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: A2084 GLN : amide:sc= 1.07 K(o=1.1,f=-1.4) USER MOD Set 1.2: B 46 SER OG : rot 180:sc= 0 USER MOD Set 2.1: B 18 THR OG1 : rot -28:sc= 0.00748 USER MOD Set 2.2: B 20 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A2085 GLN : amide:sc= 0.591 K(o=2.2,f=0.82) USER MOD Set 3.2: A2086 GLN : amide:sc= 0.283 K(o=2.2,f=-1.1) USER MOD Set 3.3: A2089 ASN : amide:sc= 1.36 K(o=2.2,f=-0.86) 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= -0.0134 X(o=-0.013,f=-0.013) USER MOD Single : A2074 THR OG1 : rot 82:sc= 1.13 USER MOD Single : A2076 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00665) 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= 0.0905 USER MOD Single : A2082 GLN : amide:sc= -0.407 X(o=-0.41,f=-0.41) USER MOD Single : A2083 GLN : amide:sc= 1.45 K(o=1.5,f=-0.5) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 75:sc= 0.634 USER MOD Single : A2094 ASN : amide:sc= -0.126 K(o=-0.13,f=-1.5!) USER MOD Single : A2096 GLN : amide:sc= -1.57 X(o=-1.6,f=-1.4) 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= 0.652 K(o=0.65,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 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 MET CE :methyl -174:sc= -0.665 (180deg=-0.806) USER MOD Single : B 52 GLN : amide:sc= -0.338 X(o=-0.34,f=-0.45) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 5.000 -4.073 -15.679 1.00 0.00 N ATOM 65 CA ILE A2063 5.835 -5.256 -15.939 1.00 0.00 C ATOM 66 C ILE A2063 5.356 -6.009 -17.194 1.00 0.00 C ATOM 67 O ILE A2063 4.206 -5.853 -17.617 1.00 0.00 O ATOM 68 CB ILE A2063 5.801 -6.199 -14.710 1.00 0.00 C ATOM 69 CG1 ILE A2063 4.345 -6.455 -14.247 1.00 0.00 C ATOM 70 CG2 ILE A2063 6.619 -5.603 -13.553 1.00 0.00 C ATOM 71 CD1 ILE A2063 4.204 -7.521 -13.157 1.00 0.00 C ATOM 0 HA ILE A2063 6.858 -4.923 -16.115 1.00 0.00 H new ATOM 0 HB ILE A2063 6.243 -7.151 -15.006 1.00 0.00 H new ATOM 0 HG12 ILE A2063 3.924 -5.519 -13.879 1.00 0.00 H new ATOM 0 HG13 ILE A2063 3.750 -6.755 -15.110 1.00 0.00 H new ATOM 0 HG21 ILE A2063 6.585 -6.278 -12.698 1.00 0.00 H new ATOM 0 HG22 ILE A2063 7.654 -5.470 -13.869 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.200 -4.637 -13.270 1.00 0.00 H new ATOM 0 HD11 ILE A2063 3.152 -7.635 -12.894 1.00 0.00 H new ATOM 0 HD12 ILE A2063 4.591 -8.471 -13.525 1.00 0.00 H new ATOM 0 HD13 ILE A2063 4.768 -7.217 -12.275 1.00 0.00 H new ATOM 83 N SER A2064 6.224 -6.851 -17.765 1.00 0.00 N ATOM 84 CA SER A2064 5.938 -7.670 -18.957 1.00 0.00 C ATOM 85 C SER A2064 6.648 -9.033 -18.879 1.00 0.00 C ATOM 86 O SER A2064 7.831 -9.071 -18.526 1.00 0.00 O ATOM 87 CB SER A2064 6.426 -6.958 -20.231 1.00 0.00 C ATOM 88 OG SER A2064 5.775 -5.710 -20.421 1.00 0.00 O ATOM 0 H SER A2064 7.169 -6.988 -17.406 1.00 0.00 H new ATOM 0 HA SER A2064 4.859 -7.817 -18.992 1.00 0.00 H new ATOM 0 HB2 SER A2064 7.503 -6.800 -20.169 1.00 0.00 H new ATOM 0 HB3 SER A2064 6.246 -7.597 -21.096 1.00 0.00 H new ATOM 0 HG SER A2064 6.111 -5.287 -21.238 1.00 0.00 H new ATOM 94 N PRO A2065 5.988 -10.157 -19.229 1.00 0.00 N ATOM 95 CA PRO A2065 6.607 -11.487 -19.207 1.00 0.00 C ATOM 96 C PRO A2065 7.675 -11.654 -20.298 1.00 0.00 C ATOM 97 O PRO A2065 8.602 -12.438 -20.123 1.00 0.00 O ATOM 98 CB PRO A2065 5.451 -12.475 -19.384 1.00 0.00 C ATOM 99 CG PRO A2065 4.423 -11.682 -20.189 1.00 0.00 C ATOM 100 CD PRO A2065 4.604 -10.252 -19.678 1.00 0.00 C ATOM 0 HA PRO A2065 7.142 -11.656 -18.273 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.769 -13.373 -19.913 1.00 0.00 H new ATOM 0 HB3 PRO A2065 5.047 -12.796 -18.424 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.609 -11.753 -21.261 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.410 -12.046 -20.017 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.399 -9.527 -20.466 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.914 -10.039 -18.862 1.00 0.00 H new ATOM 108 N SER A2066 7.605 -10.889 -21.394 1.00 0.00 N ATOM 109 CA SER A2066 8.606 -10.903 -22.476 1.00 0.00 C ATOM 110 C SER A2066 10.030 -10.621 -21.971 1.00 0.00 C ATOM 111 O SER A2066 10.992 -11.187 -22.492 1.00 0.00 O ATOM 112 CB SER A2066 8.216 -9.900 -23.565 1.00 0.00 C ATOM 113 OG SER A2066 7.957 -8.622 -23.000 1.00 0.00 O ATOM 0 H SER A2066 6.842 -10.233 -21.560 1.00 0.00 H new ATOM 0 HA SER A2066 8.615 -11.910 -22.893 1.00 0.00 H new ATOM 0 HB2 SER A2066 9.018 -9.823 -24.300 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.332 -10.255 -24.094 1.00 0.00 H new ATOM 0 HG SER A2066 7.711 -7.994 -23.711 1.00 0.00 H new ATOM 119 N ALA A2067 10.169 -9.812 -20.912 1.00 0.00 N ATOM 120 CA ALA A2067 11.445 -9.518 -20.259 1.00 0.00 C ATOM 121 C ALA A2067 12.139 -10.794 -19.733 1.00 0.00 C ATOM 122 O ALA A2067 13.364 -10.896 -19.773 1.00 0.00 O ATOM 123 CB ALA A2067 11.180 -8.520 -19.122 1.00 0.00 C ATOM 0 H ALA A2067 9.378 -9.335 -20.479 1.00 0.00 H new ATOM 0 HA ALA A2067 12.129 -9.085 -20.988 1.00 0.00 H new ATOM 0 HB1 ALA A2067 12.118 -8.284 -18.619 1.00 0.00 H new ATOM 0 HB2 ALA A2067 10.749 -7.607 -19.532 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.485 -8.960 -18.407 1.00 0.00 H new ATOM 129 N LEU A2068 11.360 -11.784 -19.276 1.00 0.00 N ATOM 130 CA LEU A2068 11.848 -13.066 -18.762 1.00 0.00 C ATOM 131 C LEU A2068 12.390 -13.938 -19.913 1.00 0.00 C ATOM 132 O LEU A2068 13.455 -14.542 -19.784 1.00 0.00 O ATOM 133 CB LEU A2068 10.714 -13.787 -17.998 1.00 0.00 C ATOM 134 CG LEU A2068 10.262 -13.183 -16.648 1.00 0.00 C ATOM 135 CD1 LEU A2068 9.846 -11.710 -16.661 1.00 0.00 C ATOM 136 CD2 LEU A2068 9.084 -13.998 -16.111 1.00 0.00 C ATOM 0 H LEU A2068 10.343 -11.710 -19.254 1.00 0.00 H new ATOM 0 HA LEU A2068 12.670 -12.886 -18.069 1.00 0.00 H new ATOM 0 HB2 LEU A2068 9.844 -13.833 -18.653 1.00 0.00 H new ATOM 0 HB3 LEU A2068 11.031 -14.814 -17.817 1.00 0.00 H new ATOM 0 HG LEU A2068 11.151 -13.229 -16.019 1.00 0.00 H new ATOM 0 HD11 LEU A2068 9.551 -11.406 -15.657 1.00 0.00 H new ATOM 0 HD12 LEU A2068 10.684 -11.098 -16.994 1.00 0.00 H new ATOM 0 HD13 LEU A2068 9.006 -11.575 -17.342 1.00 0.00 H new ATOM 0 HD21 LEU A2068 8.757 -13.581 -15.159 1.00 0.00 H new ATOM 0 HD22 LEU A2068 8.261 -13.962 -16.825 1.00 0.00 H new ATOM 0 HD23 LEU A2068 9.394 -15.033 -15.966 1.00 0.00 H new ATOM 148 N GLN A2069 11.700 -13.971 -21.061 1.00 0.00 N ATOM 149 CA GLN A2069 12.164 -14.696 -22.253 1.00 0.00 C ATOM 150 C GLN A2069 13.433 -14.047 -22.838 1.00 0.00 C ATOM 151 O GLN A2069 14.381 -14.749 -23.197 1.00 0.00 O ATOM 152 CB GLN A2069 11.056 -14.765 -23.322 1.00 0.00 C ATOM 153 CG GLN A2069 9.973 -15.817 -23.028 1.00 0.00 C ATOM 154 CD GLN A2069 8.960 -15.389 -21.970 1.00 0.00 C ATOM 155 OE1 GLN A2069 8.034 -14.633 -22.234 1.00 0.00 O ATOM 156 NE2 GLN A2069 9.069 -15.872 -20.750 1.00 0.00 N ATOM 0 H GLN A2069 10.806 -13.497 -21.190 1.00 0.00 H new ATOM 0 HA GLN A2069 12.410 -15.712 -21.946 1.00 0.00 H new ATOM 0 HB2 GLN A2069 10.585 -13.786 -23.407 1.00 0.00 H new ATOM 0 HB3 GLN A2069 11.510 -14.985 -24.288 1.00 0.00 H new ATOM 0 HG2 GLN A2069 9.442 -16.045 -23.952 1.00 0.00 H new ATOM 0 HG3 GLN A2069 10.456 -16.738 -22.702 1.00 0.00 H new ATOM 0 HE21 GLN A2069 9.836 -16.503 -20.518 1.00 0.00 H new ATOM 0 HE22 GLN A2069 8.386 -15.615 -20.037 1.00 0.00 H new ATOM 165 N ASP A2070 13.484 -12.711 -22.902 1.00 0.00 N ATOM 166 CA ASP A2070 14.663 -11.979 -23.383 1.00 0.00 C ATOM 167 C ASP A2070 15.875 -12.142 -22.448 1.00 0.00 C ATOM 168 O ASP A2070 17.016 -12.161 -22.916 1.00 0.00 O ATOM 169 CB ASP A2070 14.326 -10.506 -23.654 1.00 0.00 C ATOM 170 CG ASP A2070 13.448 -10.301 -24.909 1.00 0.00 C ATOM 171 OD1 ASP A2070 13.571 -11.075 -25.893 1.00 0.00 O ATOM 172 OD2 ASP A2070 12.671 -9.317 -24.940 1.00 0.00 O ATOM 0 H ASP A2070 12.711 -12.107 -22.622 1.00 0.00 H new ATOM 0 HA ASP A2070 14.957 -12.424 -24.333 1.00 0.00 H new ATOM 0 HB2 ASP A2070 13.810 -10.093 -22.787 1.00 0.00 H new ATOM 0 HB3 ASP A2070 15.253 -9.944 -23.772 1.00 0.00 H new ATOM 177 N LEU A2071 15.656 -12.340 -21.144 1.00 0.00 N ATOM 178 CA LEU A2071 16.727 -12.648 -20.195 1.00 0.00 C ATOM 179 C LEU A2071 17.347 -14.007 -20.556 1.00 0.00 C ATOM 180 O LEU A2071 18.565 -14.100 -20.710 1.00 0.00 O ATOM 181 CB LEU A2071 16.153 -12.603 -18.767 1.00 0.00 C ATOM 