USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=14 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: A2074 THR OG1 : rot 83:sc= 1.42 USER MOD Set 1.2: A2085 GLN : amide:sc= 0.66 K(o=3.5,f=2) USER MOD Set 1.3: A2086 GLN : amide:sc= 0.418 K(o=3.5,f=0.48) USER MOD Set 1.4: A2089 ASN : amide:sc= 0.959 K(o=3.5,f=1.2) 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= -0.0497 X(o=-0.05,f=-0.36) 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 180:sc= 0.102 USER MOD Single : A2082 GLN : amide:sc= -0.0326 X(o=-0.033,f=-0.033) USER MOD Single : A2083 GLN : amide:sc= 1.08 K(o=1.1,f=-0.42) USER MOD Single : A2084 GLN : amide:sc= 1.16 K(o=1.2,f=0) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 83:sc= 0.88 USER MOD Single : A2094 ASN : amide:sc= 0.881 K(o=0.88,f=-2.1!) USER MOD Single : A2096 GLN : amide:sc= -1.29 X(o=-1.3,f=-1.5) USER MOD Single : A2098 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A2103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2104 GLN : amide:sc= 0.864 K(o=0.86,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 -38:sc= 0.172 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ -167:sc= 1.23 (180deg=1.15) USER MOD Single : B 44 MET CE :methyl 158:sc= 0 (180deg=-0.047) USER MOD Single : B 46 SER OG : rot 31:sc= 0.039 USER MOD Single : B 52 GLN : amide:sc= -0.128 K(o=-0.13,f=-2.5!) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 4.810 -5.177 -14.984 1.00 0.00 N ATOM 65 CA ILE A2063 5.937 -5.947 -15.535 1.00 0.00 C ATOM 66 C ILE A2063 5.466 -6.678 -16.808 1.00 0.00 C ATOM 67 O ILE A2063 4.255 -6.830 -17.012 1.00 0.00 O ATOM 68 CB ILE A2063 6.452 -6.962 -14.477 1.00 0.00 C ATOM 69 CG1 ILE A2063 5.300 -7.844 -13.923 1.00 0.00 C ATOM 70 CG2 ILE A2063 7.220 -6.237 -13.353 1.00 0.00 C ATOM 71 CD1 ILE A2063 5.634 -8.645 -12.666 1.00 0.00 C ATOM 0 HA ILE A2063 6.758 -5.277 -15.790 1.00 0.00 H new ATOM 0 HB ILE A2063 7.152 -7.637 -14.969 1.00 0.00 H new ATOM 0 HG12 ILE A2063 4.445 -7.203 -13.708 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.989 -8.538 -14.704 1.00 0.00 H new ATOM 0 HG21 ILE A2063 7.572 -6.967 -12.623 1.00 0.00 H new ATOM 0 HG22 ILE A2063 8.073 -5.708 -13.778 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.559 -5.523 -12.862 1.00 0.00 H new ATOM 0 HD11 ILE A2063 4.763 -9.226 -12.363 1.00 0.00 H new ATOM 0 HD12 ILE A2063 6.465 -9.319 -12.874 1.00 0.00 H new ATOM 0 HD13 ILE A2063 5.913 -7.963 -11.863 1.00 0.00 H new ATOM 83 N SER A2064 6.388 -7.141 -17.659 1.00 0.00 N ATOM 84 CA SER A2064 6.062 -7.818 -18.932 1.00 0.00 C ATOM 85 C SER A2064 6.708 -9.207 -19.079 1.00 0.00 C ATOM 86 O SER A2064 7.861 -9.391 -18.678 1.00 0.00 O ATOM 87 CB SER A2064 6.489 -6.937 -20.117 1.00 0.00 C ATOM 88 OG SER A2064 5.705 -5.754 -20.183 1.00 0.00 O ATOM 0 H SER A2064 7.390 -7.059 -17.488 1.00 0.00 H new ATOM 0 HA SER A2064 4.983 -7.969 -18.926 1.00 0.00 H new ATOM 0 HB2 SER A2064 7.542 -6.674 -20.018 1.00 0.00 H new ATOM 0 HB3 SER A2064 6.387 -7.497 -21.046 1.00 0.00 H new ATOM 0 HG SER A2064 5.997 -5.210 -20.944 1.00 0.00 H new ATOM 94 N PRO A2065 6.005 -10.196 -19.682 1.00 0.00 N ATOM 95 CA PRO A2065 6.527 -11.551 -19.896 1.00 0.00 C ATOM 96 C PRO A2065 7.648 -11.604 -20.945 1.00 0.00 C ATOM 97 O PRO A2065 8.428 -12.553 -20.940 1.00 0.00 O ATOM 98 CB PRO A2065 5.323 -12.391 -20.328 1.00 0.00 C ATOM 99 CG PRO A2065 4.413 -11.377 -21.020 1.00 0.00 C ATOM 100 CD PRO A2065 4.649 -10.098 -20.214 1.00 0.00 C ATOM 0 HA PRO A2065 6.987 -11.930 -18.983 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.616 -13.195 -21.004 1.00 0.00 H new ATOM 0 HB3 PRO A2065 4.830 -12.856 -19.474 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.677 -11.247 -22.069 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.368 -11.686 -20.990 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.541 -9.215 -20.844 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.921 -10.006 -19.408 1.00 0.00 H new ATOM 108 N SER A2066 7.785 -10.588 -21.805 1.00 0.00 N ATOM 109 CA SER A2066 8.871 -10.475 -22.795 1.00 0.00 C ATOM 110 C SER A2066 10.258 -10.585 -22.147 1.00 0.00 C ATOM 111 O SER A2066 11.161 -11.210 -22.708 1.00 0.00 O ATOM 112 CB SER A2066 8.745 -9.154 -23.563 1.00 0.00 C ATOM 113 OG SER A2066 8.587 -8.059 -22.669 1.00 0.00 O ATOM 0 H SER A2066 7.133 -9.804 -21.836 1.00 0.00 H new ATOM 0 HA SER A2066 8.772 -11.310 -23.489 1.00 0.00 H new ATOM 0 HB2 SER A2066 9.631 -9.001 -24.179 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.892 -9.202 -24.239 1.00 0.00 H new ATOM 0 HG SER A2066 8.510 -7.227 -23.181 1.00 0.00 H new ATOM 119 N ALA A2067 10.402 -10.050 -20.929 1.00 0.00 N ATOM 120 CA ALA A2067 11.614 -10.115 -20.117 1.00 0.00 C ATOM 121 C ALA A2067 12.114 -11.553 -19.886 1.00 0.00 C ATOM 122 O ALA A2067 13.319 -11.775 -19.815 1.00 0.00 O ATOM 123 CB ALA A2067 11.315 -9.424 -18.780 1.00 0.00 C ATOM 0 H ALA A2067 9.647 -9.542 -20.468 1.00 0.00 H new ATOM 0 HA ALA A2067 12.419 -9.610 -20.652 1.00 0.00 H new ATOM 0 HB1 ALA A2067 12.202 -9.455 -18.148 1.00 0.00 H new ATOM 0 HB2 ALA A2067 11.035 -8.386 -18.961 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.495 -9.939 -18.280 1.00 0.00 H new ATOM 129 N LEU A2068 11.208 -12.536 -19.796 1.00 0.00 N ATOM 130 CA LEU A2068 11.547 -13.948 -19.589 1.00 0.00 C ATOM 131 C LEU A2068 12.250 -14.520 -20.835 1.00 0.00 C ATOM 132 O LEU A2068 13.268 -15.202 -20.711 1.00 0.00 O ATOM 133 CB LEU A2068 10.274 -14.753 -19.245 1.00 0.00 C ATOM 134 CG LEU A2068 9.624 -14.530 -17.860 1.00 0.00 C ATOM 135 CD1 LEU A2068 9.420 -13.077 -17.421 1.00 0.00 C ATOM 136 CD2 LEU A2068 8.261 -15.222 -17.833 1.00 0.00 C ATOM 0 H LEU A2068 10.204 -12.369 -19.866 1.00 0.00 H new ATOM 0 HA LEU A2068 12.238 -14.029 -18.750 1.00 0.00 H new ATOM 0 HB2 LEU A2068 9.524 -14.532 -20.005 1.00 0.00 H new ATOM 0 HB3 LEU A2068 10.515 -15.812 -19.334 1.00 0.00 H new ATOM 0 HG LEU A2068 10.343 -14.949 -17.156 1.00 0.00 H new ATOM 0 HD11 LEU A2068 8.957 -13.057 -16.435 1.00 0.00 H new ATOM 0 HD12 LEU A2068 10.384 -12.571 -17.380 1.00 0.00 H new ATOM 0 HD13 LEU A2068 8.773 -12.568 -18.136 1.00 0.00 H new ATOM 0 HD21 LEU A2068 7.795 -15.070 -16.859 1.00 0.00 H new ATOM 0 HD22 LEU A2068 7.624 -14.801 -18.610 1.00 0.00 H new ATOM 0 HD23 LEU A2068 8.391 -16.290 -18.010 1.00 0.00 H new ATOM 148 N GLN A2069 11.750 -14.205 -22.037 1.00 0.00 N ATOM 149 CA GLN A2069 12.382 -14.621 -23.298 1.00 0.00 C ATOM 150 C GLN A2069 13.725 -13.896 -23.503 1.00 0.00 C ATOM 151 O GLN A2069 14.716 -14.523 -23.884 1.00 0.00 O ATOM 152 CB GLN A2069 11.462 -14.370 -24.508 1.00 0.00 C ATOM 153 CG GLN A2069 10.188 -15.231 -24.546 1.00 0.00 C ATOM 154 CD GLN A2069 9.030 -14.622 -23.763 1.00 0.00 C ATOM 155 OE1 GLN A2069 8.361 -13.699 -24.207 1.00 0.00 O ATOM 156 NE2 GLN A2069 8.726 -15.119 -22.585 1.00 0.00 N ATOM 0 H GLN A2069 10.899 -13.657 -22.164 1.00 0.00 H new ATOM 0 HA GLN A2069 12.563 -15.693 -23.227 1.00 0.00 H new ATOM 0 HB2 GLN A2069 11.172 -13.319 -24.513 1.00 0.00 H new ATOM 0 HB3 GLN A2069 12.030 -14.549 -25.421 1.00 0.00 H new ATOM 0 HG2 GLN A2069 9.883 -15.372 -25.583 1.00 0.00 H new ATOM 0 HG3 GLN A2069 10.412 -16.218 -24.142 1.00 0.00 H new ATOM 0 HE21 GLN A2069 9.273 -15.889 -22.200 1.00 0.00 H new ATOM 0 HE22 GLN A2069 7.943 -14.735 -22.056 1.00 0.00 H new ATOM 165 N ASP A2070 13.785 -12.590 -23.215 1.00 0.00 N ATOM 166 CA ASP A2070 15.022 -11.805 -23.317 1.00 0.00 C ATOM 167 C ASP A2070 16.099 -12.296 -22.331 1.00 0.00 C ATOM 168 O ASP A2070 17.284 -12.319 -22.669 1.00 0.00 O ATOM 169 CB ASP A2070 14.740 -10.309 -23.099 1.00 0.00 C ATOM 170 CG ASP A2070 14.065 -9.628 -24.300 1.00 0.00 C ATOM 171 OD1 ASP A2070 14.640 -9.685 -25.414 1.00 0.00 O ATOM 172 OD2 ASP A2070 13.013 -8.971 -24.126 1.00 0.00 O ATOM 0 H ASP A2070 12.978 -12.048 -22.905 1.00 0.00 H new ATOM 0 HA ASP A2070 15.409 -11.947 -24.326 1.00 0.00 H new ATOM 0 HB2 ASP A2070 14.104 -10.192 -22.221 1.00 0.00 H new ATOM 0 HB3 ASP A2070 15.679 -9.799 -22.883 1.00 0.00 H new ATOM 177 N LEU A2071 15.713 -12.735 -21.128 1.00 0.00 N ATOM 178 CA LEU A2071 16.640 -13.306 -20.148 1.00 0.00 C ATOM 179 C LEU A2071 17.223 -14.613 -20.702 1.00 0.00 C ATOM 180 O LEU A2071 18.441 -14.770 -20.732 1.00 0.00 O ATOM 181 CB LEU A2071 15.904 -13.489 -18.808 