551 -14.970 -12.156 1.00 0.00 H new ATOM 0 HA ASP B 48 26.590 -17.600 -12.082 1.00 0.00 H new ATOM 0 HB2 ASP B 48 28.527 -16.566 -10.806 1.00 0.00 H new ATOM 0 HB3 ASP B 48 27.376 -15.683 -9.823 1.00 0.00 H new ATOM 1500 N ASP B 49 24.500 -15.442 -10.732 1.00 0.00 N ATOM 1501 CA ASP B 49 23.117 -15.257 -10.273 1.00 0.00 C ATOM 1502 C ASP B 49 22.105 -15.522 -11.407 1.00 0.00 C ATOM 1503 O ASP B 49 21.007 -16.037 -11.177 1.00 0.00 O ATOM 1504 CB ASP B 49 22.922 -13.823 -9.755 1.00 0.00 C ATOM 1505 CG ASP B 49 23.823 -13.490 -8.557 1.00 0.00 C ATOM 1506 OD1 ASP B 49 23.513 -13.956 -7.434 1.00 0.00 O ATOM 1507 OD2 ASP B 49 24.816 -12.743 -8.733 1.00 0.00 O ATOM 0 H ASP B 49 25.004 -14.564 -10.855 1.00 0.00 H new ATOM 0 HA ASP B 49 22.938 -15.974 -9.471 1.00 0.00 H new ATOM 0 HB2 ASP B 49 23.126 -13.120 -10.563 1.00 0.00 H new ATOM 0 HB3 ASP B 49 21.880 -13.685 -9.468 1.00 0.00 H new ATOM 1512 N ILE B 50 22.488 -15.190 -12.645 1.00 0.00 N ATOM 1513 CA ILE B 50 21.670 -15.360 -13.853 1.00 0.00 C ATOM 1514 C ILE B 50 21.587 -16.843 -14.255 1.00 0.00 C ATOM 1515 O ILE B 50 20.521 -17.336 -14.619 1.00 0.00 O ATOM 1516 CB ILE B 50 22.210 -14.489 -15.019 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.632 -13.065 -14.575 1.00 0.00 C ATOM 1518 CG2 ILE B 50 21.142 -14.391 -16.123 1.00 0.00 C ATOM 1519 CD1 ILE B 50 23.252 -12.204 -15.684 1.00 0.00 C ATOM 0 H ILE B 50 23.403 -14.783 -12.841 1.00 0.00 H new ATOM 0 HA ILE B 50 20.660 -15.019 -13.627 1.00 0.00 H new ATOM 0 HB ILE B 50 23.108 -14.981 -15.393 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.757 -12.549 -14.179 1.00 0.00 H new ATOM 0 HG13 ILE B 50 23.348 -13.151 -13.758 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.520 -13.780 -16.942 1.00 0.00 H new ATOM 0 HG22 ILE B 50 20.909 -15.389 -16.493 1.00 0.00 H new ATOM 0 HG23 ILE B 50 20.239 -13.935 -15.717 1.00 0.00 H new ATOM 0 HD11 ILE B 50 23.516 -11.226 -15.281 1.00 0.00 H new ATOM 0 HD12 ILE B 50 24.148 -12.693 -16.066 1.00 0.00 H new ATOM 0 HD13 ILE B 50 22.533 -12.081 -16.494 1.00 0.00 H new ATOM 1531 N GLU B 51 22.691 -17.590 -14.160 1.00 0.00 N ATOM 1532 CA GLU B 51 22.714 -19.032 -14.460 1.00 0.00 C ATOM 1533 C GLU B 51 22.157 -19.903 -13.311 1.00 0.00 C ATOM 1534 O GLU B 51 22.027 -21.119 -13.446 1.00 0.00 O ATOM 1535 CB GLU B 51 24.127 -19.460 -14.894 1.00 0.00 C ATOM 1536 CG GLU B 51 25.128 -19.626 -13.746 1.00 0.00 C ATOM 1537 CD GLU B 51 26.511 -20.046 -14.281 1.00 0.00 C ATOM 1538 OE1 GLU B 51 