182 CG LEU A2071 17.179 -12.693 -17.623 1.00 0.00 C ATOM 183 CD1 LEU A2071 16.458 -12.338 -16.320 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.810 -14.079 -17.441 1.00 0.00 C ATOM 0 H LEU A2071 14.730 -12.291 -20.718 1.00 0.00 H new ATOM 0 HA LEU A2071 17.528 -11.911 -20.246 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.591 -11.676 -18.652 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.443 -13.422 -18.656 1.00 0.00 H new ATOM 0 HG LEU A2071 17.989 -12.009 -17.876 1.00 0.00 H new ATOM 0 HD11 LEU A2071 17.161 -12.393 -15.489 1.00 0.00 H new ATOM 0 HD12 LEU A2071 16.057 -11.327 -16.390 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.642 -13.041 -16.152 1.00 0.00 H new ATOM 0 HD21 LEU A2071 18.520 -14.050 -16.614 1.00 0.00 H new ATOM 0 HD22 LEU A2071 17.030 -14.808 -17.224 1.00 0.00 H new ATOM 0 HD23 LEU A2071 18.330 -14.365 -18.355 1.00 0.00 H new ATOM 196 N LEU A2072 16.529 -15.053 -20.749 1.00 0.00 N ATOM 197 CA LEU A2072 17.030 -16.381 -21.129 1.00 0.00 C ATOM 198 C LEU A2072 17.798 -16.364 -22.456 1.00 0.00 C ATOM 199 O LEU A2072 18.897 -16.916 -22.512 1.00 0.00 O ATOM 200 CB LEU A2072 15.898 -17.421 -21.189 1.00 0.00 C ATOM 201 CG LEU A2072 15.269 -17.818 -19.841 1.00 0.00 C ATOM 202 CD1 LEU A2072 14.282 -18.957 -20.106 1.00 0.00 C ATOM 203 CD2 LEU A2072 16.289 -18.309 -18.809 1.00 0.00 C ATOM 0 H LEU A2072 15.515 -15.003 -20.648 1.00 0.00 H new ATOM 0 HA LEU A2072 17.729 -16.671 -20.345 1.00 0.00 H new ATOM 0 HB2 LEU A2072 15.110 -17.033 -21.834 1.00 0.00 H new ATOM 0 HB3 LEU A2072 16.285 -18.322 -21.665 1.00 0.00 H new ATOM 0 HG LEU A2072 14.795 -16.928 -19.427 1.00 0.00 H new ATOM 0 HD11 LEU A2072 13.818 -19.262 -19.168 1.00 0.00 H new ATOM 0 HD12 LEU A2072 13.512 -18.617 -20.798 1.00 0.00 H new ATOM 0 HD13 LEU A2072 14.812 -19.804 -20.541 1.00 0.00 H new ATOM 0 HD21 LEU A2072 15.774 -18.571 -17.885 1.00 0.00 H new ATOM 0 HD22 LEU A2072 16.806 -19.186 -19.197 1.00 0.00 H new ATOM 0 HD23 LEU A2072 17.014 -17.520 -18.610 1.00 0.00 H new ATOM 215 N ARG A2073 17.279 -15.720 -23.515 1.00 0.00 N ATOM 216 CA ARG A2073 17.991 -15.646 -24.811 1.00 0.00 C ATOM 217 C ARG A2073 19.342 -14.919 -24.690 1.00 0.00 C ATOM 218 O ARG A2073 20.286 -15.261 -25.399 1.00 0.00 O ATOM 219 CB ARG A2073 17.073 -15.108 -25.929 1.00 0.00 C ATOM 220 CG ARG A2073 17.126 -13.585 -26.131 1.00 0.00 C ATOM 221 CD ARG A2073 15.859 -13.023 -26.778 1.00 0.00 C ATOM 222 NE ARG A2073 15.643 -13.458 -28.167 1.00 0.00 N ATOM 223 CZ ARG A2073 14.578 -13.152 -28.886 1.00 0.00 C ATOM 224 NH1 ARG A2073 13.623 -12.390 -28.423 1.00 0.00 N ATOM 225 NH2 ARG A2073 14.448 -13.612 -30.098 1.00 0.00 N ATOM 0 H ARG A2073 16.376 -15.245 -23.504 1.00 0.00 H new ATOM 0 HA ARG A2073 18.251 -16.660 -25.113 1.00 0.00 H new ATOM 0 HB2 ARG A2073 17.343 -15.594 -26.867 1.00 0.00 H new ATOM 0 HB3 ARG A2073 16.046 -15.395 -25.705 1.00 0.00 H new ATOM 0 HG2 ARG A2073 17.280 -13.101 -25.166 1.00 0.00 H new ATOM 0 HG3 ARG A2073 17.986 -13.336 -26.753 1.00 0.00 H new ATOM 0 HD2 ARG A2073 14.998 -13.319 -26.179 1.00 0.00 H new ATOM 0 HD3 ARG A2073 15.905 -11.934 -26.754 1.00 0.00 H new ATOM 0 HE ARG A2073 16.363 -14.034 -28.603 1.00 0.00 H new ATOM 0 HH11 ARG A2073 13.686 -12.011 -27.478 1.00 0.00 H new ATOM 0 HH12 ARG A2073 12.815 -12.174 -29.006 1.00 0.00 H new ATOM 0 HH21 ARG A2073 15.171 -14.212 -30.496 1.00 0.00 H new ATOM 0 HH22 ARG A2073 13.624 -13.373 -30.649 1.00 0.00 H new ATOM 239 N THR A2074 19.452 -13.972 -23.750 1.00 0.00 N ATOM 240 CA THR A2074 20.702 -13.259 -23.425 1.00 0.00 C ATOM 241 C THR A2074 21.656 -14.180 -22.650 1.00 0.00 C ATOM 242 O THR A2074 22.849 -14.218 -22.945 1.00 0.00 O ATOM 243 CB THR A2074 20.410 -11.974 -22.626 1.00 0.00 C ATOM 244 OG1 THR A2074 19.562 -11.128 -23.372 1.00 0.00 O ATOM 245 CG2 THR A2074 21.659 -11.152 -22.317 1.00 0.00 C ATOM 0 H THR A2074 18.661 -13.671 -23.181 1.00 0.00 H new ATOM 0 HA THR A2074 21.185 -12.969 -24.358 1.00 0.00 H new ATOM 0 HB THR A2074 19.960 -12.310 -21.692 1.00 0.00 H new ATOM 0 HG1 THR A2074 18.633 -11.423 -23.270 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.379 -10.262 -21.753 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.353 -11.752 -21.728 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.138 -10.854 -23.249 1.00 0.00 H new ATOM 253 N LEU A2075 21.147 -14.970 -21.693 1.00 0.00 N ATOM 254 CA LEU A2075 21.904 -15.958 -20.904 1.00 0.00 C ATOM 255 C LEU A2075 22.521 -17.059 -21.796 1.00 0.00 C ATOM 256 O LEU A2075 23.624 -17.525 -21.513 1.00 0.00 O ATOM 257 CB LEU A2075 20.967 -16.496 -19.797 1.00 0.00 C ATOM 258 CG LEU A2075 21.465 -17.579 -18.813 1.00 0.00 C ATOM 259 CD1 LEU A2075 21.347 -18.997 -19.374 1.00 0.00 C ATOM 260 CD2 LEU A2075 22.885 -17.358 -18.285 1.00 0.00 C ATOM 0 H LEU A2075 20.160 -14.939 -21.436 1.00 0.00 H new ATOM 0 HA LEU A2075 22.767 -15.491 -20.429 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.647 -15.641 -19.201 1.00 0.00 H new ATOM 0 HB3 LEU A2075 20.079 -16.891 -20.290 1.00 0.00 H new ATOM 0 HG LEU A2075 20.786 -17.473 -17.967 1.00 0.00 H new ATOM 0 HD11 LEU A2075 21.712 -19.712 -18.636 1.00 0.00 H new ATOM 0 HD12 LEU A2075 20.303 -19.212 -19.602 1.00 0.00 H new ATOM 0 HD13 LEU A2075 21.941 -19.079 -20.284 1.00 0.00 H new ATOM 0 HD21 LEU A2075 23.149 -18.166 -17.602 1.00 0.00 H new ATOM 0 HD22 LEU A2075 23.586 -17.345 -19.120 1.00 0.00 H new ATOM 0 HD23 LEU A2075 22.933 -16.406 -17.756 1.00 0.00 H new ATOM 272 N LYS A2076 21.855 -17.461 -22.892 1.00 0.00 N ATOM 273 CA LYS A2076 22.387 -18.482 -23.832 1.00 0.00 C ATOM 274 C LYS A2076 23.759 -18.141 -24.447 1.00 0.00 C ATOM 275 O LYS A2076 24.507 -19.055 -24.801 1.00 0.00 O ATOM 276 CB LYS A2076 21.392 -18.806 -24.965 1.00 0.00 C ATOM 277 CG LYS A2076 20.026 -19.385 -24.561 1.00 0.00 C ATOM 278 CD LYS A2076 20.082 -20.452 -23.454 1.00 0.00 C ATOM 279 CE LYS A2076 18.712 -21.099 -23.209 1.00 0.00 C ATOM 280 NZ LYS A2076 18.329 -22.036 -24.300 1.00 0.00 N ATOM 0 H LYS A2076 20.940 -17.096 -23.156 1.00 0.00 H new ATOM 0 HA LYS A2076 22.529 -19.360 -23.202 1.00 0.00 H new ATOM 0 HB2 LYS A2076 21.216 -17.891 -25.531 1.00 0.00 H new ATOM 0 HB3 LYS A2076 21.871 -19.513 -25.642 1.00 0.00 H new ATOM 0 HG2 LYS A2076 19.385 -18.569 -24.228 1.00 0.00 H new ATOM 0 HG3 LYS A2076 19.556 -19.820 -25.443 1.00 0.00 H new ATOM 0 HD2 LYS A2076 20.803 -21.222 -23.729 1.00 0.00 H new ATOM 0 HD3 LYS A2076 20.439 -19.997 -22.530 1.00 0.00 H new ATOM 0 HE2 LYS A2076 18.730 -21.636 -22.261 1.00 0.00 H new ATOM 0 HE3 LYS A2076 17.955 -20.320 -23.119 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 17.413 -22.474 -24.075 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 18.252 -21.513 -25.196 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 19.054 -22.776 -24.392 1.00 0.00 H new ATOM 294 N SER A2077 24.100 -16.858 -24.577 1.00 0.00 N ATOM 295 CA SER A2077 25.390 -16.377 -25.107 1.00 0.00 C ATOM 296 C SER A2077 26.580 -16.743 -24.190 1.00 0.00 C ATOM 297 O SER A2077 26.376 -17.005 -22.998 1.00 0.00 O ATOM 298 CB SER A2077 25.316 -14.850 -25.249 1.00 0.00 C ATOM 299 OG SER A2077 24.299 -14.474 -26.166 1.00 0.00 O ATOM 0 H SER A2077 23.473 -16.099 -24.311 1.00 0.00 H new ATOM 0 HA SER A2077 25.561 -16.860 -26.069 1.00 0.00 H new ATOM 0 HB2 SER A2077 25.118 -14.400 -24.276 1.00 0.00 H new ATOM 0 HB3 SER A2077 26.278 -14.466 -25.589 1.00 0.00 H new ATOM 0 HG SER A2077 24.269 -13.497 -26.239 1.00 0.00 H new ATOM 305 N PRO A2078 27.837 -16.748 -24.684 1.00 0.00 N ATOM 306 CA PRO A2078 29.004 -17.015 -23.840 1.00 0.00 C ATOM 307 C PRO A2078 29.218 -15.892 -22.804 1.00 0.00 C ATOM 308 O PRO A2078 28.863 -14.730 -23.027 1.00 0.00 O ATOM 309 CB PRO A2078 30.187 -17.159 -24.802 1.00 0.00 C ATOM 310 CG PRO A2078 29.774 -16.303 -25.996 1.00 0.00 C ATOM 311 CD PRO A2078 28.257 -16.487 -26.056 1.00 0.00 C ATOM 0 HA PRO A2078 28.877 -17.921 -23.248 1.00 0.00 H new ATOM 0 HB2 PRO A2078 31.115 -16.804 -24.354 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.348 -18.198 -25.089 1.00 0.00 H new ATOM 0 HG2 PRO A2078 30.047 -15.257 -25.854 1.00 0.00 H new ATOM 0 HG3 PRO A2078 30.256 -16.636 -26.915 1.00 0.00 H new ATOM 0 HD2 PRO A2078 27.770 -15.596 -26.452 1.00 0.00 H new ATOM 0 HD3 PRO A2078 27.989 -17.315 -26.712 1.00 0.00 H new ATOM 319 N SER A2079 29.799 -16.253 -21.658 1.00 0.00 N ATOM 320 CA SER A2079 30.060 -15.367 -20.509 1.00 0.00 C ATOM 321 C SER A2079 30.882 -14.120 -20.867 1.00 0.00 C ATOM 322 O SER A2079 32.003 -14.240 -21.372 1.00 0.00 O ATOM 323 CB SER A2079 30.784 -16.148 -19.403 1.00 0.00 C ATOM 324 OG SER A2079 30.087 -17.342 -19.072 1.00 0.00 O ATOM 0 H SER A2079 30.115 -17.209 -21.493 1.00 0.00 H new ATOM 0 HA SER A2079 29.086 -15.018 -20.166 1.00 0.00 H new ATOM 0 HB2 SER A2079 31.794 -16.393 -19.730 1.00 0.00 H new ATOM 0 HB3 SER A2079 30.879 -15.522 -18.516 1.00 0.00 H new ATOM 0 HG SER A2079 30.572 -17.819 -18.367 1.00 0.00 H new ATOM 330 N SER A2080 30.346 -12.923 -20.597 1.00 0.00 N ATOM 331 CA SER A2080 31.019 -11.640 -20.873 1.00 0.00 C ATOM 332 C SER A2080 30.408 -10.438 -20.122 1.00 0.00 C ATOM 333 O SER A2080 29.231 -10.482 -19.743 1.00 0.00 O ATOM 334 CB SER A2080 30.946 -11.338 -22.383 1.00 0.00 C ATOM 335 OG SER A2080 29.608 -11.108 -22.795 1.00 0.00 O ATOM 0 H SER A2080 29.423 -12.813 -20.176 1.00 0.00 H new ATOM 0 HA SER A2080 32.045 -11.759 -20.524 1.00 0.00 H new ATOM 0 HB2 SER A2080 31.555 -10.464 -22.612 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.364 -12.174 -22.945 1.00 0.00 H new ATOM 0 HG SER A2080 29.590 -10.917 -23.756 1.00 0.00 H new ATOM 341 N PRO A2081 31.152 -9.322 -19.945 1.00 0.00 N ATOM 342 CA PRO A2081 30.608 -8.082 -19.372 1.00 0.00 C ATOM 343 C PRO A2081 29.439 -7.518 -20.206 1.00 0.00 C ATOM 344 O PRO A2081 28.541 -6.867 -19.672 1.00 0.00 O ATOM 345 CB PRO A2081 31.768 -7.078 -19.345 1.00 0.00 C ATOM 346 CG PRO A2081 33.022 -7.932 -19.505 1.00 0.00 C ATOM 347 CD PRO A2081 32.548 -9.133 -20.315 1.00 0.00 C ATOM 0 HA PRO A2081 30.207 -8.274 -18.377 1.00 0.00 H new ATOM 0 HB2 PRO A2081 31.680 -6.349 -20.151 1.00 0.00 H new ATOM 0 HB3 PRO A2081 31.786 -6.519 -18.410 1.00 0.00 H new ATOM 0 HG2 PRO A2081 33.812 -7.388 -20.022 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.424 -8.236 -18.539 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.650 -8.950 -21.385 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.139 -10.020 -20.085 1.00 0.00 H new ATOM 355 N GLN A2082 29.422 -7.787 -21.517 1.00 0.00 N ATOM 356 CA GLN A2082 28.345 -7.372 -22.428 1.00 0.00 C ATOM 357 C GLN A2082 27.026 -8.084 -22.072 1.00 0.00 C ATOM 358 O GLN A2082 25.978 -7.442 -21.983 1.00 0.00 O ATOM 359 CB GLN A2082 28.744 -7.645 -23.891 1.00 0.00 C ATOM 360 CG GLN A2082 29.741 -6.621 -24.466 1.00 0.00 C ATOM 361 CD GLN A2082 31.097 -6.596 -23.761 1.00 0.00 C ATOM 362 OE1 GLN A2082 31.450 -5.659 -23.058 1.00 0.00 O ATOM 363 NE2 GLN A2082 31.903 -7.626 -23.902 1.00 0.00 N ATOM 0 H GLN A2082 30.166 -8.306 -21.983 1.00 0.00 H new ATOM 0 HA GLN A2082 28.188 -6.300 -22.313 1.00 0.00 H new ATOM 0 HB2 GLN A2082 29.181 -8.641 -23.958 1.00 0.00 H new ATOM 0 HB3 GLN A2082 27.845 -7.649 -24.508 1.00 0.00 H new ATOM 0 HG2 GLN A2082 29.898 -6.839 -25.522 1.00 0.00 H new ATOM 0 HG3 GLN A2082 29.297 -5.627 -24.408 1.00 0.00 H new ATOM 0 HE21 GLN A2082 31.624 -8.416 -24.484 1.00 0.00 H new ATOM 0 HE22 GLN A2082 32.807 -7.635 -23.429 1.00 0.00 H new ATOM 372 N GLN A2083 27.079 -9.395 -21.801 1.00 0.00 N ATOM 373 CA GLN A2083 25.928 -10.193 -21.354 1.00 0.00 C ATOM 374 C GLN A2083 25.400 -9.680 -20.004 1.00 0.00 C ATOM 375 O GLN A2083 24.198 -9.466 -19.841 1.00 0.00 O ATOM 376 CB GLN A2083 26.367 -11.664 -21.269 1.00 0.00 C ATOM 377 CG GLN A2083 25.277 -12.602 -20.740 1.00 0.00 C ATOM 378 CD GLN A2083 25.771 -14.043 -20.724 1.00 0.00 C ATOM 379 OE1 GLN A2083 26.677 -14.414 -19.990 1.00 0.00 O ATOM 380 NE2 GLN A2083 25.186 -14.896 -21.527 1.00 0.00 N ATOM 0 H GLN A2083 27.937 -9.940 -21.887 1.00 0.00 H new ATOM 0 HA GLN A2083 25.108 -10.102 -22.066 1.00 0.00 H new ATOM 0 HB2 GLN A2083 26.674 -12.000 -22.259 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.242 -11.736 -20.622 1.00 0.00 H new ATOM 0 HG2 GLN A2083 24.987 -12.300 -19.734 1.00 0.00 H new ATOM 0 HG3 GLN A2083 24.387 -12.524 -21.365 1.00 0.00 H new ATOM 0 HE21 GLN A2083 24.431 -14.585 -22.138 1.00 0.00 H new ATOM 0 HE22 GLN A2083 25.485 -15.871 -21.541 1.00 0.00 H new ATOM 389 N GLN A2084 26.311 -9.436 -19.054 1.00 0.00 N ATOM 390 CA GLN A2084 26.016 -8.878 -17.729 1.00 0.00 C ATOM 391 C GLN A2084 25.269 -7.538 -17.857 1.00 0.00 C ATOM 392 O GLN A2084 24.209 -7.355 -17.253 1.00 0.00 O ATOM 393 CB GLN A2084 27.360 -8.728 -16.992 1.00 0.00 C ATOM 394 CG GLN A2084 27.320 -7.997 -15.640 1.00 0.00 C ATOM 395 CD GLN A2084 28.729 -7.704 -15.110 1.00 0.00 C ATOM 396 OE1 GLN A2084 29.681 -7.465 -15.843 1.00 0.00 O ATOM 397 NE2 GLN A2084 28.934 -7.700 -13.815 1.00 0.00 N ATOM 0 H GLN A2084 27.304 -9.627 -19.190 1.00 0.00 H new ATOM 0 HA GLN A2084 25.358 -9.535 -17.161 1.00 0.00 H new ATOM 0 HB2 GLN A2084 27.774 -9.723 -16.830 1.00 0.00 H new ATOM 0 HB3 GLN A2084 28.051 -8.198 -17.647 1.00 0.00 H new ATOM 0 HG2 GLN A2084 26.771 -7.062 -15.748 1.00 0.00 H new ATOM 0 HG3 GLN A2084 26.777 -8.603 -14.915 1.00 0.00 H new ATOM 0 HE21 GLN A2084 28.163 -7.895 -13.176 1.00 0.00 H new ATOM 0 HE22 GLN A2084 29.864 -7.502 -13.447 1.00 0.00 H new ATOM 406 N GLN A2085 25.790 -6.612 -18.671 1.00 0.00 N ATOM 407 CA GLN A2085 25.164 -5.310 -18.905 1.00 0.00 C ATOM 408 C GLN A2085 23.788 -5.442 -19.570 1.00 0.00 C ATOM 409 O GLN A2085 22.867 -4.735 -19.170 1.00 0.00 O ATOM 410 CB GLN A2085 26.106 -4.409 -19.723 1.00 0.00 C ATOM 411 CG GLN A2085 25.606 -2.955 -19.810 1.00 0.00 C ATOM 412 CD GLN A2085 25.494 -2.282 -18.440 1.00 0.00 C ATOM 413 OE1 GLN A2085 26.464 -2.136 -17.706 1.00 0.00 O ATOM 414 NE2 GLN A2085 24.319 -1.853 -18.031 1.00 0.00 N ATOM 0 H GLN A2085 26.660 -6.747 -19.186 1.00 0.00 H new ATOM 0 HA GLN A2085 24.992 -4.841 -17.936 1.00 0.00 H new ATOM 0 HB2 GLN A2085 27.098 -4.422 -19.272 1.00 0.00 H new ATOM 0 HB3 GLN A2085 26.208 -4.815 -20.729 1.00 0.00 H new ATOM 0 HG2 GLN A2085 26.286 -2.379 -20.438 1.00 0.00 H new ATOM 0 HG3 GLN A2085 24.631 -2.940 -20.298 1.00 0.00 H new ATOM 0 HE21 GLN A2085 23.499 -1.965 -18.627 1.00 0.00 H new ATOM 0 HE22 GLN A2085 24.228 -1.408 -17.118 1.00 0.00 H new ATOM 423 N GLN A2086 23.603 -6.343 -20.545 1.00 0.00 N ATOM 424 CA GLN A2086 22.289 -6.528 -21.171 1.00 0.00 C ATOM 425 C GLN A2086 21.230 -7.030 -20.185 1.00 0.00 C ATOM 426 O GLN A2086 20.117 -6.510 -20.199 1.00 0.00 O ATOM 427 CB GLN A2086 22.361 -7.441 -22.408 1.00 0.00 C ATOM 428 CG GLN A2086 22.650 -6.657 -23.696 1.00 0.00 C ATOM 429 CD GLN A2086 21.569 -5.616 -24.003 1.00 0.00 C ATOM 430 OE1 GLN A2086 21.716 -4.426 -23.752 1.00 0.00 O ATOM 431 NE2 GLN A2086 20.424 -6.019 -24.514 1.00 0.00 N ATOM 0 H GLN A2086 24.337 -6.948 -20.913 1.00 0.00 H new ATOM 0 HA GLN A2086 21.977 -5.538 -21.503 1.00 0.00 H new ATOM 0 HB2 GLN A2086 23.139 -8.190 -22.259 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.418 -7.978 -22.516 1.00 0.00 H new ATOM 0 HG2 GLN A2086 23.615 -6.158 -23.605 1.00 0.00 H new ATOM 0 HG3 GLN A2086 22.728 -7.353 -24.531 1.00 0.00 H new ATOM 0 HE21 GLN A2086 20.281 -7.006 -24.730 1.00 0.00 H new ATOM 0 HE22 GLN A2086 19.680 -5.345 -24.694 1.00 0.00 H new ATOM 440 N VAL A2087 21.547 -7.977 -19.296 1.00 0.00 N ATOM 441 CA VAL A2087 20.573 -8.420 -18.278 1.00 0.00 C ATOM 442 C VAL A2087 20.242 -7.275 -17.313 1.00 0.00 C ATOM 443 O VAL A2087 19.069 -7.074 -16.999 1.00 0.00 O ATOM 444 CB VAL A2087 21.041 -9.692 -17.556 1.00 0.00 C ATOM 445 CG1 VAL A2087 20.116 -10.078 -16.393 1.00 0.00 C ATOM 446 CG2 VAL A2087 21.050 -10.856 -18.560 1.00 0.00 C ATOM 0 H VAL A2087 22.451 -8.447 -19.255 1.00 0.00 H new ATOM 0 HA VAL A2087 19.647 -8.690 -18.785 1.00 0.00 H new ATOM 0 HB VAL A2087 22.034 -9.493 -17.153 1.00 0.00 H new ATOM 0 HG11 VAL A2087 20.490 -10.984 -15.915 1.00 0.00 H new ATOM 0 HG12 VAL A2087 20.090 -9.268 -15.664 1.00 0.00 H new ATOM 0 HG13 VAL A2087 19.110 -10.257 -16.772 1.00 0.00 H new ATOM 0 HG21 VAL A2087 21.381 -11.766 -18.059 1.00 0.00 H new ATOM 0 HG22 VAL A2087 20.045 -11.004 -18.955 1.00 0.00 H new ATOM 0 HG23 VAL A2087 21.731 -10.625 -19.379 1.00 0.00 H new ATOM 456 N LEU A2088 21.229 -6.464 -16.910 1.00 0.00 N ATOM 457 CA LEU A2088 20.980 -5.262 -16.100 1.00 0.00 C ATOM 458 C LEU A2088 20.065 -4.283 -16.860 1.00 0.00 C