1.00 0.00 C ATOM 182 CG LEU A2071 16.773 -13.846 -17.587 1.00 0.00 C ATOM 183 CD1 LEU A2071 15.875 -13.818 -16.351 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.422 -15.236 -17.656 1.00 0.00 C ATOM 0 H LEU A2071 14.745 -12.704 -20.807 1.00 0.00 H new ATOM 0 HA LEU A2071 17.481 -12.638 -19.964 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.367 -12.567 -18.586 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.156 -14.272 -18.934 1.00 0.00 H new ATOM 0 HG LEU A2071 17.583 -13.118 -17.555 1.00 0.00 H new ATOM 0 HD11 LEU A2071 16.463 -14.067 -15.468 1.00 0.00 H new ATOM 0 HD12 LEU A2071 15.449 -12.822 -16.233 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.071 -14.545 -16.469 1.00 0.00 H new ATOM 0 HD21 LEU A2071 18.015 -15.406 -16.758 1.00 0.00 H new ATOM 0 HD22 LEU A2071 16.645 -15.997 -17.727 1.00 0.00 H new ATOM 0 HD23 LEU A2071 18.067 -15.293 -18.533 1.00 0.00 H new ATOM 196 N LEU A2072 16.383 -15.533 -21.194 1.00 0.00 N ATOM 197 CA LEU A2072 16.862 -16.794 -21.770 1.00 0.00 C ATOM 198 C LEU A2072 17.778 -16.584 -22.990 1.00 0.00 C ATOM 199 O LEU A2072 18.796 -17.272 -23.086 1.00 0.00 O ATOM 200 CB LEU A2072 15.686 -17.737 -22.073 1.00 0.00 C ATOM 201 CG LEU A2072 14.965 -18.278 -20.820 1.00 0.00 C ATOM 202 CD1 LEU A2072 13.828 -19.199 -21.263 1.00 0.00 C ATOM 203 CD2 LEU A2072 15.880 -19.076 -19.886 1.00 0.00 C ATOM 0 H LEU A2072 15.369 -15.427 -21.204 1.00 0.00 H new ATOM 0 HA LEU A2072 17.487 -17.276 -21.019 1.00 0.00 H new ATOM 0 HB2 LEU A2072 14.963 -17.208 -22.694 1.00 0.00 H new ATOM 0 HB3 LEU A2072 16.053 -18.580 -22.659 1.00 0.00 H new ATOM 0 HG LEU A2072 14.605 -17.410 -20.268 1.00 0.00 H new ATOM 0 HD11 LEU A2072 13.311 -19.587 -20.385 1.00 0.00 H new ATOM 0 HD12 LEU A2072 13.125 -18.639 -21.880 1.00 0.00 H new ATOM 0 HD13 LEU A2072 14.236 -20.029 -21.840 1.00 0.00 H new ATOM 0 HD21 LEU A2072 15.307 -19.426 -19.027 1.00 0.00 H new ATOM 0 HD22 LEU A2072 16.289 -19.932 -20.422 1.00 0.00 H new ATOM 0 HD23 LEU A2072 16.695 -18.439 -19.544 1.00 0.00 H new ATOM 215 N ARG A2073 17.500 -15.621 -23.888 1.00 0.00 N ATOM 216 CA ARG A2073 18.425 -15.331 -25.008 1.00 0.00 C ATOM 217 C ARG A2073 19.750 -14.732 -24.509 1.00 0.00 C ATOM 218 O ARG A2073 20.800 -14.995 -25.091 1.00 0.00 O ATOM 219 CB ARG A2073 17.759 -14.514 -26.135 1.00 0.00 C ATOM 220 CG ARG A2073 17.764 -12.994 -25.946 1.00 0.00 C ATOM 221 CD ARG A2073 17.079 -12.281 -27.117 1.00 0.00 C ATOM 222 NE ARG A2073 16.770 -10.882 -26.776 1.00 0.00 N ATOM 223 CZ ARG A2073 17.531 -9.812 -26.874 1.00 0.00 C ATOM 224 NH1 ARG A2073 18.745 -9.835 -27.348 1.00 0.00 N ATOM 225 NH2 ARG A2073 17.037 -8.679 -26.475 1.00 0.00 N ATOM 0 H ARG A2073 16.662 -15.040 -23.866 1.00 0.00 H new ATOM 0 HA ARG A2073 18.681 -16.285 -25.470 1.00 0.00 H new ATOM 0 HB2 ARG A2073 18.262 -14.747 -27.073 1.00 0.00 H new ATOM 0 HB3 ARG A2073 16.726 -14.846 -26.237 1.00 0.00 H new ATOM 0 HG2 ARG A2073 17.255 -12.740 -25.016 1.00 0.00 H new ATOM 0 HG3 ARG A2073 18.791 -12.641 -25.854 1.00 0.00 H new ATOM 0 HD2 ARG A2073 17.726 -12.311 -27.994 1.00 0.00 H new ATOM 0 HD3 ARG A2073 16.161 -12.806 -27.380 1.00 0.00 H new ATOM 0 HE ARG A2073 15.831 -10.718 -26.411 1.00 0.00 H new ATOM 0 HH11 ARG A2073 19.151 -10.715 -27.667 1.00 0.00 H new ATOM 0 HH12 ARG A2073 19.289 -8.973 -27.400 1.00 0.00 H new ATOM 0 HH21 ARG A2073 16.089 -8.639 -26.101 1.00 0.00 H new ATOM 0 HH22 ARG A2073 17.597 -7.829 -26.536 1.00 0.00 H new ATOM 239 N THR A2074 19.714 -13.975 -23.407 1.00 0.00 N ATOM 240 CA THR A2074 20.896 -13.389 -22.747 1.00 0.00 C ATOM 241 C THR A2074 21.731 -14.461 -22.032 1.00 0.00 C ATOM 242 O THR A2074 22.959 -14.414 -22.083 1.00 0.00 O ATOM 243 CB THR A2074 20.466 -12.280 -21.769 1.00 0.00 C ATOM 244 OG1 THR A2074 19.837 -11.243 -22.496 1.00 0.00 O ATOM 245 CG2 THR A2074 21.625 -11.654 -20.997 1.00 0.00 C ATOM 0 H THR A2074 18.841 -13.744 -22.933 1.00 0.00 H new ATOM 0 HA THR A2074 21.528 -12.947 -23.517 1.00 0.00 H new ATOM 0 HB THR A2074 19.801 -12.754 -21.048 1.00 0.00 H new ATOM 0 HG1 THR A2074 18.897 -11.474 -22.648 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.243 -10.882 -20.329 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.130 -12.423 -20.412 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.331 -11.210 -21.698 1.00 0.00 H new ATOM 253 N LEU A2075 21.103 -15.460 -21.397 1.00 0.00 N ATOM 254 CA LEU A2075 21.765 -16.590 -20.721 1.00 0.00 C ATOM 255 C LEU A2075 22.683 -17.364 -21.690 1.00 0.00 C ATOM 256 O LEU A2075 23.771 -17.790 -21.301 1.00 0.00 O ATOM 257 CB LEU A2075 20.662 -17.461 -20.072 1.00 0.00 C ATOM 258 CG LEU A2075 21.013 -18.794 -19.369 1.00 0.00 C ATOM 259 CD1 LEU A2075 21.160 -19.961 -20.349 1.00 0.00 C ATOM 260 CD2 LEU A2075 22.247 -18.759 -18.465 1.00 0.00 C ATOM 0 H LEU A2075 20.086 -15.508 -21.336 1.00 0.00 H new ATOM 0 HA LEU A2075 22.433 -16.239 -19.934 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.152 -16.837 -19.338 1.00 0.00 H new ATOM 0 HB3 LEU A2075 19.937 -17.692 -20.852 1.00 0.00 H new ATOM 0 HG LEU A2075 20.148 -18.950 -18.724 1.00 0.00 H new ATOM 0 HD11 LEU A2075 21.406 -20.869 -19.799 1.00 0.00 H new ATOM 0 HD12 LEU A2075 20.223 -20.105 -20.886 1.00 0.00 H new ATOM 0 HD13 LEU A2075 21.956 -19.741 -21.060 1.00 0.00 H new ATOM 0 HD21 LEU A2075 22.402 -19.743 -18.023 1.00 0.00 H new ATOM 0 HD22 LEU A2075 23.122 -18.484 -19.054 1.00 0.00 H new ATOM 0 HD23 LEU A2075 22.097 -18.025 -17.673 1.00 0.00 H new ATOM 272 N LYS A2076 22.283 -17.501 -22.964 1.00 0.00 N ATOM 273 CA LYS A2076 23.085 -18.172 -24.014 1.00 0.00 C ATOM 274 C LYS A2076 24.464 -17.543 -24.274 1.00 0.00 C ATOM 275 O LYS A2076 25.371 -18.242 -24.732 1.00 0.00 O ATOM 276 CB LYS A2076 22.316 -18.248 -25.341 1.00 0.00 C ATOM 277 CG LYS A2076 21.067 -19.136 -25.272 1.00 0.00 C ATOM 278 CD LYS A2076 20.521 -19.367 -26.686 1.00 0.00 C ATOM 279 CE LYS A2076 19.252 -20.226 -26.651 1.00 0.00 C ATOM 280 NZ LYS A2076 18.767 -20.531 -28.023 1.00 0.00 N ATOM 0 H LYS A2076 21.388 -17.148 -23.303 1.00 0.00 H new ATOM 0 HA LYS A2076 23.264 -19.170 -23.615 1.00 0.00 H new ATOM 0 HB2 LYS A2076 22.021 -17.242 -25.640 1.00 0.00 H new ATOM 0 HB3 LYS A2076 22.981 -18.629 -26.116 1.00 0.00 H new ATOM 0 HG2 LYS A2076 21.312 -20.090 -24.806 1.00 0.00 H new ATOM 0 HG3 LYS A2076 20.306 -18.664 -24.650 1.00 0.00 H new ATOM 0 HD2 LYS A2076 20.303 -18.408 -27.157 1.00 0.00 H new ATOM 0 HD3 LYS A2076 21.279 -19.857 -27.297 1.00 0.00 H new ATOM 0 HE2 LYS A2076 19.455 -21.156 -26.120 1.00 0.00 H new ATOM 0 HE3 LYS A2076 18.473 -19.705 -26.095 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 17.907 -21.113 -27.966 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 18.551 -19.643 -28.520 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 19.503 -21.050 -28.544 1.00 0.00 H new ATOM 294 N SER A2077 24.635 -16.247 -24.007 1.00 0.00 N ATOM 295 CA SER A2077 25.899 -15.520 -24.211 1.00 0.00 C ATOM 296 C SER A2077 27.041 -16.021 -23.302 1.00 0.00 C ATOM 297 O SER A2077 26.780 -16.549 -22.215 1.00 0.00 O ATOM 298 CB SER A2077 25.674 -14.029 -23.936 1.00 0.00 C ATOM 299 OG SER A2077 24.749 -13.492 -24.868 1.00 0.00 O ATOM 0 H SER A2077 23.889 -15.659 -23.636 1.00 0.00 H new ATOM 0 HA SER A2077 26.201 -15.696 -25.243 1.00 0.00 H new ATOM 0 HB2 SER A2077 25.300 -13.891 -22.921 1.00 0.00 H new ATOM 0 HB3 SER A2077 26.621 -13.493 -24.002 1.00 0.00 H new ATOM 0 HG SER A2077 24.612 -12.540 -24.681 1.00 0.00 H new ATOM 305 N PRO A2078 28.318 -15.842 -23.698 1.00 0.00 N ATOM 306 CA PRO A2078 29.466 -16.205 -22.864 1.00 0.00 C ATOM 307 C PRO A2078 29.627 -15.223 -21.687 1.00 0.00 C ATOM 308 O PRO A2078 29.005 -14.156 -21.659 1.00 0.00 O ATOM 309 CB PRO A2078 30.670 -16.152 -23.812 1.00 0.00 C ATOM 310 CG PRO A2078 30.283 -15.056 -24.803 1.00 0.00 C ATOM 311 CD PRO A2078 28.774 -15.243 -24.949 1.00 0.00 C ATOM 0 HA PRO A2078 29.353 -17.189 -22.410 1.00 0.00 H new ATOM 0 HB2 PRO A2078 31.590 -15.909 -23.281 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.833 -17.107 -24.311 1.00 0.00 H new ATOM 0 HG2 PRO A2078 30.532 -14.064 -24.426 1.00 0.00 H new ATOM 0 HG3 PRO A2078 30.798 -15.173 -25.756 1.00 0.00 H new ATOM 0 HD2 PRO A2078 28.278 -14.289 -25.128 1.00 0.00 H new ATOM 0 HD3 PRO A2078 28.541 -15.887 -25.797 1.00 0.00 H new ATOM 319 N SER A2079 30.491 -15.564 -20.725 1.00 0.00 N ATOM 320 CA SER A2079 30.818 -14.733 -19.554 1.00 0.00 C ATOM 321 C SER A2079 31.478 -13.409 -19.988 1.00 0.00 C ATOM 322 O SER A2079 32.678 -13.375 -20.285 1.00 0.00 O ATOM 323 CB SER A2079 31.741 -15.507 -18.597 1.00 0.00 C ATOM 324 OG SER A2079 31.197 -16.780 -18.269 1.00 0.00 O ATOM 0 H SER A2079 30.998 -16.449 -20.737 1.00 0.00 H new ATOM 0 HA SER A2079 29.892 -14.493 -19.032 1.00 0.00 H new ATOM 0 HB2 SER A2079 32.720 -15.636 -19.058 1.00 0.00 H new ATOM 0 HB3 SER A2079 31.891 -14.928 -17.686 1.00 0.00 H new ATOM 0 HG SER A2079 31.806 -17.249 -17.661 1.00 0.00 H new ATOM 330 N SER A2080 30.697 -12.325 -20.084 1.00 0.00 N ATOM 331 CA SER A2080 31.156 -11.019 -20.587 1.00 0.00 C ATOM 332 C SER A2080 30.439 -9.817 -19.942 1.00 0.00 C ATOM 333 O SER A2080 29.314 -9.957 -19.447 1.00 0.00 O ATOM 334 CB SER A2080 30.919 -10.985 -22.110 1.00 0.00 C ATOM 335 OG SER A2080 29.547 -10.785 -22.417 1.00 0.00 O ATOM 0 H SER A2080 29.714 -12.328 -19.811 1.00 0.00 H new ATOM 0 HA SER A2080 32.211 -10.923 -20.329 1.00 0.00 H new ATOM 0 HB2 SER A2080 31.513 -10.186 -22.554 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.260 -11.920 -22.554 1.00 0.00 H new ATOM 0 HG SER A2080 29.429 -10.766 -23.390 1.00 0.00 H new ATOM 341 N PRO A2081 31.032 -8.602 -19.984 1.00 0.00 N ATOM 342 CA PRO A2081 30.368 -7.388 -19.502 1.00 0.00 C ATOM 343 C PRO A2081 29.168 -7.004 -20.393 1.00 0.00 C ATOM 344 O PRO A2081 28.264 -6.293 -19.953 1.00 0.00 O ATOM 345 CB PRO A2081 31.456 -6.311 -19.479 1.00 0.00 C ATOM 346 CG PRO A2081 32.424 -6.753 -20.574 1.00 0.00 C ATOM 347 CD PRO A2081 32.352 -8.278 -20.517 1.00 0.00 C ATOM 0 HA PRO A2081 29.938 -7.526 -18.510 1.00 0.00 H new ATOM 0 HB2 PRO A2081 31.045 -5.322 -19.683 1.00 0.00 H new ATOM 0 HB3 PRO A2081 31.947 -6.258 -18.507 1.00 0.00 H new ATOM 0 HG2 PRO A2081 32.126 -6.373 -21.551 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.435 -6.391 -20.386 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.489 -8.712 -21.507 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.139 -8.682 -19.880 1.00 0.00 H new ATOM 355 N GLN A2082 29.109 -7.520 -21.628 1.00 0.00 N ATOM 356 CA GLN A2082 27.974 -7.326 -22.537 1.00 0.00 C ATOM 357 C GLN A2082 26.737 -8.068 -22.002 1.00 0.00 C ATOM 358 O GLN A2082 25.632 -7.523 -22.014 1.00 0.00 O ATOM 359 CB GLN A2082 28.342 -7.803 -23.954 1.00 0.00 C ATOM 360 CG GLN A2082 29.626 -7.171 -24.524 1.00 0.00 C ATOM 361 CD GLN A2082 29.651 -5.643 -24.442 1.00 0.00 C ATOM 362 OE1 GLN A2082 28.711 -4.949 -24.811 1.00 0.00 O ATOM 363 NE2 GLN A2082 30.723 -5.055 -23.950 1.00 0.00 N ATOM 0 H GLN A2082 29.856 -8.089 -22.027 1.00 0.00 H new ATOM 0 HA GLN A2082 27.734 -6.264 -22.591 1.00 0.00 H new ATOM 0 HB2 GLN A2082 28.460 -8.887 -23.940 1.00 0.00 H new ATOM 0 HB3 GLN A2082 27.513 -7.581 -24.626 1.00 0.00 H new ATOM 0 HG2 GLN A2082 30.486 -7.569 -23.985 1.00 0.00 H new ATOM 0 HG3 GLN A2082 29.736 -7.472 -25.566 1.00 0.00 H new ATOM 0 HE21 GLN A2082 31.515 -5.617 -23.638 1.00 0.00 H new ATOM 0 HE22 GLN A2082 30.761 -4.038 -23.881 1.00 0.00 H new ATOM 372 N GLN A2083 26.924 -9.281 -21.462 1.00 0.00 N ATOM 373 CA GLN A2083 25.857 -10.055 -20.821 1.00 0.00 C ATOM 374 C GLN A2083 25.337 -9.324 -19.570 1.00 0.00 C ATOM 375 O GLN A2083 24.125 -9.214 -19.387 1.00 0.00 O ATOM 376 CB GLN A2083 26.380 -11.462 -20.495 1.00 0.00 C ATOM 377 CG GLN A2083 25.253 -12.411 -20.067 1.00 0.00 C ATOM 378 CD GLN A2083 25.776 -13.818 -19.780 1.00 0.00 C ATOM 379 OE1 GLN A2083 26.744 -14.019 -19.060 1.00 0.00 O ATOM 380 NE2 GLN A2083 25.148 -14.838 -20.321 1.00 0.00 N ATOM 0 H GLN A2083 27.828 -9.754 -21.459 1.00 0.00 H new ATOM 0 HA GLN A2083 25.011 -10.156 -21.501 1.00 0.00 H new ATOM 0 HB2 GLN A2083 26.886 -11.872 -21.369 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.121 -11.397 -19.698 1.00 0.00 H new ATOM 0 HG2 GLN A2083 24.764 -12.016 -19.177 1.00 0.00 H new ATOM 0 HG3 GLN A2083 24.498 -12.457 -20.852 1.00 0.00 H new ATOM 0 HE21 GLN A2083 24.340 -14.679 -20.923 1.00 0.00 H new ATOM 0 HE22 GLN A2083 25.469 -15.789 -20.139 1.00 0.00 H new ATOM 389 N GLN A2084 26.236 -8.760 -18.748 1.00 0.00 N ATOM 390 CA GLN A2084 25.877 -7.941 -17.578 1.00 0.00 C ATOM 391 C GLN A2084 24.987 -6.762 -18.002 1.00 0.00 C ATOM 392 O GLN A2084 23.924 -6.554 -17.413 1.00 0.00 O ATOM 393 CB GLN A2084 27.162 -7.461 -16.870 1.00 0.00 C ATOM 394 CG GLN A2084 26.939 -6.401 -15.777 1.00 0.00 C ATOM 395 CD GLN A2084 28.271 -5.865 -15.249 1.00 0.00 C ATOM 396 OE1 GLN A2084 28.843 -4.919 -15.771 1.00 0.00 O ATOM 397 NE2 GLN A2084 28.821 -6.445 -14.206 1.00 0.00 N ATOM 0 H GLN A2084 27.243 -8.860 -18.878 1.00 0.00 H new ATOM 0 HA GLN A2084 25.304 -8.543 -16.873 1.00 0.00 H new ATOM 0 HB2 GLN A2084 27.658 -8.323 -16.424 1.00 0.00 H new ATOM 0 HB3 GLN A2084 27.842 -7.054 -17.618 1.00 0.00 H new ATOM 0 HG2 GLN A2084 26.346 -5.579 -16.179 1.00 0.00 H new ATOM 0 HG3 GLN A2084 26.367 -6.835 -14.957 1.00 0.00 H new ATOM 0 HE21 GLN A2084 28.357 -7.236 -13.758 1.00 0.00 H new ATOM 0 HE22 GLN A2084 29.712 -6.105 -13.844 1.00 0.00 H new ATOM 406 N GLN A2085 25.383 -6.012 -19.038 1.00 0.00 N ATOM 407 CA GLN A2085 24.586 -4.896 -19.553 1.00 0.00 C ATOM 408 C GLN A2085 23.204 -5.364 -20.029 1.00 0.00 C ATOM 409 O GLN A2085 22.211 -4.709 -19.726 1.00 0.00 O ATOM 410 CB GLN A2085 25.352 -4.161 -20.666 1.00 0.00 C ATOM 411 CG GLN A2085 24.636 -2.880 -21.134 1.00 0.00 C ATOM 412 CD GLN A2085 24.479 -1.847 -20.016 1.00 0.00 C ATOM 413 OE1 GLN A2085 25.444 -1.341 -19.457 1.00 0.00 O ATOM 414 NE2 GLN A2085 23.267 -1.499 -19.636 1.00 0.00 N ATOM 0 H GLN A2085 26.259 -6.162 -19.539 1.00 0.00 H new ATOM 0 HA GLN A2085 24.417 -4.192 -18.738 1.00 0.00 H new ATOM 0 HB2 GLN A2085 26.349 -3.905 -20.307 1.00 0.00 H new ATOM 0 HB3 GLN A2085 25.482 -4.831 -21.516 1.00 0.00 H new ATOM 0 HG2 GLN A2085 25.196 -2.436 -21.957 1.00 0.00 H new ATOM 0 HG3 GLN A2085 23.652 -3.141 -21.523 1.00 0.00 H new ATOM 0 HE21 GLN A2085 22.452 -1.911 -20.091 1.00 0.00 H new ATOM 0 HE22 GLN A2085 23.143 -0.818 -18.887 1.00 0.00 H new ATOM 423 N GLN A2086 23.104 -6.503 -20.725 1.00 0.00 N ATOM 424 CA GLN A2086 21.811 -7.045 -21.159 1.00 0.00 C ATOM 425 C GLN A2086 20.905 -7.416 -19.975 1.00 0.00 C ATOM 426 O GLN A2086 19.728 -7.054 -19.976 1.00 0.00 O ATOM 427 CB GLN A2086 22.011 -8.246 -22.099 1.00 0.00 C ATOM 428 CG GLN A2086 21.686 -7.903 -23.559 1.00 0.00 C ATOM 429 CD GLN A2086 20.220 -7.512 -23.735 1.00 0.00 C ATOM 430 OE1 GLN A2086 19.879 -6.351 -23.932 1.00 0.00 O ATOM 431 NE2 GLN A2086 19.305 -8.451 -23.623 1.00 0.00 N ATOM 0 H GLN A2086 23.907 -7.069 -21.000 1.00 0.00 H new ATOM 0 HA GLN A2086 21.301 -6.255 -21.710 1.00 0.00 H new ATOM 0 HB2 GLN A2086 23.043 -8.591 -22.030 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.377 -9.070 -21.772 1.00 0.00 H new ATOM 0 HG2 GLN A2086 22.323 -7.083 -23.891 1.00 0.00 H new ATOM 0 HG3 GLN A2086 21.913 -8.760 -24.193 1.00 0.00 H new ATOM 0 HE21 GLN A2086 19.584 -9.418 -23.459 1.00 0.00 H new ATOM 0 HE22 GLN A2086 18.316 -8.212 -23.700 1.00 0.00 H new ATOM 440 N VAL A2087 21.440 -8.077 -18.940 1.00 0.00 N ATOM 441 CA VAL A2087 20.684 -8.401 -17.714 1.00 0.00 C ATOM 442 C VAL A2087 20.156 -7.112 -17.072 1.00 0.00 C ATOM 443 O VAL A2087 18.972 -7.026 -16.744 1.00 0.00 O ATOM 444 CB VAL A2087 21.547 -9.219 -16.732 1.00 0.00 C ATOM 445 CG1 VAL A2087 20.909 -9.375 -15.348 1.00 0.00 C ATOM 446 CG2 VAL A2087 21.780 -10.631 -17.277 1.00 0.00 C ATOM 0 H VAL A2087 22.406 -8.403 -18.925 1.00 0.00 H new ATOM 0 HA VAL A2087 19.829 -9.023 -17.978 1.00 0.00 H new ATOM 0 HB VAL A2087 22.478 -8.661 -16.631 1.00 0.00 H new ATOM 0 HG11 VAL A2087 21.568 -9.961 -14.707 1.00 0.00 H new ATOM 0 HG12 VAL A2087 20.754 -8.391 -14.906 1.00 0.00 H new ATOM 0 HG13 VAL A2087 19.950 -9.885 -15.445 1.00 0.00 H new ATOM 0 HG21 VAL A2087 22.391 -11.197 -16.573 1.00 0.00 H new ATOM 0 HG22 VAL A2087 20.821 -11.132 -17.410 1.00 0.00 H new ATOM 0 HG23 VAL A2087 22.294 -10.571 -18.236 1.00 0.00 H new ATOM 456 N LEU A2088 21.001 -6.082 -16.957 1.00 0.00 N ATOM 457 CA LEU A2088 20.604 -4.767 -16.448 1.00 0.00 C ATOM 458 C LEU A2088 19.540 -4.111 -17.342 1.00 0.00 C ATOM 459 O LEU A2088 18.583 -3.571 -16.803 1.00 0.00 O ATOM 460 CB LEU A2088 21.844 -3.868 -16.300 1.00 0.00 C ATOM 461 CG LEU A2088 22.787 -4.288 -15.158 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.074 -3.467 -15.231 1.00 0.00 C ATOM 463 CD2 LEU A2088 22.148 -4.073 -13.784 1.00 0.00 C ATOM 0 H LEU A2088 21.986 -6.139 -17.216 1.00 0.00 H new ATOM 0 HA LEU A2088 20.151 -4.901 -15.466 1.00 0.00 H new ATOM 0 HB2 LEU A2088 22.400 -3.875 -17.238 1.00 0.00 H new ATOM 0 HB3 LEU A2088 21.518 -2.842 -16.130 1.00 0.00 H new ATOM 0 HG LEU A2088 22.997 -5.351 -15.279 1.00 0.00 H new ATOM 0 HD11 LEU A2088 24.742 -3.764 -14.422 1.00 0.00 H new ATOM 0 HD12 LEU A2088 24.564 -3.642 -16.189 1.00 0.00 H new ATOM 0 HD13 LEU A2088 23.836 -2.408 -15.134 1.00 0.00 H new ATOM 0 HD21 LEU A2088 22.846 -4.382 -13.006 1.00 0.00 H new ATOM 0 HD22 LEU A2088 21.906 -3.018 -13.656 1.00 0.00 H new ATOM 0 HD23 LEU A2088 21.236 -4.666 -13.710 1.00 0.00 H new ATOM 475 N ASN A2089 19.638 -4.177 -18.676 1.00 0.00 N ATOM 476 CA ASN A2089 18.628 -3.609 -19.583 1.00 0.00 C ATOM 477 C ASN A2089 17.229 -4.201 -19.312 1.00 0.00 C ATOM 478 O ASN A2089 16.243 -3.469 -19.202 1.00 0.00 O ATOM 479 CB ASN A2089 19.007 -3.863 -21.060 1.00 0.00 C ATOM 480 CG ASN A2089 20.273 -3.188 -21.559 1.00 0.00 C ATOM 481 OD1 ASN A2089 20.802 -2.244 -20.987 1.00 0.00 O ATOM 482 ND2 ASN A2089 20.796 -3.652 -22.675 1.00 0.00 N ATOM 0 H ASN A2089 20.418 -4.625 -19.158 1.00 0.00 H new ATOM 0 HA ASN A2089 18.599 -2.536 -19.395 1.00 0.00 H new ATOM 0 HB2 ASN A2089 19.113 -4.938 -21.205 1.00 0.00 H new ATOM 0 HB3 ASN A2089 18.177 -3.537 -21.686 1.00 0.00 H new ATOM 0 HD21 ASN A2089 21.639 -3.225 -23.059 1.00 0.00 H new ATOM 0 HD22 ASN A2089 20.358 -4.439 -23.155 1.00 0.00 H new ATOM 489 N ILE A2090 17.153 -5.530 -19.186 1.00 0.00 N ATOM 490 CA ILE A2090 15.914 -6.283 -18.926 1.00 0.00 C ATOM 491 C ILE A2090 15.340 -5.935 -17.544 1.00 0.00 C ATOM 492 O ILE A2090 14.150 -5.626 -17.415 1.00 0.00 O ATOM 493 CB ILE A2090 16.204 -7.800 -19.051 1.00 0.00 C ATOM 494 CG1 ILE A2090 16.632 -8.170 -20.491 1.00 0.00 C ATOM 495 CG2 ILE A2090 14.974 -8.637 -18.655 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.398 -9.495 -20.559 1.00 0.00 C ATOM 0 H ILE A2090 17.973 -6.132 -19.264 1.00 0.00 H new ATOM 0 HA ILE A2090 15.162 -6.006 -19.664 1.00 0.00 H new ATOM 0 HB ILE A2090 17.022 -8.026 -18.367 1.00 0.00 H new ATOM 0 HG12 ILE A2090 15.747 -8.234 -21.123 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.256 -7.373 -20.896 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.208 -9.697 -18.753 1.00 0.00 H new ATOM 0 HG22 ILE A2090 14.703 -8.419 -17.622 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.139 -8.388 -19.309 1.00 0.00 H new ATOM 0 HD11 ILE A2090 17.673 -9.704 -21.593 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.300 -9.426 -19.951 1.00 0.00 H new ATOM 0 HD13 ILE A2090 16.767 -10.300 -20.182 1.00 0.00 H new ATOM 508 N LEU A2091 16.183 -5.968 -16.507 1.00 0.00 N ATOM 509 CA LEU A2091 15.789 -5.680 -15.128 1.00 0.00 C ATOM 510 C LEU A2091 15.424 -4.201 -14.898 1.00 0.00 C ATOM 511 O LEU A2091 14.436 -3.927 -14.222 1.00 0.00 O ATOM 512 CB LEU A2091 16.908 -6.147 -14.185 1.00 0.00 C ATOM 513 CG LEU A2091 17.107 -7.674 -14.083 1.00 0.00 C ATOM 514 CD1 LEU A2091 18.341 -7.956 -13.225 1.00 0.00 C ATOM 515 CD2 LEU A2091 15.913 -8.373 -13.427 1.00 0.00 C ATOM 0 H LEU A2091 17.172 -6.199 -16.605 1.00 0.00 H new ATOM 0 HA LEU A2091 14.874 -6.232 -14.912 1.00 0.00 H new ATOM 0 HB2 LEU A2091 17.845 -5.699 -14.514 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.702 -5.759 -13.187 1.00 0.00 H new ATOM 0 HG LEU A2091 17.219 -8.057 -15.097 1.00 0.00 H new ATOM 0 HD11 LEU A2091 18.491 -9.033 -13.146 1.00 0.00 H new ATOM 0 HD12 LEU A2091 19.217 -7.500 -13.687 1.00 0.00 H new ATOM 0 HD13 LEU A2091 18.196 -7.536 -12.230 1.00 0.00 H new ATOM 0 HD21 LEU A2091 16.101 -9.446 -13.378 1.00 0.00 H new ATOM 0 HD22 LEU A2091 15.772 -7.983 -12.419 1.00 0.00 H new ATOM 0 HD23 LEU A2091 15.015 -8.189 -14.016 1.00 0.00 H new ATOM 527 N LYS A2092 16.143 -3.237 -15.493 1.00 0.00 N ATOM 528 CA LYS A2092 15.823 -1.793 -15.412 1.00 0.00 C ATOM 529 C LYS A2092 14.523 -1.432 -16.146 1.00 0.00 C ATOM 530 O LYS A2092 13.946 -0.380 -15.871 1.00 0.00 O ATOM 531 CB LYS A2092 16.999 -0.941 -15.929 1.00 0.00 C ATOM 532 CG LYS A2092 18.227 -0.930 -14.996 1.00 0.00 C ATOM 533 CD LYS A2092 18.010 -0.260 -13.625 1.00 0.00 C ATOM 534 CE LYS A2092 17.500 1.190 -13.684 1.00 0.00 C ATOM 535 NZ LYS A2092 18.479 2.117 -14.315 1.00 0.00 N ATOM 0 H LYS A2092 16.973 -3.434 -16.052 1.00 0.00 H new ATOM 0 HA LYS A2092 15.662 -1.566 -14.358 1.00 0.00 H new ATOM 0 HB2 LYS A2092 17.302 -1.315 -16.907 1.00 0.00 H new ATOM 0 HB3 LYS A2092 16.656 0.084 -16.072 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.547 -1.959 -14.832 1.00 0.00 H new ATOM 0 HG3 LYS A2092 19.044 -0.420 -15.505 1.00 0.00 H new ATOM 0 HD2 LYS A2092 17.298 -0.857 -13.054 1.00 0.00 H new ATOM 0 HD3 LYS A2092 18.952 -0.276 -13.076 1.00 0.00 H new ATOM 0 HE2 LYS A2092 16.565 1.220 -14.243 1.00 0.00 H new ATOM 0 HE3 LYS A2092 17.278 1.534 -12.674 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 18.086 3.080 -14.329 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 19.364 2.112 -13.768 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 18.672 1.807 -15.289 1.00 0.00 H new ATOM 549 N SER A2093 14.033 -2.312 -17.022 1.00 0.00 N ATOM 550 CA SER A2093 12.732 -2.182 -17.705 1.00 0.00 C ATOM 551 C SER A2093 11.589 -2.821 -16.888 1.00 0.00 C ATOM 552 O SER A2093 10.416 -2.646 -17.217 1.00 0.00 O ATOM 553 CB SER A2093 12.788 -2.824 -19.098 1.00 0.00 C ATOM 554 OG SER A2093 13.777 -2.205 -19.904 1.00 0.00 O ATOM 0 H SER A2093 14.538 -3.158 -17.287 1.00 0.00 H new ATOM 0 HA SER A2093 12.526 -1.116 -17.803 1.00 0.00 H new ATOM 0 HB2 SER A2093 13.005 -3.888 -19.003 1.00 0.00 H new ATOM 0 HB3 SER A2093 11.815 -2.739 -19.581 1.00 0.00 H new ATOM 0 HG SER A2093 14.653 -2.598 -19.706 1.00 0.00 H new ATOM 560 N ASN A2094 11.922 -3.546 -15.808 1.00 0.00 N ATOM 561 CA ASN A2094 11.014 -4.237 -14.883 1.00 0.00 C ATOM 562 C ASN A2094 11.529 -4.091 -13.420 1.00 0.00 C ATOM 563 O ASN A2094 11.730 -5.100 -12.734 1.00 0.00 O ATOM 564 CB ASN A2094 10.907 -5.717 -15.319 1.00 0.00 C ATOM 565 CG ASN A2094 10.354 -5.921 -16.719 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.155 -6.050 -16.928 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.211 -5.980 -17.717 1.00 0.00 N ATOM 0 H ASN A2094 12.898 -3.672 -15.542 1.00 0.00 H new ATOM 0 HA ASN A2094 10.019 -3.793 -14.914 1.00 0.00 H new ATOM 0 HB2 ASN A2094 11.896 -6.172 -15.262 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.271 -6.247 -14.610 1.00 0.00 H new ATOM 0 HD21 ASN A2094 10.876 -6.134 -18.668 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.209 -5.872 -17.539 1.00 0.00 H new ATOM 574 N PRO A2095 11.789 -2.865 -12.909 1.00 0.00 N ATOM 575 CA PRO A2095 12.396 -2.663 -11.587 1.00 0.00 C ATOM 576 C PRO A2095 11.587 -3.220 -10.406 1.00 0.00 C ATOM 577 O PRO A2095 12.162 -3.489 -9.353 1.00 0.00 O ATOM 578 CB PRO A2095 12.668 -1.160 -11.466 1.00 0.00 C ATOM 579 CG PRO A2095 11.694 -0.527 -12.456 1.00 0.00 C ATOM 580 CD PRO A2095 11.584 -1.578 -13.557 1.00 0.00 C ATOM 0 HA PRO A2095 13.316 -3.243 -11.524 1.00 0.00 H new ATOM 0 HB2 PRO A2095 12.493 -0.803 -10.451 1.00 0.00 H new ATOM 0 HB3 PRO A2095 13.702 -0.920 -11.715 1.00 0.00 H new ATOM 0 HG2 PRO A2095 10.727 -0.323 -11.996 1.00 0.00 H new ATOM 0 HG3 PRO A2095 12.070 0.421 -12.840 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.608 -1.536 -14.040 1.00 0.00 H new ATOM 0 HD3 PRO A2095 12.331 -1.409 -14.333 1.00 0.00 H new ATOM 588 N GLN A2096 10.281 -3.446 -10.585 1.00 0.00 N ATOM 589 CA GLN A2096 9.376 -4.025 -9.582 1.00 0.00 C ATOM 590 C GLN A2096 9.893 -5.380 -9.070 1.00 0.00 C ATOM 591 O GLN A2096 9.942 -5.616 -7.861 1.00 0.00 O ATOM 592 CB GLN A2096 7.977 -4.216 -10.204 1.00 0.00 C ATOM 593 CG GLN A2096 7.156 -2.937 -10.436 1.00 0.00 C ATOM 594 CD GLN A2096 7.854 -1.898 -11.309 1.00 0.00 C ATOM 595 OE1 GLN A2096 8.338 -0.876 -10.843 1.00 0.00 O ATOM 596 NE2 GLN A2096 7.958 -2.124 -12.601 1.00 0.00 N ATOM 0 H GLN A2096 9.808 -3.224 -11.461 1.00 0.00 H new ATOM 0 HA GLN A2096 