USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 559 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A2085 GLN : amide:sc= 0.746 K(o=2.3,f=0.75) USER MOD Set 1.2: A2086 GLN : amide:sc= 0.284 K(o=2.3,f=-0.5) USER MOD Set 1.3: A2089 ASN : amide:sc= 1.32 K(o=2.3,f=-0.5) USER MOD Set 2.1: A2064 SER OG : rot -120:sc= 0.218 USER MOD Set 2.2: A2066 SER OG : rot 180:sc= 0.222 USER MOD Single : A2069 GLN : amide:sc=-0.00616 X(o=-0.0062,f=-0.0062) USER MOD Single : A2074 THR OG1 : rot 78:sc= 1.06 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= 0.174 USER MOD Single : A2082 GLN : amide:sc= -0.315 X(o=-0.32,f=-0.32) USER MOD Single : A2083 GLN : amide:sc= 1.16 K(o=1.2,f=-0.42) USER MOD Single : A2084 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 83:sc= 1.2 USER MOD Single : A2094 ASN : amide:sc= 0.558 K(o=0.56,f=-1.1) USER MOD Single : A2096 GLN : amide:sc= -3.18 K(o=-3.2,f=-1.3) USER MOD Single : A2098 MET CE :methyl 174:sc=-0.00119 (180deg=-0.063) USER MOD Single : A2103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2106 THR OG1 : rot 180:sc= 0 USER MOD Single : A2108 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0306) USER MOD Single : B 18 THR OG1 : rot -32:sc= 0.0368 USER MOD Single : B 20 SER OG : rot 58:sc= 0.587 USER MOD Single : B 24 LYS NZ :NH3+ 172:sc= 1.25 (180deg=1.13) USER MOD Single : B 44 MET CE :methyl 148:sc= 0 (180deg=-0.112) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 52 GLN : amide:sc= 0.625 K(o=0.62,f=-0.32) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 5.546 -4.199 -16.145 1.00 0.00 N ATOM 65 CA ILE A2063 6.440 -5.326 -16.478 1.00 0.00 C ATOM 66 C ILE A2063 5.944 -6.077 -17.730 1.00 0.00 C ATOM 67 O ILE A2063 4.838 -5.816 -18.209 1.00 0.00 O ATOM 68 CB ILE A2063 6.683 -6.269 -15.271 1.00 0.00 C ATOM 69 CG1 ILE A2063 5.427 -6.836 -14.590 1.00 0.00 C ATOM 70 CG2 ILE A2063 7.489 -5.539 -14.183 1.00 0.00 C ATOM 71 CD1 ILE A2063 4.530 -7.708 -15.471 1.00 0.00 C ATOM 0 HA ILE A2063 7.416 -4.906 -16.721 1.00 0.00 H new ATOM 0 HB ILE A2063 7.215 -7.113 -15.711 1.00 0.00 H new ATOM 0 HG12 ILE A2063 5.738 -7.424 -13.727 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.834 -6.003 -14.212 1.00 0.00 H new ATOM 0 HG21 ILE A2063 7.654 -6.210 -13.340 1.00 0.00 H new ATOM 0 HG22 ILE A2063 8.450 -5.226 -14.591 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.935 -4.663 -13.846 1.00 0.00 H new ATOM 0 HD11 ILE A2063 3.675 -8.054 -14.890 1.00 0.00 H new ATOM 0 HD12 ILE A2063 4.178 -7.125 -16.322 1.00 0.00 H new ATOM 0 HD13 ILE A2063 5.097 -8.567 -15.829 1.00 0.00 H new ATOM 83 N SER A2064 6.736 -7.014 -18.268 1.00 0.00 N ATOM 84 CA SER A2064 6.351 -7.828 -19.435 1.00 0.00 C ATOM 85 C SER A2064 7.001 -9.222 -19.420 1.00 0.00 C ATOM 86 O SER A2064 8.191 -9.330 -19.111 1.00 0.00 O ATOM 87 CB SER A2064 6.763 -7.126 -20.733 1.00 0.00 C ATOM 88 OG SER A2064 6.307 -7.857 -21.858 1.00 0.00 O ATOM 0 H SER A2064 7.665 -7.232 -17.907 1.00 0.00 H new ATOM 0 HA SER A2064 5.269 -7.946 -19.383 1.00 0.00 H new ATOM 0 HB2 SER A2064 6.350 -6.118 -20.755 1.00 0.00 H new ATOM 0 HB3 SER A2064 7.848 -7.027 -20.771 1.00 0.00 H new ATOM 0 HG SER A2064 7.074 -8.128 -22.405 1.00 0.00 H new ATOM 94 N PRO A2065 6.270 -10.297 -19.786 1.00 0.00 N ATOM 95 CA PRO A2065 6.806 -11.661 -19.848 1.00 0.00 C ATOM 96 C PRO A2065 7.887 -11.852 -20.926 1.00 0.00 C ATOM 97 O PRO A2065 8.702 -12.769 -20.807 1.00 0.00 O ATOM 98 CB PRO A2065 5.591 -12.555 -20.129 1.00 0.00 C ATOM 99 CG PRO A2065 4.641 -11.626 -20.882 1.00 0.00 C ATOM 100 CD PRO A2065 4.864 -10.296 -20.177 1.00 0.00 C ATOM 0 HA PRO A2065 7.311 -11.909 -18.914 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.861 -13.425 -20.727 1.00 0.00 H new ATOM 0 HB3 PRO A2065 5.144 -12.928 -19.208 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.883 -11.570 -21.943 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.605 -11.957 -20.809 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.640 -9.458 -20.838 1.00 0.00 H new ATOM 0 HD3 PRO A2065 4.214 -10.198 -19.307 1.00 0.00 H new ATOM 108 N SER A2066 7.948 -11.004 -21.961 1.00 0.00 N ATOM 109 CA SER A2066 8.975 -11.105 -23.012 1.00 0.00 C ATOM 110 C SER A2066 10.393 -10.883 -22.471 1.00 0.00 C ATOM 111 O SER A2066 11.344 -11.520 -22.930 1.00 0.00 O ATOM 112 CB SER A2066 8.683 -10.131 -24.160 1.00 0.00 C ATOM 113 OG SER A2066 8.642 -8.792 -23.694 1.00 0.00 O ATOM 0 H SER A2066 7.293 -10.233 -22.095 1.00 0.00 H new ATOM 0 HA SER A2066 8.931 -12.125 -23.394 1.00 0.00 H new ATOM 0 HB2 SER A2066 9.450 -10.229 -24.928 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.731 -10.387 -24.625 1.00 0.00 H new ATOM 0 HG SER A2066 8.456 -8.190 -24.445 1.00 0.00 H new ATOM 119 N ALA A2067 10.541 -10.029 -21.451 1.00 0.00 N ATOM 120 CA ALA A2067 11.814 -9.756 -20.791 1.00 0.00 C ATOM 121 C ALA A2067 12.403 -11.006 -20.108 1.00 0.00 C ATOM 122 O ALA A2067 13.621 -11.179 -20.081 1.00 0.00 O ATOM 123 CB ALA A2067 11.597 -8.621 -19.788 1.00 0.00 C ATOM 0 H ALA A2067 9.762 -9.501 -21.057 1.00 0.00 H new ATOM 0 HA ALA A2067 12.547 -9.459 -21.541 1.00 0.00 H new ATOM 0 HB1 ALA A2067 12.536 -8.399 -19.281 1.00 0.00 H new ATOM 0 HB2 ALA A2067 11.249 -7.732 -20.314 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.851 -8.923 -19.053 1.00 0.00 H new ATOM 129 N LEU A2068 11.551 -11.900 -19.595 1.00 0.00 N ATOM 130 CA LEU A2068 11.959 -13.157 -18.956 1.00 0.00 C ATOM 131 C LEU A2068 12.563 -14.115 -20.002 1.00 0.00 C ATOM 132 O LEU A2068 13.547 -14.800 -19.727 1.00 0.00 O ATOM 133 CB LEU A2068 10.754 -13.801 -18.238 1.00 0.00 C ATOM 134 CG LEU A2068 10.275 -13.113 -16.942 1.00 0.00 C ATOM 135 CD1 LEU A2068 9.858 -11.649 -17.098 1.00 0.00 C ATOM 136 CD2 LEU A2068 9.076 -13.878 -16.383 1.00 0.00 C ATOM 0 H LEU A2068 10.540 -11.768 -19.612 1.00 0.00 H new ATOM 0 HA LEU A2068 12.726 -12.947 -18.210 1.00 0.00 H new ATOM 0 HB2 LEU A2068 9.918 -13.832 -18.937 1.00 0.00 H new ATOM 0 HB3 LEU A2068 11.010 -14.834 -18.001 1.00 0.00 H new ATOM 0 HG LEU A2068 11.138 -13.125 -16.276 1.00 0.00 H new ATOM 0 HD11 LEU A2068 9.538 -11.257 -16.133 1.00 0.00 H new ATOM 0 HD12 LEU A2068 10.704 -11.067 -17.464 1.00 0.00 H new ATOM 0 HD13 LEU A2068 9.035 -11.579 -17.809 1.00 0.00 H new ATOM 0 HD21 LEU A2068 8.732 -13.397 -15.467 1.00 0.00 H new ATOM 0 HD22 LEU A2068 8.270 -13.878 -17.117 1.00 0.00 H new ATOM 0 HD23 LEU A2068 9.369 -14.905 -16.166 1.00 0.00 H new ATOM 148 N GLN A2069 12.020 -14.124 -21.225 1.00 0.00 N ATOM 149 CA GLN A2069 12.556 -14.919 -22.339 1.00 0.00 C ATOM 150 C GLN A2069 13.887 -14.323 -22.840 1.00 0.00 C ATOM 151 O GLN A2069 14.848 -15.050 -23.100 1.00 0.00 O ATOM 152 CB GLN A2069 11.536 -15.001 -23.490 1.00 0.00 C ATOM 153 CG GLN A2069 10.122 -15.443 -23.071 1.00 0.00 C ATOM 154 CD GLN A2069 10.088 -16.760 -22.293 1.00 0.00 C ATOM 155 OE1 GLN A2069 10.703 -17.753 -22.656 1.00 0.00 O ATOM 156 NE2 GLN A2069 9.368 -16.820 -21.191 1.00 0.00 N ATOM 0 H GLN A2069 11.194 -13.579 -21.472 1.00 0.00 H new ATOM 0 HA GLN A2069 12.745 -15.929 -21.976 1.00 0.00 H new ATOM 0 HB2 GLN A2069 11.469 -14.023 -23.967 1.00 0.00 H new ATOM 0 HB3 GLN A2069 11.911 -15.697 -24.240 1.00 0.00 H new ATOM 0 HG2 GLN A2069 9.674 -14.660 -22.460 1.00 0.00 H new ATOM 0 HG3 GLN A2069 9.504 -15.544 -23.963 1.00 0.00 H new ATOM 0 HE21 GLN A2069 8.850 -16.000 -20.875 1.00 0.00 H new ATOM 0 HE22 GLN A2069 9.329 -17.686 -20.654 1.00 0.00 H new ATOM 165 N ASP A2070 13.963 -12.990 -22.936 1.00 0.00 N ATOM 166 CA ASP A2070 15.168 -12.250 -23.336 1.00 0.00 C ATOM 167 C ASP A2070 16.323 -12.457 -22.334 1.00 0.00 C ATOM 168 O ASP A2070 17.489 -12.529 -22.725 1.00 0.00 O ATOM 169 CB ASP A2070 14.797 -10.762 -23.488 1.00 0.00 C ATOM 170 CG ASP A2070 15.832 -9.925 -24.257 1.00 0.00 C ATOM 171 OD1 ASP A2070 16.250 -10.349 -25.361 1.00 0.00 O ATOM 172 OD2 ASP A2070 16.161 -8.801 -23.814 1.00 0.00 O ATOM 0 H ASP A2070 13.170 -12.381 -22.733 1.00 0.00 H new ATOM 0 HA ASP A2070 15.530 -12.630 -24.291 1.00 0.00 H new ATOM 0 HB2 ASP A2070 13.837 -10.690 -23.999 1.00 0.00 H new ATOM 0 HB3 ASP A2070 14.663 -10.330 -22.496 1.00 0.00 H new ATOM 177 N LEU A2071 16.005 -12.622 -21.043 1.00 0.00 N ATOM 178 CA LEU A2071 16.967 -12.935 -19.981 1.00 0.00 C ATOM 179 C LEU A2071 17.628 -14.293 -20.255 1.00 0.00 C ATOM 180 O LEU A2071 18.855 -14.387 -20.262 1.00 0.00 O ATOM 181 CB LEU A2071 16.229 -12.891 -18.628 1.00 0.00 C ATOM 182 CG LEU A2071 17.115 -12.914 -17.368 1.00 0.00 C ATOM 183 CD1 LEU A2071 16.243 -12.607 -16.148 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.783 -14.269 -17.121 1.00 0.00 C ATOM 0 H LEU A2071 15.048 -12.539 -20.701 1.00 0.00 H new ATOM 0 HA LEU A2071 17.772 -12.200 -19.952 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.618 -11.989 -18.600 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.547 -13.740 -18.582 1.00 0.00 H new ATOM 0 HG LEU A2071 17.899 -12.173 -17.523 1.00 0.00 H new ATOM 0 HD11 LEU A2071 16.858 -12.620 -15.248 1.00 0.00 H new ATOM 0 HD12 LEU A2071 15.790 -11.622 -16.263 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.459 -13.360 -16.062 1.00 0.00 H new ATOM 0 HD21 LEU A2071 18.392 -14.215 -16.219 1.00 0.00 H new ATOM 0 HD22 LEU A2071 17.017 -15.035 -16.997 1.00 0.00 H new ATOM 0 HD23 LEU A2071 18.416 -14.523 -17.971 1.00 0.00 H new ATOM 196 N LEU A2072 16.837 -15.336 -20.534 1.00 0.00 N ATOM 197 CA LEU A2072 17.367 -16.666 -20.850 1.00 0.00 C ATOM 198 C LEU A2072 18.269 -16.643 -22.095 1.00 0.00 C ATOM 199 O LEU A2072 19.363 -17.208 -22.056 1.00 0.00 O ATOM 200 CB LEU A2072 16.225 -17.686 -21.006 1.00 0.00 C ATOM 201 CG LEU A2072 15.433 -17.994 -19.719 1.00 0.00 C ATOM 202 CD1 LEU A2072 14.354 -19.027 -20.044 1.00 0.00 C ATOM 203 CD2 LEU A2072 16.309 -18.561 -18.597 1.00 0.00 C ATOM 0 H LEU A2072 15.819 -15.282 -20.547 1.00 0.00 H new ATOM 0 HA LEU A2072 17.990 -16.979 -20.012 1.00 0.00 H new ATOM 0 HB2 LEU A2072 15.530 -17.316 -21.760 1.00 0.00 H new ATOM 0 HB3 LEU A2072 16.642 -18.618 -21.387 1.00 0.00 H new ATOM 0 HG LEU A2072 15.011 -17.052 -19.369 1.00 0.00 H new ATOM 0 HD11 LEU A2072 13.785 -19.255 -19.143 1.00 0.00 H new ATOM 0 HD12 LEU A2072 13.684 -18.626 -20.804 1.00 0.00 H new ATOM 0 HD13 LEU A2072 14.823 -19.938 -20.417 1.00 0.00 H new ATOM 0 HD21 LEU A2072 15.694 -18.757 -17.719 1.00 0.00 H new ATOM 0 HD22 LEU A2072 16.771 -19.490 -18.931 1.00 0.00 H new ATOM 0 HD23 LEU A2072 17.086 -17.840 -18.342 1.00 0.00 H new ATOM 215 N ARG A2073 17.874 -15.961 -23.184 1.00 0.00 N ATOM 216 CA ARG A2073 18.746 -15.861 -24.375 1.00 0.00 C ATOM 217 C ARG A2073 20.030 -15.064 -24.089 1.00 0.00 C ATOM 218 O ARG A2073 21.083 -15.377 -24.645 1.00 0.00 O ATOM 219 CB ARG A2073 17.974 -15.418 -25.632 1.00 0.00 C ATOM 220 CG ARG A2073 17.878 -13.910 -25.872 1.00 0.00 C ATOM 221 CD ARG A2073 17.156 -13.632 -27.194 1.00 0.00 C ATOM 222 NE ARG A2073 16.844 -12.202 -27.303 1.00 0.00 N ATOM 223 CZ ARG A2073 16.633 -11.470 -28.375 1.00 0.00 C ATOM 224 NH1 ARG A2073 16.702 -11.941 -29.589 1.00 0.00 N ATOM 225 NH2 ARG A2073 16.339 -10.219 -28.197 1.00 0.00 N ATOM 0 H ARG A2073 16.979 -15.480 -23.268 1.00 0.00 H new ATOM 0 HA ARG A2073 19.094 -16.866 -24.613 1.00 0.00 H new ATOM 0 HB2 ARG A2073 18.447 -15.874 -26.502 1.00 0.00 H new ATOM 0 HB3 ARG A2073 16.963 -15.820 -25.572 1.00 0.00 H new ATOM 0 HG2 ARG A2073 17.342 -13.436 -25.049 1.00 0.00 H new ATOM 0 HG3 ARG A2073 18.876 -13.473 -25.895 1.00 0.00 H new ATOM 0 HD2 ARG A2073 17.781 -13.941 -28.032 1.00 0.00 H new ATOM 0 HD3 ARG A2073 16.239 -14.218 -27.247 1.00 0.00 H new ATOM 0 HE ARG A2073 16.782 -11.702 -26.416 1.00 0.00 H new ATOM 0 HH11 ARG A2073 16.929 -12.923 -29.743 1.00 0.00 H new ATOM 0 HH12 ARG A2073 16.529 -11.327 -30.385 1.00 0.00 H new ATOM 0 HH21 ARG A2073 16.279 -9.839 -27.252 1.00 0.00 H new ATOM 0 HH22 ARG A2073 16.168 -9.616 -29.002 1.00 0.00 H new ATOM 239 N THR A2074 19.969 -14.088 -23.176 1.00 0.00 N ATOM 240 CA THR A2074 21.138 -13.317 -22.714 1.00 0.00 C ATOM 241 C THR A2074 22.078 -14.213 -21.898 1.00 0.00 C ATOM 242 O THR A2074 23.284 -14.182 -22.132 1.00 0.00 O ATOM 243 CB THR A2074 20.715 -12.075 -21.907 1.00 0.00 C ATOM 244 OG1 THR A2074 19.956 -11.216 -22.731 1.00 0.00 O ATOM 245 CG2 THR A2074 21.896 -11.243 -21.403 1.00 0.00 C ATOM 0 H THR A2074 19.097 -13.805 -22.729 1.00 0.00 H new ATOM 0 HA THR A2074 21.676 -12.961 -23.593 1.00 0.00 H new ATOM 0 HB THR A2074 20.156 -12.455 -21.052 1.00 0.00 H new ATOM 0 HG1 THR A2074 19.045 -11.567 -22.818 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.524 -10.385 -20.843 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.522 -11.856 -20.754 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.485 -10.895 -22.252 1.00 0.00 H new ATOM 253 N LEU A2075 21.565 -15.056 -20.988 1.00 0.00 N ATOM 254 CA LEU A2075 22.362 -16.015 -20.197 1.00 0.00 C ATOM 255 C LEU A2075 23.177 -16.958 -21.103 1.00 0.00 C ATOM 256 O LEU A2075 24.350 -17.218 -20.836 1.00 0.00 O ATOM 257 CB LEU A2075 21.420 -16.810 -19.265 1.00 0.00 C ATOM 258 CG LEU A2075 22.082 -17.978 -18.499 1.00 0.00 C ATOM 259 CD1 LEU A2075 23.142 -17.497 -17.507 1.00 0.00 C ATOM 260 CD2 LEU A2075 21.024 -18.788 -17.750 1.00 0.00 C ATOM 0 H LEU A2075 20.568 -15.093 -20.776 1.00 0.00 H new ATOM 0 HA LEU A2075 23.081 -15.462 -19.593 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.986 -16.121 -18.540 1.00 0.00 H new ATOM 0 HB3 LEU A2075 20.597 -17.207 -19.860 1.00 0.00 H new ATOM 0 HG LEU A2075 22.576 -18.603 -19.243 1.00 0.00 H new ATOM 0 HD11 LEU A2075 23.577 -18.355 -16.995 1.00 0.00 H new ATOM 0 HD12 LEU A2075 23.924 -16.959 -18.043 1.00 0.00 H new ATOM 0 HD13 LEU A2075 22.681 -16.833 -16.776 1.00 0.00 H new ATOM 0 HD21 LEU A2075 21.504 -19.607 -17.215 1.00 0.00 H new ATOM 0 HD22 LEU A2075 20.508 -18.143 -17.039 1.00 0.00 H new ATOM 0 HD23 LEU A2075 20.304 -19.192 -18.462 1.00 0.00 H new ATOM 272 N LYS A2076 22.555 -17.457 -22.180 1.00 0.00 N ATOM 273 CA LYS A2076 23.173 -18.358 -23.172 1.00 0.00 C ATOM 274 C LYS A2076 24.372 -17.775 -23.946 1.00 0.00 C ATOM 275 O LYS A2076 25.147 -18.545 -24.518 1.00 0.00 O ATOM 276 CB LYS A2076 22.079 -18.845 -24.145 1.00 0.00 C ATOM 277 CG LYS A2076 21.497 -20.221 -23.790 1.00 0.00 C ATOM 278 CD LYS A2076 20.950 -20.359 -22.359 1.00 0.00 C ATOM 279 CE LYS A2076 20.186 -21.675 -22.151 1.00 0.00 C ATOM 280 NZ LYS A2076 21.050 -22.877 -22.315 1.00 0.00 N ATOM 0 H LYS A2076 21.581 -17.241 -22.394 1.00 0.00 H new ATOM 0 HA LYS A2076 23.603 -19.185 -22.606 1.00 0.00 H new ATOM 0 HB2 LYS A2076 21.271 -18.114 -24.163 1.00 0.00 H new ATOM 0 HB3 LYS A2076 22.494 -18.886 -25.152 1.00 0.00 H new ATOM 0 HG2 LYS A2076 20.694 -20.448 -24.491 1.00 0.00 H new ATOM 0 HG3 LYS A2076 22.272 -20.973 -23.938 1.00 0.00 H new ATOM 0 HD2 LYS A2076 21.776 -20.305 -21.650 1.00 0.00 H new ATOM 0 HD3 LYS A2076 20.289 -19.520 -22.143 1.00 0.00 H new ATOM 0 HE2 LYS A2076 19.748 -21.682 -21.153 1.00 0.00 H new ATOM 0 HE3 LYS A2076 19.361 -21.727 -22.861 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 20.483 -23.735 -22.164 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 21.448 -22.890 -23.276 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 21.823 -22.846 -21.620 1.00 0.00 H new ATOM 294 N SER A2077 24.547 -16.453 -23.974 1.00 0.00 N ATOM 295 CA SER A2077 25.672 -15.783 -24.656 1.00 0.00 C ATOM 296 C SER A2077 27.020 -15.986 -23.925 1.00 0.00 C ATOM 297 O SER A2077 27.030 -16.250 -22.717 1.00 0.00 O ATOM 298 CB SER A2077 25.384 -14.278 -24.751 1.00 0.00 C ATOM 299 OG SER A2077 24.290 -14.031 -25.621 1.00 0.00 O ATOM 0 H SER A2077 23.906 -15.802 -23.519 1.00 0.00 H new ATOM 0 HA SER A2077 25.761 -16.231 -25.646 1.00 0.00 H new ATOM 0 HB2 SER A2077 25.164 -13.881 -23.760 1.00 0.00 H new ATOM 0 HB3 SER A2077 26.269 -13.755 -25.114 1.00 0.00 H new ATOM 0 HG SER A2077 24.120 -13.067 -25.668 1.00 0.00 H new ATOM 305 N PRO A2078 28.175 -15.840 -24.608 1.00 0.00 N ATOM 306 CA PRO A2078 29.487 -15.917 -23.960 1.00 0.00 C ATOM 307 C PRO A2078 29.738 -14.671 -23.085 1.00 0.00 C ATOM 308 O PRO A2078 29.148 -13.608 -23.309 1.00 0.00 O ATOM 309 CB PRO A2078 30.495 -16.018 -25.107 1.00 0.00 C ATOM 310 CG PRO A2078 29.815 -15.257 -26.244 1.00 0.00 C ATOM 311 CD PRO A2078 28.330 -15.559 -26.032 1.00 0.00 C ATOM 0 HA PRO A2078 29.567 -16.771 -23.288 1.00 0.00 H new ATOM 0 HB2 PRO A2078 31.453 -15.571 -24.841 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.692 -17.055 -25.379 1.00 0.00 H new ATOM 0 HG2 PRO A2078 30.019 -14.188 -26.191 1.00 0.00 H new ATOM 0 HG3 PRO A2078 30.160 -15.599 -27.220 1.00 0.00 H new ATOM 0 HD2 PRO A2078 27.713 -14.712 -26.332 1.00 0.00 H new ATOM 0 HD3 PRO A2078 28.015 -16.411 -26.634 1.00 0.00 H new ATOM 319 N SER A2079 30.635 -14.787 -22.097 1.00 0.00 N ATOM 320 CA SER A2079 30.992 -13.680 -21.192 1.00 0.00 C ATOM 321 C SER A2079 31.547 -12.474 -21.961 1.00 0.00 C ATOM 322 O SER A2079 32.525 -12.589 -22.708 1.00 0.00 O ATOM 323 CB SER A2079 31.990 -14.144 -20.133 1.00 0.00 C ATOM 324 OG SER A2079 32.190 -13.119 -19.173 1.00 0.00 O ATOM 0 H SER A2079 31.137 -15.653 -21.900 1.00 0.00 H new ATOM 0 HA SER A2079 30.077 -13.362 -20.692 1.00 0.00 H new ATOM 0 HB2 SER A2079 31.621 -15.045 -19.643 1.00 0.00 H new ATOM 0 HB3 SER A2079 32.938 -14.403 -20.604 1.00 0.00 H new ATOM 0 HG SER A2079 32.830 -13.425 -18.496 1.00 0.00 H new ATOM 330 N SER A2080 30.902 -11.319 -21.793 1.00 0.00 N ATOM 331 CA SER A2080 31.234 -10.056 -22.472 1.00 0.00 C ATOM 332 C SER A2080 30.603 -8.839 -21.775 1.00 0.00 C ATOM 333 O SER A2080 29.591 -8.986 -21.077 1.00 0.00 O ATOM 334 CB SER A2080 30.708 -10.113 -23.919 1.00 0.00 C ATOM 335 OG SER A2080 29.294 -10.187 -23.942 1.00 0.00 O ATOM 0 H SER A2080 30.107 -11.229 -21.160 1.00 0.00 H new ATOM 0 HA SER A2080 32.318 -9.941 -22.445 1.00 0.00 H new ATOM 0 HB2 SER A2080 31.038 -9.229 -24.465 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.129 -10.979 -24.429 1.00 0.00 H new ATOM 0 HG SER A2080 28.983 -10.220 -24.871 1.00 0.00 H new ATOM 341 N PRO A2081 31.132 -7.614 -21.984 1.00 0.00 N ATOM 342 CA PRO A2081 30.520 -6.403 -21.435 1.00 0.00 C ATOM 343 C PRO A2081 29.110 -6.165 -22.008 1.00 0.00 C ATOM 344 O PRO A2081 28.253 -5.615 -21.316 1.00 0.00 O ATOM 345 CB PRO A2081 31.498 -5.262 -21.740 1.00 0.00 C ATOM 346 CG PRO A2081 32.305 -5.768 -22.934 1.00 0.00 C ATOM 347 CD PRO A2081 32.324 -7.284 -22.757 1.00 0.00 C ATOM 0 HA PRO A2081 30.360 -6.484 -20.360 1.00 0.00 H new ATOM 0 HB2 PRO A2081 30.970 -4.339 -21.979 1.00 0.00 H new ATOM 0 HB3 PRO A2081 32.141 -5.050 -20.886 1.00 0.00 H new ATOM 0 HG2 PRO A2081 31.841 -5.483 -23.878 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.314 -5.355 -22.937 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.315 -7.790 -23.723 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.227 -7.605 -22.238 1.00 0.00 H new ATOM 355 N GLN A2082 28.831 -6.637 -23.233 1.00 0.00 N ATOM 356 CA GLN A2082 27.500 -6.570 -23.851 1.00 0.00 C ATOM 357 C GLN A2082 26.490 -7.429 -23.071 1.00 0.00 C ATOM 358 O GLN A2082 25.383 -6.966 -22.798 1.00 0.00 O ATOM 359 CB GLN A2082 27.556 -7.023 -25.322 1.00 0.00 C ATOM 360 CG GLN A2082 28.123 -5.962 -26.282 1.00 0.00 C ATOM 361 CD GLN A2082 29.589 -5.615 -26.034 1.00 0.00 C ATOM 362 OE1 GLN A2082 29.939 -4.506 -25.652 1.00 0.00 O ATOM 363 NE2 GLN A2082 30.502 -6.545 -26.228 1.00 0.00 N ATOM 0 H GLN A2082 29.531 -7.080 -23.827 1.00 0.00 H new ATOM 0 HA GLN A2082 27.170 -5.532 -23.819 1.00 0.00 H new ATOM 0 HB2 GLN A2082 28.166 -7.924 -25.391 1.00 0.00 H new ATOM 0 HB3 GLN A2082 26.551 -7.293 -25.647 1.00 0.00 H new ATOM 0 HG2 GLN A2082 28.014 -6.319 -27.306 1.00 0.00 H new ATOM 0 HG3 GLN A2082 27.526 -5.054 -26.196 1.00 0.00 H new ATOM 0 HE21 GLN A2082 30.225 -7.474 -26.546 1.00 0.00 H new ATOM 0 HE22 GLN A2082 31.486 -6.336 -26.060 1.00 0.00 H new ATOM 372 N GLN A2083 26.867 -8.649 -22.661 1.00 0.00 N ATOM 373 CA GLN A2083 26.013 -9.518 -21.840 1.00 0.00 C ATOM 374 C GLN A2083 25.725 -8.863 -20.481 1.00 0.00 C ATOM 375 O GLN A2083 24.568 -8.795 -20.061 1.00 0.00 O ATOM 376 CB GLN A2083 26.684 -10.892 -21.663 1.00 0.00 C ATOM 377 CG GLN A2083 25.826 -11.860 -20.831 1.00 0.00 C ATOM 378 CD GLN A2083 26.509 -13.212 -20.643 1.00 0.00 C ATOM 379 OE1 GLN A2083 27.628 -13.320 -20.163 1.00 0.00 O ATOM 380 NE2 GLN A2083 25.848 -14.291 -20.988 1.00 0.00 N ATOM 0 H GLN A2083 27.772 -9.060 -22.889 1.00 0.00 H new ATOM 0 HA GLN A2083 25.059 -9.662 -22.347 1.00 0.00 H new ATOM 0 HB2 GLN A2083 26.874 -11.330 -22.643 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.652 -10.761 -21.179 1.00 0.00 H new ATOM 0 HG2 GLN A2083 25.623 -11.418 -19.856 1.00 0.00 H new ATOM 0 HG3 GLN A2083 24.864 -12.005 -21.322 1.00 0.00 H new ATOM 0 HE21 GLN A2083 24.914 -14.210 -21.389 1.00 0.00 H new ATOM 0 HE22 GLN A2083 26.268 -15.211 -20.855 1.00 0.00 H new ATOM 389 N GLN A2084 26.760 -8.343 -19.808 1.00 0.00 N ATOM 390 CA GLN A2084 26.620 -7.656 -18.519 1.00 0.00 C ATOM 391 C GLN A2084 25.670 -6.448 -18.628 1.00 0.00 C ATOM 392 O GLN A2084 24.774 -6.289 -17.796 1.00 0.00 O ATOM 393 CB GLN A2084 28.019 -7.272 -18.006 1.00 0.00 C ATOM 394 CG GLN A2084 27.995 -6.764 -16.555 1.00 0.00 C ATOM 395 CD GLN A2084 29.405 -6.540 -16.010 1.00 0.00 C ATOM 396 OE1 GLN A2084 30.171 -7.469 -15.784 1.00 0.00 O ATOM 397 NE2 GLN A2084 29.813 -5.310 -15.774 1.00 0.00 N ATOM 0 H GLN A2084 27.722 -8.388 -20.145 1.00 0.00 H new ATOM 0 HA GLN A2084 26.161 -8.325 -17.791 1.00 0.00 H new ATOM 0 HB2 GLN A2084 28.678 -8.138 -18.074 1.00 0.00 H new ATOM 0 HB3 GLN A2084 28.440 -6.500 -18.651 1.00 0.00 H new ATOM 0 HG2 GLN A2084 27.434 -5.831 -16.506 1.00 0.00 H new ATOM 0 HG3 GLN A2084 27.472 -7.484 -15.926 1.00 0.00 H new ATOM 0 HE21 GLN A2084 29.191 -4.523 -15.955 1.00 0.00 H new ATOM 0 HE22 GLN A2084 30.751 -5.145 -15.410 1.00 0.00 H new ATOM 406 N GLN A2085 25.812 -5.630 -19.679 1.00 0.00 N ATOM 407 CA GLN A2085 24.923 -4.502 -19.947 1.00 0.00 C ATOM 408 C GLN A2085 23.489 -4.975 -20.239 1.00 0.00 C ATOM 409 O GLN A2085 22.546 -4.377 -19.730 1.00 0.00 O ATOM 410 CB GLN A2085 25.498 -3.666 -21.104 1.00 0.00 C ATOM 411 CG GLN A2085 24.725 -2.360 -21.342 1.00 0.00 C ATOM 412 CD GLN A2085 24.741 -1.434 -20.126 1.00 0.00 C ATOM 413 OE1 GLN A2085 25.779 -0.999 -19.641 1.00 0.00 O ATOM 414 NE2 GLN A2085 23.597 -1.104 -19.575 1.00 0.00 N ATOM 0 H GLN A2085 26.554 -5.737 -20.370 1.00 0.00 H new ATOM 0 HA GLN A2085 24.865 -3.873 -19.058 1.00 0.00 H new ATOM 0 HB2 GLN A2085 26.541 -3.431 -20.892 1.00 0.00 H new ATOM 0 HB3 GLN A2085 25.485 -4.261 -22.017 1.00 0.00 H new ATOM 0 HG2 GLN A2085 25.156 -1.838 -22.196 1.00 0.00 H new ATOM 0 HG3 GLN A2085 23.693 -2.596 -21.600 1.00 0.00 H new ATOM 0 HE21 GLN A2085 22.723 -1.456 -19.965 1.00 0.00 H new ATOM 0 HE22 GLN A2085 23.582 -0.495 -18.757 1.00 0.00 H new ATOM 423 N GLN A2086 23.297 -6.051 -21.012 1.00 0.00 N ATOM 424 CA GLN A2086 21.962 -6.591 -21.295 1.00 0.00 C ATOM 425 C GLN A2086 21.239 -7.068 -20.031 1.00 0.00 C ATOM 426 O GLN A2086 20.054 -6.781 -19.880 1.00 0.00 O ATOM 427 CB GLN A2086 22.018 -7.710 -22.350 1.00 0.00 C ATOM 428 CG GLN A2086 21.738 -7.185 -23.764 1.00 0.00 C ATOM 429 CD GLN A2086 20.305 -6.668 -23.896 1.00 0.00 C ATOM 430 OE1 GLN A2086 20.043 -5.469 -23.879 1.00 0.00 O ATOM 431 NE2 GLN A2086 19.329 -7.546 -23.986 1.00 0.00 N ATOM 0 H GLN A2086 24.056 -6.568 -21.456 1.00 0.00 H new ATOM 0 HA GLN A2086 21.379 -5.766 -21.704 1.00 0.00 H new ATOM 0 HB2 GLN A2086 23.001 -8.181 -22.327 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.289 -8.481 -22.099 1.00 0.00 H new ATOM 0 HG2 GLN A2086 22.438 -6.384 -24.001 1.00 0.00 H new ATOM 0 HG3 GLN A2086 21.907 -7.981 -24.489 1.00 0.00 H new ATOM 0 HE21 GLN A2086 19.540 -8.544 -24.001 1.00 0.00 H new ATOM 0 HE22 GLN A2086 18.361 -7.229 -24.041 1.00 0.00 H new ATOM 440 N VAL A2087 21.930 -7.735 -19.097 1.00 0.00 N ATOM 441 CA VAL A2087 21.325 -8.143 -17.814 1.00 0.00 C ATOM 442 C VAL A2087 20.817 -6.904 -17.063 1.00 0.00 C ATOM 443 O VAL A2087 19.663 -6.875 -16.637 1.00 0.00 O ATOM 444 CB VAL A2087 22.312 -8.970 -16.967 1.00 0.00 C ATOM 445 CG1 VAL A2087 21.792 -9.237 -15.549 1.00 0.00 C ATOM 446 CG2 VAL A2087 22.569 -10.335 -17.623 1.00 0.00 C ATOM 0 H VAL A2087 22.908 -8.005 -19.202 1.00 0.00 H new ATOM 0 HA VAL A2087 20.472 -8.791 -18.015 1.00 0.00 H new ATOM 0 HB VAL A2087 23.225 -8.378 -16.908 1.00 0.00 H new ATOM 0 HG11 VAL A2087 22.526 -9.823 -14.996 1.00 0.00 H new ATOM 0 HG12 VAL A2087 21.626 -8.289 -15.038 1.00 0.00 H new ATOM 0 HG13 VAL A2087 20.854 -9.789 -15.603 1.00 0.00 H new ATOM 0 HG21 VAL A2087 23.268 -10.906 -17.012 1.00 0.00 H new ATOM 0 HG22 VAL A2087 21.629 -10.881 -17.706 1.00 0.00 H new ATOM 0 HG23 VAL A2087 22.992 -10.187 -18.617 1.00 0.00 H new ATOM 456 N LEU A2088 21.634 -5.849 -16.965 1.00 0.00 N ATOM 457 CA LEU A2088 21.236 -4.576 -16.348 1.00 0.00 C ATOM 458 C LEU A2088 20.049 -3.936 -17.090 1.00 0.00 C ATOM 459 O LEU A2088 19.103 -3.496 -16.440 1.00 0.00 O ATOM 460 CB LEU A2088 22.446 -3.622 -16.303 1.00 0.00 C ATOM 461 CG LEU A2088 23.558 -4.054 -15.330 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.812 -3.211 -15.564 1.00 0.00 C ATOM 463 CD2 LEU A2088 23.132 -3.879 -13.871 1.00 0.00 C ATOM 0 H LEU A2088 22.593 -5.853 -17.312 1.00 0.00 H new ATOM 0 HA LEU A2088 20.904 -4.773 -15.329 1.00 0.00 H new ATOM 0 HB2 LEU A2088 22.867 -3.541 -17.305 1.00 0.00 H new ATOM 0 HB3 LEU A2088 22.099 -2.628 -16.022 1.00 0.00 H new ATOM 0 HG LEU A2088 23.759 -5.109 -15.518 1.00 0.00 H new ATOM 0 HD11 LEU A2088 25.594 -3.523 -14.872 1.00 0.00 H new ATOM 0 HD12 LEU A2088 25.158 -3.350 -16.588 1.00 0.00 H new ATOM 0 HD13 LEU A2088 24.579 -2.159 -15.399 1.00 0.00 H new ATOM 0 HD21 LEU A2088 23.943 -4.194 -13.215 1.00 0.00 H new ATOM 0 HD22 LEU A2088 22.900 -2.831 -13.683 1.00 0.00 H new ATOM 0 HD23 LEU A2088 22.249 -4.487 -13.674 1.00 0.00 H new ATOM 475 N ASN A2089 20.058 -3.911 -18.429 1.00 0.00 N ATOM 476 CA ASN A2089 18.968 -3.361 -19.246 1.00 0.00 C ATOM 477 C ASN A2089 17.633 -4.067 -18.957 1.00 0.00 C ATOM 478 O ASN A2089 16.625 -3.409 -18.697 1.00 0.00 O ATOM 479 CB ASN A2089 19.290 -3.490 -20.752 1.00 0.00 C ATOM 480 CG ASN A2089 20.470 -2.683 -21.265 1.00 0.00 C ATOM 481 OD1 ASN A2089 20.981 -1.764 -20.639 1.00 0.00 O ATOM 482 ND2 ASN A2089 20.939 -3.005 -22.450 1.00 0.00 N ATOM 0 H ASN A2089 20.833 -4.277 -18.983 1.00 0.00 H new ATOM 0 HA ASN A2089 18.874 -2.308 -18.981 1.00 0.00 H new ATOM 0 HB2 ASN A2089 19.474 -4.541 -20.972 1.00 0.00 H new ATOM 0 HB3 ASN A2089 18.405 -3.196 -21.316 1.00 0.00 H new ATOM 0 HD21 ASN A2089 21.726 -2.490 -22.844 1.00 0.00 H new ATOM 0 HD22 ASN A2089 20.516 -3.770 -22.975 1.00 0.00 H new ATOM 489 N ILE A2090 17.624 -5.404 -18.991 1.00 0.00 N ATOM 490 CA ILE A2090 16.444 -6.249 -18.753 1.00 0.00 C ATOM 491 C ILE A2090 15.869 -6.016 -17.351 1.00 0.00 C ATOM 492 O ILE A2090 14.660 -5.810 -17.204 1.00 0.00 O ATOM 493 CB ILE A2090 16.829 -7.729 -18.992 1.00 0.00 C ATOM 494 CG1 ILE A2090 17.089 -7.959 -20.500 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.748 -8.707 -18.493 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.809 -9.277 -20.800 1.00 0.00 C ATOM 0 H ILE A2090 18.464 -5.947 -19.191 1.00 0.00 H new ATOM 0 HA ILE A2090 15.653 -5.980 -19.453 1.00 0.00 H new ATOM 0 HB ILE A2090 17.734 -7.929 -18.418 1.00 0.00 H new ATOM 0 HG12 ILE A2090 16.137 -7.945 -21.031 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.684 -7.132 -20.889 1.00 0.00 H new ATOM 0 HG21 ILE A2090 16.068 -9.731 -18.685 1.00 0.00 H new ATOM 0 HG22 ILE A2090 15.598 -8.568 -17.422 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.813 -8.515 -19.019 1.00 0.00 H new ATOM 0 HD11 ILE A2090 17.959 -9.373 -21.875 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.776 -9.286 -20.297 1.00 0.00 H new ATOM 0 HD13 ILE A2090 17.206 -10.111 -20.442 1.00 0.00 H new ATOM 508 N LEU A2091 16.728 -6.012 -16.326 1.00 0.00 N ATOM 509 CA LEU A2091 16.326 -5.777 -14.938 1.00 0.00 C ATOM 510 C LEU A2091 15.784 -4.349 -14.750 1.00 0.00 C ATOM 511 O LEU A2091 14.670 -4.185 -14.252 1.00 0.00 O ATOM 512 CB LEU A2091 17.517 -6.081 -14.006 1.00 0.00 C ATOM 513 CG LEU A2091 17.940 -7.567 -13.959 1.00 0.00 C ATOM 514 CD1 LEU A2091 19.244 -7.699 -13.171 1.00 0.00 C ATOM 515 CD2 LEU A2091 16.908 -8.486 -13.302 1.00 0.00 C ATOM 0 H LEU A2091 17.729 -6.173 -16.439 1.00 0.00 H new ATOM 0 HA LEU A2091 15.508 -6.449 -14.677 1.00 0.00 H new ATOM 0 HB2 LEU A2091 18.372 -5.484 -14.325 1.00 0.00 H new ATOM 0 HB3 LEU A2091 17.262 -5.758 -12.997 1.00 0.00 H new ATOM 0 HG LEU A2091 18.048 -7.879 -14.998 1.00 0.00 H new ATOM 0 HD11 LEU A2091 19.544 -8.746 -13.137 1.00 0.00 H new ATOM 0 HD12 LEU A2091 20.024 -7.114 -13.658 1.00 0.00 H new ATOM 0 HD13 LEU A2091 19.095 -7.331 -12.156 1.00 0.00 H new ATOM 0 HD21 LEU A2091 17.278 -9.511 -13.308 1.00 0.00 H new ATOM 0 HD22 LEU A2091 16.739 -8.167 -12.274 1.00 0.00 H new ATOM 0 HD23 LEU A2091 15.971 -8.436 -13.856 1.00 0.00 H new ATOM 527 N LYS A2092 16.509 -3.308 -15.189 1.00 0.00 N ATOM 528 CA LYS A2092 16.063 -1.902 -15.086 1.00 0.00 C ATOM 529 C LYS A2092 14.801 -1.592 -15.907 1.00 0.00 C ATOM 530 O LYS A2092 14.087 -0.648 -15.572 1.00 0.00 O ATOM 531 CB LYS A2092 17.216 -0.939 -15.427 1.00 0.00 C ATOM 532 CG LYS A2092 18.366 -0.949 -14.398 1.00 0.00 C ATOM 533 CD LYS A2092 17.978 -0.560 -12.957 1.00 0.00 C ATOM 534 CE LYS A2092 17.303 0.816 -12.818 1.00 0.00 C ATOM 535 NZ LYS A2092 18.231 1.937 -13.124 1.00 0.00 N ATOM 0 H LYS A2092 17.424 -3.414 -15.627 1.00 0.00 H new ATOM 0 HA LYS A2092 15.774 -1.746 -14.047 1.00 0.00 H new ATOM 0 HB2 LYS A2092 17.616 -1.200 -16.407 1.00 0.00 H new ATOM 0 HB3 LYS A2092 16.820 0.073 -15.504 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.804 -1.947 -14.380 1.00 0.00 H new ATOM 0 HG3 LYS A2092 19.143 -0.266 -14.742 1.00 0.00 H new ATOM 0 HD2 LYS A2092 17.306 -1.320 -12.559 1.00 0.00 H new ATOM 0 HD3 LYS A2092 18.875 -0.573 -12.338 1.00 0.00 H new ATOM 0 HE2 LYS A2092 16.445 0.866 -13.488 1.00 0.00 H new ATOM 0 HE3 LYS A2092 16.922 0.930 -11.803 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 17.730 2.842 -13.016 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 19.038 1.908 -12.469 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 18.575 1.846 -14.101 1.00 0.00 H new ATOM 549 N SER A2093 14.486 -2.397 -16.924 1.00 0.00 N ATOM 550 CA SER A2093 13.238 -2.290 -17.704 1.00 0.00 C ATOM 551 C SER A2093 12.033 -2.912 -16.971 1.00 0.00 C ATOM 552 O SER A2093 10.892 -2.732 -17.400 1.00 0.00 O ATOM 553 CB SER A2093 13.384 -2.960 -19.076 1.00 0.00 C ATOM 554 OG SER A2093 14.384 -2.316 -19.846 1.00 0.00 O ATOM 0 H SER A2093 15.094 -3.153 -17.238 1.00 0.00 H new ATOM 0 HA SER A2093 13.052 -1.224 -17.832 1.00 0.00 H new ATOM 0 HB2 SER A2093 13.639 -4.012 -18.947 1.00 0.00 H new ATOM 0 HB3 SER A2093 12.432 -2.926 -19.606 1.00 0.00 H new ATOM 0 HG SER A2093 15.266 -2.658 -19.589 1.00 0.00 H new ATOM 560 N ASN A2094 12.267 -3.627 -15.860 1.00 0.00 N ATOM 561 CA ASN A2094 11.264 -4.285 -15.017 1.00 0.00 C ATOM 562 C ASN A2094 11.586 -4.078 -13.507 1.00 0.00 C ATOM 563 O ASN A2094 11.812 -5.062 -12.794 1.00 0.00 O ATOM 564 CB ASN A2094 11.208 -5.779 -15.411 1.00 0.00 C ATOM 565 CG ASN A2094 10.824 -6.025 -16.859 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.660 -6.164 -17.206 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.790 -6.109 -17.747 1.00 0.00 N ATOM 0 H ASN A2094 13.214 -3.768 -15.509 1.00 0.00 H new ATOM 0 HA ASN A2094 10.281 -3.843 -15.178 1.00 0.00 H new ATOM 0 HB2 ASN A2094 12.183 -6.230 -15.223 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.492 -6.287 -14.765 1.00 0.00 H new ATOM 0 HD21 ASN A2094 11.568 -6.290 -18.726 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.761 -5.993 -17.457 1.00 0.00 H new ATOM 574 N PRO A2095 11.641 -2.824 -12.994 1.00 0.00 N ATOM 575 CA PRO A2095 12.016 -2.517 -11.603 1.00 0.00 C ATOM 576 C PRO A2095 11.330 -3.352 -10.512 1.00 0.00 C ATOM 577 O PRO A2095 11.958 -3.725 -9.521 1.00 0.00 O ATOM 578 CB PRO A2095 11.715 -1.028 -11.405 1.00 0.00 C ATOM 579 CG PRO A2095 11.880 -0.450 -12.804 1.00 0.00 C ATOM 580 CD PRO A2095 11.368 -1.574 -13.701 1.00 0.00 C ATOM 0 HA PRO A2095 13.068 -2.775 -11.480 1.00 0.00 H new ATOM 0 HB2 PRO A2095 10.708 -0.869 -11.020 1.00 0.00 H new ATOM 0 HB3 PRO A2095 12.404 -0.569 -10.696 1.00 0.00 H new ATOM 0 HG2 PRO A2095 11.302 0.465 -12.934 1.00 0.00 H new ATOM 0 HG3 PRO A2095 12.920 -0.204 -13.019 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.301 -1.462 -13.893 1.00 0.00 H new ATOM 0 HD3 PRO A2095 11.870 -1.558 -14.669 1.00 0.00 H new ATOM 588 N GLN A2096 10.043 -3.650 -10.698 1.00 0.00 N ATOM 589 CA GLN A2096 9.195 -4.391 -9.758 1.00 0.00 C ATOM 590 C GLN A2096 9.800 -5.736 -9.325 1.00 0.00 C ATOM 591 O GLN A2096 9.842 -6.040 -8.131 1.00 0.00 O ATOM 592 CB GLN A2096 7.811 -4.624 -10.397 1.00 0.00 C ATOM 593 CG GLN A2096 6.914 -3.377 -10.505 1.00 0.00 C ATOM 594 CD GLN A2096 7.532 -2.206 -11.269 1.00 0.00 C ATOM 595 OE1 GLN A2096 7.776 -1.134 -10.731 1.00 0.00 O ATOM 596 NE2 GLN A2096 7.849 -2.360 -12.538 1.00 0.00 N ATOM 0 H GLN A2096 9.541 -3.371 -11.541 1.00 0.00 H new ATOM 0 HA GLN A2096 9.109 -3.784 -8.857 1.00 0.00 H new ATOM 0 HB2 GLN A2096 7.956 -5.034 -11.397 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.284 -5.380 -9.815 1.00 0.00 H new ATOM 0 HG2 GLN A2096 5.981 -3.659 -10.993 1.00 0.00 H new ATOM 0 HG3 GLN A2096 6.659 -3.042 -9.500 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.656 -3.244 -13.008 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.288 -1.595 -13.050 1.00 0.00 H new ATOM 605 N LEU A2097 10.274 -6.537 -10.287 1.00 0.00 N ATOM 606 CA LEU A2097 10.856 -7.858 -10.021 1.00 0.00 C ATOM 607 C LEU A2097 12.341 -7.834 -9.619 1.00 0.00 C ATOM 608 O LEU A2097 12.767 -8.710 -8.864 1.00 0.00 O ATOM 609 CB LEU A2097 10.507 -8.841 -11.162 1.00 0.00 C ATOM 610 CG LEU A2097 10.866 -8.462 -12.615 1.00 0.00 C ATOM 611 CD1 LEU A2097 12.359 -8.548 -12.935 1.00 0.00 C ATOM 612 CD2 LEU A2097 10.147 -9.413 -13.576 1.00 0.00 C ATOM 0 H LEU A2097 10.265 -6.286 -11.276 1.00 0.00 H new ATOM 0 HA LEU A2097 10.385 -8.242 -9.117 1.00 0.00 H new ATOM 0 HB2 LEU A2097 10.996 -9.790 -10.939 1.00 0.00 H new ATOM 0 HB3 LEU A2097 9.432 -9.020 -11.125 1.00 0.00 H new ATOM 0 HG LEU A2097 10.557 -7.423 -12.732 1.00 0.00 H new ATOM 0 HD11 LEU A2097 12.525 -8.266 -13.975 1.00 0.00 H new ATOM 0 HD12 LEU A2097 12.910 -7.871 -12.283 1.00 0.00 H new ATOM 0 HD13 LEU A2097 12.707 -9.569 -12.776 1.00 0.00 H new ATOM 0 HD21 LEU A2097 10.397 -9.150 -14.604 1.00 0.00 H new ATOM 0 HD22 LEU A2097 10.461 -10.438 -13.377 1.00 0.00 H new ATOM 0 HD23 LEU A2097 9.070 -9.330 -13.432 1.00 0.00 H new ATOM 624 N MET A2098 13.127 -6.839 -10.052 1.00 0.00 N ATOM 625 CA MET A2098 14.549 -6.756 -9.678 1.00 0.00 C ATOM 626 C MET A2098 14.768 -6.178 -8.276 1.00 0.00 C ATOM 627 O MET A2098 15.628 -6.669 -7.543 1.00 0.00 O ATOM 628 CB MET A2098 15.390 -6.050 -10.758 1.00 0.00 C ATOM 629 CG MET A2098 15.062 -4.597 -11.128 1.00 0.00 C ATOM 630 SD MET A2098 15.344 -3.255 -9.936 1.00 0.00 S ATOM 631 CE MET A2098 17.105 -3.445 -9.568 1.00 0.00 C ATOM 0 H MET A2098 12.807 -6.084 -10.658 1.00 0.00 H new ATOM 0 HA MET A2098 14.913 -7.782 -9.625 1.00 0.00 H new ATOM 0 HB2 MET A2098 16.431 -6.080 -10.436 1.00 0.00 H new ATOM 0 HB3 MET A2098 15.321 -6.645 -11.669 1.00 0.00 H new ATOM 0 HG2 MET A2098 15.634 -4.356 -12.024 1.00 0.00 H new ATOM 0 HG3 MET A2098 14.008 -4.566 -11.404 1.00 0.00 H new ATOM 0 HE1 MET A2098 17.435 -2.622 -8.933 1.00 0.00 H new ATOM 0 HE2 MET A2098 17.269 -4.390 -9.051 1.00 0.00 H new ATOM 0 HE3 MET A2098 17.674 -3.437 -10.498 1.00 0.00 H new ATOM 641 N ALA A2099 13.986 -5.171 -7.873 1.00 0.00 N ATOM 642 CA ALA A2099 14.116 -4.547 -6.560 1.00 0.00 C ATOM 643 C ALA A2099 13.672 -5.489 -5.426 1.00 0.00 C ATOM 644 O ALA A2099 14.333 -5.557 -4.387 1.00 0.00 O ATOM 645 CB ALA A2099 13.373 -3.213 -6.569 1.00 0.00 C ATOM 0 H ALA A2099 13.247 -4.769 -8.450 1.00 0.00 H new ATOM 0 HA ALA A2099 15.167 -4.345 -6.354 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.464 -2.739 -5.592 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.803 -2.562 -7.330 1.00 0.00 H new ATOM 0 HB3 ALA A2099 12.320 -3.385 -6.792 1.00 0.00 H new ATOM 651 N ALA A2100 12.602 -6.266 -5.643 1.00 0.00 N ATOM 652 CA ALA A2100 12.120 -7.265 -4.684 1.00 0.00 C ATOM 653 C ALA A2100 13.161 -8.379 -4.433 1.00 0.00 C ATOM 654 O ALA A2100 13.261 -8.902 -3.320 1.00 0.00 O ATOM 655 CB ALA A2100 10.801 -7.841 -5.217 1.00 0.00 C ATOM 0 H ALA A2100 12.044 -6.217 -6.495 1.00 0.00 H new ATOM 0 HA ALA A2100 11.955 -6.787 -3.718 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.422 -8.588 -4.519 1.00 0.00 H new ATOM 0 HB2 ALA A2100 10.070 -7.039 -5.323 1.00 0.00 H new ATOM 0 HB3 ALA A2100 10.973 -8.306 -6.188 1.00 0.00 H new ATOM 661 N PHE A2101 13.942 -8.731 -5.459 1.00 0.00 N ATOM 662 CA PHE A2101 15.016 -9.725 -5.396 1.00 0.00 C ATOM 663 C PHE A2101 16.283 -9.190 -4.703 1.00 0.00 C ATOM 664 O PHE A2101 16.767 -9.807 -3.752 1.00 0.00 O ATOM 665 CB PHE A2101 15.307 -10.202 -6.829 1.00 0.00 C ATOM 666 CG PHE A2101 16.614 -10.951 -7.008 1.00 0.00 C ATOM 667 CD1 PHE A2101 16.782 -12.237 -6.460 1.00 0.00 C ATOM 668 CD2 PHE A2101 17.674 -10.349 -7.717 1.00 0.00 C ATOM 669 CE1 PHE A2101 18.002 -12.918 -6.624 1.00 0.00 C ATOM 670 CE2 PHE A2101 18.891 -11.033 -7.884 1.00 0.00 C ATOM 671 CZ PHE A2101 19.054 -12.319 -7.338 1.00 0.00 C ATOM 0 H PHE A2101 13.840 -8.318 -6.386 1.00 0.00 H new ATOM 0 HA PHE A2101 14.689 -10.564 -4.781 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.490 -10.847 -7.153 1.00 0.00 H new ATOM 0 HB3 PHE A2101 15.310 -9.335 -7.490 1.00 0.00 H new ATOM 0 HD1 PHE A2101 15.974 -12.701 -5.914 1.00 0.00 H new ATOM 0 HD2 PHE A2101 17.551 -9.360 -8.133 1.00 0.00 H new ATOM 0 HE1 PHE A2101 18.130 -13.903 -6.200 1.00 0.00 H new ATOM 0 HE2 PHE A2101 19.700 -10.571 -8.431 1.00 0.00 H new ATOM 0 HZ PHE A2101 19.988 -12.846 -7.467 1.00 0.00 H new ATOM 681 N ILE A2102 16.831 -8.044 -5.136 1.00 0.00 N ATOM 682 CA ILE A2102 18.079 -7.511 -4.555 1.00 0.00 C ATOM 683 C ILE A2102 17.958 -7.163 -3.071 1.00 0.00 C ATOM 684 O ILE A2102 18.855 -7.500 -2.296 1.00 0.00 O ATOM 685 CB ILE A2102 18.649 -6.348 -5.397 1.00 0.00 C ATOM 686 CG1 ILE A2102 20.133 -6.061 -5.080 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.809 -5.066 -5.349 1.00 0.00 C ATOM 688 CD1 ILE A2102 20.453 -5.074 -3.944 1.00 0.00 C ATOM 0 H ILE A2102 16.435 -7.470 -5.881 1.00 0.00 H new ATOM 0 HA ILE A2102 18.806 -8.322 -4.597 1.00 0.00 H new ATOM 0 HB ILE A2102 18.591 -6.702 -6.426 1.00 0.00 H new ATOM 0 HG12 ILE A2102 20.613 -7.010 -4.842 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.602 -5.686 -5.990 1.00 0.00 H new ATOM 0 HG21 ILE A2102 18.279 -4.300 -5.966 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.808 -5.273 -5.727 1.00 0.00 H new ATOM 0 HG23 ILE A2102 17.743 -4.713 -4.320 1.00 0.00 H new ATOM 0 HD11 ILE A2102 21.534 -4.976 -3.841 1.00 0.00 H new ATOM 0 HD12 ILE A2102 20.021 -4.101 -4.175 1.00 0.00 H new ATOM 0 HD13 ILE A2102 20.032 -5.445 -3.010 1.00 0.00 H new ATOM 700 N LYS A2103 16.850 -6.542 -2.644 1.00 0.00 N ATOM 701 CA LYS A2103 16.628 -6.158 -1.239 1.00 0.00 C ATOM 702 C LYS A2103 16.657 -7.330 -0.245 1.00 0.00 C ATOM 703 O LYS A2103 16.938 -7.102 0.930 1.00 0.00 O ATOM 704 CB LYS A2103 15.354 -5.307 -1.117 1.00 0.00 C ATOM 705 CG LYS A2103 15.627 -3.850 -1.536 1.00 0.00 C ATOM 706 CD LYS A2103 14.467 -2.885 -1.245 1.00 0.00 C ATOM 707 CE LYS A2103 14.140 -2.846 0.255 1.00 0.00 C ATOM 708 NZ LYS A2103 13.327 -1.664 0.635 1.00 0.00 N ATOM 0 H LYS A2103 16.079 -6.290 -3.263 1.00 0.00 H new ATOM 0 HA LYS A2103 17.483 -5.549 -0.944 1.00 0.00 H new ATOM 0 HB2 LYS A2103 14.568 -5.729 -1.743 1.00 0.00 H new ATOM 0 HB3 LYS A2103 14.991 -5.333 -0.090 1.00 0.00 H new ATOM 0 HG2 LYS A2103 16.519 -3.496 -1.019 1.00 0.00 H new ATOM 0 HG3 LYS A2103 15.847 -3.825 -2.603 1.00 0.00 H new ATOM 0 HD2 LYS A2103 14.728 -1.884 -1.589 1.00 0.00 H new ATOM 0 HD3 LYS A2103 13.584 -3.194 -1.804 1.00 0.00 H new ATOM 0 HE2 LYS A2103 13.603 -3.754 0.529 1.00 0.00 H new ATOM 0 HE3 LYS A2103 15.069 -2.841 0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 13.136 -1.688 1.657 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 13.848 -0.795 0.401 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 12.427 -1.680 0.114 1.00 0.00 H new ATOM 722 N GLN A2104 16.444 -8.569 -0.704 1.00 0.00 N ATOM 723 CA GLN A2104 16.610 -9.777 0.119 1.00 0.00 C ATOM 724 C GLN A2104 17.969 -10.465 -0.131 1.00 0.00 C ATOM 725 O GLN A2104 18.590 -10.952 0.813 1.00 0.00 O ATOM 726 CB GLN A2104 15.401 -10.716 -0.017 1.00 0.00 C ATOM 727 CG GLN A2104 15.168 -11.303 -1.416 1.00 0.00 C ATOM 728 CD GLN A2104 14.004 -12.281 -1.407 1.00 0.00 C ATOM 729 OE1 GLN A2104 14.149 -13.456 -1.101 1.00 0.00 O ATOM 730 NE2 GLN A2104 12.809 -11.841 -1.729 1.00 0.00 N ATOM 0 H GLN A2104 16.150 -8.765 -1.661 1.00 0.00 H new ATOM 0 HA GLN A2104 16.635 -9.473 1.165 1.00 0.00 H new ATOM 0 HB2 GLN A2104 15.523 -11.539 0.687 1.00 0.00 H new ATOM 0 HB3 GLN A2104 14.506 -10.171 0.282 1.00 0.00 H new ATOM 0 HG2 GLN A2104 14.967 -10.499 -2.123 1.00 0.00 H new ATOM 0 HG3 GLN A2104 16.071 -11.809 -1.757 1.00 0.00 H new ATOM 0 HE21 GLN A2104 12.678 -10.863 -1.986 