ATOM 459 O LEU A2088 19.111 -3.773 -16.280 1.00 0.00 O ATOM 460 CB LEU A2088 22.314 -4.593 -15.709 1.00 0.00 C ATOM 461 CG LEU A2088 23.105 -5.340 -14.618 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.529 -4.787 -14.531 1.00 0.00 C ATOM 463 CD2 LEU A2088 22.463 -5.183 -13.237 1.00 0.00 C ATOM 0 H LEU A2088 22.212 -6.619 -17.133 1.00 0.00 H new ATOM 0 HA LEU A2088 20.469 -5.554 -15.182 1.00 0.00 H new ATOM 0 HB2 LEU A2088 22.938 -4.507 -16.599 1.00 0.00 H new ATOM 0 HB3 LEU A2088 22.111 -3.579 -15.364 1.00 0.00 H new ATOM 0 HG LEU A2088 23.107 -6.394 -14.897 1.00 0.00 H new ATOM 0 HD11 LEU A2088 25.080 -5.321 -13.757 1.00 0.00 H new ATOM 0 HD12 LEU A2088 25.030 -4.919 -15.490 1.00 0.00 H new ATOM 0 HD13 LEU A2088 24.493 -3.726 -14.284 1.00 0.00 H new ATOM 0 HD21 LEU A2088 23.053 -5.725 -12.498 1.00 0.00 H new ATOM 0 HD22 LEU A2088 22.428 -4.127 -12.970 1.00 0.00 H new ATOM 0 HD23 LEU A2088 21.450 -5.585 -13.259 1.00 0.00 H new ATOM 475 N ASN A2089 20.296 -4.059 -18.160 1.00 0.00 N ATOM 476 CA ASN A2089 19.459 -3.188 -18.999 1.00 0.00 C ATOM 477 C ASN A2089 18.003 -3.701 -19.060 1.00 0.00 C ATOM 478 O ASN A2089 17.059 -2.929 -18.873 1.00 0.00 O ATOM 479 CB ASN A2089 20.059 -3.068 -20.419 1.00 0.00 C ATOM 480 CG ASN A2089 21.404 -2.359 -20.503 1.00 0.00 C ATOM 481 OD1 ASN A2089 21.860 -1.681 -19.591 1.00 0.00 O ATOM 482 ND2 ASN A2089 22.097 -2.492 -21.611 1.00 0.00 N ATOM 0 H ASN A2089 21.076 -4.480 -18.665 1.00 0.00 H new ATOM 0 HA ASN A2089 19.442 -2.197 -18.546 1.00 0.00 H new ATOM 0 HB2 ASN A2089 20.169 -4.070 -20.834 1.00 0.00 H new ATOM 0 HB3 ASN A2089 19.348 -2.537 -21.052 1.00 0.00 H new ATOM 0 HD21 ASN A2089 23.003 -2.033 -21.704 1.00 0.00 H new ATOM 0 HD22 ASN A2089 21.729 -3.054 -22.378 1.00 0.00 H new ATOM 489 N ILE A2090 17.823 -5.008 -19.290 1.00 0.00 N ATOM 490 CA ILE A2090 16.517 -5.688 -19.344 1.00 0.00 C ATOM 491 C ILE A2090 15.770 -5.551 -18.006 1.00 0.00 C ATOM 492 O ILE A2090 14.588 -5.205 -18.008 1.00 0.00 O ATOM 493 CB ILE A2090 16.713 -7.167 -19.774 1.00 0.00 C ATOM 494 CG1 ILE A2090 17.143 -7.233 -21.262 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.441 -8.015 -19.570 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.800 -8.561 -21.667 1.00 0.00 C ATOM 0 H ILE A2090 18.605 -5.643 -19.449 1.00 0.00 H new ATOM 0 HA ILE A2090 15.888 -5.209 -20.095 1.00 0.00 H new ATOM 0 HB ILE A2090 17.493 -7.584 -19.137 1.00 0.00 H new ATOM 0 HG12 ILE A2090 16.267 -7.067 -21.890 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.839 -6.419 -21.464 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.633 -9.040 -19.886 1.00 0.00 H new ATOM 0 HG22 ILE A2090 15.163 -8.006 -18.516 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.627 -7.598 -20.163 1.00 0.00 H new ATOM 0 HD11 ILE A2090 18.071 -8.526 -22.722 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.696 -8.721 -21.067 1.00 0.00 H new ATOM 0 HD13 ILE A2090 17.100 -9.379 -21.499 1.00 0.00 H new ATOM 508 N LEU A2091 16.437 -5.774 -16.867 1.00 0.00 N ATOM 509 CA LEU A2091 15.839 -5.648 -15.529 1.00 0.00 C ATOM 510 C LEU A2091 15.498 -4.195 -15.155 1.00 0.00 C ATOM 511 O LEU A2091 14.415 -3.924 -14.635 1.00 0.00 O ATOM 512 CB LEU A2091 16.804 -6.235 -14.483 1.00 0.00 C ATOM 513 CG LEU A2091 16.947 -7.767 -14.491 1.00 0.00 C ATOM 514 CD1 LEU A2091 18.046 -8.160 -13.502 1.00 0.00 C ATOM 515 CD2 LEU A2091 15.658 -8.477 -14.075 1.00 0.00 C ATOM 0 H LEU A2091 17.419 -6.050 -16.847 1.00 0.00 H new ATOM 0 HA LEU A2091 14.900 -6.200 -15.544 1.00 0.00 H new ATOM 0 HB2 LEU A2091 17.789 -5.796 -14.638 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.469 -5.925 -13.493 1.00 0.00 H new ATOM 0 HG LEU A2091 17.187 -8.070 -15.510 1.00 0.00 H new ATOM 0 HD11 LEU A2091 18.160 -9.244 -13.496 1.00 0.00 H new ATOM 0 HD12 LEU A2091 18.987 -7.698 -13.801 1.00 0.00 H new ATOM 0 HD13 LEU A2091 17.776 -7.818 -12.503 1.00 0.00 H new ATOM 0 HD21 LEU A2091 15.813 -9.556 -14.098 1.00 0.00 H new ATOM 0 HD22 LEU A2091 15.384 -8.171 -13.066 1.00 0.00 H new ATOM 0 HD23 LEU A2091 14.857 -8.211 -14.765 1.00 0.00 H new ATOM 527 N LYS A2092 16.396 -3.238 -15.427 1.00 0.00 N ATOM 528 CA LYS A2092 16.197 -1.802 -15.141 1.00 0.00 C ATOM 529 C LYS A2092 15.065 -1.156 -15.955 1.00 0.00 C ATOM 530 O LYS A2092 14.595 -0.076 -15.600 1.00 0.00 O ATOM 531 CB LYS A2092 17.525 -1.053 -15.287 1.00 0.00 C ATOM 532 CG LYS A2092 18.456 -1.425 -14.113 1.00 0.00 C ATOM 533 CD LYS A2092 19.747 -0.602 -14.069 1.00 0.00 C ATOM 534 CE LYS A2092 19.425 0.842 -13.668 1.00 0.00 C ATOM 535 NZ LYS A2092 20.659 1.633 -13.419 1.00 0.00 N ATOM 0 H LYS A2092 17.298 -3.439 -15.859 1.00 0.00 H new ATOM 0 HA LYS A2092 15.862 -1.723 -14.107 1.00 0.00 H new ATOM 0 HB2 LYS A2092 17.997 -1.309 -16.235 1.00 0.00 H new ATOM 0 HB3 LYS A2092 17.349 0.023 -15.299 1.00 0.00 H new ATOM 0 HG2 LYS A2092 17.917 -1.289 -13.176 1.00 0.00 H new ATOM 0 HG3 LYS A2092 18.711 -2.482 -14.184 1.00 0.00 H new ATOM 0 HD2 LYS A2092 20.445 -1.041 -13.356 1.00 0.00 H new ATOM 0 HD3 LYS A2092 20.234 -0.619 -15.044 1.00 0.00 H new ATOM 0 HE2 LYS A2092 18.842 1.317 -14.457 1.00 0.00 H new ATOM 0 HE3 LYS A2092 18.806 0.841 -12.771 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 20.401 2.604 -13.150 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 21.203 1.194 -12.649 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 21.237 1.655 -14.283 1.00 0.00 H new ATOM 549 N SER A2093 14.587 -1.834 -17.000 1.00 0.00 N ATOM 550 CA SER A2093 13.412 -1.433 -17.798 1.00 0.00 C ATOM 551 C SER A2093 12.075 -1.838 -17.131 1.00 0.00 C ATOM 552 O SER A2093 11.007 -1.416 -17.576 1.00 0.00 O ATOM 553 CB SER A2093 13.489 -2.043 -19.204 1.00 0.00 C ATOM 554 OG SER A2093 14.645 -1.590 -19.892 1.00 0.00 O ATOM 0 H SER A2093 15.013 -2.701 -17.329 1.00 0.00 H new ATOM 0 HA SER A2093 13.432 -0.345 -17.863 1.00 0.00 H new ATOM 0 HB2 SER A2093 13.507 -3.130 -19.132 1.00 0.00 H new ATOM 0 HB3 SER A2093 12.597 -1.776 -19.770 1.00 0.00 H new ATOM 0 HG SER A2093 15.437 -2.046 -19.537 1.00 0.00 H new ATOM 560 N ASN A2094 12.119 -2.648 -16.065 1.00 0.00 N ATOM 561 CA ASN A2094 10.988 -3.153 -15.266 1.00 0.00 C ATOM 562 C ASN A2094 11.438 -3.344 -13.790 1.00 0.00 C ATOM 563 O ASN A2094 11.435 -4.462 -13.266 1.00 0.00 O ATOM 564 CB ASN A2094 10.399 -4.426 -15.927 1.00 0.00 C ATOM 565 CG ASN A2094 11.452 -5.346 -16.529 1.00 0.00 C ATOM 566 OD1 ASN A2094 12.102 -6.133 -15.863 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.641 -5.283 -17.828 1.00 0.00 N ATOM 0 H ASN A2094 13.010 -2.995 -15.710 1.00 0.00 H new ATOM 0 HA ASN A2094 10.173 -2.429 -15.243 1.00 0.00 H new ATOM 0 HB2 ASN A2094 9.828 -4.980 -15.182 1.00 0.00 H new ATOM 0 HB3 ASN A2094 9.700 -4.129 -16.708 1.00 0.00 H new ATOM 0 HD21 ASN A2094 12.329 -5.891 -18.273 1.00 0.00 H new ATOM 0 HD22 ASN A2094 11.100 -4.626 -18.391 1.00 0.00 H new ATOM 574 N PRO A2095 11.854 -2.262 -13.093 1.00 0.00 N ATOM 575 CA PRO A2095 12.407 -2.333 -11.736 1.00 0.00 C ATOM 576 C PRO A2095 11.453 -2.862 -10.657 1.00 0.00 C ATOM 577 O PRO A2095 11.919 -3.262 -9.593 1.00 0.00 O ATOM 578 CB PRO A2095 12.923 -0.924 -11.417 1.00 0.00 C ATOM 579 CG PRO A2095 12.088 -0.018 -12.318 1.00 0.00 C ATOM 580 CD PRO A2095 11.872 -0.881 -13.558 1.00 0.00 C ATOM 0 HA PRO A2095 13.201 -3.079 -11.719 1.00 0.00 H new ATOM 0 HB2 PRO A2095 12.787 -0.677 -10.364 1.00 0.00 H new ATOM 0 HB3 PRO A2095 13.988 -0.830 -11.631 1.00 0.00 H new ATOM 0 HG2 PRO A2095 11.144 0.260 -11.849 1.00 0.00 H new ATOM 0 HG3 PRO A2095 12.611 0.908 -12.556 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.935 -0.624 -14.053 1.00 0.00 H new ATOM 0 HD3 PRO A2095 12.669 -0.725 -14.285 1.00 0.00 H new ATOM 588 N GLN A2096 10.144 -2.911 -10.922 1.00 0.00 N ATOM 589 CA GLN A2096 9.111 -3.420 -10.007 1.00 0.00 C ATOM 590 C GLN A2096 9.448 -4.834 -9.495 1.00 0.00 C ATOM 591 O GLN A2096 9.396 -5.092 -8.291 1.00 0.00 O ATOM 592 CB GLN A2096 7.750 -3.430 -10.734 1.00 0.00 C ATOM 593 CG GLN A2096 7.103 -2.050 -10.946 1.00 0.00 C ATOM 594 CD GLN A2096 7.971 -1.066 -11.729 1.00 0.00 C ATOM 595 OE1 GLN A2096 8.490 -0.095 -11.198 1.00 0.00 O ATOM 596 NE2 GLN A2096 8.204 -1.290 -13.005 1.00 0.00 N ATOM 0 H GLN A2096 9.759 -2.587 -11.809 1.00 0.00 H new ATOM 0 HA GLN