9.325 -3.339 -8.737 1.00 0.00 H new ATOM 0 HB2 GLN A2096 8.094 -4.726 -11.160 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.402 -4.879 -9.557 1.00 0.00 H new ATOM 0 HG2 GLN A2096 6.207 -3.206 -10.899 1.00 0.00 H new ATOM 0 HG3 GLN A2096 6.923 -2.487 -9.471 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.559 -2.972 -13.004 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.437 -1.451 -13.199 1.00 0.00 H new ATOM 605 N LEU A2097 10.309 -6.256 -9.995 1.00 0.00 N ATOM 606 CA LEU A2097 10.865 -7.572 -9.676 1.00 0.00 C ATOM 607 C LEU A2097 12.367 -7.519 -9.339 1.00 0.00 C ATOM 608 O LEU A2097 12.832 -8.324 -8.532 1.00 0.00 O ATOM 609 CB LEU A2097 10.475 -8.607 -10.758 1.00 0.00 C ATOM 610 CG LEU A2097 10.706 -8.269 -12.249 1.00 0.00 C ATOM 611 CD1 LEU A2097 12.175 -8.333 -12.675 1.00 0.00 C ATOM 612 CD2 LEU A2097 9.955 -9.281 -13.120 1.00 0.00 C ATOM 0 H LEU A2097 10.267 -6.066 -10.996 1.00 0.00 H new ATOM 0 HA LEU A2097 10.410 -7.923 -8.750 1.00 0.00 H new ATOM 0 HB2 LEU A2097 11.019 -9.526 -10.543 1.00 0.00 H new ATOM 0 HB3 LEU A2097 9.415 -8.828 -10.633 1.00 0.00 H new ATOM 0 HG LEU A2097 10.351 -7.247 -12.379 1.00 0.00 H new ATOM 0 HD11 LEU A2097 12.258 -8.084 -13.733 1.00 0.00 H new ATOM 0 HD12 LEU A2097 12.755 -7.621 -12.088 1.00 0.00 H new ATOM 0 HD13 LEU A2097 12.559 -9.339 -12.508 1.00 0.00 H new ATOM 0 HD21 LEU A2097 10.116 -9.046 -14.172 1.00 0.00 H new ATOM 0 HD22 LEU A2097 10.325 -10.285 -12.912 1.00 0.00 H new ATOM 0 HD23 LEU A2097 8.889 -9.233 -12.896 1.00 0.00 H new ATOM 624 N MET A2098 13.121 -6.556 -9.886 1.00 0.00 N ATOM 625 CA MET A2098 14.556 -6.401 -9.608 1.00 0.00 C ATOM 626 C MET A2098 14.829 -5.925 -8.177 1.00 0.00 C ATOM 627 O MET A2098 15.672 -6.498 -7.491 1.00 0.00 O ATOM 628 CB MET A2098 15.191 -5.410 -10.596 1.00 0.00 C ATOM 629 CG MET A2098 16.725 -5.404 -10.460 1.00 0.00 C ATOM 630 SD MET A2098 17.586 -4.075 -11.344 1.00 0.00 S ATOM 631 CE MET A2098 17.267 -2.712 -10.201 1.00 0.00 C ATOM 0 H MET A2098 12.753 -5.861 -10.535 1.00 0.00 H new ATOM 0 HA MET A2098 15.003 -7.388 -9.726 1.00 0.00 H new ATOM 0 HB2 MET A2098 14.913 -5.679 -11.615 1.00 0.00 H new ATOM 0 HB3 MET A2098 14.802 -4.408 -10.413 1.00 0.00 H new ATOM 0 HG2 MET A2098 16.978 -5.335 -9.402 1.00 0.00 H new ATOM 0 HG3 MET A2098 17.107 -6.360 -10.817 1.00 0.00 H new ATOM 0 HE1 MET A2098 17.727 -1.801 -10.584 1.00 0.00 H new ATOM 0 HE2 MET A2098 16.192 -2.563 -10.104 1.00 0.00 H new ATOM 0 HE3 MET A2098 17.690 -2.949 -9.225 1.00 0.00 H new ATOM 641 N ALA A2099 14.138 -4.879 -7.716 1.00 0.00 N ATOM 642 CA ALA A2099 14.344 -4.312 -6.384 1.00 0.00 C ATOM 643 C ALA A2099 13.980 -5.293 -5.252 1.00 0.00 C ATOM 644 O ALA A2099 14.651 -5.323 -4.219 1.00 0.00 O ATOM 645 CB ALA A2099 13.578 -2.993 -6.301 1.00 0.00 C ATOM 0 H ALA A2099 13.418 -4.401 -8.259 1.00 0.00 H new ATOM 0 HA ALA A2099 15.406 -4.118 -6.236 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.718 -2.552 -5.314 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.952 -2.307 -7.061 1.00 0.00 H new ATOM 0 HB3 ALA A2099 12.517 -3.177 -6.469 1.00 0.00 H new ATOM 651 N ALA A2100 12.963 -6.137 -5.460 1.00 0.00 N ATOM 652 CA ALA A2100 12.596 -7.186 -4.511 1.00 0.00 C ATOM 653 C ALA A2100 13.642 -8.325 -4.500 1.00 0.00 C ATOM 654 O ALA A2100 13.923 -8.893 -3.443 1.00 0.00 O ATOM 655 CB ALA A2100 11.201 -7.706 -4.877 1.00 0.00 C ATOM 0 H ALA A2100 12.373 -6.109 -6.292 1.00 0.00 H new ATOM 0 HA ALA A2100 12.576 -6.776 -3.501 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.910 -8.491 -4.178 1.00 0.00 H new ATOM 0 HB2 ALA A2100 10.482 -6.888 -4.824 1.00 0.00 H new ATOM 0 HB3 ALA A2100 11.217 -8.109 -5.889 1.00 0.00 H new ATOM 661 N PHE A2101 14.231 -8.639 -5.661 1.00 0.00 N ATOM 662 CA PHE A2101 15.268 -9.663 -5.828 1.00 0.00 C ATOM 663 C PHE A2101 16.622 -9.241 -5.239 1.00 0.00 C ATOM 664 O PHE A2101 17.179 -9.978 -4.427 1.00 0.00 O ATOM 665 CB PHE A2101 15.409 -9.972 -7.333 1.00 0.00 C ATOM 666 CG PHE A2101 16.714 -10.632 -7.748 1.00 0.00 C ATOM 667 CD1 PHE A2101 16.997 -11.952 -7.348 1.00 0.00 C ATOM 668 CD2 PHE A2101 17.658 -9.916 -8.515 1.00 0.00 C ATOM 669 CE1 PHE A2101 18.211 -12.556 -7.719 1.00 0.00 C ATOM 670 CE2 PHE A2101 18.874 -10.521 -8.886 1.00 0.00 C ATOM 671 CZ PHE A2101 19.148 -11.843 -8.489 1.00 0.00 C ATOM 0 H PHE A2101 13.991 -8.173 -6.536 1.00 0.00 H new ATOM 0 HA PHE A2101 14.962 -10.553 -5.278 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.584 -10.619 -7.632 1.00 0.00 H new ATOM 0 HB3 PHE A2101 15.301 -9.041 -7.889 1.00 0.00 H new ATOM 0 HD1 PHE A2101 16.280 -12.501 -6.755 1.00 0.00 H new ATOM 0 HD2 PHE A2101 17.447 -8.901 -8.818 1.00 0.00 H new ATOM 0 HE1 PHE A2101 18.425 -13.569 -7.412 1.00 0.00 H new ATOM 0 HE2 PHE A2101 19.595 -9.972 -9.474 1.00 0.00 H new ATOM 0 HZ PHE A2101 20.078 -12.311 -8.776 1.00 0.00 H new ATOM 681 N ILE A2102 17.157 -8.072 -5.611 1.00 0.00 N ATOM 682 CA ILE A2102 18.482 -7.598 -5.170 1.00 0.00 C ATOM 683 C ILE A2102 18.609 -7.562 -3.639 1.00 0.00 C ATOM 684 O ILE A2102 19.572 -8.094 -3.083 1.00 0.00 O ATOM 685 CB ILE A2102 18.835 -6.262 -5.876 1.00 0.00 C ATOM 686 CG1 ILE A2102 20.348 -5.947 -5.942 1.00 0.00 C ATOM 687 CG2 ILE A2102 18.056 -5.044 -5.346 1.00 0.00 C ATOM 688 CD1 ILE A2102 21.152 -5.976 -4.634 1.00 0.00 C ATOM 0 H ILE A2102 16.680 -7.419 -6.233 1.00 0.00 H new ATOM 0 HA ILE A2102 19.237 -8.320 -5.481 1.00 0.00 H new ATOM 0 HB ILE A2102 18.504 -6.443 -6.899 1.00 0.00 H new ATOM 0 HG12 ILE A2102 20.806 -6.657 -6.631 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.463 -4.956 -6.382 1.00 0.00 H new ATOM 0 HG21 ILE A2102 18.361 -4.151 -5.892 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.987 -5.207 -5.485 1.00 0.00 H new ATOM 0 HG23 ILE A2102 18.267 -4.911 -4.285 1.00 0.00 H new ATOM 0 HD11 ILE A2102 22.194 -5.735 -4.842 1.00 0.00 H new ATOM 0 HD12 ILE A2102 20.742 -5.243 -3.939 1.00 0.00 H new ATOM 0 HD13 ILE A2102 21.091 -6.970 -4.191 1.00 0.00 H new ATOM 700 N LYS A2103 17.618 -7.003 -2.934 1.00 0.00 N ATOM 701 CA LYS A2103 17.614 -6.898 -1.463 1.00 0.00 C ATOM 702 C LYS A2103 17.620 -8.247 -0.727 1.00 0.00 C ATOM 703 O LYS A2103 17.994 -8.300 0.444 1.00 0.00 O ATOM 704 CB LYS A2103 16.458 -5.987 -1.012 1.00 0.00 C ATOM 705 CG LYS A2103 16.698 -4.546 -1.467 1.00 0.00 C ATOM 706 CD LYS A2103 15.636 -3.579 -0.926 1.00 0.00 C ATOM 707 CE LYS A2103 15.095 -2.692 -2.048 1.00 0.00 C ATOM 708 NZ LYS A2103 14.218 -1.620 -1.506 1.00 0.00 N ATOM 0 H LYS A2103 16.786 -6.606 -3.370 1.00 0.00 H new ATOM 0 HA LYS A2103 18.562 -6.443 -1.176 1.00 0.00 H new ATOM 0 HB2 LYS A2103 15.518 -6.352 -1.425 1.00 0.00 H new ATOM 0 HB3 LYS A2103 16.364 -6.020 0.073 1.00 0.00 H new ATOM 0 HG2 LYS A2103 17.684 -4.222 -1.134 1.00 0.00 H new ATOM 0 HG3 LYS A2103 16.700 -4.507 -2.556 1.00 0.00 H new ATOM 0 HD2 LYS A2103 14.819 -4.142 -0.475 1.00 0.00 H new ATOM 0 HD3 LYS A2103 16.068 -2.959 -0.141 1.00 0.00 H new ATOM 0 HE2 LYS A2103 15.925 -2.245 -2.595 1.00 0.00 H new ATOM 0 HE3 LYS A2103 14.535 -3.300 -2.759 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 13.864 -1.032 -2.288 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 13.414 -2.049 -1.004 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 14.761 -1.028 -0.846 1.00 0.00 H new ATOM 722 N GLN A2104 17.260 -9.338 -1.407 1.00 0.00 N ATOM 723 CA GLN A2104 17.313 -10.708 -0.876 1.00 0.00 C ATOM 724 C GLN A2104 18.585 -11.433 -1.361 1.00 0.00 C ATOM 725 O GLN A2104 19.260 -12.094 -0.572 1.00 0.00 O ATOM 726 CB GLN A2104 16.008 -11.441 -1.240 1.00 0.00 C ATOM 727 CG GLN A2104 14.810 -10.800 -0.513 1.00 0.00 C ATOM 728 CD GLN A2104 13.477 -11.460 -0.853 1.00 0.00 C ATOM 729 OE1 GLN A2104 13.088 -12.479 -0.298 1.00 0.00 O ATOM 730 NE2 GLN A2104 12.728 -10.901 -1.776 1.00 0.00 N ATOM 0 H GLN A2104 16.915 -9.295 -2.366 1.00 0.00 H new ATOM 0 HA GLN A2104 17.383 -10.691 0.212 1.00 0.00 H new ATOM 0 HB2 GLN A2104 15.850 -11.402 -2.318 1.00 0.00 H new ATOM 0 HB3 GLN A2104 16.086 -12.493 -0.967 1.00 0.00 H new ATOM 0 HG2 GLN A2104 14.973 -10.858 0.563 1.00 0.00 H new ATOM 0 HG3 GLN A2104 14.760 -9.742 -0.771 1.00 0.00 H new ATOM 0 HE21 GLN A2104 13.044 -10.052 -2.244 1.00 0.00 H new ATOM 0 HE22 GLN A2104 11.830 -11.316 -2.025 1.00 0.00 H new ATOM 739 N ARG A2105 