USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 793 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 190 THR OG1 : rot 180:sc= -0.268 USER MOD Set 1.2: A 191 THR OG1 : rot 67:sc= 1.02 USER MOD Set 2.1: A 187 HIS : no HE2:sc= -3.22! C(o=-5!,f=-8.8!) USER MOD Set 2.2: A 188 THR OG1 : rot -160:sc= 0 USER MOD Set 2.3: A 206 MET CE :methyl -139:sc= -1.74! (180deg=-1.33) USER MOD Set 3.1: A 181 ASN : amide:sc= -1.29 K(o=-1.1,f=-8.6!) USER MOD Set 3.2: A 185 LYS NZ :NH3+ 144:sc= 0.168 (180deg=0) USER MOD Set 4.1: A 163 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 217 GLN : amide:sc= -0.371 K(o=-0.37,f=-0.94) USER MOD Set 5.1: A 159 ASN : amide:sc= 0.22 K(o=1,f=-3.3!) USER MOD Set 5.2: A 160 GLN : amide:sc= 0.813 K(o=1,f=0.22) USER MOD Single : A 128 TYR OH : rot -114:sc= 1.3 USER MOD Single : A 129 MET CE :methyl 157:sc= -0.0688 (180deg=-0.745) USER MOD Single : A 132 SER OG : rot 180:sc= 0.102 USER MOD Single : A 134 MET CE :methyl -171:sc= -0.0276 (180deg=-0.375) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl 161:sc= -1.16 (180deg=-2.02!) USER MOD Single : A 140 HIS : no HE2:sc= 0.998 K(o=1,f=-4.6!) USER MOD Single : A 143 ASN : amide:sc= 0.877 K(o=0.88,f=-0.28) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot -145:sc= 1.32 USER MOD Single : A 153 ASN : amide:sc= 1.16 K(o=1.2,f=-2.2!) USER MOD Single : A 154 MET CE :methyl 175:sc= -0.41 (180deg=-0.552) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 170 SER OG : rot 120:sc= 0 USER MOD Single : A 171 ASN : amide:sc= -0.0739 K(o=-0.074,f=-2.1) USER MOD Single : A 172 GLN : amide:sc= -0.323 X(o=-0.32,f=-0.021) USER MOD Single : A 173 ASN : amide:sc= -0.32 X(o=-0.32,f=0) USER MOD Single : A 174 ASN : amide:sc= -0.118 K(o=-0.12,f=-1.8) USER MOD Single : A 177 HIS : no HD1:sc= -1.48! K(o=-1.5!,f=-0.66) USER MOD Single : A 183 THR OG1 : rot 80:sc= 1.68 USER MOD Single : A 186 GLN : amide:sc= -0.861 K(o=-0.86,f=-1.8) USER MOD Single : A 192 THR OG1 : rot 180:sc= -0.669 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ -126:sc= 0.117 (180deg=-0.603) USER MOD Single : A 197 ASN : amide:sc= -0.534! X(o=-0.53!,f=-0.26) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.00388 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -105:sc= -2.1 (180deg=-2.89!) USER MOD Single : A 212 GLN : amide:sc= -0.359 K(o=-0.36,f=-3.4!) USER MOD Single : A 213 MET CE :methyl -156:sc= -0.575 (180deg=-2.84) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 223 GLN : amide:sc= 0.0979 X(o=0.098,f=0) USER MOD Single : A 225 TYR OH : rot 150:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 6.505 -13.605 -1.475 1.00 0.00 N ATOM 66 CA LEU A 125 6.962 -12.979 -0.230 1.00 0.00 C ATOM 67 C LEU A 125 8.243 -13.588 0.355 1.00 0.00 C ATOM 68 O LEU A 125 8.494 -13.486 1.554 1.00 0.00 O ATOM 69 CB LEU A 125 5.809 -12.945 0.787 1.00 0.00 C ATOM 70 CG LEU A 125 4.787 -11.858 0.408 1.00 0.00 C ATOM 71 CD1 LEU A 125 3.595 -12.365 -0.389 1.00 0.00 C ATOM 72 CD2 LEU A 125 4.408 -11.015 1.615 1.00 0.00 C ATOM 0 HA LEU A 125 7.251 -11.957 -0.477 1.00 0.00 H new ATOM 0 HB2 LEU A 125 5.318 -13.918 0.822 1.00 0.00 H new ATOM 0 HB3 LEU A 125 6.202 -12.751 1.785 1.00 0.00 H new ATOM 0 HG LEU A 125 5.291 -11.196 -0.296 1.00 0.00 H new ATOM 0 HD11 LEU A 125 2.927 -11.534 -0.613 1.00 0.00 H new ATOM 0 HD12 LEU A 125 3.943 -12.811 -1.320 1.00 0.00 H new ATOM 0 HD13 LEU A 125 3.059 -13.114 0.194 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.685 -10.256 1.316 1.00 0.00 H new ATOM 0 HD22 LEU A 125 3.968 -11.654 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.299 -10.530 2.014 1.00 0.00 H new ATOM 84 N GLY A 126 9.080 -14.192 -0.480 1.00 0.00 N ATOM 85 CA GLY A 126 10.366 -14.775 -0.122 1.00 0.00 C ATOM 86 C GLY A 126 11.432 -13.734 0.198 1.00 0.00 C ATOM 87 O GLY A 126 12.453 -13.687 -0.477 1.00 0.00 O ATOM 0 H GLY A 126 8.870 -14.293 -1.473 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.234 -15.427 0.742 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.714 -15.401 -0.943 1.00 0.00 H new ATOM 91 N GLY A 127 11.187 -12.850 1.166 1.00 0.00 N ATOM 92 CA GLY A 127 12.094 -11.800 1.587 1.00 0.00 C ATOM 93 C GLY A 127 11.371 -10.474 1.748 1.00 0.00 C ATOM 94 O GLY A 127 11.898 -9.563 2.385 1.00 0.00 O ATOM 0 H GLY A 127 10.315 -12.852 1.695 1.00 0.00 H new ATOM 0 HA2 GLY A 127 12.561 -12.078 2.532 1.00 0.00 H new ATOM 0 HA3 GLY A 127 12.894 -11.693 0.855 1.00 0.00 H new ATOM 98 N TYR A 128 10.124 -10.393 1.276 1.00 0.00 N ATOM 99 CA TYR A 128 9.258 -9.277 1.564 1.00 0.00 C ATOM 100 C TYR A 128 9.091 -9.115 3.067 1.00 0.00 C ATOM 101 O TYR A 128 9.094 -10.090 3.831 1.00 0.00 O ATOM 102 CB TYR A 128 7.899 -9.521 0.931 1.00 0.00 C ATOM 103 CG TYR A 128 7.831 -9.229 -0.551 1.00 0.00 C ATOM 104 CD1 TYR A 128 8.494 -10.079 -1.454 1.00 0.00 C ATOM 105 CD2 TYR A 128 7.067 -8.146 -1.030 1.00 0.00 C ATOM 106 CE1 TYR A 128 8.309 -9.921 -2.830 1.00 0.00 C ATOM 107 CE2 TYR A 128 6.898 -7.972 -2.417 1.00 0.00 C ATOM 108 CZ TYR A 128 7.492 -8.890 -3.320 1.00 0.00 C ATOM 109 OH TYR A 128 7.245 -8.878 -4.653 1.00 0.00 O ATOM 0 H TYR A 128 9.698 -11.107 0.684 1.00 0.00 H new ATOM 0 HA TYR A 128 9.701 -8.368 1.156 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.618 -10.561 1.096 1.00 0.00 H new ATOM 0 HB3 TYR A 128 7.159 -8.906 1.443 1.00 0.00 H new ATOM 0 HD1 TYR A 128 9.147 -10.855 -1.083 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.613 -7.453 -0.337 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.796 -10.595 -3.519 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.318 -7.142 -2.792 1.00 0.00 H new ATOM 0 HH TYR A 128 7.659 -8.086 -5.055 1.00 0.00 H new ATOM 119 N MET A 129 8.913 -7.866 3.455 1.00 0.00 N ATOM 120 CA MET A 129 8.808 -7.393 4.816 1.00 0.00 C ATOM 121 C MET A 129 7.421 -6.834 4.977 1.00 0.00 C ATOM 122 O MET A 129 6.793 -6.442 3.990 1.00 0.00 O ATOM 123 CB MET A 129 9.864 -6.314 5.094 1.00 0.00 C ATOM 124 CG MET A 129 11.193 -6.645 4.425 1.00 0.00 C ATOM 125 SD MET A 129 12.662 -6.049 5.274 1.00 0.00 S ATOM 126 CE MET A 129 13.574 -7.592 5.042 1.00 0.00 C ATOM 0 H MET A 129 8.833 -7.106 2.779 1.00 0.00 H new ATOM 0 HA MET A 129 8.983 -8.203 5.525 1.00 0.00 H new ATOM 0 HB2 MET A 129 9.504 -5.350 4.733 1.00 0.00 H new ATOM 0 HB3 MET A 129 10.012 -6.217 6.170 1.00 0.00 H new ATOM 0 HG2 MET A 129 11.268 -7.728 4.324 1.00 0.00 H new ATOM 0 HG3 MET A 129 11.185 -6.230 3.417 1.00 0.00 H new ATOM 0 HE1 MET A 129 14.644 -7.395 5.103 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.291 -8.302 5.819 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.338 -8.011 4.064 1.00 0.00 H new ATOM 136 N LEU A 130 6.967 -6.773 6.220 1.00 0.00 N ATOM 137 CA LEU A 130 5.683 -6.215 6.562 1.00 0.00 C ATOM 138 C LEU A 130 5.968 -5.021 7.448 1.00 0.00 C ATOM 139 O LEU A 130 6.478 -5.196 8.557 1.00 0.00 O ATOM 140 CB LEU A 130 4.816 -7.279 7.240 1.00 0.00 C ATOM 141 CG LEU A 130 3.328 -6.912 7.451 1.00 0.00 C ATOM 142 CD1 LEU A 130 2.952 -7.139 8.904 1.00 0.00 C ATOM 143 CD2 LEU A 130 2.807 -5.590 6.884 1.00 0.00 C ATOM 0 H LEU A 130 7.493 -7.116 7.024 1.00 0.00 H new ATOM 0 HA LEU A 130 5.117 -5.891 5.689 1.00 0.00 H new ATOM 0 HB2 LEU A 130 4.863 -8.191 6.644 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.253 -7.510 8.211 1.00 0.00 H new ATOM 0 HG LEU A 130 2.789 -7.601 6.801 1.00 0.00 H new ATOM 0 HD11 LEU A 130 1.904 -6.881 9.053 1.00 0.00 H new ATOM 0 HD12 LEU A 130 3.107 -8.187 9.161 1.00 0.00 H new ATOM 0 HD13 LEU A 130 