1.00 0.00 H new ATOM 0 HE22 GLN A2104 12.012 -12.478 -1.722 1.00 0.00 H new ATOM 739 N ARG A2105 18.474 -10.473 -1.378 1.00 0.00 N ATOM 740 CA ARG A2105 19.784 -11.053 -1.754 1.00 0.00 C ATOM 741 C ARG A2105 20.956 -10.331 -1.080 1.00 0.00 C ATOM 742 O ARG A2105 21.930 -10.970 -0.684 1.00 0.00 O ATOM 743 CB ARG A2105 19.897 -11.061 -3.297 1.00 0.00 C ATOM 744 CG ARG A2105 20.950 -12.023 -3.884 1.00 0.00 C ATOM 745 CD ARG A2105 22.373 -11.457 -3.963 1.00 0.00 C ATOM 746 NE ARG A2105 23.301 -12.436 -4.565 1.00 0.00 N ATOM 747 CZ ARG A2105 24.429 -12.903 -4.068 1.00 0.00 C ATOM 748 NH1 ARG A2105 24.884 -12.569 -2.894 1.00 0.00 N ATOM 749 NH2 ARG A2105 25.115 -13.749 -4.770 1.00 0.00 N ATOM 0 H ARG A2105 17.976 -10.069 -2.171 1.00 0.00 H new ATOM 0 HA ARG A2105 19.840 -12.079 -1.391 1.00 0.00 H new ATOM 0 HB2 ARG A2105 18.923 -11.319 -3.713 1.00 0.00 H new ATOM 0 HB3 ARG A2105 20.129 -10.050 -3.632 1.00 0.00 H new ATOM 0 HG2 ARG A2105 20.969 -12.930 -3.279 1.00 0.00 H new ATOM 0 HG3 ARG A2105 20.635 -12.315 -4.886 1.00 0.00 H new ATOM 0 HD2 ARG A2105 22.371 -10.541 -4.554 1.00 0.00 H new ATOM 0 HD3 ARG A2105 22.718 -11.191 -2.964 1.00 0.00 H new ATOM 0 HE ARG A2105 23.035 -12.796 -5.481 1.00 0.00 H new ATOM 0 HH11 ARG A2105 24.361 -11.916 -2.311 1.00 0.00 H new ATOM 0 HH12 ARG A2105 25.764 -12.961 -2.558 1.00 0.00 H new ATOM 0 HH21 ARG A2105 24.779 -14.041 -5.688 1.00 0.00 H new ATOM 0 HH22 ARG A2105 25.991 -14.123 -4.405 1.00 0.00 H new ATOM 763 N THR A2106 20.864 -9.009 -0.909 1.00 0.00 N ATOM 764 CA THR A2106 21.890 -8.168 -0.257 1.00 0.00 C ATOM 765 C THR A2106 22.253 -8.633 1.163 1.00 0.00 C ATOM 766 O THR A2106 23.411 -8.538 1.573 1.00 0.00 O ATOM 767 CB THR A2106 21.484 -6.685 -0.300 1.00 0.00 C ATOM 768 OG1 THR A2106 22.579 -5.875 0.051 1.00 0.00 O ATOM 769 CG2 THR A2106 20.322 -6.325 0.627 1.00 0.00 C ATOM 0 H THR A2106 20.056 -8.474 -1.226 1.00 0.00 H new ATOM 0 HA THR A2106 22.807 -8.286 -0.834 1.00 0.00 H new ATOM 0 HB THR A2106 21.156 -6.508 -1.324 1.00 0.00 H new ATOM 0 HG1 THR A2106 22.312 -4.933 0.020 1.00 0.00 H new ATOM 0 HG21 THR A2106 20.100 -5.262 0.536 1.00 0.00 H new ATOM 0 HG22 THR A2106 19.442 -6.905 0.349 1.00 0.00 H new ATOM 0 HG23 THR A2106 20.595 -6.551 1.658 1.00 0.00 H new ATOM 777 N ALA A2107 21.305 -9.233 1.897 1.00 0.00 N ATOM 778 CA ALA A2107 21.532 -9.802 3.231 1.00 0.00 C ATOM 779 C ALA A2107 22.524 -10.991 3.246 1.00 0.00 C ATOM 780 O ALA A2107 23.011 -11.379 4.310 1.00 0.00 O ATOM 781 CB ALA A2107 20.176 -10.219 3.802 1.00 0.00 C ATOM 0 H ALA A2107 20.343 -9.338 1.574 1.00 0.00 H new ATOM 0 HA ALA A2107 22.002 -9.036 3.848 1.00 0.00 H new ATOM 0 HB1 ALA A2107 20.315 -10.646 4.795 1.00 0.00 H new ATOM 0 HB2 ALA A2107 19.526 -9.347 3.870 1.00 0.00 H new ATOM 0 HB3 ALA A2107 19.719 -10.962 3.148 1.00 0.00 H new ATOM 787 N LYS A2108 22.828 -11.563 2.070 1.00 0.00 N ATOM 788 CA LYS A2108 23.741 -12.700 1.854 1.00 0.00 C ATOM 789 C LYS A2108 24.959 -12.341 0.993 1.00 0.00 C ATOM 790 O LYS A2108 25.748 -13.218 0.652 1.00 0.00 O ATOM 791 CB LYS A2108 22.949 -13.860 1.221 1.00 0.00 C ATOM 792 CG LYS A2108 21.787 -14.409 2.067 1.00 0.00 C ATOM 793 CD LYS A2108 22.243 -15.031 3.400 1.00 0.00 C ATOM 794 CE LYS A2108 21.086 -15.606 4.232 1.00 0.00 C ATOM 795 NZ LYS A2108 20.403 -16.741 3.558 1.00 0.00 N ATOM 0 H LYS A2108 22.422 -11.228 1.196 1.00 0.00 H new ATOM 0 HA LYS A2108 24.140 -12.997 2.824 1.00 0.00 H new ATOM 0 HB2 LYS A2108 22.551 -13.525 0.263 1.00 0.00 H new ATOM 0 HB3 LYS A2108 23.640 -14.677 1.011 1.00 0.00 H new ATOM 0 HG2 LYS A2108 21.084 -13.602 2.273 1.00 0.00 H new ATOM 0 HG3 LYS A2108 21.249 -15.160 1.489 1.00 0.00 H new ATOM 0 HD2 LYS A2108 22.963 -15.824 3.195 1.00 0.00 H new ATOM 0 HD3 LYS A2108 22.762 -14.273 3.987 1.00 0.00 H new ATOM 0 HE2 LYS A2108 21.468 -15.939 5.197 1.00 0.00 H new ATOM 0 HE3 LYS A2108 20.360 -14.817 4.431 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 19.677 -17.134 4.190 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 19.955 -16.405 2.682 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 21.099 -17.479 3.330 1.00 0.00 H new ATOM 1019 N THR B 18 8.972 -23.238 -11.450 1.00 0.00 N ATOM 1020 CA THR B 18 9.631 -22.667 -12.648 1.00 0.00 C ATOM 1021 C THR B 18 10.209 -21.270 -12.421 1.00 0.00 C ATOM 1022 O THR B 18 9.728 -20.515 -11.572 1.00 0.00 O ATOM 1023 CB THR B 18 8.680 -22.547 -13.848 1.00 0.00 C ATOM 1024 OG1 THR B 18 7.547 -21.762 -13.537 1.00 0.00 O ATOM 1025 CG2 THR B 18 8.223 -23.893 -14.399 1.00 0.00 C ATOM 0 HA THR B 18 10.433 -23.376 -12.853 1.00 0.00 H new ATOM 0 HB THR B 18 9.265 -22.055 -14.625 1.00 0.00 H new ATOM 0 HG1 THR B 18 7.317 -21.880 -12.592 1.00 0.00 H new ATOM 0 HG21 THR B 18 7.554 -23.732 -15.244 1.00 0.00 H new ATOM 0 HG22 THR B 18 9.091 -24.466 -14.727 1.00 0.00 H new ATOM 0 HG23 THR B 18 7.697 -24.445 -13.620 1.00 0.00 H new ATOM 1033 N PHE B 19 11.220 -20.900 -13.215 1.00 0.00 N ATOM 1034 CA PHE B 19 11.907 -19.603 -13.151 1.00 0.00 C ATOM 1035 C PHE B 19 10.969 -18.383 -13.198 1.00 0.00 C ATOM 1036 O PHE B 19 11.222 -17.386 -12.520 1.00 0.00 O ATOM 1037 CB PHE B 19 12.997 -19.518 -14.237 1.00 0.00 C ATOM 1038 CG PHE B 19 12.542 -18.994 -15.587 1.00 0.00 C ATOM 1039 CD1 PHE B 19 11.637 -19.736 -16.370 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.003 -17.745 -16.047 1.00 0.00 C ATOM 1041 CE1 PHE B 19 11.185 -19.225 -17.600 1.00 0.00 C ATOM 1042 CE2 PHE B 19 12.552 -17.236 -17.277 1.00 0.00 C ATOM 1043 CZ PHE B 19 11.636 -17.971 -18.050 1.00 0.00 C ATOM 0 H PHE B 19 11.594 -21.511 -13.941 1.00 0.00 H new ATOM 0 HA PHE B 19 12.374 -19.558 -12.167 1.00 0.00 H new ATOM 0 HB2 PHE B 19 13.799 -18.877 -13.871 1.00 0.00 H new ATOM 0 HB3 PHE B 19 13.422 -20.512 -14.378 1.00 0.00 H new ATOM 0 HD1 PHE B 19 11.289 -20.699 -16.026 1.00 0.00 H new ATOM 0 HD2 PHE B 19 13.704 -17.177 -15.453 1.00 0.00 H new ATOM 0 HE1 PHE B 19 10.491 -19.796 -18.199 1.00 0.00 H new ATOM 0 HE2 PHE B 19 12.909 -16.279 -17.629 1.00 0.00 H new ATOM 0 HZ PHE B 19 11.279 -17.573 -18.988 1.00 0.00 H new ATOM 1053 N SER B 20 9.876 -18.457 -13.968 1.00 0.00 N ATOM 1054 CA SER B 20 8.902 -17.364 -14.085 1.00 0.00 C ATOM 1055 C SER B 20 8.056 -17.184 -12.824 1.00 0.00 C ATOM 1056 O SER B 20 7.775 -16.051 -12.435 1.00 0.00 O ATOM 1057 CB SER B 20 7.967 -17.582 -15.277 1.00 0.00 C ATOM 1058 OG SER B 20 8.669 -17.504 -16.505 1.00 0.00 O ATOM 0 H SER B 20 9.642 -19.277 -14.528 1.00 0.00 H new ATOM 0 HA SER B 20 9.492 -16.459 -14.233 1.00 0.00 H new ATOM 0 HB2 SER B 20 7.487 -18.557 -15.192 1.00 0.00 H new ATOM 0 HB3 SER B 20 7.174 -16.834 -15.261 1.00 0.00 H new ATOM 0 HG SER B 20 9.385 -18.173 -16.516 1.00 0.00 H new ATOM 1064 N ASP B 21 7.667 -18.274 -12.154 1.00 0.00 N ATOM 1065 CA ASP B 21 6.877 -18.185 -10.922 1.00 0.00 C ATOM 1066 C ASP B 21 7.728 -17.795 -9.704 1.00 0.00 C ATOM 1067 O ASP B 21 7.215 -17.177 -8.770 1.00 0.00 O ATOM 1068 CB ASP B 21 6.107 -19.483 -10.684 1.00 0.00 C ATOM 1069 CG ASP B 21 4.860 -19.229 -9.822 1.00 0.00 C ATOM 1070 OD1 ASP B 21 3.831 -18.780 -10.382 1.00 0.00 O ATOM 1071 OD2 ASP B 21 4.899 -19.471 -8.594 1.00 0.00 O ATOM 0 H ASP B 21 7.886 -19.227 -12.444 1.00 0.00 H new ATOM 0 HA ASP B 21 6.155 -17.380 -11.055 1.00 0.00 H new ATOM 0 HB2 ASP B 21 5.812 -19.916 -11.640 1.00 0.00 H new ATOM 0 HB3 ASP B 21 6.753 -20.209 -10.191 1.00 0.00 H new ATOM 1076 N LEU B 22 9.040 -18.074 -9.731 1.00 0.00 N ATOM 1077 CA LEU B 22 9.963 -17.648 -8.670 1.00 0.00 C ATOM 1078 C LEU B 22 9.901 -16.122 -8.472 1.00 0.00 C ATOM 1079 O LEU B 22 9.917 -15.672 -7.329 1.00 0.00 O ATOM 1080 CB LEU B 22 11.411 -18.109 -8.945 1.00 0.00 C ATOM 1081 CG LEU B 22 11.674 -19.626 -8.852 1.00 0.00 C ATOM 1082 CD1 LEU B 22 13.139 -19.930 -9.179 1.00 0.00 C ATOM 1083 CD2 LEU B 22 11.363 -20.214 -7.476 1.00 0.00 C ATOM 0 H LEU B 22 9.488 -18.597 -10.483 1.00 0.00 H new ATOM 0 HA LEU B 22 9.641 -18.130 -7.747 1.00 0.00 H new ATOM 0 HB2 LEU B 22 11.693 -17.773 -9.943 1.00 0.00 H new ATOM 0 HB3 LEU B 22 12.071 -17.603 -8.240 1.00 0.00 H new ATOM 0 HG LEU B 22 11.002 -20.088 -9.575 1.00 0.00 H new ATOM 0 HD11 LEU B 22 13.312 -21.004 -9.110 1.00 0.00 H new ATOM 0 HD12 LEU B 22 13.364 -19.591 -10.190 1.00 0.00 H new ATOM 0 HD13 LEU B 22 13.785 -19.412 -8.470 1.00 0.00 