A2096 9.067 -2.761 -9.140 1.00 0.00 H new ATOM 0 HB2 GLN A2096 7.881 -3.904 -11.707 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.059 -4.053 -10.166 1.00 0.00 H new ATOM 0 HG2 GLN A2096 6.157 -2.181 -11.472 1.00 0.00 H new ATOM 0 HG3 GLN A2096 6.869 -1.617 -9.973 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.781 -2.095 -13.467 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.808 -0.659 -13.532 1.00 0.00 H new ATOM 605 N LEU A2097 9.826 -5.737 -10.408 1.00 0.00 N ATOM 606 CA LEU A2097 10.223 -7.115 -10.086 1.00 0.00 C ATOM 607 C LEU A2097 11.702 -7.247 -9.663 1.00 0.00 C ATOM 608 O LEU A2097 12.038 -8.126 -8.867 1.00 0.00 O ATOM 609 CB LEU A2097 9.786 -8.068 -11.222 1.00 0.00 C ATOM 610 CG LEU A2097 10.191 -7.737 -12.678 1.00 0.00 C ATOM 611 CD1 LEU A2097 11.680 -7.954 -12.955 1.00 0.00 C ATOM 612 CD2 LEU A2097 9.414 -8.644 -13.637 1.00 0.00 C ATOM 0 H LEU A2097 9.866 -5.529 -11.406 1.00 0.00 H new ATOM 0 HA LEU A2097 9.688 -7.426 -9.189 1.00 0.00 H new ATOM 0 HB2 LEU A2097 10.177 -9.058 -10.989 1.00 0.00 H new ATOM 0 HB3 LEU A2097 8.699 -8.139 -11.191 1.00 0.00 H new ATOM 0 HG LEU A2097 9.964 -6.681 -12.827 1.00 0.00 H new ATOM 0 HD11 LEU A2097 11.897 -7.704 -13.993 1.00 0.00 H new ATOM 0 HD12 LEU A2097 12.269 -7.315 -12.297 1.00 0.00 H new ATOM 0 HD13 LEU A2097 11.936 -8.998 -12.772 1.00 0.00 H new ATOM 0 HD21 LEU A2097 9.696 -8.414 -14.664 1.00 0.00 H new ATOM 0 HD22 LEU A2097 9.647 -9.687 -13.421 1.00 0.00 H new ATOM 0 HD23 LEU A2097 8.344 -8.478 -13.509 1.00 0.00 H new ATOM 624 N MET A2098 12.584 -6.361 -10.139 1.00 0.00 N ATOM 625 CA MET A2098 14.014 -6.367 -9.797 1.00 0.00 C ATOM 626 C MET A2098 14.256 -5.950 -8.343 1.00 0.00 C ATOM 627 O MET A2098 14.986 -6.618 -7.611 1.00 0.00 O ATOM 628 CB MET A2098 14.769 -5.431 -10.755 1.00 0.00 C ATOM 629 CG MET A2098 16.293 -5.569 -10.645 1.00 0.00 C ATOM 630 SD MET A2098 17.128 -4.833 -9.214 1.00 0.00 S ATOM 631 CE MET A2098 17.094 -3.098 -9.723 1.00 0.00 C ATOM 0 H MET A2098 12.324 -5.611 -10.779 1.00 0.00 H new ATOM 0 HA MET A2098 14.386 -7.386 -9.905 1.00 0.00 H new ATOM 0 HB2 MET A2098 14.463 -5.643 -11.779 1.00 0.00 H new ATOM 0 HB3 MET A2098 14.486 -4.399 -10.545 1.00 0.00 H new ATOM 0 HG2 MET A2098 16.531 -6.633 -10.657 1.00 0.00 H new ATOM 0 HG3 MET A2098 16.731 -5.135 -11.544 1.00 0.00 H new ATOM 0 HE1 MET A2098 17.570 -2.485 -8.958 1.00 0.00 H new ATOM 0 HE2 MET A2098 17.631 -2.984 -10.665 1.00 0.00 H new ATOM 0 HE3 MET A2098 16.060 -2.778 -9.854 1.00 0.00 H new ATOM 641 N ALA A2099 13.622 -4.862 -7.904 1.00 0.00 N ATOM 642 CA ALA A2099 13.752 -4.353 -6.545 1.00 0.00 C ATOM 643 C ALA A2099 13.267 -5.375 -5.494 1.00 0.00 C ATOM 644 O ALA A2099 13.876 -5.517 -4.432 1.00 0.00 O ATOM 645 CB ALA A2099 13.042 -3.007 -6.492 1.00 0.00 C ATOM 0 H ALA A2099 12.999 -4.307 -8.490 1.00 0.00 H new ATOM 0 HA ALA A2099 14.799 -4.200 -6.283 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.119 -2.594 -5.486 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.507 -2.322 -7.202 1.00 0.00 H new ATOM 0 HB3 ALA A2099 11.991 -3.139 -6.750 1.00 0.00 H new ATOM 651 N ALA A2100 12.225 -6.154 -5.818 1.00 0.00 N ATOM 652 CA ALA A2100 11.759 -7.257 -4.977 1.00 0.00 C ATOM 653 C ALA A2100 12.799 -8.398 -4.946 1.00 0.00 C ATOM 654 O ALA A2100 13.053 -8.975 -3.887 1.00 0.00 O ATOM 655 CB ALA A2100 10.401 -7.735 -5.506 1.00 0.00 C ATOM 0 H ALA A2100 11.683 -6.034 -6.674 1.00 0.00 H new ATOM 0 HA ALA A2100 11.637 -6.918 -3.948 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.039 -8.558 -4.889 1.00 0.00 H new ATOM 0 HB2 ALA A2100 9.686 -6.913 -5.469 1.00 0.00 H new ATOM 0 HB3 ALA A2100 10.511 -8.075 -6.536 1.00 0.00 H new ATOM 661 N PHE A2101 13.437 -8.698 -6.086 1.00 0.00 N ATOM 662 CA PHE A2101 14.490 -9.714 -6.193 1.00 0.00 C ATOM 663 C PHE A2101 15.703 -9.360 -5.327 1.00 0.00 C ATOM 664 O PHE A2101 16.100 -10.179 -4.496 1.00 0.00 O ATOM 665 CB PHE A2101 14.865 -9.957 -7.665 1.00 0.00 C ATOM 666 CG PHE A2101 16.192 -10.669 -7.871 1.00 0.00 C ATOM 667 CD1 PHE A2101 16.350 -12.009 -7.469 1.00 0.00 C ATOM 668 CD2 PHE A2101 17.279 -9.978 -8.441 1.00 0.00 C ATOM 669 CE1 PHE A2101 17.588 -12.655 -7.639 1.00 0.00 C ATOM 670 CE2 PHE A2101 18.514 -10.627 -8.618 1.00 0.00 C ATOM 671 CZ PHE A2101 18.668 -11.966 -8.219 1.00 0.00 C ATOM 0 H PHE A2101 13.232 -8.234 -6.971 1.00 0.00 H new ATOM 0 HA PHE A2101 14.100 -10.654 -5.802 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.076 -10.544 -8.135 1.00 0.00 H new ATOM 0 HB3 PHE A2101 14.899 -8.997 -8.181 1.00 0.00 H new ATOM 0 HD1 PHE A2101 15.520 -12.542 -7.030 1.00 0.00 H new ATOM 0 HD2 PHE A2101 17.164 -8.947 -8.743 1.00 0.00 H new ATOM 0 HE1 PHE A2101 17.709 -13.681 -7.324 1.00 0.00 H new ATOM 0 HE2 PHE A2101 19.344 -10.097 -9.061 1.00 0.00 H new ATOM 0 HZ PHE A2101 19.615 -12.465 -8.358 1.00 0.00 H new ATOM 681 N ILE A2102 16.271 -8.153 -5.452 1.00 0.00 N ATOM 682 CA ILE A2102 17.424 -7.749 -4.628 1.00 0.00 C ATOM 683 C ILE A2102 17.088 -7.753 -3.129 1.00 0.00 C ATOM 684 O ILE A2102 17.906 -8.219 -2.335 1.00 0.00 O ATOM 685 CB ILE A2102 18.080 -6.445 -5.139 1.00 0.00 C ATOM 686 CG1 ILE A2102 19.479 -6.209 -4.517 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.177 -5.212 -5.041 1.00 0.00 C ATOM 688 CD1 ILE A2102 19.546 -5.439 -3.189 1.00 0.00 C ATOM 0 H ILE A2102 15.955 -7.441 -6.111 1.00 0.00 H new ATOM 0 HA ILE A2102 18.197 -8.508 -4.744 1.00 0.00 H new ATOM 0 HB ILE A2102 18.229 -6.599 -6.208 1.00 0.00 H new ATOM 0 HG12 ILE A2102 19.948 -7.181 -4.366 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.085 -5.673 -5.247 1.00 0.00 H new ATOM 0 HG21 ILE A2102 17.710 -4.340 -5.419 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.277 -5.372 -5.634 1.00 0.00 H new ATOM 0 HG23 ILE A2102 16.900 -5.045 -4.000 1.00 0.00 H new ATOM 0 HD11 ILE A2102 20.585 -5.349 -2.873 1.00 0.00 H new ATOM 0 HD12 ILE A2102 19.120 -4.445 -3.323 1.00 0.00 H new ATOM 0 HD13 ILE A2102 18.980 -5.976 -2.428 1.00 0.00 H new ATOM 700 N LYS A2103 15.875 -7.331 -2.727 1.00 0.00 N ATOM 701 CA LYS A2103 15.424 -7.364 -1.320 1.00 0.00 C ATOM 702 C LYS A2103 15.488 -8.775 -0.703 1.00 0.00 C ATOM 703 O LYS A2103 15.720 -8.898 0.499 1.00 0.00 O ATOM 704 CB LYS A2103 14.025 -6.724 -1.197 1.00 0.00 C ATOM 705 CG LYS A2103 13.613 -6.505 0.272 1.00 0.00 C ATOM 706 CD LYS A2103 12.266 -5.790 0.467 1.00 0.00 C ATOM 707 CE LYS A2103 12.273 -4.352 -0.068 1.00 0.00 C ATOM 708 NZ LYS A2103 11.086 -3.592 0.404 1.00 0.00 N ATOM 0 H LYS A2103 15.177 -6.956 -3.369 1.00 0.00 H new ATOM 0 HA LYS A2103 16.122 -6.768 -0.732 1.00 0.00 H new ATOM 0 HB2 LYS A2103 14.017 -5.768 -1.721 1.00 0.00 H new ATOM 0 HB3 LYS A2103 13.290 -7.363 -1.687 1.00 0.00 H new ATOM 0 HG2 LYS A2103 13.569 -7.474 0.770 1.00 0.00 H new ATOM 0 HG3 LYS A2103 14.391 -5.926 0.770 1.00 0.00 H new ATOM 0 HD2 LYS A2103 11.483 -6.356 -0.037 1.00 0.00 H new ATOM 0 HD3 LYS A2103 12.017 -5.777 1.528 1.00 0.00 H new ATOM 0 HE2 LYS A2103 13.183 -3.846 0.255 1.00 0.00 H new ATOM 0 HE3 LYS A2103 12.287 -4.368 -1.158 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 11.120 -2.624 0.025 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 10.219 -4.062 0.074 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 11.087 -3.557 1.443 1.00 0.00 H new ATOM 722 N GLN A2104 15.343 -9.834 -1.509 1.00 0.00 N ATOM 723 CA GLN A2104 15.486 -11.224 -1.052 1.00 0.00 C ATOM 724 C GLN A2104 16.924 -11.743 -1.252 1.00 0.00 C ATOM 725 O GLN A2104 17.479 -12.380 -0.358 1.00 0.00 O ATOM 726 CB GLN A2104 14.455 -12.109 -1.772 1.00 0.00 C ATOM 727 CG GLN A2104 14.335 -13.497 -1.118 1.00 0.00 C ATOM 728 CD GLN A2104 13.114 -14.270 -1.614 1.00 0.00 C ATOM 729 OE1 GLN A2104 13.169 -15.037 -2.564 1.00 0.00 O ATOM 730 NE2 GLN A2104 11.969 -14.112 -0.980 1.00 0.00 N ATOM 0 H GLN A2104 15.122 -9.752 -2.501 1.00 0.00 H new ATOM 0 HA GLN A2104 15.291 -11.263 0.020 1.00 0.00 H new ATOM 0 HB2 GLN A2104 13.483 -11.617 -1.760 1.00 0.00 H new ATOM 0 HB3 GLN A2104 14.742 -12.224 -2.817 1.00 0.00 H new ATOM 0 HG2 GLN A2104 15.236 -14.073 -1.327 1.00 0.00 H new ATOM 0 HG3 GLN A2104 14.274 -13.382 -0.036 1.00 0.00 H new ATOM 0 HE21 GLN A2104 11.910 -13.475 -0.186 1.00 0.00 H new ATOM 0 HE22 GLN A2104 11.143 -14.627 -1.284 1.00 0.00 H