3.575 -6.513 9.543 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.748 -5.486 7.119 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.360 -4.761 7.326 1.00 0.00 H new ATOM 0 HD23 LEU A 130 2.942 -5.580 5.802 1.00 0.00 H new ATOM 155 N GLY A 131 5.704 -3.816 6.945 1.00 0.00 N ATOM 156 CA GLY A 131 5.937 -2.603 7.691 1.00 0.00 C ATOM 157 C GLY A 131 5.074 -2.538 8.945 1.00 0.00 C ATOM 158 O GLY A 131 4.192 -3.362 9.188 1.00 0.00 O ATOM 0 H GLY A 131 5.324 -3.664 6.011 1.00 0.00 H new ATOM 0 HA2 GLY A 131 6.989 -2.544 7.970 1.00 0.00 H new ATOM 0 HA3 GLY A 131 5.726 -1.741 7.059 1.00 0.00 H new ATOM 162 N SER A 132 5.336 -1.524 9.749 1.00 0.00 N ATOM 163 CA SER A 132 4.585 -1.225 10.946 1.00 0.00 C ATOM 164 C SER A 132 3.283 -0.490 10.637 1.00 0.00 C ATOM 165 O SER A 132 3.135 0.105 9.566 1.00 0.00 O ATOM 166 CB SER A 132 5.488 -0.404 11.857 1.00 0.00 C ATOM 167 OG SER A 132 6.400 0.455 11.179 1.00 0.00 O ATOM 0 H SER A 132 6.100 -0.869 9.579 1.00 0.00 H new ATOM 0 HA SER A 132 4.289 -2.151 11.439 1.00 0.00 H new ATOM 0 HB2 SER A 132 4.864 0.200 12.516 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.056 -1.085 12.492 1.00 0.00 H new ATOM 0 HG SER A 132 6.938 0.945 11.836 1.00 0.00 H new ATOM 173 N ALA A 133 2.377 -0.486 11.616 1.00 0.00 N ATOM 174 CA ALA A 133 1.108 0.231 11.587 1.00 0.00 C ATOM 175 C ALA A 133 1.339 1.709 11.278 1.00 0.00 C ATOM 176 O ALA A 133 2.122 2.365 11.965 1.00 0.00 O ATOM 177 CB ALA A 133 0.395 0.028 12.924 1.00 0.00 C ATOM 0 H ALA A 133 2.516 -1.004 12.484 1.00 0.00 H new ATOM 0 HA ALA A 133 0.472 -0.162 10.794 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -0.556 0.560 12.914 1.00 0.00 H new ATOM 0 HB2 ALA A 133 0.214 -1.035 13.082 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.018 0.414 13.731 1.00 0.00 H new ATOM 183 N MET A 134 0.692 2.215 10.232 1.00 0.00 N ATOM 184 CA MET A 134 0.799 3.582 9.741 1.00 0.00 C ATOM 185 C MET A 134 -0.564 4.258 9.839 1.00 0.00 C ATOM 186 O MET A 134 -1.591 3.612 10.083 1.00 0.00 O ATOM 187 CB MET A 134 1.309 3.585 8.289 1.00 0.00 C ATOM 188 CG MET A 134 2.741 3.054 8.173 1.00 0.00 C ATOM 189 SD MET A 134 3.970 4.240 7.546 1.00 0.00 S ATOM 190 CE MET A 134 3.980 3.724 5.817 1.00 0.00 C ATOM 0 H MET A 134 0.047 1.653 9.677 1.00 0.00 H new ATOM 0 HA MET A 134 1.513 4.136 10.350 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.647 2.976 7.673 1.00 0.00 H new ATOM 0 HB3 MET A 134 1.267 4.600 7.894 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.063 2.710 9.156 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.735 2.183 7.517 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.792 4.227 5.292 1.00 0.00 H new ATOM 0 HE2 MET A 134 4.125 2.645 5.760 1.00 0.00 H new ATOM 0 HE3 MET A 134 3.030 3.988 5.353 1.00 0.00 H new ATOM 200 N SER A 135 -0.583 5.569 9.625 1.00 0.00 N ATOM 201 CA SER A 135 -1.778 6.381 9.720 1.00 0.00 C ATOM 202 C SER A 135 -2.276 6.700 8.321 1.00 0.00 C ATOM 203 O SER A 135 -1.501 6.928 7.389 1.00 0.00 O ATOM 204 CB SER A 135 -1.446 7.628 10.523 1.00 0.00 C ATOM 205 OG SER A 135 -2.582 8.323 10.994 1.00 0.00 O ATOM 0 H SER A 135 0.251 6.102 9.376 1.00 0.00 H new ATOM 0 HA SER A 135 -2.581 5.854 10.234 1.00 0.00 H new ATOM 0 HB2 SER A 135 -0.826 7.346 11.374 1.00 0.00 H new ATOM 0 HB3 SER A 135 -0.852 8.300 9.904 1.00 0.00 H new ATOM 0 HG SER A 135 -2.296 9.111 11.502 1.00 0.00 H new ATOM 211 N ARG A 136 -3.595 6.703 8.214 1.00 0.00 N ATOM 212 CA ARG A 136 -4.370 6.822 6.981 1.00 0.00 C ATOM 213 C ARG A 136 -4.072 8.161 6.269 1.00 0.00 C ATOM 214 O ARG A 136 -4.419 9.213 6.815 1.00 0.00 O ATOM 215 CB ARG A 136 -5.865 6.567 7.234 1.00 0.00 C ATOM 216 CG ARG A 136 -6.405 7.392 8.397 1.00 0.00 C ATOM 217 CD ARG A 136 -7.762 6.941 8.910 1.00 0.00 C ATOM 218 NE ARG A 136 -7.950 7.675 10.156 1.00 0.00 N ATOM 219 CZ ARG A 136 -8.359 7.224 11.349 1.00 0.00 C ATOM 220 NH1 ARG A 136 -8.873 6.007 11.495 1.00 0.00 N ATOM 221 NH2 ARG A 136 -8.221 7.998 12.416 1.00 0.00 N ATOM 0 H ARG A 136 -4.194 6.617 9.035 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.055 6.040 6.289 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.429 6.803 6.332 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -6.021 5.508 7.440 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.689 7.353 9.218 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.476 8.434 8.085 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -8.552 7.168 8.194 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.784 5.864 9.078 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.741 8.672 10.113 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.964 5.391 10.687 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -9.177 5.689 12.415 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.807 8.926 12.323 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -8.529 7.666 13.330 1.00 0.00 H new ATOM 235 N PRO A 137 -3.424 8.170 5.088 1.00 0.00 N ATOM 236 CA PRO A 137 -3.269 9.372 4.263 1.00 0.00 C ATOM 237 C PRO A 137 -4.589 9.979 3.802 1.00 0.00 C ATOM 238 O PRO A 137 -5.677 9.427 4.027 1.00 0.00 O ATOM 239 CB PRO A 137 -2.360 9.010 3.078 1.00 0.00 C ATOM 240 CG PRO A 137 -1.894 7.579 3.352 1.00 0.00 C ATOM 241 CD PRO A 137 -2.806 7.025 4.445 1.00 0.00 C ATOM 0 HA PRO A 137 -2.816 10.155 4.871 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -2.900 9.074 2.133 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -1.514 9.693 3.008 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -1.958 6.971 2.449 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -0.852 7.565 3.673 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -3.562 6.364 4.021 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.236 6.437 5.165 1.00 0.00 H new ATOM 249 N MET A 138 -4.472 11.145 3.159 1.00 0.00 N ATOM 250 CA MET A 138 -5.588 11.887 2.613 1.00 0.00 C ATOM 251 C MET A 138 -5.487 11.937 1.097 1.00 0.00 C ATOM 252 O MET A 138 -4.452 12.318 0.539 1.00 0.00 O ATOM 253 CB MET A 138 -5.694 13.287 3.228 1.00 0.00 C ATOM 254 CG MET A 138 -6.483 13.258 4.542 1.00 0.00 C ATOM 255 SD MET A 138 -8.293 13.459 4.459 1.00 0.00 S ATOM 256 CE MET A 138 -8.810 11.859 3.791 1.00 0.00 C ATOM 0 H MET A 138 -3.573 11.601 3.006 1.00 0.00 H new ATOM 0 HA MET A 138 -6.509 11.367 2.875 1.00 0.00 H new ATOM 0 HB2 MET A 138 -4.695 13.684 3.409 1.00 0.00 H new ATOM 0 HB3 MET A 138 -6.181 13.961 2.523 1.00 0.00 H new ATOM 0 HG2 MET A 138 -6.275 12.309 5.035 1.00 0.00 H new ATOM 0 HG3 MET A 138 -6.089 14.045 5.185 1.00 0.00 H new ATOM 0 HE1 MET A 138 -9.869 11.704 3.997 1.00 0.00 H new ATOM 0 HE2 MET A 138 -8.643 11.843 2.714 1.00 0.00 H new ATOM 0 HE3 MET A 138 -8.229 11.064 4.260 1.00 0.00 H new ATOM 266 N ILE A 139 -6.564 11.509 0.448 1.00 0.00 N ATOM 267 CA ILE A 139 -6.666 11.370 -0.988 1.00 0.00 C ATOM 268 C ILE A 139 -7.996 11.973 -1.363 1.00 0.00 C ATOM 269 O ILE A 139 -9.011 11.658 -0.738 1.00 0.00 O ATOM 270 CB ILE A 139 -6.596 9.894 -1.411 1.00 0.00 C ATOM 271 CG1 ILE A 139 -5.340 9.169 -0.893 1.00 0.00 C ATOM 272 CG2 ILE A 139 -6.595 9.805 -2.945 1.00 0.00 C ATOM 273 CD1 ILE A 139 -5.613 7.674 -0.836 1.00 0.00 C ATOM 0 H ILE A 139 -7.420 11.240 0.933 1.00 0.00 H new ATOM 0 HA ILE A 139 -5.840 11.870 -1.494 1.00 0.00 H new ATOM 0 HB ILE A 139 -7.467 9.406 -0.974 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -4.493 9.371 -1.548 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -5.074 9.540 0.097 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -6.545 