18.965 -11.262 -2.636 1.00 0.00 N ATOM 740 CA ARG A2105 20.182 -11.813 -3.263 1.00 0.00 C ATOM 741 C ARG A2105 21.466 -11.313 -2.596 1.00 0.00 C ATOM 742 O ARG A2105 22.402 -12.092 -2.422 1.00 0.00 O ATOM 743 CB ARG A2105 20.139 -11.453 -4.760 1.00 0.00 C ATOM 744 CG ARG A2105 21.374 -11.835 -5.589 1.00 0.00 C ATOM 745 CD ARG A2105 21.670 -13.340 -5.660 1.00 0.00 C ATOM 746 NE ARG A2105 22.746 -13.562 -6.636 1.00 0.00 N ATOM 747 CZ ARG A2105 23.593 -14.561 -6.751 1.00 0.00 C ATOM 748 NH1 ARG A2105 23.481 -15.685 -6.107 1.00 0.00 N ATOM 749 NH2 ARG A2105 24.585 -14.413 -7.568 1.00 0.00 N ATOM 0 H ARG A2105 18.409 -10.711 -3.290 1.00 0.00 H new ATOM 0 HA ARG A2105 20.198 -12.895 -3.134 1.00 0.00 H new ATOM 0 HB2 ARG A2105 19.268 -11.935 -5.203 1.00 0.00 H new ATOM 0 HB3 ARG A2105 19.987 -10.377 -4.849 1.00 0.00 H new ATOM 0 HG2 ARG A2105 21.243 -11.458 -6.603 1.00 0.00 H new ATOM 0 HG3 ARG A2105 22.244 -11.329 -5.171 1.00 0.00 H new ATOM 0 HD2 ARG A2105 21.966 -13.714 -4.680 1.00 0.00 H new ATOM 0 HD3 ARG A2105 20.775 -13.888 -5.953 1.00 0.00 H new ATOM 0 HE ARG A2105 22.852 -12.826 -7.334 1.00 0.00 H new ATOM 0 HH11 ARG A2105 22.700 -15.831 -5.467 1.00 0.00 H new ATOM 0 HH12 ARG A2105 24.174 -16.421 -6.242 1.00 0.00 H new ATOM 0 HH21 ARG A2105 24.688 -13.545 -8.094 1.00 0.00 H new ATOM 0 HH22 ARG A2105 25.265 -15.164 -7.686 1.00 0.00 H new ATOM 763 N THR A2106 21.520 -10.040 -2.192 1.00 0.00 N ATOM 764 CA THR A2106 22.686 -9.434 -1.514 1.00 0.00 C ATOM 765 C THR A2106 23.131 -10.214 -0.264 1.00 0.00 C ATOM 766 O THR A2106 24.323 -10.280 0.026 1.00 0.00 O ATOM 767 CB THR A2106 22.440 -7.945 -1.211 1.00 0.00 C ATOM 768 OG1 THR A2106 23.644 -7.327 -0.815 1.00 0.00 O ATOM 769 CG2 THR A2106 21.404 -7.696 -0.115 1.00 0.00 C ATOM 0 H THR A2106 20.748 -9.387 -2.325 1.00 0.00 H new ATOM 0 HA THR A2106 23.521 -9.498 -2.211 1.00 0.00 H new ATOM 0 HB THR A2106 22.052 -7.522 -2.137 1.00 0.00 H new ATOM 0 HG1 THR A2106 23.479 -6.380 -0.626 1.00 0.00 H new ATOM 0 HG21 THR A2106 21.288 -6.623 0.039 1.00 0.00 H new ATOM 0 HG22 THR A2106 20.448 -8.125 -0.414 1.00 0.00 H new ATOM 0 HG23 THR A2106 21.737 -8.162 0.813 1.00 0.00 H new ATOM 777 N ALA A2107 22.208 -10.903 0.425 1.00 0.00 N ATOM 778 CA ALA A2107 22.511 -11.762 1.577 1.00 0.00 C ATOM 779 C ALA A2107 23.502 -12.911 1.253 1.00 0.00 C ATOM 780 O ALA A2107 24.160 -13.431 2.158 1.00 0.00 O ATOM 781 CB ALA A2107 21.188 -12.304 2.133 1.00 0.00 C ATOM 0 H ALA A2107 21.215 -10.878 0.193 1.00 0.00 H new ATOM 0 HA ALA A2107 23.022 -11.157 2.326 1.00 0.00 H new ATOM 0 HB1 ALA A2107 21.389 -12.946 2.991 1.00 0.00 H new ATOM 0 HB2 ALA A2107 20.556 -11.472 2.443 1.00 0.00 H new ATOM 0 HB3 ALA A2107 20.678 -12.880 1.361 1.00 0.00 H new ATOM 787 N LYS A2108 23.628 -13.285 -0.032 1.00 0.00 N ATOM 788 CA LYS A2108 24.534 -14.323 -0.567 1.00 0.00 C ATOM 789 C LYS A2108 25.497 -13.799 -1.648 1.00 0.00 C ATOM 790 O LYS A2108 26.390 -14.538 -2.066 1.00 0.00 O ATOM 791 CB LYS A2108 23.693 -15.497 -1.113 1.00 0.00 C ATOM 792 CG LYS A2108 22.873 -16.260 -0.055 1.00 0.00 C ATOM 793 CD LYS A2108 23.696 -16.884 1.088 1.00 0.00 C ATOM 794 CE LYS A2108 24.769 -17.860 0.581 1.00 0.00 C ATOM 795 NZ LYS A2108 25.598 -18.394 1.694 1.00 0.00 N ATOM 0 H LYS A2108 23.071 -12.849 -0.767 1.00 0.00 H new ATOM 0 HA LYS A2108 25.165 -14.658 0.256 1.00 0.00 H new ATOM 0 HB2 LYS A2108 23.011 -15.113 -1.872 1.00 0.00 H new ATOM 0 HB3 LYS A2108 24.360 -16.201 -1.611 1.00 0.00 H new ATOM 0 HG2 LYS A2108 22.141 -15.577 0.377 1.00 0.00 H new ATOM 0 HG3 LYS A2108 22.314 -17.052 -0.553 1.00 0.00 H new ATOM 0 HD2 LYS A2108 24.175 -16.090 1.661 1.00 0.00 H new ATOM 0 HD3 LYS A2108 23.026 -17.409 1.769 1.00 0.00 H new ATOM 0 HE2 LYS A2108 24.290 -18.686 0.055 1.00 0.00 H new ATOM 0 HE3 LYS A2108 25.411 -17.353 -0.140 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 26.311 -19.049 1.313 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 26.075 -17.608 2.180 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 24.989 -18.900 2.369 1.00 0.00 H new ATOM 1019 N THR B 18 9.971 -23.051 -13.106 1.00 0.00 N ATOM 1020 CA THR B 18 11.388 -22.643 -13.145 1.00 0.00 C ATOM 1021 C THR B 18 11.511 -21.184 -12.663 1.00 0.00 C ATOM 1022 O THR B 18 10.679 -20.722 -11.879 1.00 0.00 O ATOM 1023 CB THR B 18 11.920 -22.822 -14.578 1.00 0.00 C ATOM 1024 OG1 THR B 18 11.103 -22.088 -15.468 1.00 0.00 O ATOM 1025 CG2 THR B 18 11.916 -24.282 -15.032 1.00 0.00 C ATOM 0 HA THR B 18 11.989 -23.264 -12.481 1.00 0.00 H new ATOM 0 HB THR B 18 12.950 -22.467 -14.583 1.00 0.00 H new ATOM 0 HG1 THR B 18 10.167 -22.156 -15.184 1.00 0.00 H new ATOM 0 HG21 THR B 18 12.301 -24.348 -16.050 1.00 0.00 H new ATOM 0 HG22 THR B 18 12.546 -24.872 -14.366 1.00 0.00 H new ATOM 0 HG23 THR B 18 10.897 -24.669 -15.004 1.00 0.00 H new ATOM 1033 N PHE B 19 12.514 -20.424 -13.129 1.00 0.00 N ATOM 1034 CA PHE B 19 12.705 -18.993 -12.833 1.00 0.00 C ATOM 1035 C PHE B 19 11.413 -18.156 -12.965 1.00 0.00 C ATOM 1036 O PHE B 19 11.202 -17.216 -12.201 1.00 0.00 O ATOM 1037 CB PHE B 19 13.808 -18.422 -13.743 1.00 0.00 C ATOM 1038 CG PHE B 19 13.414 -18.209 -15.195 1.00 0.00 C ATOM 1039 CD1 PHE B 19 13.120 -19.306 -16.030 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.330 -16.902 -15.710 1.00 0.00 C ATOM 1041 CE1 PHE B 19 12.727 -19.092 -17.363 1.00 0.00 C ATOM 1042 CE2 PHE B 19 12.950 -16.690 -17.046 1.00 0.00 C ATOM 1043 CZ PHE B 19 12.642 -17.785 -17.873 1.00 0.00 C ATOM 0 H PHE B 19 13.238 -20.799 -13.742 1.00 0.00 H new ATOM 0 HA PHE B 19 13.002 -18.923 -11.787 1.00 0.00 H new ATOM 0 HB2 PHE B 19 14.137 -17.468 -13.331 1.00 0.00 H new ATOM 0 HB3 PHE B 19 14.665 -19.095 -13.712 1.00 0.00 H new ATOM 0 HD1 PHE B 19 13.197 -20.312 -15.645 1.00 0.00 H new ATOM 0 HD2 PHE B 19 13.559 -16.058 -15.076 1.00 0.00 H new ATOM 0 HE1 PHE B 19 12.490 -19.934 -17.997 1.00 0.00 H new ATOM 0 HE2 PHE B 19 12.894 -15.685 -17.438 1.00 0.00 H new ATOM 0 HZ PHE B 19 12.341 -17.622 -18.897 1.00 0.00 H new ATOM 1053 N SER B 20 10.524 -18.530 -13.898 1.00 0.00 N ATOM 1054 CA SER B 20 9.218 -17.895 -14.129 1.00 0.00 C ATOM 1055 C SER B 20 8.318 -17.873 -12.880 1.00 0.00 C ATOM 1056 O SER B 20 7.569 -16.921 -12.656 1.00 0.00 O ATOM 1057 CB SER B 20 8.525 -18.622 -15.288 1.00 0.00 C ATOM 1058 OG SER B 20 7.308 -17.990 -15.638 1.00 0.00 O ATOM 0 H SER B 20 10.701 -19.308 -14.533 1.00 0.00 H new ATOM 0 HA SER B 20 9.392 -16.848 -14.379 1.00 0.00 H new ATOM 0 HB2 SER B 20 9.187 -18.645 -16.153 1.00 0.00 H new ATOM 0 HB3 SER B 20 8.332 -19.657 -15.007 1.00 0.00 H new ATOM 0 HG SER B 20 6.890 -18.474 -16.380 1.00 0.00 H new ATOM 1064 N ASP B 21 8.414 -18.894 -12.024 1.00 0.00 N ATOM 1065 CA ASP B 21 7.649 -18.997 -10.775 1.00 0.00 C ATOM 1066 C ASP B 21 8.202 -18.116 -9.650 1.00 0.00 C ATOM 1067 O ASP B 21 7.450 -17.674 -8.782 1.00 0.00 O ATOM 1068 CB ASP B 21 7.628 -20.472 -10.351 1.00 0.00 C ATOM 1069 CG ASP B 21 6.522 -20.784 -9.337 1.00 0.00 C ATOM 1070 OD1 ASP B 21 5.339 -20.816 -9.752 1.00 0.00 O ATOM 1071 OD2 ASP B 21 6.832 -21.037 -8.149 1.00 0.00 O ATOM 0 H ASP B 21 9.036 -19.687 -12.181 1.00 0.00 H new ATOM 0 HA ASP B 21 6.640 -18.630 -10.961 1.00 0.00 H new ATOM 0 HB2 ASP B 21 7.492 -21.097 -11.234 1.00 0.00 H new ATOM 0 HB3 ASP B 21 8.594 -20.735 -9.920 1.00 0.00 H new ATOM 1076 N LEU B 22 9.499 -17.800 -9.690 1.00 0.00 N ATOM 1077 CA LEU B 22 10.136 -16.918 -8.712 1.00 0.00 C ATOM 1078 C LEU B 22 9.556 -15.498 -8.803 1.00 0.00 C ATOM 1079 O LEU B 22 9.320 -14.866 -7.775 1.00 0.00 O ATOM 1080 CB LEU B 22 11.664 -16.918 -8.908 1.00 0.00 C ATOM 1081 CG LEU B 22 12.332 -18.306 -8.896 1.00 0.00 C ATOM 1082 CD1 LEU B 22 13.836 -18.130 -9.090 1.00 0.00 C ATOM 1083 CD2 LEU B 22 12.097 -19.066 -7.589 1.00 0.00 C ATOM 0 H LEU B 22 10.138 -18.150 -10.404 1.00 0.00 H new ATOM 0 HA LEU B 22 9.926 -17.294 -7.711 1.00 0.00 H new ATOM 0 HB2 LEU B 22 11.891 -16.432 -9.857 1.00 0.00 H new ATOM 0 HB3 LEU B 22 12.114 -16.310 -8.123 1.00 0.00 H new ATOM 0 HG LEU B 22 11.886 -18.888 -9.702 1.00 0.00 H new ATOM 0 HD11 LEU B 22 14.320 -19.106 -9.083 1.00 0.00 H new ATOM 0 HD12 LEU B 22 14.025 -17.638 -10.044 1.00 0.00 H new ATOM 0 HD13 LEU B 22 14.238 -17.520 -8.281 1.00 0.00 H new ATOM 0 HD21 LEU B 22 12.591 -20.036 -7.639 1.00 0.00 