H new ATOM 0 HD21 LEU B 22 11.571 -21.284 -7.482 1.00 0.00 H new ATOM 0 HD22 LEU B 22 11.984 -19.728 -6.724 1.00 0.00 H new ATOM 0 HD23 LEU B 22 10.312 -20.050 -7.239 1.00 0.00 H new ATOM 1095 N TRP B 23 9.756 -15.326 -9.544 1.00 0.00 N ATOM 1096 CA TRP B 23 9.630 -13.858 -9.448 1.00 0.00 C ATOM 1097 C TRP B 23 8.372 -13.393 -8.693 1.00 0.00 C ATOM 1098 O TRP B 23 8.390 -12.341 -8.050 1.00 0.00 O ATOM 1099 CB TRP B 23 9.598 -13.223 -10.845 1.00 0.00 C ATOM 1100 CG TRP B 23 10.820 -13.394 -11.690 1.00 0.00 C ATOM 1101 CD1 TRP B 23 10.880 -14.131 -12.820 1.00 0.00 C ATOM 1102 CD2 TRP B 23 12.141 -12.786 -11.539 1.00 0.00 C ATOM 1103 NE1 TRP B 23 12.141 -14.041 -13.373 1.00 0.00 N ATOM 1104 CE2 TRP B 23 12.954 -13.202 -12.639 1.00 0.00 C ATOM 1105 CE3 TRP B 23 12.732 -11.914 -10.597 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 14.274 -12.758 -12.805 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 14.054 -11.456 -10.760 1.00 0.00 C ATOM 1108 CH2 TRP B 23 14.821 -11.869 -11.863 1.00 0.00 C ATOM 0 H TRP B 23 9.723 -15.679 -10.501 1.00 0.00 H new ATOM 0 HA TRP B 23 10.505 -13.534 -8.885 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.749 -13.638 -11.388 1.00 0.00 H new ATOM 0 HB3 TRP B 23 9.411 -12.155 -10.729 1.00 0.00 H new ATOM 0 HD1 TRP B 23 10.063 -14.705 -13.230 1.00 0.00 H new ATOM 0 HE1 TRP B 23 12.435 -14.532 -14.217 1.00 0.00 H new ATOM 0 HE3 TRP B 23 12.161 -11.594 -9.738 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 14.863 -13.095 -13.646 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 14.481 -10.782 -10.032 1.00 0.00 H new ATOM 0 HH2 TRP B 23 15.830 -11.504 -11.987 1.00 0.00 H new ATOM 1119 N LYS B 24 7.277 -14.163 -8.766 1.00 0.00 N ATOM 1120 CA LYS B 24 5.992 -13.857 -8.108 1.00 0.00 C ATOM 1121 C LYS B 24 5.986 -14.146 -6.600 1.00 0.00 C ATOM 1122 O LYS B 24 5.121 -13.623 -5.895 1.00 0.00 O ATOM 1123 CB LYS B 24 4.862 -14.661 -8.773 1.00 0.00 C ATOM 1124 CG LYS B 24 4.561 -14.232 -10.220 1.00 0.00 C ATOM 1125 CD LYS B 24 3.715 -15.276 -10.968 1.00 0.00 C ATOM 1126 CE LYS B 24 2.404 -15.637 -10.253 1.00 0.00 C ATOM 1127 NZ LYS B 24 1.829 -16.893 -10.795 1.00 0.00 N ATOM 0 H LYS B 24 7.256 -15.035 -9.295 1.00 0.00 H new ATOM 0 HA LYS B 24 5.838 -12.785 -8.229 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.128 -15.718 -8.765 1.00 0.00 H new ATOM 0 HB3 LYS B 24 3.955 -14.556 -8.177 1.00 0.00 H new ATOM 0 HG2 LYS B 24 4.035 -13.277 -10.213 1.00 0.00 H new ATOM 0 HG3 LYS B 24 5.498 -14.075 -10.754 1.00 0.00 H new ATOM 0 HD2 LYS B 24 3.483 -14.897 -11.963 1.00 0.00 H new ATOM 0 HD3 LYS B 24 4.307 -16.182 -11.102 1.00 0.00 H new ATOM 0 HE2 LYS B 24 2.588 -15.749 -9.184 1.00 0.00 H new ATOM 0 HE3 LYS B 24 1.687 -14.825 -10.370 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 1.022 -17.187 -10.209 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 1.508 -16.735 -11.772 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 2.553 -17.639 -10.785 1.00 0.00 H new ATOM 1141 N LEU B 25 6.914 -14.976 -6.109 1.00 0.00 N ATOM 1142 CA LEU B 25 6.975 -15.401 -4.702 1.00 0.00 C ATOM 1143 C LEU B 25 8.251 -14.976 -3.957 1.00 0.00 C ATOM 1144 O LEU B 25 8.156 -14.617 -2.783 1.00 0.00 O ATOM 1145 CB LEU B 25 6.842 -16.938 -4.641 1.00 0.00 C ATOM 1146 CG LEU B 25 5.528 -17.530 -5.189 1.00 0.00 C ATOM 1147 CD1 LEU B 25 5.578 -19.054 -5.074 1.00 0.00 C ATOM 1148 CD2 LEU B 25 4.299 -17.040 -4.421 1.00 0.00 C ATOM 0 H LEU B 25 7.654 -15.378 -6.684 1.00 0.00 H new ATOM 0 HA LEU B 25 6.152 -14.897 -4.195 1.00 0.00 H new ATOM 0 HB2 LEU B 25 7.672 -17.376 -5.195 1.00 0.00 H new ATOM 0 HB3 LEU B 25 6.952 -17.250 -3.603 1.00 0.00 H new ATOM 0 HG LEU B 25 5.437 -17.205 -6.225 1.00 0.00 H new ATOM 0 HD11 LEU B 25 4.651 -19.479 -5.460 1.00 0.00 H new ATOM 0 HD12 LEU B 25 6.420 -19.435 -5.652 1.00 0.00 H new ATOM 0 HD13 LEU B 25 5.698 -19.336 -4.028 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.401 -17.487 -4.848 1.00 0.00 H new ATOM 0 HD22 LEU B 25 4.386 -17.329 -3.374 1.00 0.00 H new ATOM 0 HD23 LEU B 25 4.233 -15.954 -4.494 1.00 0.00 H new ATOM 1408 N LEU B 43 28.393 -3.621 -4.658 1.00 0.00 N ATOM 1409 CA LEU B 43 28.007 -4.998 -5.004 1.00 0.00 C ATOM 1410 C LEU B 43 27.365 -5.061 -6.400 1.00 0.00 C ATOM 1411 O LEU B 43 26.715 -4.105 -6.828 1.00 0.00 O ATOM 1412 CB LEU B 43 27.073 -5.561 -3.905 1.00 0.00 C ATOM 1413 CG LEU B 43 25.755 -4.784 -3.690 1.00 0.00 C ATOM 1414 CD1 LEU B 43 24.586 -5.319 -4.523 1.00 0.00 C ATOM 1415 CD2 LEU B 43 25.319 -4.838 -2.225 1.00 0.00 C ATOM 0 HA LEU B 43 28.899 -5.623 -5.048 1.00 0.00 H new ATOM 0 HB2 LEU B 43 26.829 -6.594 -4.154 1.00 0.00 H new ATOM 0 HB3 LEU B 43 27.620 -5.581 -2.963 1.00 0.00 H new ATOM 0 HG LEU B 43 25.979 -3.765 -4.006 1.00 0.00 H new ATOM 0 HD11 LEU B 43 23.694 -4.726 -4.321 1.00 0.00 H new ATOM 0 HD12 LEU B 43 24.834 -5.253 -5.582 1.00 0.00 H new ATOM 0 HD13 LEU B 43 24.397 -6.360 -4.259 1.00 0.00 H new ATOM 0 HD21 LEU B 43 24.389 -4.283 -2.102 1.00 0.00 H new ATOM 0 HD22 LEU B 43 25.165 -5.876 -1.929 1.00 0.00 H new ATOM 0 HD23 LEU B 43 26.092 -4.393 -1.599 1.00 0.00 H new ATOM 1427 N MET B 44 27.525 -6.189 -7.103 1.00 0.00 N ATOM 1428 CA MET B 44 26.933 -6.419 -8.429 1.00 0.00 C ATOM 1429 C MET B 44 26.843 -7.914 -8.769 1.00 0.00 C ATOM 1430 O MET B 44 27.791 -8.673 -8.544 1.00 0.00 O ATOM 1431 CB MET B 44 27.731 -5.663 -9.508 1.00 0.00 C ATOM 1432 CG MET B 44 27.096 -5.753 -10.904 1.00 0.00 C ATOM 1433 SD MET B 44 25.303 -5.453 -11.016 1.00 0.00 S ATOM 1434 CE MET B 44 25.154 -3.861 -10.159 1.00 0.00 C ATOM 0 H MET B 44 28.076 -6.978 -6.764 1.00 0.00 H new ATOM 0 HA MET B 44 25.914 -6.033 -8.405 1.00 0.00 H new ATOM 0 HB2 MET B 44 27.815 -4.615 -9.221 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.744 -6.064 -9.550 1.00 0.00 H new ATOM 0 HG2 MET B 44 27.601 -5.037 -11.553 1.00 0.00 H new ATOM 0 HG3 MET B 44 27.299 -6.746 -11.306 1.00 0.00 H new ATOM 0 HE1 MET B 44 24.337 -3.287 -10.596 1.00 0.00 H new ATOM 0 HE2 MET B 44 24.951 -4.034 -9.102 1.00 0.00 H new ATOM 0 HE3 MET B 44 26.085 -3.303 -10.263 1.00 0.00 H new ATOM 1444 N LEU B 45 25.688 -8.311 -9.313 1.00 0.00 N ATOM 1445 CA LEU B 45 25.333 -9.680 -9.696 1.00 0.00 C ATOM 1446 C LEU B 45 26.267 -10.269 -10.771 1.00 0.00 C ATOM 1447 O LEU B 45 26.888 -9.552 -11.562 1.00 0.00 O ATOM 1448 CB LEU B 45 23.853 -9.715 -10.148 1.00 0.00 C ATOM 1449 CG LEU B 45 22.765 -9.602 -9.054 1.00 0.00 C ATOM 1450 CD1 LEU B 45 22.777 -10.783 -8.083 1.00 0.00 C ATOM 1451 CD2 LEU B 45 22.819 -8.316 -8.227 1.00 0.00 C ATOM 0 H LEU B 45 24.936 -7.650 -9.508 1.00 0.00 H new ATOM 0 HA LEU B 45 25.463 -10.317 -8.821 1.00 0.00 H new ATOM 0 HB2 LEU B 45 23.700 -8.903 -10.859 1.00 0.00 H new ATOM 0 HB3 LEU B 45 23.689 -10.647 -10.689 1.00 0.00 H new ATOM 0 HG LEU B 45 21.842 -9.596 -9.633 1.00 0.00 H new ATOM 0 HD11 LEU B 45 21.993 -10.649 -7.338 1.00 0.00 H new ATOM 0 HD12 LEU B 45 22.602 -11.708 -8.633 1.00 0.00 H new ATOM 0 HD13 LEU B 45 23.745 -10.835 -7.585 1.00 0.00 H new ATOM 0 HD21 LEU B 45 22.019 -8.326 -7.486 1.00 0.00 H new ATOM 0 HD22 LEU B 45 23.782 -8.249 -7.721 1.00 0.00 H new ATOM 0 HD23 LEU B 45 22.694 -7.455 -8.884 1.00 0.00 H new ATOM 1463 N SER B 46 26.317 -11.601 -10.806 1.00 0.00 N ATOM 1464 CA SER B 46 27.131 -12.424 -11.714 1.00 0.00 C ATOM 1465 C SER B 46 26.288 -13.565 -12.307 1.00 0.00 C ATOM 1466 O SER B 46 25.236 -13.891 -11.746 1.00 0.00 O ATOM 1467 CB SER B 46 28.308 -13.012 -10.914 1.00 0.00 C ATOM 1468 OG SER B 46 29.256 -12.006 -10.598 1.00 0.00 O ATOM 0 H SER B 46 25.761 -12.170 -10.168 1.00 0.00 H new ATOM 0 HA SER B 46 27.499 -11.808 -12.534 1.00 0.00 H new ATOM 0 HB2 SER B 46 27.937 -13.469 -9.997 1.00 0.00 H new ATOM 0 HB3 SER B 46 28.788 -13.801 -11.492 1.00 0.00 H new ATOM 0 HG SER B 46 29.994 -12.401 -10.088 1.00 0.00 H new ATOM 1474 N PRO B 47 26.715 -14.219 -13.410 1.00 0.00 N ATOM 1475 CA PRO B 47 25.965 -15.328 -14.012 1.00 0.00 C ATOM 1476 C PRO B 47 25.698 -16.495 -13.046 1.00 0.00 C ATOM 1477 O PRO B 47 24.733 -17.225 -13.248 1.00 0.00 O ATOM 1478 CB PRO B 47 26.741 -15.748 -15.263 1.00 0.00 C ATOM 1479 CG PRO B 47 28.154 -15.223 -15.013 1.00 0.00 C ATOM 1480 CD PRO B 47 27.918 -13.959 -14.190 1.00 0.00 C ATOM 0 HA PRO B 47 24.960 -14.998 -14.275 1.00 0.00 H new