8.759 -3.249 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -7.508 10.254 -3.336 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -5.731 10.339 -3.340 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -4.727 7.156 -0.470 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -6.449 7.482 -0.164 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.859 7.311 -1.834 1.00 0.00 H new ATOM 285 N HIS A 140 -7.960 12.817 -2.388 1.00 0.00 N ATOM 286 CA HIS A 140 -9.094 13.563 -2.879 1.00 0.00 C ATOM 287 C HIS A 140 -9.262 13.285 -4.363 1.00 0.00 C ATOM 288 O HIS A 140 -8.783 14.039 -5.212 1.00 0.00 O ATOM 289 CB HIS A 140 -8.918 15.051 -2.544 1.00 0.00 C ATOM 290 CG HIS A 140 -8.682 15.232 -1.072 1.00 0.00 C ATOM 291 ND1 HIS A 140 -9.429 14.628 -0.089 1.00 0.00 N ATOM 292 CD2 HIS A 140 -7.554 15.744 -0.494 1.00 0.00 C ATOM 293 CE1 HIS A 140 -8.748 14.738 1.056 1.00 0.00 C ATOM 294 NE2 HIS A 140 -7.640 15.476 0.877 1.00 0.00 N ATOM 0 H HIS A 140 -7.105 13.001 -2.913 1.00 0.00 H new ATOM 0 HA HIS A 140 -10.016 13.248 -2.390 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -8.079 15.460 -3.106 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -9.806 15.606 -2.847 1.00 0.00 H new ATOM 0 HD1 HIS A 140 -10.336 14.178 -0.211 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -6.749 16.258 -0.999 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -9.047 14.295 1.995 1.00 0.00 H new ATOM 302 N PHE A 141 -9.981 12.204 -4.673 1.00 0.00 N ATOM 303 CA PHE A 141 -10.364 11.803 -6.029 1.00 0.00 C ATOM 304 C PHE A 141 -11.120 12.920 -6.760 1.00 0.00 C ATOM 305 O PHE A 141 -11.264 12.889 -7.987 1.00 0.00 O ATOM 306 CB PHE A 141 -11.258 10.550 -5.968 1.00 0.00 C ATOM 307 CG PHE A 141 -10.785 9.479 -5.005 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.163 9.553 -3.653 1.00 0.00 C ATOM 309 CD2 PHE A 141 -9.944 8.441 -5.442 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.665 8.609 -2.736 1.00 0.00 C ATOM 311 CE2 PHE A 141 -9.446 7.494 -4.529 1.00 0.00 C ATOM 312 CZ PHE A 141 -9.817 7.573 -3.176 1.00 0.00 C ATOM 0 H PHE A 141 -10.325 11.560 -3.961 1.00 0.00 H new ATOM 0 HA PHE A 141 -9.448 11.590 -6.580 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -12.266 10.853 -5.686 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -11.323 10.118 -6.967 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.833 10.331 -3.319 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -9.678 8.370 -6.486 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.933 8.679 -1.692 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -8.783 6.711 -4.866 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.452 6.839 -2.473 1.00 0.00 H new ATOM 322 N GLY A 142 -11.645 13.898 -6.012 1.00 0.00 N ATOM 323 CA GLY A 142 -12.390 15.038 -6.513 1.00 0.00 C ATOM 324 C GLY A 142 -13.806 14.668 -6.937 1.00 0.00 C ATOM 325 O GLY A 142 -14.574 15.567 -7.279 1.00 0.00 O ATOM 0 H GLY A 142 -11.553 13.908 -4.996 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -12.434 15.807 -5.741 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -11.861 15.469 -7.363 1.00 0.00 H new ATOM 329 N ASN A 143 -14.162 13.379 -6.907 1.00 0.00 N ATOM 330 CA ASN A 143 -15.547 12.946 -6.958 1.00 0.00 C ATOM 331 C ASN A 143 -16.070 13.149 -5.553 1.00 0.00 C ATOM 332 O ASN A 143 -15.470 12.648 -4.603 1.00 0.00 O ATOM 333 CB ASN A 143 -15.650 11.466 -7.341 1.00 0.00 C ATOM 334 CG ASN A 143 -15.859 11.268 -8.828 1.00 0.00 C ATOM 335 OD1 ASN A 143 -16.767 11.846 -9.419 1.00 0.00 O ATOM 336 ND2 ASN A 143 -15.034 10.447 -9.451 1.00 0.00 N ATOM 0 H ASN A 143 -13.492 12.613 -6.847 1.00 0.00 H new ATOM 0 HA ASN A 143 -16.113 13.504 -7.704 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -14.741 10.950 -7.033 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -16.476 11.009 -6.797 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -15.141 10.278 -10.451 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -14.289 9.982 -8.932 1.00 0.00 H new ATOM 343 N ASP A 144 -17.171 13.879 -5.425 1.00 0.00 N ATOM 344 CA ASP A 144 -17.770 14.240 -4.144 1.00 0.00 C ATOM 345 C ASP A 144 -18.123 13.013 -3.326 1.00 0.00 C ATOM 346 O ASP A 144 -17.955 13.015 -2.104 1.00 0.00 O ATOM 347 CB ASP A 144 -19.024 15.076 -4.416 1.00 0.00 C ATOM 348 CG ASP A 144 -19.541 15.773 -3.166 1.00 0.00 C ATOM 349 OD1 ASP A 144 -19.017 16.860 -2.839 1.00 0.00 O ATOM 350 OD2 ASP A 144 -20.554 15.328 -2.581 1.00 0.00 O ATOM 0 H ASP A 144 -17.685 14.245 -6.226 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.048 14.815 -3.563 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -18.801 15.822 -5.179 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -19.806 14.432 -4.819 1.00 0.00 H new ATOM 355 N TRP A 145 -18.570 11.960 -4.013 1.00 0.00 N ATOM 356 CA TRP A 145 -18.951 10.731 -3.363 1.00 0.00 C ATOM 357 C TRP A 145 -17.735 9.890 -2.980 1.00 0.00 C ATOM 358 O TRP A 145 -17.719 9.329 -1.893 1.00 0.00 O ATOM 359 CB TRP A 145 -19.921 9.944 -4.251 1.00 0.00 C ATOM 360 CG TRP A 145 -19.339 9.224 -5.436 1.00 0.00 C ATOM 361 CD1 TRP A 145 -19.178 9.699 -6.697 1.00 0.00 C ATOM 362 CD2 TRP A 145 -18.895 7.835 -5.482 1.00 0.00 C ATOM 363 NE1 TRP A 145 -18.671 8.688 -7.497 1.00 0.00 N ATOM 364 CE2 TRP A 145 -18.599 7.503 -6.831 1.00 0.00 C ATOM 365 CE3 TRP A 145 -18.694 6.815 -4.533 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -18.255 6.217 -7.246 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -18.425 5.504 -4.954 1.00 0.00 C ATOM 368 CH2 TRP A 145 -18.242 5.194 -6.307 1.00 0.00 C ATOM 0 H TRP A 145 -18.673 11.947 -5.028 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.461 10.983 -2.433 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.430 9.210 -3.627 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -20.681 10.635 -4.616 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -19.408 10.702 -7.024 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -18.386 8.816 -8.468 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.747 7.042 -3.478 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -18.004 6.020 -8.278 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -18.358 4.716 -4.218 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -18.092 4.170 -6.617 1.00 0.00 H new ATOM 379 N GLU A 146 -16.722 9.787 -3.844 1.00 0.00 N ATOM 380 CA GLU A 146 -15.549 8.947 -3.595 1.00 0.00 C ATOM 381 C GLU A 146 -14.741 9.509 -2.430 1.00 0.00 C ATOM 382 O GLU A 146 -14.177 8.749 -1.644 1.00 0.00 O ATOM 383 CB GLU A 146 -14.674 8.863 -4.851 1.00 0.00 C ATOM 384 CG GLU A 146 -15.331 7.942 -5.887 1.00 0.00 C ATOM 385 CD GLU A 146 -14.570 7.815 -7.214 1.00 0.00 C ATOM 386 OE1 GLU A 146 -13.814 8.725 -7.625 1.00 0.00 O ATOM 387 OE2 GLU A 146 -14.806 6.832 -7.949 1.00 0.00 O ATOM 0 H GLU A 146 -16.692 10.283 -4.735 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.888 7.943 -3.340 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -14.534 9.858 -5.274 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.685 8.485 -4.591 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.440 6.949 -5.451 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.335 8.311 -6.095 1.00 0.00 H new ATOM 394 N ASP A 147 -14.707 10.839 -2.307 1.00 0.00 N ATOM 395 CA ASP A 147 -14.071 11.510 -1.184 1.00 0.00 C ATOM 396 C ASP A 147 -14.729 11.045 0.116 1.00 0.00 C ATOM 397 O ASP A 147 -14.057 10.483 0.987 1.00 0.00 O ATOM 398 CB ASP A 147 -14.139 13.037 -1.340 1.00 0.00 C ATOM 399 CG ASP A 147 -13.060 13.676 -0.465 1.00 0.00 C ATOM 400 OD1 ASP A 147 -11.871 13.620 -0.849 1.00 0.00 O ATOM 401 OD2 ASP A 147 -13.376 14.209 0.618 1.00 0.00 O ATOM 0 H ASP A 147 -15.122 11.476 -2.987 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.014 11.245 -1.157 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -13.991 13.316 -2.383 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.124 13.402 -1.049 1.00 0.00 H new ATOM 406 N ARG A 148 -16.061 11.198 0.219 1.00 0.00 N ATOM 407 CA ARG A 148 -16.779 10.845 1.442 1.00 0.00 C ATOM 408 C ARG A 148 -16.618 9.359 1.715 1.00 0.00 C ATOM 409 O ARG A 148 -16.347 9.005 2.855 1.00 0.00 O ATOM 410 CB ARG A 148 -18.266 11.268 1.407 1.00 0.00 C ATOM 411 CG ARG A 148 -19.285 10.199 0.980 1.00 0.00 C ATOM 412 CD ARG A 148 -20.698 10.747 0.780 1.00 0.00 C ATOM 413 NE ARG A 148 -21.461 10.646 2.029 1.00 0.00 N ATOM 414 CZ ARG A 148 -21.522 11.534 3.025 1.00 0.00 C ATOM 415 NH1 ARG A 148 -21.059 12.775 2.888 1.00 0.00 N ATOM 416 NH2 ARG A 148 -22.055 11.144 4.168 1.00 0.00 N ATOM 0 H ARG A 148 -16.653 11.562 -0.528 1.00 0.00 H new ATOM 0 HA ARG A 148 -16.338 11.406 2.266 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -18.541 11.621 2.401 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -18.361 12.117 0.730 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -18.948 9.738 0.052 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.312 9.413 1.735 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -20.650 11.787 0.457 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.203 10.191 -0.010 1.00 0.00 H new ATOM 0 HE ARG A 148 -22.011 9.796 2.152 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -20.644 13.070 2.004 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -21.120 13.431 3.667 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -22.404 10.191 4.269 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -22.118 11.796 4.950 1.00 0.00 H new ATOM 430 N TYR A 149 -16.747 8.505 0.693 1.00 0.00 N ATOM 431 CA TYR A 149 -16.611 7.067 0.764 1.00 0.00 C ATOM 432 C TYR A 149 -15.317 6.721 1.481 1.00 0.00 C ATOM 433 O TYR A 149 -15.307 5.919 2.410 1.00 0.00 O ATOM 434 CB TYR A 149 -16.635 6.467 -0.647 1.00 0.00 C ATOM 435 CG TYR A 149 -17.888 5.698 -1.007 1.00 0.00 C ATOM 436 CD1 TYR A 149 -19.152 6.303 -0.886 1.00 0.00 C ATOM 437 CD2 TYR A 149 -17.779 4.405 -1.551 1.00 0.00 C ATOM 438 CE1 TYR A 149 -20.298 5.630 -1.341 1.00 0.00 C ATOM 439 CE2 TYR A 149 -18.920 3.724 -2.002 1.00 0.00 C ATOM 440 CZ TYR A 149 -20.183 4.349 -1.922 1.00 0.00 C ATOM 441 OH TYR A 149 -21.277 3.739 -2.446 1.00 0.00 O ATOM 0 H TYR A 149 -16.960 8.828 -0.251 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.446 6.645 1.323 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -16.505 7.274 -1.368 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -15.778 5.802 -0.755 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -19.241 7.284 -0.444 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -16.810 3.933 -1.622 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -21.269 6.094 -1.246 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -18.832 2.727 -2.408 1.00 0.00 H new ATOM 0 HH TYR A 149 -21.022 2.864 -2.806 1.00 0.00 H new ATOM 451 N TYR A 150 -14.207 7.337 1.089 1.00 0.00 N ATOM 452 CA TYR A 150 -12.939 7.027 1.706 1.00 0.00 C ATOM 453 C TYR A 150 -12.962 7.427 3.184 1.00 0.00 C ATOM 454 O TYR A 150 -12.518 6.671 4.051 1.00 0.00 O ATOM 455 CB TYR A 150 -11.801 7.693 0.927 1.00 0.00 C ATOM 456 CG TYR A 150 -10.438 7.500 1.559 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.131 6.294 2.211 1.00 0.00 C ATOM 458 CD2 TYR A 150 -9.496 8.542 1.544 1.00 0.00 C ATOM 459 CE1 TYR A 150 -8.901 6.114 2.852 1.00 0.00 C ATOM 460 CE2 TYR A 150 -8.257 8.380 2.192 1.00 0.00 C ATOM 461 CZ TYR A 150 -7.960 7.170 2.865 1.00 0.00 C ATOM 462 OH TYR A 150 -6.810 7.052 3.579 1.00 0.00 O ATOM 0 H TYR A 150 -14.167 8.044 0.355 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.762 5.952 1.672 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -11.782 7.292 -0.086 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.005 8.760 0.843 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.856 5.494 2.217 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -9.722 9.467 1.035 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.671 5.175 3.334 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -7.532 9.180 2.176 1.00 0.00 H new ATOM 0 HH TYR A 150 -6.560 7.927 3.944 1.00 0.00 H new ATOM 472 N ARG A 151 -13.492 8.605 3.496 1.00 0.00 N ATOM 473 CA ARG A 151 -13.652 9.100 4.865 1.00 0.00 C ATOM 474 C ARG A 151 -14.770 8.385 5.640 1.00 0.00 C ATOM 475 O ARG A 151 -14.933 8.662 6.831 1.00 0.00 O ATOM 476 CB ARG A 151 -13.910 10.613 4.779 1.00 0.00 C ATOM 477 CG ARG A 151 -12.696 11.392 4.241 1.00 0.00 C ATOM 478 CD ARG A 151 -13.039 12.364 3.108 1.00 0.00 C ATOM 479 NE ARG A 151 -12.885 13.776 3.470 1.00 0.00 N ATOM 480 CZ ARG A 151 -13.794 14.562 4.053 1.00 0.00 C ATOM 481 NH1 ARG A 151 -14.883 14.081 4.643 1.00 0.00 N ATOM 482 NH2 ARG A 151 -13.583 15.867 4.037 1.00 0.00 N ATOM 0 H ARG A 151 -13.831 9.259 2.791 1.00 0.00 H new ATOM 0 HA ARG A 151 -12.742 8.891 5.428 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -14.769 10.795 4.133 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -14.170 10.990 5.768 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -12.241 11.949 5.060 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -11.949 10.682 3.885 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -12.401 12.147 2.251 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.068 12.190 2.792 1.00 0.00 H new ATOM 0 HE ARG A 151 -11.985 14.205 3.253 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.050 13.075 4.663 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -15.552 14.718 5.076 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -12.747 16.243 3.589 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -14.256 16.498 4.472 1.00 0.00 H new ATOM 496 N GLU A 152 -15.501 7.449 5.036 1.00 0.00 N ATOM 497 CA GLU A 152 -16.584 6.710 5.678 1.00 0.00 C ATOM 498 C GLU A 152 -16.352 5.194 5.655 1.00 0.00 C ATOM 499 O GLU A 152 -17.113 4.452 6.272 1.00 0.00 O ATOM 500 CB GLU A 152 -17.947 7.228 5.197 1.00 0.00 C ATOM 501 CG GLU A 152 -18.467 6.690 3.883 1.00 0.00 C ATOM 502 CD GLU A 152 -19.716 7.436 3.380 1.00 0.00 C ATOM 503 OE1 GLU A 152 -20.268 8.299 4.107 1.00 0.00 O ATOM 504 OE2 GLU A 152 -20.178 7.163 2.250 1.00 0.00 O ATOM 0 H GLU A 152 -15.352 7.178 4.064 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.592 6.912 6.749 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -18.684 7.005 5.968 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -17.887 8.313 5.117 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -17.681 6.761 3.131 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -18.704 5.632 3.998 1.00 0.00 H new ATOM 511 N ASN A 153 -15.252 4.732 5.042 1.00 0.00 N ATOM 512 CA ASN A 153 -14.877 3.319 4.958 1.00 0.00 C ATOM 513 C ASN A 153 -13.439 3.075 5.435 1.00 0.00 C ATOM 514 O ASN A 153 -12.964 1.945 5.356 1.00 0.00 O ATOM 515 CB ASN A 153 -15.090 2.792 3.525 1.00 0.00 C ATOM 516 CG ASN A 153 -16.569 2.764 3.155 1.00 0.00 C ATOM 517 OD1 ASN A 153 -17.267 1.809 3.479 1.00 0.00 O ATOM 518 ND2 ASN A 153 -17.056 3.805 2.497 1.00 0.00 N ATOM 0 H ASN A 153 -14.584 5.349 4.580 1.00 0.00 H new ATOM 0 HA ASN A 153 -15.528 2.762 5.632 