26.750 -21.267 -14.459 1.00 0.00 O ATOM 1539 OE2 GLU B 51 27.374 -19.168 -14.526 1.00 0.00 O ATOM 0 H GLU B 51 23.596 -17.216 -13.873 1.00 0.00 H new ATOM 0 HA GLU B 51 22.034 -19.204 -15.294 1.00 0.00 H new ATOM 0 HB2 GLU B 51 24.056 -20.404 -15.435 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.517 -18.720 -15.593 1.00 0.00 H new ATOM 0 HG2 GLU B 51 25.215 -18.689 -13.196 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.762 -20.375 -13.044 1.00 0.00 H new ATOM 1546 N GLN B 52 21.819 -19.294 -12.170 1.00 0.00 N ATOM 1547 CA GLN B 52 21.266 -19.974 -10.997 1.00 0.00 C ATOM 1548 C GLN B 52 19.748 -20.193 -11.113 1.00 0.00 C ATOM 1549 O GLN B 52 19.280 -21.319 -10.957 1.00 0.00 O ATOM 1550 CB GLN B 52 21.658 -19.153 -9.746 1.00 0.00 C ATOM 1551 CG GLN B 52 20.792 -19.309 -8.472 1.00 0.00 C ATOM 1552 CD GLN B 52 20.307 -17.988 -7.861 1.00 0.00 C ATOM 1553 OE1 GLN B 52 20.326 -17.802 -6.652 1.00 0.00 O ATOM 1554 NE2 GLN B 52 19.892 -16.991 -8.618 1.00 0.00 N ATOM 0 H GLN B 52 21.926 -18.289 -12.034 1.00 0.00 H new ATOM 0 HA GLN B 52 21.685 -20.977 -10.917 1.00 0.00 H new ATOM 0 HB2 GLN B 52 22.684 -19.411 -9.485 1.00 0.00 H new ATOM 0 HB3 GLN B 52 21.655 -18.099 -10.024 1.00 0.00 H new ATOM 0 HG2 GLN B 52 19.924 -19.923 -8.712 1.00 0.00 H new ATOM 0 HG3 GLN B 52 21.368 -19.851 -7.722 1.00 0.00 H new ATOM 0 HE21 GLN B 52 19.859 -17.100 -9.632 1.00 0.00 H new ATOM 0 HE22 GLN B 52 19.604 -16.111 -8.190 1.00 0.00 H new ATOM 1563 N TRP B 53 18.956 -19.141 -11.354 1.00 0.00 N ATOM 1564 CA TRP B 53 17.487 -19.243 -11.324 1.00 0.00 C ATOM 1565 C TRP B 53 16.831 -20.127 -12.402 1.00 0.00 C ATOM 1566 O TRP B 53 15.702 -20.576 -12.214 1.00 0.00 O ATOM 1567 CB TRP B 53 16.876 -17.836 -11.218 1.00 0.00 C ATOM 1568 CG TRP B 53 17.340 -16.757 -12.150 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.716 -16.909 -13.440 1.00 0.00 C ATOM 1570 CD2 TRP B 53 17.477 -15.327 -11.871 1.00 0.00 C ATOM 1571 NE1 TRP B 53 18.098 -15.692 -13.961 1.00 0.00 N ATOM 1572 CE2 TRP B 53 17.990 -14.680 -13.036 1.00 0.00 C ATOM 1573 CE3 TRP B 53 17.227 -14.510 -10.747 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 18.287 -13.310 -13.075 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 17.496 -13.128 -10.782 1.00 0.00 C ATOM 1576 CH2 TRP B 53 18.040 -12.529 -11.933 1.00 0.00 C ATOM 0 H TRP B 53 19.305 -18.208 -11.572 1.00 0.00 H new ATOM 0 HA TRP B 53 17.246 -19.810 -10.425 1.00 0.00 H new ATOM 0 HB2 TRP B 53 15.798 -17.937 -11.347 1.00 