ATOM 0 HB2 PRO B 47 26.734 -16.830 -15.393 1.00 0.00 H new ATOM 0 HB3 PRO B 47 26.308 -15.316 -16.165 1.00 0.00 H new ATOM 0 HG2 PRO B 47 28.763 -15.948 -14.472 1.00 0.00 H new ATOM 0 HG3 PRO B 47 28.673 -15.004 -15.946 1.00 0.00 H new ATOM 0 HD2 PRO B 47 28.768 -13.749 -13.541 1.00 0.00 H new ATOM 0 HD3 PRO B 47 27.787 -13.090 -14.835 1.00 0.00 H new ATOM 1488 N ASP B 48 26.480 -16.641 -11.969 1.00 0.00 N ATOM 1489 CA ASP B 48 26.271 -17.645 -10.911 1.00 0.00 C ATOM 1490 C ASP B 48 24.877 -17.538 -10.249 1.00 0.00 C ATOM 1491 O ASP B 48 24.262 -18.547 -9.902 1.00 0.00 O ATOM 1492 CB ASP B 48 27.377 -17.479 -9.862 1.00 0.00 C ATOM 1493 CG ASP B 48 27.317 -18.574 -8.782 1.00 0.00 C ATOM 1494 OD1 ASP B 48 27.662 -19.741 -9.084 1.00 0.00 O ATOM 1495 OD2 ASP B 48 26.959 -18.264 -7.621 1.00 0.00 O ATOM 0 H ASP B 48 27.296 -16.052 -11.803 1.00 0.00 H new ATOM 0 HA ASP B 48 26.315 -18.635 -11.365 1.00 0.00 H new ATOM 0 HB2 ASP B 48 28.350 -17.507 -10.353 1.00 0.00 H new ATOM 0 HB3 ASP B 48 27.286 -16.500 -9.391 1.00 0.00 H new ATOM 1500 N ASP B 49 24.351 -16.315 -10.112 1.00 0.00 N ATOM 1501 CA ASP B 49 23.012 -16.035 -9.576 1.00 0.00 C ATOM 1502 C ASP B 49 21.901 -16.311 -10.603 1.00 0.00 C ATOM 1503 O ASP B 49 20.765 -16.616 -10.236 1.00 0.00 O ATOM 1504 CB ASP B 49 22.905 -14.558 -9.176 1.00 0.00 C ATOM 1505 CG ASP B 49 23.835 -14.177 -8.018 1.00 0.00 C ATOM 1506 OD1 ASP B 49 25.005 -13.800 -8.261 1.00 0.00 O ATOM 1507 OD2 ASP B 49 23.383 -14.222 -6.851 1.00 0.00 O ATOM 0 H ASP B 49 24.857 -15.470 -10.378 1.00 0.00 H new ATOM 0 HA ASP B 49 22.879 -16.694 -8.718 1.00 0.00 H new ATOM 0 HB2 ASP B 49 23.138 -13.936 -10.040 1.00 0.00 H new ATOM 0 HB3 ASP B 49 21.875 -14.338 -8.894 1.00 0.00 H new ATOM 1512 N ILE B 50 22.226 -16.175 -11.892 1.00 0.00 N ATOM 1513 CA ILE B 50 21.307 -16.338 -13.026 1.00 0.00 C ATOM 1514 C ILE B 50 21.166 -17.820 -13.415 1.00 0.00 C ATOM 1515 O ILE B 50 20.068 -18.293 -13.706 1.00 0.00 O ATOM 1516 CB ILE B 50 21.785 -15.474 -14.217 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.096 -14.015 -13.796 1.00 0.00 C ATOM 1518 CG2 ILE B 50 20.701 -15.475 -15.303 1.00 0.00 C ATOM 1519 CD1 ILE B 50 22.577 -13.105 -14.934 1.00 0.00 C ATOM 0 H ILE B 50 23.173 -15.939 -12.187 1.00 0.00 H new ATOM 0 HA ILE B 50 20.316 -15.993 -12.731 1.00 0.00 H new ATOM 0 HB ILE B 50 22.710 -15.908 -14.596 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.199 -13.580 -13.356 1.00 0.00 H new ATOM 0 HG13 ILE B 50 22.857 -14.031 -13.016 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.030 -14.868 -16.146 1.00 0.00 H new ATOM 0 HG22 ILE B 50 20.523 -16.497 -15.639 1.00 0.00 H new ATOM 0 HG23 ILE B 50 19.778 -15.061 -14.896 1.00 0.00 H new ATOM 0 HD11 ILE B 50 22.769 -12.105 -14.544 1.00 0.00 H new ATOM 0 HD12 ILE B 50 23.494 -13.510 -15.361 1.00 0.00 H new ATOM 0 HD13 ILE B 50 21.810 -13.052 -15.706 1.00 0.00 H new ATOM 1531 N GLU B 51 22.253 -18.595 -13.367 1.00 0.00 N ATOM 1532 CA GLU B 51 22.244 -20.041 -13.643 1.00 0.00 C ATOM 1533 C GLU B 51 21.558 -20.871 -12.530 1.00 0.00 C ATOM 1534 O GLU B 51 21.523 -22.101 -12.583 1.00 0.00 O ATOM 1535 CB GLU B 51 23.662 -20.534 -13.984 1.00 0.00 C ATOM 1536 CG GLU B 51 24.607 -20.673 -12.786 1.00 0.00 C ATOM 1537 CD GLU B 51 25.989 -21.181 -13.239 1.00 0.00 C ATOM 1538 OE1 GLU B 51 26.872 -20.357 -13.584 1.00 0.00 O ATOM 1539 OE2 GLU B 51 26.208 -22.417 -13.256 1.00 0.00 O ATOM 0 H GLU B 51 23.178 -18.235 -13.133 1.00 0.00 H new ATOM 0 HA GLU B 51 21.622 -20.203 -14.523 1.00 0.00 H new ATOM 0 HB2 GLU B 51 23.584 -21.502 -14.480 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.107 -19.844 -14.700 1.00 0.00 H new ATOM 0 HG2 GLU B 51 24.714 -19.710 -12.287 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.181 -21.364 -12.058 1.00 0.00 H new ATOM 1546 N GLN B 52 20.995 -20.209 -11.514 1.00 0.00 N ATOM 1547 CA GLN B 52 20.254 -20.828 -10.417 1.00 0.00 C ATOM 1548 C GLN B 52 18.790 -21.111 -10.798 1.00 0.00 C ATOM 1549 O GLN B 52 18.345 -22.250 -10.684 1.00 0.00 O ATOM 1550 CB GLN B 52 20.419 -19.926 -9.178 1.00 0.00 C ATOM 1551 CG GLN B 52 19.300 -19.933 -8.115 1.00 0.00 C ATOM 1552 CD GLN B 52 18.146 -18.959 -8.380 1.00 0.00 C ATOM 1553 OE1 GLN B 52 16.988 -19.275 -8.144 1.00 0.00 O ATOM 1554 NE2 GLN B 52 18.384 -17.765 -8.885 1.00 0.00 N ATOM 0 H GLN B 52 21.046 -19.194 -11.433 1.00 0.00 H new ATOM 0 HA GLN B 52 20.657 -21.814 -10.185 1.00 0.00 H new ATOM 0 HB2 GLN B 52 21.349 -20.207 -8.684 1.00 0.00 H new ATOM 0 HB3 GLN B 52 20.540 -18.900 -9.527 1.00 0.00 H new ATOM 0 HG2 GLN B 52 18.894 -20.942 -8.044 1.00 0.00 H new ATOM 0 HG3 GLN B 52 19.739 -19.697 -7.146 1.00 0.00 H new ATOM 0 HE21 GLN B 52 19.342 -17.480 -9.090 1.00 0.00 H new ATOM 0 HE22 GLN B 52 17.611 -17.126 -9.071 1.00 0.00 H new ATOM 1563 N TRP B 53 18.026 -20.112 -11.260 1.00 0.00 N ATOM 1564 CA TRP B 53 16.603 -20.292 -11.591 1.00 0.00 C ATOM 1565 C TRP B 53 16.334 -21.046 -12.897 1.00 0.00 C ATOM 1566 O TRP B 53 15.302 -21.705 -13.008 1.00 0.00 O ATOM 1567 CB TRP B 53 15.857 -18.949 -11.495 1.00 0.00 C ATOM 1568 CG TRP B 53 16.494 -17.729 -12.091 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.078 -17.654 -13.305 1.00 0.00 C ATOM 1570 CD2 TRP B 53 16.651 -16.399 -11.497 1.00 0.00 C ATOM 1571 NE1 TRP B 53 17.587 -16.388 -13.507 1.00 0.00 N ATOM 1572 CE2 TRP B 53 17.399 -15.585 -12.403 1.00 0.00 C ATOM 1573 CE3 TRP B 53 16.264 -15.805 -10.275 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 17.788 -14.273 -12.097 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 16.645 -14.487 -9.958 1.00 0.00 C ATOM 1576 CH2 TRP B 53 17.418 -13.728 -10.855 1.00 0.00 C ATOM 0 H TRP B 53 18.371 -19.165 -11.414 1.00 0.00 H new ATOM 0 HA TRP B 53 16.194 -20.963 -10.836 1.00 0.00 H new ATOM 0 HB2 TRP B 53 14.883 -19.077 -11.966 1.00 0.00 H new ATOM 0 HB3 TRP B 53 15.676 -18.746 -10.440 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.138 -18.466 -14.014 1.00 0.00 H new ATOM 0 HE1 TRP B 53 18.045 -16.084 -14.366 1.00 0.00 H new ATOM 0 HE3 TRP B 53 15.667 -16.370 -9.574 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 18.362 -13.691 -12.803 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 16.341 -14.054 -9.016 1.00 0.00 H new ATOM 0 HH2 TRP B 53 17.727 -12.728 -10.590 1.00 0.00 H new ATOM 1587 N PHE B 54 17.262 -21.026 -13.860 1.00 0.00 N ATOM 1588 CA PHE B 54 17.102 -21.762 -15.126 1.00 0.00 C ATOM 1589 C PHE B 54 17.284 -23.291 -14.965 1.00 0.00 C ATOM 1590 O PHE B 54 16.985 -24.050 -15.889 1.00 0.00 O ATOM 1591 CB PHE B 54 18.017 -21.166 -16.221 1.00 0.00 C ATOM 1592 CG PHE B 54 19.329 -21.886 -16.498 1.00 0.00 C ATOM 1593 CD1 PHE B 54 20.169 -22.273 -15.440 1.00 0.00 C ATOM 1594 CD2 PHE B 54 19.708 -22.195 -17.820 1.00 0.00 C ATOM 1595 CE1 PHE B 54 21.355 -22.983 -15.685 1.00 0.00 C ATOM 1596 CE2 PHE B 54 20.905 -22.891 -18.072 1.00 0.00 C ATOM 1597 CZ PHE B 54 21.728 -23.289 -17.004 1.00 0.00 C ATOM 0 H PHE B 54 18.137 -20.506 -13.789 1.00 0.00 H new ATOM 0 HA PHE B 54 16.069 -21.632 -15.449 1.00 0.00 H new ATOM 0 HB2 PHE B 54 17.450 -21.127 -17.151 1.00 0.00 H new ATOM 0 HB3 PHE B 54 18.248 -20.137 -15.945 1.00 0.00 H new ATOM 0 HD1 PHE B 54 19.899 -22.021 -14.425 1.00 0.00 H new ATOM 0 HD2 PHE B 54 19.077 -21.896 -18.644 1.00 0.00 H new ATOM 0 HE1 PHE B 54 21.980 -23.293 -14.860 1.00 0.00 H new ATOM 0 HE2 PHE B 54 21.192 -23.120 -19.088 1.00 0.00 H new ATOM 0 HZ PHE B 54 22.644 -23.828 -17.197 1.00 0.00 H new ATOM 1607 N THR B 55 17.782 -23.749 -13.803 1.00 0.00 N ATOM 1608 CA THR B 55 18.045 -25.171 -13.524 1.00 0.00 C ATOM 1609 C THR B 55 16.768 -26.005 -13.343 1.00 0.00 C ATOM 1610 O THR B 55 16.793 -27.195 -13.647 1.00 0.00 O ATOM 1611 CB THR B 55 18.992 -25.324 -12.312 1.00 0.00 C ATOM 1612 OG1 THR B 55 19.821 -26.454 -12.485 1.00 0.00 O ATOM 1613 CG2 THR B 55 18.308 -25.460 -10.947 1.00 0.00 C ATOM 0 H THR B 55 18.016 -23.135 -13.023 1.00 0.00 H new ATOM 0 HA THR B 55 18.538 -25.573 -14.409 1.00 0.00 H new ATOM 0 HB THR B 55 19.551 -24.388 -12.293 1.00 0.00 H new ATOM 0 HG1 THR B 55 20.419 -26.542 -11.713 1.00 0.00 H new ATOM 0 HG21 THR B 55 19.065 -25.561 -10.169 1.00 0.00 H new ATOM 0 HG22 THR B 55 17.704 -24.574 -10.753 1.00 0.00 H new ATOM 0 HG23 THR B 55 17.668 -26.342 -10.947 1.00 0.00 H new