H new ATOM 0 HD22 LEU B 22 12.505 -18.493 -6.756 1.00 0.00 H new ATOM 0 HD23 LEU B 22 11.027 -19.211 -7.440 1.00 0.00 H new ATOM 1095 N TRP B 23 9.249 -15.011 -10.012 1.00 0.00 N ATOM 1096 CA TRP B 23 8.641 -13.684 -10.214 1.00 0.00 C ATOM 1097 C TRP B 23 7.288 -13.521 -9.502 1.00 0.00 C ATOM 1098 O TRP B 23 6.923 -12.412 -9.112 1.00 0.00 O ATOM 1099 CB TRP B 23 8.477 -13.391 -11.706 1.00 0.00 C ATOM 1100 CG TRP B 23 9.688 -13.615 -12.556 1.00 0.00 C ATOM 1101 CD1 TRP B 23 9.689 -14.347 -13.688 1.00 0.00 C ATOM 1102 CD2 TRP B 23 11.065 -13.148 -12.378 1.00 0.00 C ATOM 1103 NE1 TRP B 23 10.957 -14.369 -14.234 1.00 0.00 N ATOM 1104 CE2 TRP B 23 11.846 -13.641 -13.470 1.00 0.00 C ATOM 1105 CE3 TRP B 23 11.736 -12.363 -11.413 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 13.213 -13.360 -13.599 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 13.112 -12.080 -11.534 1.00 0.00 C ATOM 1108 CH2 TRP B 23 13.849 -12.574 -12.624 1.00 0.00 C ATOM 0 H TRP B 23 9.414 -15.523 -10.879 1.00 0.00 H new ATOM 0 HA TRP B 23 9.327 -12.965 -9.766 1.00 0.00 H new ATOM 0 HB2 TRP B 23 7.668 -14.011 -12.091 1.00 0.00 H new ATOM 0 HB3 TRP B 23 8.165 -12.353 -11.820 1.00 0.00 H new ATOM 0 HD1 TRP B 23 8.826 -14.843 -14.106 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.205 -14.861 -15.093 1.00 0.00 H new ATOM 0 HE3 TRP B 23 11.186 -11.974 -10.569 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 13.772 -13.744 -14.440 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 13.603 -11.479 -10.783 1.00 0.00 H new ATOM 0 HH2 TRP B 23 14.902 -12.350 -12.712 1.00 0.00 H new ATOM 1119 N LYS B 24 6.558 -14.627 -9.301 1.00 0.00 N ATOM 1120 CA LYS B 24 5.275 -14.664 -8.579 1.00 0.00 C ATOM 1121 C LYS B 24 5.461 -14.543 -7.055 1.00 0.00 C ATOM 1122 O LYS B 24 4.518 -14.168 -6.355 1.00 0.00 O ATOM 1123 CB LYS B 24 4.539 -15.988 -8.868 1.00 0.00 C ATOM 1124 CG LYS B 24 4.434 -16.392 -10.352 1.00 0.00 C ATOM 1125 CD LYS B 24 3.840 -17.804 -10.454 1.00 0.00 C ATOM 1126 CE LYS B 24 3.992 -18.395 -11.861 1.00 0.00 C ATOM 1127 NZ LYS B 24 3.752 -19.863 -11.842 1.00 0.00 N ATOM 0 H LYS B 24 6.849 -15.543 -9.643 1.00 0.00 H new ATOM 0 HA LYS B 24 4.694 -13.812 -8.931 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.046 -16.788 -8.329 1.00 0.00 H new ATOM 0 HB3 LYS B 24 3.531 -15.917 -8.459 1.00 0.00 H new ATOM 0 HG2 LYS B 24 3.807 -15.682 -10.890 1.00 0.00 H new ATOM 0 HG3 LYS B 24 5.419 -16.365 -10.818 1.00 0.00 H new ATOM 0 HD2 LYS B 24 4.332 -18.456 -9.732 1.00 0.00 H new ATOM 0 HD3 LYS B 24 2.784 -17.772 -10.187 1.00 0.00 H new ATOM 0 HE2 LYS B 24 3.288 -17.915 -12.541 1.00 0.00 H new ATOM 0 HE3 LYS B 24 4.993 -18.190 -12.241 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 4.070 -20.278 -12.741 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 4.282 -20.291 -11.056 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 2.736 -20.047 -11.716 1.00 0.00 H new ATOM 1141 N LEU B 25 6.649 -14.892 -6.544 1.00 0.00 N ATOM 1142 CA LEU B 25 6.972 -14.947 -5.107 1.00 0.00 C ATOM 1143 C LEU B 25 7.867 -13.807 -4.579 1.00 0.00 C ATOM 1144 O LEU B 25 7.566 -13.266 -3.513 1.00 0.00 O ATOM 1145 CB LEU B 25 7.622 -16.312 -4.808 1.00 0.00 C ATOM 1146 CG LEU B 25 6.742 -17.543 -5.113 1.00 0.00 C ATOM 1147 CD1 LEU B 25 7.541 -18.819 -4.850 1.00 0.00 C ATOM 1148 CD2 LEU B 25 5.474 -17.585 -4.255 1.00 0.00 C ATOM 0 H LEU B 25 7.438 -15.152 -7.135 1.00 0.00 H new ATOM 0 HA LEU B 25 6.028 -14.815 -4.578 1.00 0.00 H new ATOM 0 HB2 LEU B 25 8.543 -16.392 -5.386 1.00 0.00 H new ATOM 0 HB3 LEU B 25 7.903 -16.339 -3.755 1.00 0.00 H new ATOM 0 HG LEU B 25 6.444 -17.470 -6.159 1.00 0.00 H new ATOM 0 HD11 LEU B 25 6.920 -19.688 -5.065 1.00 0.00 H new ATOM 0 HD12 LEU B 25 8.422 -18.835 -5.491 1.00 0.00 H new ATOM 0 HD13 LEU B 25 7.852 -18.845 -3.806 1.00 0.00 H new ATOM 0 HD21 LEU B 25 4.891 -18.470 -4.510 1.00 0.00 H new ATOM 0 HD22 LEU B 25 5.749 -17.622 -3.201 1.00 0.00 H new ATOM 0 HD23 LEU B 25 4.878 -16.692 -4.443 1.00 0.00 H new ATOM 1408 N LEU B 43 29.224 -4.193 -5.477 1.00 0.00 N ATOM 1409 CA LEU B 43 28.745 -5.378 -6.210 1.00 0.00 C ATOM 1410 C LEU B 43 27.861 -4.992 -7.409 1.00 0.00 C ATOM 1411 O LEU B 43 27.242 -3.927 -7.414 1.00 0.00 O ATOM 1412 CB LEU B 43 27.995 -6.348 -5.267 1.00 0.00 C ATOM 1413 CG LEU B 43 26.851 -5.713 -4.442 1.00 0.00 C ATOM 1414 CD1 LEU B 43 25.627 -6.628 -4.377 1.00 0.00 C ATOM 1415 CD2 LEU B 43 27.298 -5.429 -3.004 1.00 0.00 C ATOM 0 HA LEU B 43 29.624 -5.890 -6.602 1.00 0.00 H new ATOM 0 HB2 LEU B 43 27.583 -7.162 -5.863 1.00 0.00 H new ATOM 0 HB3 LEU B 43 28.716 -6.790 -4.579 1.00 0.00 H new ATOM 0 HG LEU B 43 26.590 -4.783 -4.947 1.00 0.00 H new ATOM 0 HD11 LEU B 43 24.845 -6.148 -3.789 1.00 0.00 H new ATOM 0 HD12 LEU B 43 25.259 -6.816 -5.386 1.00 0.00 H new ATOM 0 HD13 LEU B 43 25.904 -7.573 -3.910 1.00 0.00 H new ATOM 0 HD21 LEU B 43 26.473 -4.983 -2.448 1.00 0.00 H new ATOM 0 HD22 LEU B 43 27.596 -6.361 -2.525 1.00 0.00 H new ATOM 0 HD23 LEU B 43 28.143 -4.740 -3.015 1.00 0.00 H new ATOM 1427 N MET B 44 27.801 -5.872 -8.414 1.00 0.00 N ATOM 1428 CA MET B 44 27.004 -5.721 -9.641 1.00 0.00 C ATOM 1429 C MET B 44 26.730 -7.090 -10.292 1.00 0.00 C ATOM 1430 O MET B 44 27.482 -8.038 -10.061 1.00 0.00 O ATOM 1431 CB MET B 44 27.750 -4.780 -10.609 1.00 0.00 C ATOM 1432 CG MET B 44 26.928 -4.354 -11.833 1.00 0.00 C ATOM 1433 SD MET B 44 25.227 -3.793 -11.512 1.00 0.00 S ATOM 1434 CE MET B 44 25.493 -2.522 -10.246 1.00 0.00 C ATOM 0 H MET B 44 28.327 -6.746 -8.396 1.00 0.00 H new ATOM 0 HA MET B 44 26.036 -5.285 -9.394 1.00 0.00 H new ATOM 0 HB2 MET B 44 28.059 -3.888 -10.064 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.659 -5.275 -10.951 1.00 0.00 H new ATOM 0 HG2 MET B 44 27.462 -3.551 -12.340 1.00 0.00 H new ATOM 0 HG3 MET B 44 26.885 -5.195 -12.525 1.00 0.00 H new ATOM 0 HE1 MET B 44 24.644 -1.838 -10.233 1.00 0.00 H new ATOM 0 HE2 MET B 44 25.592 -2.996 -9.270 1.00 0.00 H new ATOM 0 HE3 MET B 44 26.403 -1.967 -10.474 1.00 0.00 H new ATOM 1444 N LEU B 45 25.658 -7.200 -11.087 1.00 0.00 N ATOM 1445 CA LEU B 45 25.213 -8.435 -11.756 1.00 0.00 C ATOM 1446 C LEU B 45 26.324 -9.128 -12.576 1.00 0.00 C ATOM 1447 O LEU B 45 27.198 -8.480 -13.157 1.00 0.00 O ATOM 1448 CB LEU B 45 23.985 -8.136 -12.649 1.00 0.00 C ATOM 1449 CG LEU B 45 22.612 -7.949 -11.969 1.00 0.00 C ATOM 1450 CD1 LEU B 45 22.107 -9.247 -11.340 1.00 0.00 C ATOM 1451 CD2 LEU B 45 22.579 -6.859 -10.901 1.00 0.00 C ATOM 0 H LEU B 45 25.053 -6.404 -11.291 1.00 0.00 H new ATOM 0 HA LEU B 45 24.939 -9.137 -10.969 1.00 0.00 H new ATOM 0 HB2 LEU B 45 24.200 -7.231 -13.217 1.00 0.00 H new ATOM 0 HB3 LEU B 45 23.891 -8.950 -13.368 1.00 0.00 H new ATOM 0 HG LEU B 45 21.959 -7.637 -12.784 1.00 0.00 H new ATOM 0 HD11 LEU B 45 21.138 -9.072 -10.872 1.00 0.00 H new ATOM 0 HD12 LEU B 45 22.005 -10.010 -12.112 1.00 0.00 H new ATOM 0 HD13 LEU B 45 22.818 -9.587 -10.587 1.00 0.00 H new ATOM 0 HD21 LEU B 45 21.577 -6.796 -10.476 1.00 0.00 H new ATOM 0 HD22 LEU B 45 23.293 -7.100 -10.113 1.00 0.00 H new ATOM 0 HD23 LEU B 45 22.843 -5.902 -11.350 1.00 0.00 H new ATOM 1463 N SER B 46 26.281 -10.456 -12.626 1.00 0.00 N ATOM 1464 CA SER B 46 27.230 -11.357 -13.302 1.00 0.00 C ATOM 1465 C SER B 46 26.532 -12.656 -13.762 1.00 0.00 C ATOM 1466 O SER B 46 25.395 -12.909 -13.350 1.00 0.00 O ATOM 1467 CB SER B 46 28.349 -11.684 -12.294 1.00 0.00 C ATOM 1468 OG SER B 46 29.358 -10.692 -12.344 1.00 0.00 O ATOM 0 H SER B 46 25.533 -10.974 -12.165 1.00 0.00 H new ATOM 0 HA SER B 46 27.634 -10.875 -14.192 1.00 0.00 H new ATOM 0 HB2 SER B 46 27.936 -11.742 -11.287 1.00 0.00 H new ATOM 0 HB3 SER B 46 28.778 -12.661 -12.520 1.00 0.00 H new ATOM 0 HG SER B 46 28.959 -9.832 -12.592 1.00 0.00 H new ATOM 1474 N PRO B 47 27.168 -13.522 -14.587 1.00 0.00 N ATOM 1475 CA PRO B 47 26.567 -14.790 -15.034 1.00 0.00 C ATOM 1476 C PRO B 47 26.082 -15.697 -13.889 1.00 0.00 C ATOM 1477 O PRO B 47 25.114 -16.437 -14.057 1.00 0.00 O ATOM 1478 CB PRO B 47 27.623 -15.487 -15.901 1.00 0.00 C ATOM 1479 CG PRO B 47 28.932 -14.782 -15.551 1.00 0.00 C ATOM 1480 CD PRO B 47 28.490 -13.371 -15.180 1.00 0.00 C ATOM 0 HA PRO B 47 25.657 -14.577 -15.595 1.00 0.00 H new ATOM 0 HB2 PRO B 47 27.676 -16.553 -15.682 1.00 0.00 H new