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -14.549 3.423 2.820 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -14.673 1.788 3.439 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -18.043 3.831 2.242 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -16.444 4.581 2.245 1.00 0.00 H new ATOM 525 N MET A 154 -12.721 4.087 5.945 1.00 0.00 N ATOM 526 CA MET A 154 -11.270 4.050 6.174 1.00 0.00 C ATOM 527 C MET A 154 -10.757 2.947 7.115 1.00 0.00 C ATOM 528 O MET A 154 -9.546 2.740 7.189 1.00 0.00 O ATOM 529 CB MET A 154 -10.781 5.419 6.678 1.00 0.00 C ATOM 530 CG MET A 154 -11.294 5.800 8.071 1.00 0.00 C ATOM 531 SD MET A 154 -12.694 6.924 8.100 1.00 0.00 S ATOM 532 CE MET A 154 -11.721 8.432 7.843 1.00 0.00 C ATOM 0 H MET A 154 -13.144 4.975 6.216 1.00 0.00 H new ATOM 0 HA MET A 154 -10.851 3.804 5.198 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.691 5.419 6.693 1.00 0.00 H new ATOM 0 HB3 MET A 154 -11.090 6.186 5.968 1.00 0.00 H new ATOM 0 HG2 MET A 154 -11.572 4.888 8.598 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.475 6.254 8.629 1.00 0.00 H new ATOM 0 HE1 MET A 154 -12.392 9.284 7.734 1.00 0.00 H new ATOM 0 HE2 MET A 154 -11.066 8.593 8.700 1.00 0.00 H new ATOM 0 HE3 MET A 154 -11.119 8.327 6.941 1.00 0.00 H new ATOM 542 N TYR A 155 -11.619 2.272 7.876 1.00 0.00 N ATOM 543 CA TYR A 155 -11.264 1.136 8.729 1.00 0.00 C ATOM 544 C TYR A 155 -11.106 -0.155 7.919 1.00 0.00 C ATOM 545 O TYR A 155 -10.338 -1.043 8.288 1.00 0.00 O ATOM 546 CB TYR A 155 -12.350 0.965 9.804 1.00 0.00 C ATOM 547 CG TYR A 155 -13.774 0.826 9.282 1.00 0.00 C ATOM 548 CD1 TYR A 155 -14.487 1.973 8.878 1.00 0.00 C ATOM 549 CD2 TYR A 155 -14.386 -0.442 9.185 1.00 0.00 C ATOM 550 CE1 TYR A 155 -15.770 1.855 8.323 1.00 0.00 C ATOM 551 CE2 TYR A 155 -15.692 -0.562 8.667 1.00 0.00 C ATOM 552 CZ TYR A 155 -16.377 0.585 8.206 1.00 0.00 C ATOM 553 OH TYR A 155 -17.633 0.482 7.698 1.00 0.00 O ATOM 0 H TYR A 155 -12.611 2.506 7.918 1.00 0.00 H new ATOM 0 HA TYR A 155 -10.301 1.339 9.198 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -12.112 0.083 10.399 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -12.310 1.823 10.476 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -14.042 2.950 8.997 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -13.852 -1.323 9.509 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -16.294 2.736 7.985 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -16.169 -1.530 8.623 1.00 0.00 H new ATOM 0 HH TYR A 155 -17.904 -0.460 7.684 1.00 0.00 H new ATOM 563 N ARG A 156 -11.840 -0.266 6.811 1.00 0.00 N ATOM 564 CA ARG A 156 -11.935 -1.477 6.007 1.00 0.00 C ATOM 565 C ARG A 156 -10.590 -1.754 5.355 1.00 0.00 C ATOM 566 O ARG A 156 -10.153 -2.904 5.295 1.00 0.00 O ATOM 567 CB ARG A 156 -13.075 -1.305 4.980 1.00 0.00 C ATOM 568 CG ARG A 156 -14.420 -1.227 5.731 1.00 0.00 C ATOM 569 CD ARG A 156 -15.622 -0.703 4.955 1.00 0.00 C ATOM 570 NE ARG A 156 -15.830 -1.407 3.693 1.00 0.00 N ATOM 571 CZ ARG A 156 -16.534 -2.521 3.496 1.00 0.00 C ATOM 572 NH1 ARG A 156 -17.087 -3.180 4.508 1.00 0.00 N ATOM 573 NH2 ARG A 156 -16.655 -3.006 2.268 1.00 0.00 N ATOM 0 H ARG A 156 -12.397 0.505 6.442 1.00 0.00 H new ATOM 0 HA ARG A 156 -12.176 -2.343 6.624 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -12.919 -0.400 4.392 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -13.082 -2.142 4.281 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -14.662 -2.226 6.095 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.281 -0.594 6.607 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -16.516 -0.798 5.571 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -15.485 0.360 4.755 1.00 0.00 H new ATOM 0 HE ARG A 156 -15.386 -1.000 2.869 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -16.977 -2.835 5.462 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -17.621 -4.031 4.331 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -16.211 -2.527 1.484 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -17.192 -3.858 2.107 1.00 0.00 H new ATOM 587 N TYR A 157 -9.901 -0.713 4.903 1.00 0.00 N ATOM 588 CA TYR A 157 -8.600 -0.849 4.269 1.00 0.00 C ATOM 589 C TYR A 157 -7.515 -1.043 5.332 1.00 0.00 C ATOM 590 O TYR A 157 -7.654 -0.502 6.433 1.00 0.00 O ATOM 591 CB TYR A 157 -8.332 0.390 3.412 1.00 0.00 C ATOM 592 CG TYR A 157 -9.526 0.800 2.573 1.00 0.00 C ATOM 593 CD1 TYR A 157 -10.238 -0.186 1.864 1.00 0.00 C ATOM 594 CD2 TYR A 157 -9.973 2.135 2.563 1.00 0.00 C ATOM 595 CE1 TYR A 157 -11.377 0.152 1.131 1.00 0.00 C ATOM 596 CE2 TYR A 157 -11.125 2.486 1.836 1.00 0.00 C ATOM 597 CZ TYR A 157 -11.834 1.483 1.121 1.00 0.00 C ATOM 598 OH TYR A 157 -12.968 1.732 0.416 1.00 0.00 O ATOM 0 H TYR A 157 -10.231 0.250 4.967 1.00 0.00 H new ATOM 0 HA TYR A 157 -8.587 -1.728 3.624 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -8.049 1.219 4.060 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -7.484 0.195 2.756 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -9.901 -1.212 1.887 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -9.431 2.890 3.114 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -11.906 -0.606 0.573 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -11.468 3.510 1.821 1.00 0.00 H new ATOM 0 HH TYR A 157 -13.191 2.684 0.480 1.00 0.00 H new ATOM 608 N PRO A 158 -6.432 -1.778 5.030 1.00 0.00 N ATOM 609 CA PRO A 158 -5.362 -2.036 5.978 1.00 0.00 C ATOM 610 C PRO A 158 -4.611 -0.754 6.328 1.00 0.00 C ATOM 611 O PRO A 158 -4.620 0.236 5.588 1.00 0.00 O ATOM 612 CB PRO A 158 -4.455 -3.089 5.327 1.00 0.00 C ATOM 613 CG PRO A 158 -4.779 -3.013 3.841 1.00 0.00 C ATOM 614 CD PRO A 158 -6.228 -2.535 3.812 1.00 0.00 C ATOM 0 HA PRO A 158 -5.750 -2.407 6.927 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -3.403 -2.875 5.514 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -4.654 -4.084 5.725 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -4.118 -2.319 3.322 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -4.667 -3.983 3.356 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -6.416 -1.917 2.934 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -6.915 -3.380 3.760 1.00 0.00 H new ATOM 622 N ASN A 159 -3.917 -0.803 7.458 1.00 0.00 N ATOM 623 CA ASN A 159 -3.095 0.246 8.040 1.00 0.00 C ATOM 624 C ASN A 159 -1.608 -0.102 7.901 1.00 0.00 C ATOM 625 O ASN A 159 -0.773 0.557 8.511 1.00 0.00 O ATOM 626 CB ASN A 159 -3.466 0.359 9.526 1.00 0.00 C ATOM 627 CG ASN A 159 -3.004 -0.862 10.325 1.00 0.00 C ATOM 628 OD1 ASN A 159 -3.192 -2.003 9.906 1.00 0.00 O ATOM 629 ND2 ASN A 159 -2.411 -0.671 11.483 1.00 0.00 N ATOM 0 H ASN A 159 -3.915 -1.644 8.035 1.00 0.00 H new ATOM 0 HA ASN A 159 -3.271 1.191 7.525 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -3.015 1.259 9.945 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -4.546 0.469 9.623 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -2.105 -1.471 12.037 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -2.257 0.277 11.827 1.00 0.00 H new ATOM 636 N GLN A 160 -1.266 -1.144 7.142 1.00 0.00 N ATOM 637 CA GLN A 160 0.081 -1.672 6.978 1.00 0.00 C ATOM 638 C GLN A 160 0.301 -1.988 5.508 1.00 0.00 C ATOM 639 O GLN A 160 -0.657 -2.346 4.816 1.00 0.00 O ATOM 640 CB GLN A 160 0.225 -2.959 7.810 1.00 0.00 C ATOM 641 CG GLN A 160 0.914 -2.664 9.136 1.00 0.00 C ATOM 642 CD GLN A 160 0.810 -3.813 10.128 1.00 0.00 C ATOM 643 OE1 GLN A 160 -0.206 -4.019 10.791 1.00 0.00 O ATOM 644 NE2 GLN A 160 1.891 -4.533 