new ATOM 739 N ARG A2105 17.554 -11.451 -2.401 1.00 0.00 N ATOM 740 CA ARG A2105 18.928 -11.871 -2.749 1.00 0.00 C ATOM 741 C ARG A2105 19.996 -11.310 -1.803 1.00 0.00 C ATOM 742 O ARG A2105 20.991 -11.992 -1.545 1.00 0.00 O ATOM 743 CB ARG A2105 19.183 -11.516 -4.230 1.00 0.00 C ATOM 744 CG ARG A2105 20.388 -12.238 -4.855 1.00 0.00 C ATOM 745 CD ARG A2105 21.697 -11.442 -4.766 1.00 0.00 C ATOM 746 NE ARG A2105 22.839 -12.246 -5.234 1.00 0.00 N ATOM 747 CZ ARG A2105 23.532 -13.124 -4.537 1.00 0.00 C ATOM 748 NH1 ARG A2105 23.281 -13.389 -3.283 1.00 0.00 N ATOM 749 NH2 ARG A2105 24.491 -13.770 -5.125 1.00 0.00 N ATOM 0 H ARG A2105 17.112 -10.901 -3.137 1.00 0.00 H new ATOM 0 HA ARG A2105 19.011 -12.950 -2.618 1.00 0.00 H new ATOM 0 HB2 ARG A2105 18.291 -11.756 -4.808 1.00 0.00 H new ATOM 0 HB3 ARG A2105 19.336 -10.440 -4.312 1.00 0.00 H new ATOM 0 HG2 ARG A2105 20.523 -13.199 -4.358 1.00 0.00 H new ATOM 0 HG3 ARG A2105 20.171 -12.448 -5.902 1.00 0.00 H new ATOM 0 HD2 ARG A2105 21.616 -10.535 -5.366 1.00 0.00 H new ATOM 0 HD3 ARG A2105 21.867 -11.129 -3.736 1.00 0.00 H new ATOM 0 HE ARG A2105 23.125 -12.108 -6.203 1.00 0.00 H new ATOM 0 HH11 ARG A2105 22.521 -12.908 -2.802 1.00 0.00 H new ATOM 0 HH12 ARG A2105 23.845 -14.077 -2.784 1.00 0.00 H new ATOM 0 HH21 ARG A2105 24.696 -13.594 -6.108 1.00 0.00 H new ATOM 0 HH22 ARG A2105 25.040 -14.454 -4.604 1.00 0.00 H new ATOM 763 N THR A2106 19.796 -10.102 -1.265 1.00 0.00 N ATOM 764 CA THR A2106 20.713 -9.447 -0.310 1.00 0.00 C ATOM 765 C THR A2106 20.920 -10.266 0.975 1.00 0.00 C ATOM 766 O THR A2106 22.022 -10.284 1.526 1.00 0.00 O ATOM 767 CB THR A2106 20.272 -8.003 -0.006 1.00 0.00 C ATOM 768 OG1 THR A2106 21.324 -7.307 0.625 1.00 0.00 O ATOM 769 CG2 THR A2106 19.040 -7.888 0.893 1.00 0.00 C ATOM 0 H THR A2106 18.976 -9.536 -1.482 1.00 0.00 H new ATOM 0 HA THR A2106 21.687 -9.399 -0.797 1.00 0.00 H new ATOM 0 HB THR A2106 20.010 -7.577 -0.974 1.00 0.00 H new ATOM 0 HG1 THR A2106 21.041 -6.388 0.816 1.00 0.00 H new ATOM 0 HG21 THR A2106 18.803 -6.836 1.053 1.00 0.00 H new ATOM 0 HG22 THR A2106 18.194 -8.382 0.416 1.00 0.00 H new ATOM 0 HG23 THR A2106 19.244 -8.364 1.852 1.00 0.00 H new ATOM 777 N ALA A2107 19.907 -11.029 1.412 1.00 0.00 N ATOM 778 CA ALA A2107 19.979 -11.920 2.579 1.00 0.00 C ATOM 779 C ALA A2107 21.007 -13.069 2.427 1.00 0.00 C ATOM 780 O ALA A2107 21.357 -13.722 3.415 1.00 0.00 O ATOM 781 CB ALA A2107 18.572 -12.462 2.863 1.00 0.00 C ATOM 0 H ALA A2107 18.996 -11.044 0.954 1.00 0.00 H new ATOM 0 HA ALA A2107 20.341 -11.335 3.425 1.00 0.00 H new ATOM 0 HB1 ALA A2107 18.605 -13.126 3.727 1.00 0.00 H new ATOM 0 HB2 ALA A2107 17.897 -11.631 3.070 1.00 0.00 H new ATOM 0 HB3 ALA A2107 18.213 -13.014 1.995 1.00 0.00 H new ATOM 787 N LYS A2108 21.499 -13.309 1.200 1.00 0.00 N ATOM 788 CA LYS A2108 22.490 -14.339 0.837 1.00 0.00 C ATOM 789 C LYS A2108 23.716 -13.752 0.113 1.00 0.00 C ATOM 790 O LYS A2108 24.583 -14.490 -0.349 1.00 0.00 O ATOM 791 CB LYS A2108 21.756 -15.403 -0.010 1.00 0.00 C ATOM 792 CG LYS A2108 22.398 -16.802 -0.047 1.00 0.00 C ATOM 793 CD LYS A2108 22.345 -17.524 1.312 1.00 0.00 C ATOM 794 CE LYS A2108 22.858 -18.969 1.230 1.00 0.00 C ATOM 795 NZ LYS A2108 24.330 -19.041 1.025 1.00 0.00 N ATOM 0 H LYS A2108 21.202 -12.762 0.392 1.00 0.00 H new ATOM 0 HA LYS A2108 22.900 -14.795 1.738 1.00 0.00 H new ATOM 0 HB2 LYS A2108 20.739 -15.502 0.370 1.00 0.00 H new ATOM 0 HB3 LYS A2108 21.679 -15.034 -1.033 1.00 0.00 H new ATOM 0 HG2 LYS A2108 21.889 -17.410 -0.795 1.00 0.00 H new ATOM 0 HG3 LYS A2108 23.437 -16.711 -0.364 1.00 0.00 H new ATOM 0 HD2 LYS A2108 22.941 -16.971 2.037 1.00 0.00 H new ATOM 0 HD3 LYS A2108 21.319 -17.526 1.679 1.00 0.00 H new ATOM 0 HE2 LYS A2108 22.596 -19.497 2.147 1.00 0.00 H new ATOM 0 HE3 LYS A2108 22.355 -19.484 0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 24.625 -20.037 0.977 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 24.581 -18.562 0.137 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 24.814 -18.574 1.818 1.00 0.00 H new ATOM 1019 N THR B 18 10.895 -23.194 -12.677 1.00 0.00 N ATOM 1020 CA THR B 18 12.209 -22.552 -12.893 1.00 0.00 C ATOM 1021 C THR B 18 12.214 -21.114 -12.354 1.00 0.00 C ATOM 1022 O THR B 18 11.423 -20.784 -11.468 1.00 0.00 O ATOM 1023 CB THR B 18 12.625 -22.646 -14.376 1.00 0.00 C ATOM 1024 OG1 THR B 18 11.743 -21.952 -15.226 1.00 0.00 O ATOM 1025 CG2 THR B 18 12.719 -24.094 -14.848 1.00 0.00 C ATOM 0 HA THR B 18 12.965 -23.093 -12.324 1.00 0.00 H new ATOM 0 HB THR B 18 13.609 -22.180 -14.433 1.00 0.00 H new ATOM 0 HG1 THR B 18 10.850 -21.930 -14.823 1.00 0.00 H new ATOM 0 HG21 THR B 18 13.014 -24.116 -15.897 1.00 0.00 H new ATOM 0 HG22 THR B 18 13.461 -24.624 -14.251 1.00 0.00 H new ATOM 0 HG23 THR B 18 11.749 -24.578 -14.734 1.00 0.00 H new ATOM 1033 N PHE B 19 13.091 -20.236 -12.862 1.00 0.00 N ATOM 1034 CA PHE B 19 13.164 -18.813 -12.500 1.00 0.00 C ATOM 1035 C PHE B 19 11.791 -18.109 -12.493 1.00 0.00 C ATOM 1036 O PHE B 19 11.556 -17.217 -11.680 1.00 0.00 O ATOM 1037 CB PHE B 19 14.146 -18.088 -13.435 1.00 0.00 C ATOM 1038 CG PHE B 19 13.636 -17.737 -14.820 1.00 0.00 C ATOM 1039 CD1 PHE B 19 13.074 -18.717 -15.662 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.737 -16.407 -15.267 1.00 0.00 C ATOM 1041 CE1 PHE B 19 12.572 -18.355 -16.922 1.00 0.00 C ATOM 1042 CE2 PHE B 19 13.272 -16.054 -16.545 1.00 0.00 C ATOM 1043 CZ PHE B 19 12.679 -17.027 -17.369 1.00 0.00 C ATOM 0 H PHE B 19 13.789 -20.504 -13.556 1.00 0.00 H new ATOM 0 HA PHE B 19 13.527 -18.764 -11.474 1.00 0.00 H new ATOM 0 HB2 PHE B 19 14.464 -17.167 -12.946 1.00 0.00 H new ATOM 0 HB3 PHE B 19 15.033 -18.712 -13.547 1.00 0.00 H new ATOM 0 HD1 PHE B 19 13.029 -19.746 -15.338 1.00 0.00 H new ATOM 0 HD2 PHE B 19 14.173 -15.655 -14.626 1.00 0.00 H new ATOM 0 HE1 PHE B 19 12.103 -19.099 -17.549 1.00 0.00 H new ATOM 0 HE2 PHE B 19 13.370 -15.037 -16.894 1.00 0.00 H new ATOM 0 HZ PHE B 19 12.306 -16.754 -18.345 1.00 0.00 H new ATOM 1053 N SER B 20 10.865 -18.561 -13.346 1.00 0.00 N ATOM 1054 CA SER B 20 9.480 -18.094 -13.438 1.00 0.00 C ATOM 1055 C SER B 20 8.717 -18.205 -12.111 1.00 0.00 C ATOM 1056 O SER B 20 7.944 -17.312 -11.763 1.00 0.00 O ATOM 1057 CB SER B 20 8.761 -18.886 -14.539 1.00 0.00 C ATOM 1058 OG SER B 20 8.874 -20.283 -14.300 1.00 0.00 O ATOM 0 H SER B 20 11.072 -19.297 -14.022 1.00 0.00 H new ATOM 0 HA SER B 20 9.503 -17.032 -13.684 1.00 0.00 H new ATOM 0 HB2 SER B 20 7.710 -18.601 -14.573 1.00 0.00 H new ATOM 0 HB3 SER B 20 9.190 -18.641 -15.511 1.00 0.00 H new ATOM 0 HG SER B 20 8.409 -20.775 -15.009 1.00 0.00 H new ATOM 1064 N ASP B 21 8.967 -19.266 -11.341 1.00 0.00 N ATOM 1065 CA ASP B 21 8.383 -19.495 -10.018 1.00 0.00 C ATOM 1066 C ASP B 21 9.148 -18.748 -8.917 1.00 0.00 C ATOM 1067 O ASP B 21 8.547 -18.311 -7.936 1.00 0.00 O ATOM 1068 CB ASP B 21 8.355 -21.002 -9.742 1.00 0.00 C ATOM 1069 CG ASP B 21 7.580 -21.341 -8.458 1.00 0.00 C ATOM 1070 OD1 ASP B 21 6.349 -21.101 -8.412 1.00 0.00 O ATOM 1071 OD2 ASP B 21 8.193 -21.881 -7.506 1.00 0.00 O ATOM 0 H ASP B 21 9.600 -20.012 -11.630 1.00 0.00 H new ATOM 0 HA ASP B 21 7.367 -19.101 -10.011 1.00 0.00 H new ATOM 0 HB2 ASP B 21 7.898 -21.516 -10.587 1.00 0.00 H new ATOM 0 HB3 ASP B 21 9.376 -21.374 -9.657 1.00 0.00 H new ATOM 1076 N LEU B 22 10.457 -18.533 -9.094 1.00 0.00 N ATOM 1077 CA LEU B 22 11.272 -17.761 -8.147 1.00 0.00 C ATOM 1078 C LEU B 22 10.764 -16.318 -8.024 1.00 0.00 C ATOM 1079 O LEU B 22 10.763 -15.790 -6.911 1.00 0.00 O ATOM 1080 CB LEU B 22 12.773 -17.801 -8.502 1.00 0.00 C ATOM 1081 CG LEU B 22 13.423 -19.200 -8.547 1.00 0.00 C ATOM 1082 CD1 LEU B 22 14.927 -19.070 -8.813 1.00 0.00 C ATOM 1083 CD2 LEU B 22 13.249 -19.979 -7.242 1.00 0.00 C ATOM 0 H LEU B 22 10.980 -18.888 -9.895 1.00 0.00 H new ATOM 0 HA LEU B 22 11.165 -18.238 -7.173 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.908 -17.328 -9.475 1.00 0.00 H new ATOM 0 HB3 LEU B 22 13.314 -17.195 -7.775 1.00 0.00 H new ATOM 0 HG LEU B 22 12.920 -19.744 -9.346 1.00 0.00 H new ATOM 0 HD11 LEU B 22 15.378 -20.062 -8.843 1.00 0.00 H new ATOM 0 HD12 LEU B 22 15.086 -18.570 -9.768 1.00 0.00 H new ATOM 0 HD13 LEU B 22 15.388 -18.486 -8.017 1.00 0.00 H new ATOM 