ATOM 0 HB3 PRO B 47 27.392 -15.391 -16.962 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.443 -15.273 -14.723 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.623 -14.777 -16.394 1.00 0.00 H new ATOM 0 HD2 PRO B 47 29.186 -12.914 -14.477 1.00 0.00 H new ATOM 0 HD3 PRO B 47 28.455 -12.727 -16.058 1.00 0.00 H new ATOM 1488 N ASP B 48 26.708 -15.599 -12.711 1.00 0.00 N ATOM 1489 CA ASP B 48 26.340 -16.337 -11.497 1.00 0.00 C ATOM 1490 C ASP B 48 24.888 -16.076 -11.052 1.00 0.00 C ATOM 1491 O ASP B 48 24.202 -16.988 -10.592 1.00 0.00 O ATOM 1492 CB ASP B 48 27.314 -15.964 -10.375 1.00 0.00 C ATOM 1493 CG ASP B 48 27.099 -16.833 -9.125 1.00 0.00 C ATOM 1494 OD1 ASP B 48 27.591 -17.986 -9.102 1.00 0.00 O ATOM 1495 OD2 ASP B 48 26.453 -16.354 -8.163 1.00 0.00 O ATOM 0 H ASP B 48 27.510 -14.985 -12.572 1.00 0.00 H new ATOM 0 HA ASP B 48 26.405 -17.401 -11.723 1.00 0.00 H new ATOM 0 HB2 ASP B 48 28.339 -16.081 -10.728 1.00 0.00 H new ATOM 0 HB3 ASP B 48 27.185 -14.913 -10.115 1.00 0.00 H new ATOM 1500 N ASP B 49 24.386 -14.846 -11.233 1.00 0.00 N ATOM 1501 CA ASP B 49 22.999 -14.471 -10.923 1.00 0.00 C ATOM 1502 C ASP B 49 22.002 -15.106 -11.903 1.00 0.00 C ATOM 1503 O ASP B 49 20.854 -15.368 -11.545 1.00 0.00 O ATOM 1504 CB ASP B 49 22.838 -12.942 -10.995 1.00 0.00 C ATOM 1505 CG ASP B 49 23.807 -12.203 -10.067 1.00 0.00 C ATOM 1506 OD1 ASP B 49 23.536 -12.145 -8.846 1.00 0.00 O ATOM 1507 OD2 ASP B 49 24.843 -11.699 -10.550 1.00 0.00 O ATOM 0 H ASP B 49 24.939 -14.074 -11.604 1.00 0.00 H new ATOM 0 HA ASP B 49 22.786 -14.835 -9.918 1.00 0.00 H new ATOM 0 HB2 ASP B 49 23.000 -12.611 -12.021 1.00 0.00 H new ATOM 0 HB3 ASP B 49 21.814 -12.675 -10.732 1.00 0.00 H new ATOM 1512 N ILE B 50 22.441 -15.336 -13.146 1.00 0.00 N ATOM 1513 CA ILE B 50 21.636 -15.898 -14.236 1.00 0.00 C ATOM 1514 C ILE B 50 21.557 -17.429 -14.153 1.00 0.00 C ATOM 1515 O ILE B 50 20.475 -18.007 -14.252 1.00 0.00 O ATOM 1516 CB ILE B 50 22.204 -15.488 -15.620 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.737 -14.037 -15.708 1.00 0.00 C ATOM 1518 CG2 ILE B 50 21.098 -15.697 -16.673 1.00 0.00 C ATOM 1519 CD1 ILE B 50 23.404 -13.729 -17.057 1.00 0.00 C ATOM 0 H ILE B 50 23.399 -15.129 -13.430 1.00 0.00 H new ATOM 0 HA ILE B 50 20.631 -15.491 -14.125 1.00 0.00 H new ATOM 0 HB ILE B 50 23.074 -16.120 -15.799 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.913 -13.342 -15.548 1.00 0.00 H new ATOM 0 HG13 ILE B 50 23.456 -13.869 -14.906 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.474 -15.415 -17.656 1.00 0.00 H new ATOM 0 HG22 ILE B 50 20.801 -16.746 -16.685 1.00 0.00 H new ATOM 0 HG23 ILE B 50 20.236 -15.078 -16.423 1.00 0.00 H new ATOM 0 HD11 ILE B 50 23.758 -12.698 -17.061 1.00 0.00 H new ATOM 0 HD12 ILE B 50 24.247 -14.403 -17.208 1.00 0.00 H new ATOM 0 HD13 ILE B 50 22.681 -13.867 -17.861 1.00 0.00 H new ATOM 1531 N GLU B 51 22.691 -18.096 -13.934 1.00 0.00 N ATOM 1532 CA GLU B 51 22.758 -19.558 -13.807 1.00 0.00 C ATOM 1533 C GLU B 51 22.148 -20.088 -12.488 1.00 0.00 C ATOM 1534 O GLU B 51 22.075 -21.296 -12.253 1.00 0.00 O ATOM 1535 CB GLU B 51 24.201 -20.042 -14.026 1.00 0.00 C ATOM 1536 CG GLU B 51 25.137 -19.807 -12.835 1.00 0.00 C ATOM 1537 CD GLU B 51 26.571 -20.266 -13.162 1.00 0.00 C ATOM 1538 OE1 GLU B 51 26.898 -21.455 -12.925 1.00 0.00 O ATOM 1539 OE2 GLU B 51 27.384 -19.449 -13.654 1.00 0.00 O ATOM 0 H GLU B 51 23.597 -17.637 -13.839 1.00 0.00 H new ATOM 0 HA GLU B 51 22.131 -19.983 -14.591 1.00 0.00 H new ATOM 0 HB2 GLU B 51 24.183 -21.108 -14.253 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.612 -19.537 -14.900 1.00 0.00 H new ATOM 0 HG2 GLU B 51 25.141 -18.749 -12.574 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.767 -20.349 -11.965 1.00 0.00 H new ATOM 1546 N GLN B 52 21.695 -19.185 -11.616 1.00 0.00 N ATOM 1547 CA GLN B 52 21.058 -19.496 -10.340 1.00 0.00 C ATOM 1548 C GLN B 52 19.571 -19.850 -10.512 1.00 0.00 C ATOM 1549 O GLN B 52 19.158 -20.950 -10.151 1.00 0.00 O ATOM 1550 CB GLN B 52 21.245 -18.259 -9.444 1.00 0.00 C ATOM 1551 CG GLN B 52 20.385 -18.179 -8.170 1.00 0.00 C ATOM 1552 CD GLN B 52 20.401 -16.771 -7.570 1.00 0.00 C ATOM 1553 OE1 GLN B 52 20.746 -16.559 -6.413 1.00 0.00 O ATOM 1554 NE2 GLN B 52 20.046 -15.747 -8.327 1.00 0.00 N ATOM 0 H GLN B 52 21.765 -18.182 -11.788 1.00 0.00 H new ATOM 0 HA GLN B 52 21.515 -20.376 -9.888 1.00 0.00 H new ATOM 0 HB2 GLN B 52 22.293 -18.211 -9.148 1.00 0.00 H new ATOM 0 HB3 GLN B 52 21.043 -17.372 -10.045 1.00 0.00 H new ATOM 0 HG2 GLN B 52 19.359 -18.464 -8.404 1.00 0.00 H new ATOM 0 HG3 GLN B 52 20.755 -18.893 -7.435 1.00 0.00 H new ATOM 0 HE21 GLN B 52 19.756 -15.903 -9.292 1.00 0.00 H new ATOM 0 HE22 GLN B 52 20.062 -14.801 -7.946 1.00 0.00 H new ATOM 1563 N TRP B 53 18.748 -18.938 -11.047 1.00 0.00 N ATOM 1564 CA TRP B 53 17.293 -19.150 -11.134 1.00 0.00 C ATOM 1565 C TRP B 53 16.829 -20.169 -12.183 1.00 0.00 C ATOM 1566 O TRP B 53 15.751 -20.746 -12.036 1.00 0.00 O ATOM 1567 CB TRP B 53 16.565 -17.802 -11.245 1.00 0.00 C ATOM 1568 CG TRP B 53 17.121 -16.754 -12.160 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.630 -16.962 -13.393 1.00 0.00 C ATOM 1570 CD2 TRP B 53 17.226 -15.311 -11.929 1.00 0.00 C ATOM 1571 NE1 TRP B 53 18.094 -15.772 -13.908 1.00 0.00 N ATOM 1572 CE2 TRP B 53 17.871 -14.717 -13.055 1.00 0.00 C ATOM 1573 CE3 TRP B 53 16.843 -14.438 -10.885 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 18.149 -13.344 -13.139 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 17.097 -13.054 -10.967 1.00 0.00 C ATOM 1576 CH2 TRP B 53 17.757 -12.507 -12.082 1.00 0.00 C ATOM 0 H TRP B 53 19.063 -18.045 -11.427 1.00 0.00 H new ATOM 0 HA TRP B 53 17.009 -19.630 -10.198 1.00 0.00 H new ATOM 0 HB2 TRP B 53 15.541 -18.005 -11.559 1.00 0.00 H new ATOM 0 HB3 TRP B 53 16.512 -17.372 -10.245 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.668 -17.916 -13.898 1.00 0.00 H new ATOM 0 HE1 TRP B 53 18.550 -15.684 -14.816 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.349 -14.837 -10.012 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 18.656 -12.938 -14.002 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 16.781 -12.405 -10.163 1.00 0.00 H new ATOM 0 HH2 TRP B 53 17.961 -11.447 -12.125 1.00 0.00 H new ATOM 1587 N PHE B 54 17.630 -20.448 -13.215 1.00 0.00 N ATOM 1588 CA PHE B 54 17.269 -21.441 -14.242 1.00 0.00 C ATOM 1589 C PHE B 54 17.440 -22.903 -13.766 1.00 0.00 C ATOM 1590 O PHE B 54 16.988 -23.832 -14.437 1.00 0.00 O ATOM 1591 CB PHE B 54 17.999 -21.141 -15.569 1.00 0.00 C ATOM 1592 CG PHE B 54 19.316 -21.857 -15.836 1.00 0.00 C ATOM 1593 CD1 PHE B 54 20.281 -22.005 -14.823 1.00 0.00 C ATOM 1594 CD2 PHE B 54 19.577 -22.386 -17.116 1.00 0.00 C ATOM 1595 CE1 PHE B 54 21.479 -22.698 -15.073 1.00 0.00 C ATOM 1596 CE2 PHE B 54 20.781 -23.067 -17.373 1.00 0.00 C ATOM 1597 CZ PHE B 54 21.732 -23.228 -16.349 1.00 0.00 C ATOM 0 H PHE B 54 18.535 -20.002 -13.365 1.00 0.00 H new ATOM 0 HA PHE B 54 16.200 -21.342 -14.429 1.00 0.00 H new ATOM 0 HB2 PHE B 54 17.318 -21.378 -16.386 1.00 0.00 H new ATOM 0 HB3 PHE B 54 18.187 -20.068 -15.612 1.00 0.00 H new ATOM 0 HD1 PHE B 54 20.100 -21.583 -13.845 1.00 0.00 H new ATOM 0 HD2 PHE B 54 18.848 -22.268 -17.904 1.00 0.00 H new ATOM 0 HE1 PHE B 54 22.205 -22.823 -14.283 1.00 0.00 H new ATOM 0 HE2 PHE B 54 20.975 -23.467 -18.357 1.00 0.00 H new ATOM 0 HZ PHE B 54 22.653 -23.757 -16.543 1.00 0.00 H new ATOM 1607 N THR B 55 18.082 -23.113 -12.605 1.00 0.00 N ATOM 1608 CA THR B 55 18.349 -24.437 -12.008 1.00 0.00 C ATOM 1609 C THR B 55 17.154 -25.029 -11.239 1.00 0.00 C ATOM 1610 O THR B 55 17.167 -26.212 -10.890 1.00 0.00 O ATOM 1611 CB THR B 55 19.601 -24.349 -11.100 1.00 0.00 C ATOM 1612 OG1 THR B 55 20.391 -25.514 -11.240 1.00 0.00 O ATOM 1613 CG2 THR B 55 19.324 -24.172 -9.602 1.00 0.00 C ATOM 0 H THR B 55 18.441 -22.345 -12.037 1.00 0.00 H new ATOM 0 HA THR B 55 18.529 -25.126 -12.833 1.00 0.00 H new ATOM 0 HB THR B 55 20.108 -23.447 -11.444 1.00 0.00 H new ATOM 0 HG1 THR B 55 21.180 -25.446 -10.662 1.00 0.00 H new ATOM 0 HG21 THR B 55 20.269 -24.122 -9.061 1.00 0.00 H new ATOM 0 HG22 THR B 55 18.765 -23.250 -9.442 1.00 0.00 H new ATOM 0 HG23 THR B 55 18.741 -25.018 -9.237 1.00 0.00 H new