10.340 1.00 0.00 N ATOM 0 H GLN A 160 -1.957 -1.664 6.601 1.00 0.00 H new ATOM 0 HA GLN A 160 0.817 -0.942 7.315 1.00 0.00 H new ATOM 0 HB2 GLN A 160 -0.758 -3.392 7.993 1.00 0.00 H new ATOM 0 HB3 GLN A 160 0.800 -3.698 7.251 1.00 0.00 H new ATOM 0 HG2 GLN A 160 1.966 -2.444 8.952 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.474 -1.770 9.577 1.00 0.00 H new ATOM 0 HE21 GLN A 160 2.733 -4.362 9.791 1.00 0.00 H new ATOM 0 HE22 GLN A 160 1.887 -5.262 11.054 1.00 0.00 H new ATOM 653 N VAL A 161 1.557 -1.931 5.066 1.00 0.00 N ATOM 654 CA VAL A 161 1.956 -2.254 3.706 1.00 0.00 C ATOM 655 C VAL A 161 3.215 -3.126 3.743 1.00 0.00 C ATOM 656 O VAL A 161 4.075 -2.956 4.620 1.00 0.00 O ATOM 657 CB VAL A 161 2.122 -0.966 2.869 1.00 0.00 C ATOM 658 CG1 VAL A 161 0.808 -0.186 2.745 1.00 0.00 C ATOM 659 CG2 VAL A 161 3.162 0.033 3.409 1.00 0.00 C ATOM 0 H VAL A 161 2.338 -1.653 5.660 1.00 0.00 H new ATOM 0 HA VAL A 161 1.177 -2.833 3.209 1.00 0.00 H new ATOM 0 HB VAL A 161 2.464 -1.350 1.908 1.00 0.00 H new ATOM 0 HG11 VAL A 161 0.972 0.711 2.149 1.00 0.00 H new ATOM 0 HG12 VAL A 161 0.058 -0.811 2.261 1.00 0.00 H new ATOM 0 HG13 VAL A 161 0.458 0.097 3.738 1.00 0.00 H new ATOM 0 HG21 VAL A 161 3.205 0.903 2.754 1.00 0.00 H new ATOM 0 HG22 VAL A 161 2.877 0.348 4.413 1.00 0.00 H new ATOM 0 HG23 VAL A 161 4.141 -0.444 3.443 1.00 0.00 H new ATOM 669 N TYR A 162 3.297 -4.062 2.799 1.00 0.00 N ATOM 670 CA TYR A 162 4.414 -4.967 2.573 1.00 0.00 C ATOM 671 C TYR A 162 5.324 -4.389 1.491 1.00 0.00 C ATOM 672 O TYR A 162 4.836 -3.685 0.611 1.00 0.00 O ATOM 673 CB TYR A 162 3.870 -6.306 2.071 1.00 0.00 C ATOM 674 CG TYR A 162 3.100 -7.149 3.069 1.00 0.00 C ATOM 675 CD1 TYR A 162 1.708 -6.989 3.217 1.00 0.00 C ATOM 676 CD2 TYR A 162 3.775 -8.118 3.834 1.00 0.00 C ATOM 677 CE1 TYR A 162 0.994 -7.790 4.126 1.00 0.00 C ATOM 678 CE2 TYR A 162 3.065 -8.933 4.729 1.00 0.00 C ATOM 679 CZ TYR A 162 1.672 -8.772 4.880 1.00 0.00 C ATOM 680 OH TYR A 162 1.012 -9.504 5.819 1.00 0.00 O ATOM 0 H TYR A 162 2.539 -4.215 2.134 1.00 0.00 H new ATOM 0 HA TYR A 162 4.970 -5.099 3.501 1.00 0.00 H new ATOM 0 HB2 TYR A 162 3.220 -6.110 1.219 1.00 0.00 H new ATOM 0 HB3 TYR A 162 4.709 -6.897 1.703 1.00 0.00 H new ATOM 0 HD1 TYR A 162 1.187 -6.248 2.630 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.844 -8.235 3.732 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -0.071 -7.654 4.247 1.00 0.00 H new ATOM 0 HE2 TYR A 162 3.586 -9.685 5.303 1.00 0.00 H new ATOM 0 HH TYR A 162 1.634 -10.133 6.240 1.00 0.00 H new ATOM 690 N TYR A 163 6.612 -4.738 1.486 1.00 0.00 N ATOM 691 CA TYR A 163 7.566 -4.282 0.471 1.00 0.00 C ATOM 692 C TYR A 163 8.766 -5.229 0.410 1.00 0.00 C ATOM 693 O TYR A 163 8.935 -6.058 1.306 1.00 0.00 O ATOM 694 CB TYR A 163 8.039 -2.862 0.839 1.00 0.00 C ATOM 695 CG TYR A 163 8.521 -2.709 2.277 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.859 -2.998 2.620 1.00 0.00 C ATOM 697 CD2 TYR A 163 7.616 -2.309 3.282 1.00 0.00 C ATOM 698 CE1 TYR A 163 10.300 -2.853 3.946 1.00 0.00 C ATOM 699 CE2 TYR A 163 8.055 -2.159 4.609 1.00 0.00 C ATOM 700 CZ TYR A 163 9.406 -2.403 4.942 1.00 0.00 C ATOM 701 OH TYR A 163 9.839 -2.204 6.218 1.00 0.00 O ATOM 0 H TYR A 163 7.026 -5.349 2.190 1.00 0.00 H new ATOM 0 HA TYR A 163 7.083 -4.272 -0.506 1.00 0.00 H new ATOM 0 HB2 TYR A 163 8.847 -2.576 0.166 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.220 -2.164 0.668 1.00 0.00 H new ATOM 0 HD1 TYR A 163 10.548 -3.333 1.859 1.00 0.00 H new ATOM 0 HD2 TYR A 163 6.583 -2.117 3.031 1.00 0.00 H new ATOM 0 HE1 TYR A 163 11.323 -3.086 4.204 1.00 0.00 H new ATOM 0 HE2 TYR A 163 7.357 -1.856 5.376 1.00 0.00 H new ATOM 0 HH TYR A 163 9.093 -1.893 6.772 1.00 0.00 H new ATOM 711 N ARG A 164 9.625 -5.107 -0.608 1.00 0.00 N ATOM 712 CA ARG A 164 10.938 -5.768 -0.631 1.00 0.00 C ATOM 713 C ARG A 164 11.991 -4.815 -0.051 1.00 0.00 C ATOM 714 O ARG A 164 11.925 -3.622 -0.363 1.00 0.00 O ATOM 715 CB ARG A 164 11.348 -6.165 -2.060 1.00 0.00 C ATOM 716 CG ARG A 164 10.318 -7.049 -2.766 1.00 0.00 C ATOM 717 CD ARG A 164 10.842 -7.587 -4.106 1.00 0.00 C ATOM 718 NE ARG A 164 11.326 -8.973 -3.982 1.00 0.00 N ATOM 719 CZ ARG A 164 12.507 -9.478 -4.373 1.00 0.00 C ATOM 720 NH1 ARG A 164 13.429 -8.764 -5.003 1.00 0.00 N ATOM 721 NH2 ARG A 164 12.781 -10.751 -4.140 1.00 0.00 N ATOM 0 H ARG A 164 9.431 -4.548 -1.439 1.00 0.00 H new ATOM 0 HA ARG A 164 10.871 -6.677 -0.033 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.504 -5.261 -2.649 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.302 -6.691 -2.023 1.00 0.00 H new ATOM 0 HG2 ARG A 164 10.053 -7.885 -2.118 1.00 0.00 H new ATOM 0 HG3 ARG A 164 9.406 -6.477 -2.937 1.00 0.00 H new ATOM 0 HD2 ARG A 164 10.048 -7.544 -4.852 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.650 -6.949 -4.464 1.00 0.00 H new ATOM 0 HE ARG A 164 10.683 -9.632 -3.544 1.00 0.00 H new ATOM 0 HH11 ARG A 164 13.257 -7.781 -5.213 1.00 0.00 H new ATOM 0 HH12 ARG A 164 14.310 -9.198 -5.278 1.00 0.00 H new ATOM 0 HH21 ARG A 164 12.097 -11.341 -3.666 1.00 0.00 H new ATOM 0 HH22 ARG A 164 13.676 -11.142 -4.434 1.00 0.00 H new ATOM 735 N PRO A 165 12.987 -5.308 0.699 1.00 0.00 N ATOM 736 CA PRO A 165 14.040 -4.493 1.309 1.00 0.00 C ATOM 737 C PRO A 165 14.902 -3.836 0.230 1.00 0.00 C ATOM 738 O PRO A 165 15.329 -4.502 -0.718 1.00 0.00 O ATOM 739 CB PRO A 165 14.853 -5.457 2.177 1.00 0.00 C ATOM 740 CG PRO A 165 14.619 -6.811 1.518 1.00 0.00 C ATOM 741 CD PRO A 165 13.205 -6.718 0.971 1.00 0.00 C ATOM 0 HA PRO A 165 13.635 -3.677 1.908 1.00 0.00 H new ATOM 0 HB2 PRO A 165 15.911 -5.193 2.188 1.00 0.00 H new ATOM 0 HB3 PRO A 165 14.512 -5.450 3.212 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.342 -6.998 0.724 1.00 0.00 H new ATOM 0 HG3 PRO A 165 14.716 -7.626 2.236 1.00 0.00 H new ATOM 0 HD2 PRO A 165 13.094 -7.314 0.065 1.00 0.00 H new ATOM 0 HD3 PRO A 165 12.480 -7.096 1.692 1.00 0.00 H new ATOM 749 N VAL A 166 15.128 -2.532 0.338 1.00 0.00 N ATOM 750 CA VAL A 166 15.686 -1.688 -0.708 1.00 0.00 C ATOM 751 C VAL A 166 17.125 -2.102 -1.020 1.00 0.00 C ATOM 752 O VAL A 166 17.877 -2.552 -0.154 1.00 0.00 O ATOM 753 CB VAL A 166 15.518 -0.206 -0.304 1.00 0.00 C ATOM 754 CG1 VAL A 166 16.192 0.815 -1.225 1.00 0.00 C ATOM 755 CG2 VAL A 166 14.025 0.132 -0.343 1.00 0.00 C ATOM 0 H VAL A 166 14.919 -2.014 1.192 1.00 0.00 H new ATOM 0 HA VAL A 166 15.144 -1.819 -1.645 1.00 0.00 H new ATOM 0 HB VAL A 166 15.988 -0.127 0.676 1.00 0.00 H new ATOM 0 HG11 VAL A 166 16.010 1.821 -0.848 1.00 0.00 H new ATOM 0 HG12 VAL A 166 17.265 0.627 -1.253 1.00 0.00 H new ATOM 0 HG13 VAL A 166 15.781 0.725 -2.231 1.00 0.00 H new ATOM 0 HG21 VAL A 166 13.881 1.175 -0.061 1.00 0.00 H new ATOM 0 HG22 VAL A 166 13.642 -0.028 -1.351 1.00 0.00 H new ATOM 0 HG23 VAL A 166 13.488 -0.510 0.355 1.00 0.00 H new ATOM 765 N ASP A 167 17.487 -1.948 -2.290 1.00 0.00 N ATOM 766 CA ASP A 167 18.777 -2.237 -2.902 1.00 0.00 C ATOM 767 C ASP A 167 18.989 -1.199 -4.011 1.00 0.00 C ATOM 768 O ASP A 167 18.271 -0.202 -4.053 1.00 0.00 O ATOM 769 CB ASP A 167 18.795 -3.674 -3.447 1.00 0.00 C ATOM 770 CG ASP A 167 20.204 -4.171 -3.784 1.00 0.00 C ATOM 771 OD1 ASP A 167 20.990 -4.509 -2.875 1.00 0.00 O ATOM 772 OD2 ASP A 167 20.592 -4.173 -4.971 1.00 0.00 O ATOM 0 H ASP A 167 16.825 -1.586 -2.977 1.00 0.00 H new ATOM 0 HA ASP A 167 19.588 -2.171 -2.177 1.00 0.00 H new ATOM 0 HB2 ASP A 167 18.347 -4.341 -2.710 1.00 0.00 H new ATOM 0 HB3 ASP A 167 18.175 -3.725 -4.342 1.00 0.00 H new ATOM 777 N GLN A 168 19.960 -1.416 -4.896 1.00 0.00 N ATOM 778 CA GLN A 168 20.435 -0.546 -5.940 1.00 0.00 C ATOM 779 C GLN A 168 19.318 0.097 -6.755 1.00 0.00 C ATOM 780 O GLN A 168 19.448 1.270 -7.116 1.00 0.00 O ATOM 781 CB GLN A 168 21.320 -1.453 -6.792 1.00 0.00 C ATOM 782 CG GLN A 168 21.863 -0.772 -8.038 1.00 0.00 C ATOM 783 CD GLN A 168 22.718 -1.712 -8.885 1.00 0.00 C ATOM 784 OE1 GLN A 168 23.317 -2.658 -8.374 1.00 0.00 O ATOM 785 NE2 GLN A 168 22.739 -1.536 -10.195 1.00 0.00 N ATOM 0 H GLN A 168 20.477 -2.296 -4.888 1.00 0.00 H new ATOM 0 HA GLN A 168 20.969 0.313 -5.534 1.00 0.00 H new ATOM 0 HB2 GLN A 168 22.155 -1.805 -6.187 1.00 0.00 H new ATOM 0 HB3 GLN A 168 20.748 -2.332 -7.088 1.00 0.00 H new ATOM 0 HG2 GLN A 168 21.032 -0.400 -8.638 1.00 0.00 H new ATOM 0 HG3 GLN A 168 22.458 0.094 -7.747 1.00 0.00 H new ATOM 0 HE21 GLN A 168 22.240 -0.750 -10.612 1.00 0.00 H new ATOM 0 HE22 GLN A 168 23.254 -2.186 -10.789 1.00 0.00 H new ATOM 794 N ALA A 169 18.274 -0.655 -7.106 1.00 0.00 N ATOM 795 CA ALA A 169 17.100 -0.107 -7.751 1.00 0.00 C ATOM 796 C ALA A 169 16.075 0.210 -6.671 1.00 0.00 C ATOM 797 O ALA A 169 16.165 1.289 -6.087 1.00 0.00 O ATOM 798 CB ALA A 169 16.644 -0.993 -8.914 1.00 0.00 C ATOM 0 H ALA A 169 18.227 -1.661 -6.947 1.00 0.00 H new ATOM 0 HA ALA A 169 17.302 0.840 -8.251 1.00 0.00 H new ATOM 0 HB1 ALA A 169 15.760 -0.556 -9.379 1.00 0.00 H new ATOM 0 HB2 ALA A 169 17.444 -1.066 -9.651 1.00 0.00 H new ATOM 0 HB3 ALA A 169 16.403 -1.988 -8.540 1.00 0.00 H new ATOM 804 N SER A 170 15.090 -0.666 -6.446 1.00 0.00 N ATOM 805 CA SER A 170 13.918 -0.463 -5.593 1.00 0.00 C ATOM 806 C SER A 170 13.307 0.941 -5.704 1.00 0.00 C ATOM 807 O SER A 170 12.714 1.429 -4.747 1.00 0.00 O ATOM 808 CB SER A 170 14.280 -0.787 -4.140 1.00 0.00 C ATOM 809 OG SER A 170 13.308 -1.623 -3.545 1.00 0.00 O ATOM 0 H SER A 170 15.091 -1.589 -6.880 1.00 0.00 H new ATOM 0 HA SER A 170 13.145 -1.145 -5.948 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.254 -1.275 -4.105 1.00 0.00 H new ATOM 0 HB3 SER A 170 14.367 0.138 -3.569 1.00 0.00 H new ATOM 0 HG SER A 170 13.728 -2.461 -3.259 1.00 0.00 H new ATOM 815 N ASN A 171 13.493 1.633 -6.832 1.00 0.00 N ATOM 816 CA ASN A 171 12.999 2.988 -7.001 1.00 0.00 C ATOM 817 C ASN A 171 11.500 2.973 -6.790 1.00 0.00 C ATOM 818 O ASN A 171 10.835 1.954 -6.999 1.00 0.00 O ATOM 819 CB ASN A 171 13.353 3.566 -8.375 1.00 0.00 C ATOM 820 CG ASN A 171 12.807 2.721 -9.510 1.00 0.00 C ATOM 821 OD1 ASN A 171 11.606 2.638 -9.752 1.00 0.00 O ATOM 822 ND2 ASN A 171 13.690 2.044 -10.220 1.00 0.00 N ATOM 0 H ASN A 171 13.988 1.266 -7.645 1.00 0.00 H new ATOM 0 HA ASN A 171 13.479 3.636 -6.267 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.956 4.578 -8.455 1.00 0.00 H new ATOM 0 HB3 ASN A 171 14.437 3.640 -8.468 1.00 0.00 H new ATOM 0 HD21 ASN A 171 13.378 1.442 -10.982 1.00 0.00 H new ATOM 0 HD22 ASN A 171 14.684 2.123 -10.007 1.00 0.00 H new ATOM 829 N GLN A 172 10.970 4.129 -6.407 1.00 0.00 N ATOM 830 CA GLN A 172 9.604 4.233 -5.927 1.00 0.00 C ATOM 831 C GLN A 172 8.625 3.631 -6.938 1.00 0.00 C ATOM 832 O GLN A 172 7.658 2.992 -6.531 1.00 0.00 O ATOM 833 CB GLN A 172 9.310 5.698 -5.621 1.00 0.00 C ATOM 834 CG GLN A 172 7.912 5.959 -5.074 1.00 0.00 C ATOM 835 CD GLN A 172 7.725 7.440 -4.761 1.00 0.00 C ATOM 836 OE1 GLN A 172 7.917 8.287 -5.631 1.00 0.00 O ATOM 837 NE2 GLN A 172 7.364 7.805 -3.546 1.00 0.00 N ATOM 0 H GLN A 172 11.475 5.015 -6.422 1.00 0.00 H new ATOM 0 HA GLN A 172 9.478 3.658 -5.010 1.00 0.00 H new ATOM 0 HB2 GLN A 172 10.043 6.060 -4.899 1.00 0.00 H new ATOM 0 HB3 GLN A 172 9.445 6.281 -6.532 1.00 0.00 H new ATOM 0 HG2 GLN A 172 7.166 5.638 -5.801 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.753 5.368 -4.172 1.00 0.00 H new ATOM 0 HE21 GLN A 172 7.206 7.099 -2.827 1.00 0.00 H new ATOM 0 HE22 GLN A 172 7.243 8.793 -3.325 1.00 0.00 H new ATOM 846 N ASN A 173 8.909 3.761 -8.239 1.00 0.00 N ATOM 847 CA ASN A 173 8.104 3.205 -9.308 1.00 0.00 C ATOM 848 C ASN A 173 7.838 1.711 -9.116 1.00 0.00 C ATOM 849 O ASN A 173 6.674 1.314 -9.204 1.00 0.00 O ATOM 850 CB ASN A 173 8.746 3.465 -10.685 1.00 0.00 C ATOM 851 CG ASN A 173 7.692 3.730 -11.743 1.00 0.00 C ATOM 852 OD1 ASN A 173 7.886 4.580 -12.613 1.00 0.00 O ATOM 853 ND2 ASN A 173 6.562 3.049 -11.693 1.00 0.00 N ATOM 0 H ASN A 173 9.727 4.270 -8.575 1.00 0.00 H new ATOM 0 HA ASN A 173 7.142 3.716 -9.272 1.00 0.00 H new ATOM 0 HB2 ASN A 173 9.421 4.319 -10.619 1.00 0.00 H new ATOM 0 HB3 ASN A 173 9.348 2.604 -10.976 1.00 0.00 H new ATOM 0 HD21 ASN A 173 5.831 3.223 -12.383 1.00 0.00 H new ATOM 0 HD22 ASN A 173 6.420 2.349 -10.965 1.00 0.00 H new ATOM 860 N ASN A 174 8.873 0.898 -8.857 1.00 0.00 N ATOM 861 CA ASN A 174 8.696 -0.541 -8.625 1.00 0.00 C ATOM 862 C ASN A 174 8.460 -0.890 -7.161 1.00 0.00 C ATOM 863 O ASN A 174 7.848 -1.917 -6.894 1.00 0.00 O ATOM 864 CB ASN A 174 9.814 -1.420 -9.191 1.00 0.00 C ATOM 865 CG ASN A 174 11.068 -1.488 -8.337 1.00 0.00 C ATOM 866 OD1 ASN A 174 11.109 -2.150 -7.306 1.00 0.00 O ATOM 867 ND2 ASN A 174 12.146 -0.873 -8.779 1.00 0.00 N ATOM 0 H ASN A 174 9.841 1.214 -8.803 1.00 0.00 H new ATOM 0 HA ASN A 174 7.791 -0.771 -9.188 1.00 0.00 H new ATOM 0 HB2 ASN A 174 9.429 -2.431 -9.326 1.00 0.00 H new ATOM 0 HB3 ASN A 174 10.084 -1.047 -10.179 1.00 0.00 H new ATOM 0 HD21 ASN A 174 13.023 -0.946 -8.263 1.00 0.00 H new ATOM 0 HD22 ASN A 174 12.104 -0.324 -9.638 1.00 0.00 H new ATOM 874 N PHE A 175 8.871 -0.044 -6.217 1.00 0.00 N ATOM 875 CA PHE A 175 8.697 -0.270 -4.793 1.00 0.00 C ATOM 876 C PHE A 175 7.209 -0.284 -4.537 1.00 0.00 C ATOM 877 O PHE A 175 6.703 -1.204 -3.910 1.00 0.00 O ATOM 878 CB PHE A 175 9.361 0.852 -3.987 1.00 0.00 C ATOM 879 CG PHE A 175 9.321 0.692 -2.477 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.135 0.941 -1.755 1.00 0.00 C ATOM 881 CD2 PHE A 175 10.494 0.345 -1.780 1.00 0.00 C ATOM 882 CE1 PHE A 175 8.124 0.835 -0.354 1.00 0.00 C ATOM 883 CE2 PHE A 175 10.486 0.257 -0.378 1.00 0.00 C ATOM 884 CZ PHE A 175 9.302 0.505 0.336 1.00 0.00 C ATOM 0 H PHE A 175 9.343 0.834 -6.431 1.00 0.00 H new ATOM 0 HA PHE A 175 9.159 -1.209 -4.488 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.403 0.930 -4.298 1.00 0.00 H new ATOM 0 HB3 PHE A 175 8.879 1.795 -4.247 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.232 1.214 -2.281 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.404 0.146 -2.326 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.209 1.007 0.193 1.00 0.00 H new ATOM 0 HE2 PHE A 175 11.391 -0.002 0.151 1.00 0.00 H new ATOM 0 HZ PHE A 175 9.298 0.442 1.414 1.00 0.00 H new ATOM 894 N VAL A 176 6.520 0.739 -5.042 1.00 0.00 N ATOM 895 CA VAL A 176 5.090 0.924 -4.954 1.00 0.00 C ATOM 896 C VAL A 176 4.374 -0.095 -5.853 1.00 0.00 C ATOM 897 O VAL A 176 3.280 -0.520 -5.493 1.00 0.00 O ATOM 898 CB VAL A 176 4.797 2.398 -5.296 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.311 2.695 -5.386 1.00 0.00 C ATOM 900 CG2 VAL A 176 5.396 3.352 -4.244 1.00 0.00 C ATOM 0 H VAL A 176 6.979 1.496 -5.549 1.00 0.00 H new ATOM 0 HA VAL A 176 4.705 0.734 -3.952 1.00 0.00 H new ATOM 0 HB VAL A 176 5.258 2.561 -6.270 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.164 3.747 -5.629 1.00 0.00 H new ATOM 0 HG12 VAL A 176 2.863 2.077 -6.164 1.00 0.00 H new ATOM 0 HG13 VAL A 176 2.837 2.474 -4.429 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.170 4.383 -4.517 1.00 0.00 H new ATOM 0 HG22 VAL A 176 4.965 