0.00 H new ATOM 0 HB3 TRP B 53 17.044 -17.483 -10.200 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.717 -17.844 -13.981 1.00 0.00 H new ATOM 0 HE1 TRP B 53 18.422 -15.558 -14.919 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.824 -14.951 -9.847 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 18.699 -12.863 -13.968 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 17.282 -12.521 -9.915 1.00 0.00 H new ATOM 0 HH2 TRP B 53 18.267 -11.473 -11.939 1.00 0.00 H new ATOM 1587 N PHE B 54 17.514 -20.426 -13.512 1.00 0.00 N ATOM 1588 CA PHE B 54 16.979 -21.289 -14.582 1.00 0.00 C ATOM 1589 C PHE B 54 17.294 -22.794 -14.411 1.00 0.00 C ATOM 1590 O PHE B 54 16.759 -23.619 -15.153 1.00 0.00 O ATOM 1591 CB PHE B 54 17.388 -20.739 -15.965 1.00 0.00 C ATOM 1592 CG PHE B 54 18.670 -21.276 -16.589 1.00 0.00 C ATOM 1593 CD1 PHE B 54 19.862 -21.362 -15.845 1.00 0.00 C ATOM 1594 CD2 PHE B 54 18.671 -21.687 -17.938 1.00 0.00 C ATOM 1595 CE1 PHE B 54 21.034 -21.870 -16.435 1.00 0.00 C ATOM 1596 CE2 PHE B 54 19.845 -22.184 -18.532 1.00 0.00 C ATOM 1597 CZ PHE B 54 21.028 -22.280 -17.779 1.00 0.00 C ATOM 0 H PHE B 54 18.455 -20.078 -13.698 1.00 0.00 H new ATOM 0 HA PHE B 54 15.893 -21.248 -14.503 1.00 0.00 H new ATOM 0 HB2 PHE B 54 16.570 -20.934 -16.659 1.00 0.00 H new ATOM 0 HB3 PHE B 54 17.484 -19.656 -15.881 1.00 0.00 H new ATOM 0 HD1 PHE B 54 19.877 -21.036 -14.815 1.00 0.00 H new ATOM 0 HD2 PHE B 54 17.763 -21.620 -18.519 1.00 0.00 H new ATOM 0 HE1 PHE B 54 21.941 -21.945 -15.853 1.00 0.00 H new ATOM 0 HE2 PHE B 54 19.838 -22.492 -19.567 1.00 0.00 H new ATOM 0 HZ PHE B 54 21.929 -22.667 -18.232 1.00 0.00 H new ATOM 1607 N THR B 55 18.163 -23.164 -13.458 1.00 0.00 N ATOM 1608 CA THR B 55 18.616 -24.558 -13.240 1.00 0.00 C ATOM 1609 C THR B 55 17.650 -25.450 -12.439 1.00 0.00 C ATOM 1610 O THR B 55 17.778 -26.676 -12.456 1.00 0.00 O ATOM 1611 CB THR B 55 20.017 -24.543 -12.587 1.00 0.00 C ATOM 1612 OG1 THR B 55 20.771 -25.652 -13.034 1.00 0.00 O ATOM 1613 CG2 THR B 55 20.030 -24.563 -11.054 1.00 0.00 C ATOM 0 H THR B 55 18.580 -22.500 -12.806 1.00 0.00 H new ATOM 0 HA THR B 55 18.649 -25.018 -14.227 1.00 0.00 H new ATOM 0 HB THR B 55 20.447 -23.590 -12.895 1.00 0.00 H new ATOM 0 HG1 THR B 55 21.658 -25.634 -12.617 1.00 0.00 H new ATOM 0 HG21 THR B 55 21.060 -24.550 -10.699 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.504 -23.687 -10.674 1.00 0.00 H new ATOM 0 HG23 THR B 55 19.534 -25.466 -10.698 1.00 0.00 H new