0 HD21 LEU B 22 13.727 -20.954 -7.334 1.00 0.00 H new ATOM 0 HD22 LEU B 22 13.709 -19.425 -6.424 1.00 0.00 H new ATOM 0 HD23 LEU B 22 12.187 -20.113 -7.037 1.00 0.00 H new ATOM 1095 N TRP B 23 10.268 -15.694 -9.107 1.00 0.00 N ATOM 1096 CA TRP B 23 9.687 -14.340 -9.024 1.00 0.00 C ATOM 1097 C TRP B 23 8.467 -14.280 -8.084 1.00 0.00 C ATOM 1098 O TRP B 23 8.234 -13.253 -7.446 1.00 0.00 O ATOM 1099 CB TRP B 23 9.281 -13.804 -10.406 1.00 0.00 C ATOM 1100 CG TRP B 23 10.350 -13.754 -11.458 1.00 0.00 C ATOM 1101 CD1 TRP B 23 10.364 -14.523 -12.565 1.00 0.00 C ATOM 1102 CD2 TRP B 23 11.534 -12.899 -11.559 1.00 0.00 C ATOM 1103 NE1 TRP B 23 11.505 -14.275 -13.302 1.00 0.00 N ATOM 1104 CE2 TRP B 23 12.267 -13.281 -12.727 1.00 0.00 C ATOM 1105 CE3 TRP B 23 12.060 -11.832 -10.799 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 13.479 -12.676 -13.089 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 13.274 -11.211 -11.155 1.00 0.00 C ATOM 1108 CH2 TRP B 23 13.989 -11.640 -12.288 1.00 0.00 C ATOM 0 H TRP B 23 10.257 -16.100 -10.043 1.00 0.00 H new ATOM 0 HA TRP B 23 10.475 -13.709 -8.613 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.464 -14.420 -10.782 1.00 0.00 H new ATOM 0 HB3 TRP B 23 8.886 -12.796 -10.276 1.00 0.00 H new ATOM 0 HD1 TRP B 23 9.594 -15.231 -12.836 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.752 -14.765 -14.162 1.00 0.00 H new ATOM 0 HE3 TRP B 23 11.522 -11.485 -9.929 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 14.012 -13.001 -13.970 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 13.658 -10.400 -10.554 1.00 0.00 H new ATOM 0 HH2 TRP B 23 14.929 -11.173 -12.542 1.00 0.00 H new ATOM 1119 N LYS B 24 7.702 -15.376 -7.967 1.00 0.00 N ATOM 1120 CA LYS B 24 6.504 -15.485 -7.110 1.00 0.00 C ATOM 1121 C LYS B 24 6.835 -15.624 -5.615 1.00 0.00 C ATOM 1122 O LYS B 24 6.000 -15.290 -4.774 1.00 0.00 O ATOM 1123 CB LYS B 24 5.618 -16.660 -7.573 1.00 0.00 C ATOM 1124 CG LYS B 24 5.220 -16.573 -9.059 1.00 0.00 C ATOM 1125 CD LYS B 24 4.363 -17.762 -9.528 1.00 0.00 C ATOM 1126 CE LYS B 24 2.993 -17.883 -8.842 1.00 0.00 C ATOM 1127 NZ LYS B 24 2.086 -16.749 -9.171 1.00 0.00 N ATOM 0 H LYS B 24 7.902 -16.236 -8.478 1.00 0.00 H new ATOM 0 HA LYS B 24 5.959 -14.547 -7.221 1.00 0.00 H new ATOM 0 HB2 LYS B 24 6.148 -17.596 -7.400 1.00 0.00 H new ATOM 0 HB3 LYS B 24 4.715 -16.688 -6.963 1.00 0.00 H new ATOM 0 HG2 LYS B 24 4.669 -15.648 -9.227 1.00 0.00 H new ATOM 0 HG3 LYS B 24 6.123 -16.522 -9.668 1.00 0.00 H new ATOM 0 HD2 LYS B 24 4.208 -17.678 -10.604 1.00 0.00 H new ATOM 0 HD3 LYS B 24 4.921 -18.683 -9.358 1.00 0.00 H new ATOM 0 HE2 LYS B 24 2.522 -18.819 -9.142 1.00 0.00 H new ATOM 0 HE3 LYS B 24 3.134 -17.929 -7.762 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 1.177 -16.879 -8.684 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 2.520 -15.856 -8.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 1.927 -16.719 -10.198 1.00 0.00 H new ATOM 1141 N LEU B 25 8.040 -16.099 -5.276 1.00 0.00 N ATOM 1142 CA LEU B 25 8.516 -16.268 -3.890 1.00 0.00 C ATOM 1143 C LEU B 25 9.100 -14.975 -3.277 1.00 0.00 C ATOM 1144 O LEU B 25 9.379 -14.926 -2.076 1.00 0.00 O ATOM 1145 CB LEU B 25 9.564 -17.398 -3.839 1.00 0.00 C ATOM 1146 CG LEU B 25 9.065 -18.789 -4.279 1.00 0.00 C ATOM 1147 CD1 LEU B 25 10.201 -19.805 -4.139 1.00 0.00 C ATOM 1148 CD2 LEU B 25 7.880 -19.284 -3.444 1.00 0.00 C ATOM 0 H LEU B 25 8.730 -16.384 -5.971 1.00 0.00 H new ATOM 0 HA LEU B 25 7.646 -16.527 -3.286 1.00 0.00 H new ATOM 0 HB2 LEU B 25 10.406 -17.117 -4.471 1.00 0.00 H new ATOM 0 HB3 LEU B 25 9.942 -17.473 -2.819 1.00 0.00 H new ATOM 0 HG LEU B 25 8.737 -18.694 -5.314 1.00 0.00 H new ATOM 0 HD11 LEU B 25 9.850 -20.789 -4.450 1.00 0.00 H new ATOM 0 HD12 LEU B 25 11.038 -19.503 -4.768 1.00 0.00 H new ATOM 0 HD13 LEU B 25 10.525 -19.847 -3.099 1.00 0.00 H new ATOM 0 HD21 LEU B 25 7.571 -20.267 -3.798 1.00 0.00 H new ATOM 0 HD22 LEU B 25 8.176 -19.352 -2.397 1.00 0.00 H new ATOM 0 HD23 LEU B 25 7.049 -18.585 -3.542 1.00 0.00 H new ATOM 1408 N LEU B 43 27.349 -3.919 -4.839 1.00 0.00 N ATOM 1409 CA LEU B 43 26.987 -5.337 -4.993 1.00 0.00 C ATOM 1410 C LEU B 43 26.231 -5.591 -6.317 1.00 0.00 C ATOM 1411 O LEU B 43 25.148 -6.180 -6.350 1.00 0.00 O ATOM 1412 CB LEU B 43 26.233 -5.833 -3.737 1.00 0.00 C ATOM 1413 CG LEU B 43 25.073 -4.934 -3.269 1.00 0.00 C ATOM 1414 CD1 LEU B 43 23.826 -5.753 -2.932 1.00 0.00 C ATOM 1415 CD2 LEU B 43 25.451 -4.126 -2.023 1.00 0.00 C ATOM 0 HA LEU B 43 27.897 -5.933 -5.068 1.00 0.00 H new ATOM 0 HB2 LEU B 43 25.840 -6.830 -3.939 1.00 0.00 H new ATOM 0 HB3 LEU B 43 26.947 -5.932 -2.920 1.00 0.00 H new ATOM 0 HG LEU B 43 24.863 -4.260 -4.100 1.00 0.00 H new ATOM 0 HD11 LEU B 43 23.029 -5.085 -2.606 1.00 0.00 H new ATOM 0 HD12 LEU B 43 23.501 -6.301 -3.816 1.00 0.00 H new ATOM 0 HD13 LEU B 43 24.058 -6.458 -2.133 1.00 0.00 H new ATOM 0 HD21 LEU B 43 24.608 -3.504 -1.723 1.00 0.00 H new ATOM 0 HD22 LEU B 43 25.706 -4.807 -1.211 1.00 0.00 H new ATOM 0 HD23 LEU B 43 26.308 -3.491 -2.247 1.00 0.00 H new ATOM 1427 N MET B 44 26.800 -5.115 -7.429 1.00 0.00 N ATOM 1428 CA MET B 44 26.236 -5.285 -8.775 1.00 0.00 C ATOM 1429 C MET B 44 26.287 -6.757 -9.236 1.00 0.00 C ATOM 1430 O MET B 44 27.283 -7.447 -9.013 1.00 0.00 O ATOM 1431 CB MET B 44 27.000 -4.374 -9.755 1.00 0.00 C ATOM 1432 CG MET B 44 26.229 -4.094 -11.053 1.00 0.00 C ATOM 1433 SD MET B 44 25.219 -2.577 -11.081 1.00 0.00 S ATOM 1434 CE MET B 44 24.102 -2.812 -9.671 1.00 0.00 C ATOM 0 H MET B 44 27.677 -4.594 -7.421 1.00 0.00 H new ATOM 0 HA MET B 44 25.184 -5.001 -8.754 1.00 0.00 H new ATOM 0 HB2 MET B 44 27.223 -3.428 -9.262 1.00 0.00 H new ATOM 0 HB3 MET B 44 27.955 -4.838 -10.001 1.00 0.00 H new ATOM 0 HG2 MET B 44 26.946 -4.043 -11.873 1.00 0.00 H new ATOM 0 HG3 MET B 44 25.576 -4.944 -11.253 1.00 0.00 H new ATOM 0 HE1 MET B 44 23.369 -2.005 -9.649 1.00 0.00 H new ATOM 0 HE2 MET B 44 23.587 -3.768 -9.770 1.00 0.00 H new ATOM 0 HE3 MET B 44 24.678 -2.804 -8.745 1.00 0.00 H new ATOM 1444 N LEU B 45 25.214 -7.234 -9.883 1.00 0.00 N ATOM 1445 CA LEU B 45 25.083 -8.610 -10.385 1.00 0.00 C ATOM 1446 C LEU B 45 26.155 -8.974 -11.432 1.00 0.00 C ATOM 1447 O LEU B 45 26.678 -8.113 -12.145 1.00 0.00 O ATOM 1448 CB LEU B 45 23.677 -8.836 -10.989 1.00 0.00 C ATOM 1449 CG LEU B 45 22.450 -8.820 -10.053 1.00 0.00 C ATOM 1450 CD1 LEU B 45 22.578 -9.782 -8.872 1.00 0.00 C ATOM 1451 CD2 LEU B 45 22.108 -7.439 -9.502 1.00 0.00 C ATOM 0 H LEU B 45 24.393 -6.660 -10.077 1.00 0.00 H new ATOM 0 HA LEU B 45 25.230 -9.264 -9.525 1.00 0.00 H new ATOM 0 HB2 LEU B 45 23.520 -8.073 -11.751 1.00 0.00 H new ATOM 0 HB3 LEU B 45 23.689 -9.799 -11.500 1.00 0.00 H new ATOM 0 HG LEU B 45 21.641 -9.148 -10.705 1.00 0.00 H new ATOM 0 HD11 LEU B 45 21.682 -9.721 -8.254 1.00 0.00 H new ATOM 0 HD12 LEU B 45 22.694 -10.800 -9.243 1.00 0.00 H new ATOM 0 HD13 LEU B 45 23.449 -9.512 -8.275 1.00 0.00 H new ATOM 0 HD21 LEU B 45 21.235 -7.512 -8.854 1.00 0.00 H new ATOM 0 HD22 LEU B 45 22.953 -7.056 -8.930 1.00 0.00 H new ATOM 0 HD23 LEU B 45 21.891 -6.761 -10.328 1.00 0.00 H new ATOM 1463 N SER B 46 26.433 -10.271 -11.546 1.00 0.00 N ATOM 1464 CA SER B 46 27.407 -10.897 -12.458 1.00 0.00 C ATOM 1465 C SER B 46 26.808 -12.152 -13.125 1.00 0.00 C ATOM 1466 O SER B 46 25.766 -12.634 -12.671 1.00 0.00 O ATOM 1467 CB SER B 46 28.649 -11.272 -11.629 1.00 0.00 C ATOM 1468 OG SER B 46 29.485 -10.138 -11.465 1.00 0.00 O ATOM 0 H SER B 46 25.956 -10.964 -10.969 1.00 0.00 H new ATOM 0 HA SER B 46 27.673 -10.202 -13.254 1.00 0.00 H new ATOM 0 HB2 SER B 46 28.344 -11.653 -10.654 1.00 0.00 H new ATOM 0 HB3 SER B 46 29.200 -12.071 -12.125 1.00 0.00 H new ATOM 0 HG SER B 46 30.272 -10.385 -10.935 1.00 0.00 H new ATOM 1474 N PRO B 47 27.428 -12.729 -14.180 1.00 0.00 N ATOM 1475 CA PRO B 47 26.914 -13.940 -14.836 1.00 0.00 C ATOM 1476 C PRO B 47 26.697 -15.124 -13.878 1.00 0.00 C ATOM 1477 O PRO B 47 25.806 -15.937 -14.117 1.00 0.00 O ATOM 1478 CB PRO B 47 27.879 -14.254 -15.985 1.00 0.00 C ATOM 1479 CG PRO B 47 29.160 -13.515 -15.604 1.00 0.00 C ATOM 1480 CD PRO B 47 28.647 -12.290 -14.850 1.00 0.00 C ATOM 0 HA PRO B 47 25.910 -13.759 -15.219 1.00 0.00 H new ATOM 0 HB2 PRO B 47 28.050 -15.326 -16.081 1.00 0.00 H new ATOM 0 HB3 PRO B 47 27.487 -13.907 -16.941 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.808 -14.129 -14.979 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.739 -13.233 -16.484 1.00 0.00 H new ATOM 0 HD2 PRO B 47 29.384 -11.935 -14.130 1.00 0.00 H new ATOM 0 HD3 PRO B 47 28.444 -11.465 -15.533 1.00 0.00 H new ATOM 1488 N ASP B 48 27.437 -15.188 -12.765 1.00 0.00 N ATOM 1489 CA ASP B 48 27.267 -16.197 -11.710 1.00 0.00 C ATOM 1490 C ASP B 48 25.856 -16.170 -11.076 1.00 0.00 C ATOM 1491 O ASP B 48 25.308 -17.212 -10.714 1.00 0.00 O ATOM 1492 CB ASP B 48 28.336 -15.952 -10.638 1.00 0.00 C ATOM 1493 CG ASP B 48 28.334 -17.044 -9.554 1.00 0.00 C ATOM 1494 OD1 ASP B 48 28.756 -18.188 -9.847 1.00 0.00 O ATOM 1495 OD2 ASP B 48 27.948 -16.751 -8.398 1.00 0.00 O ATOM 0 H ASP B 48 28.187 -14.526 -12.567 1.00 0.00 H new ATOM 0 HA ASP B 48 27.381 -17.185 -12.157 1.00 0.00 H new ATOM 0 HB2 ASP B 48 29.318 -15.912 -11.109 1.00 0.00 H new ATOM 0 HB3 ASP B 48 28.166 -14.981 -10.173 1.00 0.00 H new ATOM 1500 N ASP B 49 25.241 -14.986 -10.976 1.00 0.00 N ATOM 1501 CA ASP B 49 23.876 -14.804 -10.472 1.00 0.00 C ATOM 1502 C ASP B 49 22.830 -15.186 -11.536 1.00 0.00 C ATOM 1503 O ASP B 49 21.774 -15.732 -11.211 1.00 0.00 O ATOM 1504 CB ASP B 49 23.641 -13.339 -10.075 1.00 0.00 C ATOM 1505 CG ASP B 49 24.622 -12.829 -9.009 1.00 0.00 C ATOM 1506 OD1 ASP B 49 24.393 -13.105 -7.806 1.00 0.00 O ATOM 1507 OD2 ASP B 49 25.586 -12.120 -9.379 1.00 0.00 O ATOM 0 H ASP B 49 25.688 -14.110 -11.249 1.00 0.00 H new ATOM 0 HA ASP B 49 23.766 -15.454 -9.604 1.00 0.00 H new ATOM 0 HB2 ASP B 49 23.724 -12.712 -10.963 1.00 0.00 H new ATOM 0 HB3 ASP B 49 22.623 -13.231 -9.702 1.00 0.00 H new ATOM 1512 N ILE B 50 23.127 -14.902 -12.809 1.00 0.00 N ATOM 1513 CA ILE B 50 22.252 -15.161 -13.963 1.00 0.00 C ATOM 1514 C ILE B 50 22.197 -16.665 -14.293 1.00 0.00 C ATOM 1515 O ILE B 50 21.140 -17.192 -14.638 1.00 0.00 O ATOM 1516 CB ILE B 50 22.701 -14.312 -15.184 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.865 -12.806 -14.835 1.00 0.00 C ATOM 1518 CG2 ILE B 50 21.670 -14.438 -16.323 1.00 0.00 C ATOM 1519 CD1 ILE B 50 23.570 -11.960 -15.908 1.00 0.00 C ATOM 0 H ILE B 50 24.012 -14.471 -13.076 1.00 0.00 H new ATOM 0 HA ILE B 50 21.237 -14.858 -13.705 1.00 0.00 H new ATOM 0 HB ILE B 50 23.672 -14.700 -15.493 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.878 -12.382 -14.651 1.00 0.00 H new ATOM 0 HG13 ILE B 50 23.425 -12.724 -13.904 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.994 -13.839 -17.174 1.00 0.00 H new ATOM 0 HG22 ILE B 50 21.587 -15.482 -16.624 1.00 0.00 H new ATOM 0 HG23 ILE B 50 20.700 -14.082 -15.977 1.00 0.00 H new ATOM 0 HD11 ILE B 50 23.636 -10.926 -15.571 1.00 0.00 H new ATOM 0 HD12 ILE B 50 24.573 -12.350 -16.078 1.00 0.00 H new ATOM 0 HD13 ILE B 50 23.002 -12.003 -16.837 1.00 0.00 H new ATOM 1531 N GLU B 51 23.307 -17.396 -14.156 1.00 0.00 N ATOM 1532 CA GLU B 51 23.345 -18.851 -14.382 1.00 0.00 C ATOM 1533 C GLU B 51 22.718 -19.666 -13.227 1.00 0.00 C ATOM 1534 O GLU B 51 22.596 -20.888 -13.320 1.00 0.00 O ATOM 1535 CB GLU B 51 24.779 -19.307 -14.710 1.00 0.00 C ATOM 1536 CG GLU B 51 25.728 -19.377 -13.508 1.00 0.00 C ATOM 1537 CD GLU B 51 27.127 -19.856 -13.944 1.00 0.00 C ATOM 1538 OE1 GLU B 51 27.368 -21.088 -13.967 1.00 0.00 O ATOM 1539 OE2 GLU B 51 27.999 -19.013 -14.266 1.00 0.00 O ATOM 0 H GLU B 51 24.207 -16.999 -13.885 1.00 0.00 H new ATOM 0 HA GLU B 51 22.716 -19.058 -15.247 1.00 0.00 H new ATOM 0 HB2 GLU B 51 24.733 -20.292 -15.176 1.00 0.00 H new ATOM 0 HB3 GLU B 51 25.201 -18.625 -15.448 1.00 0.00 H new ATOM 0 HG2 GLU B 51 25.804 -18.395 -13.041 1.00 0.00 H new ATOM 0 HG3 GLU B 51 25.323 -20.056 -12.758 1.00 0.00 H new ATOM 1546 N GLN B 52 22.317 -19.015 -12.128 1.00 0.00 N ATOM 1547 CA GLN B 52 21.728 -19.671 -10.956 1.00 0.00 C ATOM 1548 C GLN B 52 20.220 -19.954 -11.085 1.00 0.00 C ATOM 1549 O GLN B 52 19.788 -21.057 -10.760 1.00 0.00 O ATOM 1550 CB GLN B 52 22.094 -18.848 -9.699 1.00 0.00 C ATOM 1551 CG GLN B 52 21.118 -18.886 -8.504 1.00 0.00 C ATOM 1552 CD GLN B 52 19.890 -17.968 -8.600 1.00 0.00 C ATOM 1553 OE1 GLN B 52 18.823 -18.285 -8.091 1.00 0.00 O ATOM 1554 NE2 GLN B 52 19.951 -16.818 -9.242 1.00 0.00 N ATOM 0 H GLN B 52 22.394 -18.003 -12.027 1.00 0.00 H new ATOM 0 HA GLN B 52 22.156 -20.670 -10.868 1.00 0.00 H new ATOM 0 HB2 GLN B 52 23.068 -19.189 -9.347 1.00 0.00 H new ATOM 0 HB3 GLN B 52 22.211 -17.808 -10.002 1.00 0.00 H new ATOM 0 HG2 GLN B 52 20.770 -19.911 -8.379 1.00 0.00 H new ATOM 0 HG3 GLN B 52 21.671 -18.625 -7.602 1.00 0.00 H new ATOM 0 HE21 GLN B 52 20.825 -16.523 -9.678 1.00 0.00 H new ATOM 0 HE22 GLN B 52 19.125 -16.223 -9.303 1.00 0.00 H new ATOM 1563 N TRP B 53 19.397 -18.994 -11.519 1.00 0.00 N ATOM 1564 CA TRP B 53 17.934 -19.173 -11.532 1.00 0.00 C ATOM 1565 C TRP B 53 17.371 -20.112 -12.614 1.00 0.00 C ATOM 1566 O TRP B 53 16.289 -20.671 -12.433 1.00 0.00 O ATOM 1567 CB TRP B 53 17.235 -17.803 -11.493 1.00 0.00 C ATOM 1568 CG TRP B 53 17.698 -16.705 -12.408 1.00 0.00 C ATOM 1569 CD1 TRP B 53 18.277 -16.844 -13.622 1.00 0.00 C ATOM 1570 CD2 TRP B 53 17.641 -15.262 -12.169 1.00 0.00 C ATOM 1571 NE1 TRP B 53 18.633 -15.607 -14.116 1.00 0.00 N ATOM 1572 CE2 TRP B 53 18.293 -14.594 -13.250 1.00 0.00 C ATOM 1573 CE3 TRP B 53 17.121 -14.449 -11.138 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 18.476 -13.204 -13.279 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 17.259 -13.047 -11.180 1.00 0.00 C ATOM 1576 CH2 TRP B 53 17.948 -12.425 -12.236 1.00 0.00 C ATOM 0 H TRP B 53 19.713 -18.088 -11.865 1.00 0.00 H new ATOM 0 HA TRP B 53 17.699 -19.721 -10.620 1.00 0.00 H new ATOM 0 HB2 TRP B 53 16.177 -17.971 -11.695 1.00 0.00 H new ATOM 0 HB3 TRP B 53 17.309 -17.429 -10.472 1.00 0.00 H new ATOM 0 HD1 TRP B 53 18.437 -17.784 -14.129 1.00 0.00 H new ATOM 0 HE1 TRP B 53 19.093 -15.461 -15.015 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.610 -14.908 -10.305 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 19.015 -12.739 -14.091 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 16.831 -12.444 -10.393 1.00 0.00 H new ATOM 0 HH2 TRP B 53 18.071 -11.352 -12.245 1.00 0.00 H new ATOM 1587 N PHE B 54 18.093 -20.331 -13.718 1.00 0.00 N ATOM 1588 CA PHE B 54 17.646 -21.218 -14.808 1.00 0.00 C ATOM 1589 C PHE B 54 18.020 -22.701 -14.595 1.00 0.00 C ATOM 1590 O PHE B 54 17.450 -23.585 -15.236 1.00 0.00 O ATOM 1591 CB PHE B 54 18.162 -20.691 -16.164 1.00 0.00 C ATOM 1592 CG PHE B 54 19.463 -21.308 -16.660 1.00 0.00 C ATOM 1593 CD1 PHE B 54 20.650 -21.161 -15.920 1.00 0.00 C ATOM 1594 CD2 PHE B 54 19.474 -22.076 -17.841 1.00 0.00 C ATOM 1595 CE1 PHE B 54 21.835 -21.786 -16.348 1.00 0.00 C ATOM 1596 CE2 PHE B 54 20.661 -22.694 -18.275 1.00 0.00 C ATOM 1597 CZ PHE B 54 21.842 -22.552 -17.527 1.00 0.00 C ATOM 0 H PHE B 54 19.003 -19.901 -13.885 1.00 0.00 H new ATOM 0 HA PHE B 54 16.556 -21.196 -14.806 1.00 0.00 H new ATOM 0 HB2 PHE B 54 17.391 -20.860 -16.916 1.00 0.00 H new ATOM 0 HB3 PHE B 54 18.299 -19.613 -16.085 1.00 0.00 H new ATOM 0 HD1 PHE B 54 20.652 -20.565 -15.019 1.00 0.00 H new ATOM 0 HD2 PHE B 54 18.567 -22.191 -18.416 1.00 0.00 H new ATOM 0 HE1 PHE B 54 22.741 -21.677 -15.770 1.00 0.00 H new ATOM 0 HE2 PHE B 54 20.665 -23.278 -19.184 1.00 0.00 H new ATOM 0 HZ PHE B 54 22.753 -23.030 -17.857 1.00 0.00 H new ATOM 1607 N THR B 55 18.969 -22.983 -13.692 1.00 0.00 N ATOM 1608 CA THR B 55 19.480 -24.340 -13.404 1.00 0.00 C ATOM 1609 C THR B 55 18.438 -25.298 -12.799 1.00 0.00 C ATOM 1610 O THR B 55 18.614 -26.518 -12.818 1.00 0.00 O ATOM 1611 CB THR B 55 20.745 -24.243 -12.527 1.00 0.00 C ATOM 1612 OG1 THR B 55 21.620 -25.311 -12.827 1.00 0.00 O ATOM 1613 CG2 THR B 55 20.480 -24.252 -11.020 1.00 0.00 C ATOM 0 H THR B 55 19.416 -22.261 -13.126 1.00 0.00 H new ATOM 0 HA THR B 55 19.733 -24.789 -14.364 1.00 0.00 H new ATOM 0 HB THR B 55 21.184 -23.275 -12.766 1.00 0.00 H new ATOM 0 HG1 THR B 55 22.422 -25.243 -12.268 1.00 0.00 H new ATOM 0 HG21 THR B 55 21.426 -24.180 -10.484 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.848 -23.404 -10.757 1.00 0.00 H new ATOM 0 HG23 THR B 55 19.976 -25.179 -10.745 1.00 0.00 H new