3.133 -3.267 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.477 3.216 -4.203 1.00 0.00 H new ATOM 910 N HIS A 177 4.961 -0.544 -6.972 1.00 0.00 N ATOM 911 CA HIS A 177 4.394 -1.654 -7.734 1.00 0.00 C ATOM 912 C HIS A 177 4.341 -2.899 -6.852 1.00 0.00 C ATOM 913 O HIS A 177 3.251 -3.384 -6.555 1.00 0.00 O ATOM 914 CB HIS A 177 5.130 -1.902 -9.059 1.00 0.00 C ATOM 915 CG HIS A 177 4.485 -3.009 -9.862 1.00 0.00 C ATOM 916 ND1 HIS A 177 3.763 -2.874 -11.026 1.00 0.00 N ATOM 917 CD2 HIS A 177 4.395 -4.322 -9.483 1.00 0.00 C ATOM 918 CE1 HIS A 177 3.253 -4.082 -11.329 1.00 0.00 C ATOM 919 NE2 HIS A 177 3.579 -4.987 -10.394 1.00 0.00 N ATOM 0 H HIS A 177 5.820 -0.157 -7.363 1.00 0.00 H new ATOM 0 HA HIS A 177 3.377 -1.389 -8.023 1.00 0.00 H new ATOM 0 HB2 HIS A 177 5.139 -0.984 -9.647 1.00 0.00 H new ATOM 0 HB3 HIS A 177 6.169 -2.159 -8.855 1.00 0.00 H new ATOM 0 HD2 HIS A 177 4.875 -4.766 -8.624 1.00 0.00 H new ATOM 0 HE1 HIS A 177 2.661 -4.294 -12.207 1.00 0.00 H new ATOM 0 HE2 HIS A 177 3.288 -5.964 -10.358 1.00 0.00 H new ATOM 927 N ASP A 178 5.505 -3.450 -6.493 1.00 0.00 N ATOM 928 CA ASP A 178 5.665 -4.678 -5.721 1.00 0.00 C ATOM 929 C ASP A 178 4.933 -4.554 -4.396 1.00 0.00 C ATOM 930 O ASP A 178 4.259 -5.498 -3.994 1.00 0.00 O ATOM 931 CB ASP A 178 7.155 -4.982 -5.497 1.00 0.00 C ATOM 932 CG ASP A 178 7.729 -5.884 -6.590 1.00 0.00 C ATOM 933 OD1 ASP A 178 7.945 -5.460 -7.749 1.00 0.00 O ATOM 934 OD2 ASP A 178 7.950 -7.089 -6.336 1.00 0.00 O ATOM 0 H ASP A 178 6.399 -3.030 -6.746 1.00 0.00 H new ATOM 0 HA ASP A 178 5.233 -5.508 -6.280 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.715 -4.047 -5.468 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.285 -5.461 -4.527 1.00 0.00 H new ATOM 939 N CYS A 179 4.967 -3.379 -3.762 1.00 0.00 N ATOM 940 CA CYS A 179 4.230 -3.154 -2.525 1.00 0.00 C ATOM 941 C CYS A 179 2.730 -3.267 -2.738 1.00 0.00 C ATOM 942 O CYS A 179 2.094 -4.063 -2.047 1.00 0.00 O ATOM 943 CB CYS A 179 4.567 -1.786 -1.928 1.00 0.00 C ATOM 944 SG CYS A 179 3.375 -1.199 -0.701 1.00 0.00 S ATOM 0 H CYS A 179 5.498 -2.572 -4.088 1.00 0.00 H new ATOM 0 HA CYS A 179 4.536 -3.932 -1.825 1.00 0.00 H new ATOM 0 HB2 CYS A 179 5.553 -1.837 -1.465 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.631 -1.056 -2.735 1.00 0.00 H new ATOM 949 N VAL A 180 2.142 -2.466 -3.633 1.00 0.00 N ATOM 950 CA VAL A 180 0.696 -2.469 -3.822 1.00 0.00 C ATOM 951 C VAL A 180 0.257 -3.866 -4.248 1.00 0.00 C ATOM 952 O VAL A 180 -0.733 -4.365 -3.727 1.00 0.00 O ATOM 953 CB VAL A 180 0.253 -1.353 -4.790 1.00 0.00 C ATOM 954 CG1 VAL A 180 -1.241 -1.418 -5.142 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.516 0.046 -4.203 1.00 0.00 C ATOM 0 H VAL A 180 2.646 -1.812 -4.233 1.00 0.00 H new ATOM 0 HA VAL A 180 0.193 -2.239 -2.883 1.00 0.00 H new ATOM 0 HB VAL A 180 0.846 -1.518 -5.689 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.489 -0.606 -5.826 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.462 -2.374 -5.618 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.834 -1.320 -4.232 1.00 0.00 H new ATOM 0 HG21 VAL A 180 0.191 0.806 -4.914 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.038 0.160 -3.271 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.582 0.164 -4.008 1.00 0.00 H new ATOM 965 N ASN A 181 1.038 -4.518 -5.113 1.00 0.00 N ATOM 966 CA ASN A 181 0.796 -5.842 -5.665 1.00 0.00 C ATOM 967 C ASN A 181 0.642 -6.826 -4.514 1.00 0.00 C ATOM 968 O ASN A 181 -0.396 -7.466 -4.353 1.00 0.00 O ATOM 969 CB ASN A 181 1.998 -6.209 -6.555 1.00 0.00 C ATOM 970 CG ASN A 181 1.891 -7.506 -7.328 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.916 -8.236 -7.242 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.913 -7.815 -8.106 1.00 0.00 N ATOM 0 H ASN A 181 1.904 -4.108 -5.463 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.114 -5.869 -6.265 1.00 0.00 H new ATOM 0 HB2 ASN A 181 2.156 -5.399 -7.267 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.887 -6.258 -5.926 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.897 -8.678 -8.650 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.718 -7.191 -8.163 1.00 0.00 H new ATOM 979 N ILE A 182 1.685 -6.936 -3.692 1.00 0.00 N ATOM 980 CA ILE A 182 1.728 -7.921 -2.635 1.00 0.00 C ATOM 981 C ILE A 182 0.743 -7.540 -1.520 1.00 0.00 C ATOM 982 O ILE A 182 0.051 -8.414 -1.015 1.00 0.00 O ATOM 983 CB ILE A 182 3.193 -8.155 -2.192 1.00 0.00 C ATOM 984 CG1 ILE A 182 3.839 -9.298 -3.008 1.00 0.00 C ATOM 985 CG2 ILE A 182 3.334 -8.502 -0.714 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.121 -8.931 -4.466 1.00 0.00 C ATOM 0 H ILE A 182 2.514 -6.345 -3.747 1.00 0.00 H new ATOM 0 HA ILE A 182 1.384 -8.894 -2.986 1.00 0.00 H new ATOM 0 HB ILE A 182 3.699 -7.207 -2.373 1.00 0.00 H new ATOM 0 HG12 ILE A 182 4.773 -9.591 -2.529 1.00 0.00 H new ATOM 0 HG13 ILE A 182 3.182 -10.167 -2.982 1.00 0.00 H new ATOM 0 HG21 ILE A 182 4.387 -8.652 -0.474 1.00 0.00 H new ATOM 0 HG22 ILE A 182 2.937 -7.687 -0.109 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.779 -9.416 -0.500 1.00 0.00 H new ATOM 0 HD11 ILE A 182 4.574 -9.782 -4.974 1.00 0.00 H new ATOM 0 HD12 ILE A 182 3.187 -8.667 -4.962 1.00 0.00 H new ATOM 0 HD13 ILE A 182 4.803 -8.082 -4.502 1.00 0.00 H new ATOM 998 N THR A 183 0.630 -6.273 -1.125 1.00 0.00 N ATOM 999 CA THR A 183 -0.250 -5.881 -0.024 1.00 0.00 C ATOM 1000 C THR A 183 -1.713 -6.192 -0.364 1.00 0.00 C ATOM 1001 O THR A 183 -2.442 -6.738 0.466 1.00 0.00 O ATOM 1002 CB THR A 183 -0.035 -4.398 0.301 1.00 0.00 C ATOM 1003 OG1 THR A 183 1.328 -4.146 0.585 1.00 0.00 O ATOM 1004 CG2 THR A 183 -0.863 -3.934 1.501 1.00 0.00 C ATOM 0 H THR A 183 1.138 -5.498 -1.552 1.00 0.00 H new ATOM 0 HA THR A 183 -0.003 -6.460 0.866 1.00 0.00 H new ATOM 0 HB THR A 183 -0.357 -3.844 -0.581 1.00 0.00 H new ATOM 0 HG1 THR A 183 1.829 -4.075 -0.254 1.00 0.00 H new ATOM 0 HG21 THR A 183 -0.673 -2.877 1.687 1.00 0.00 H new ATOM 0 HG22 THR A 183 -1.922 -4.081 1.291 1.00 0.00 H new ATOM 0 HG23 THR A 183 -0.584 -4.513 2.381 1.00 0.00 H new ATOM 1012 N ILE A 184 -2.140 -5.905 -1.596 1.00 0.00 N ATOM 1013 CA ILE A 184 -3.431 -6.344 -2.116 1.00 0.00 C ATOM 1014 C ILE A 184 -3.486 -7.873 -2.036 1.00 0.00 C ATOM 1015 O ILE A 184 -4.395 -8.437 -1.421 1.00 0.00 O ATOM 1016 CB ILE A 184 -3.649 -5.727 -3.521 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -4.231 -4.303 -3.293 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -4.465 -6.619 -4.468 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -4.335 -3.382 -4.513 1.00 0.00 C ATOM 0 H ILE A 184 -1.594 -5.358 -2.262 1.00 0.00 H new ATOM 0 HA ILE A 184 -4.274 -5.988 -1.523 1.00 0.00 H new ATOM 0 HB ILE A 184 -2.705 -5.649 -4.060 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -5.228 -4.411 -2.866 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -3.616 -3.803 -2.545 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.576 -6.121 -5.431 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.949 -7.569 -4.608 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -5.450 -6.801 -4.038 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.757 -2.423 -4.210 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -3.343 -3.225 -4.936 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.980 -3.842 -5.262 1.00 0.00 H new ATOM 1031 N LYS A 185 -2.495 -8.586 -2.567 1.00 0.00 N ATOM 1032 CA LYS A 185 -2.454 -10.033 -2.496 1.00 0.00 C ATOM 1033 C LYS A 185 -2.520 -10.585 -1.075 1.00 0.00 C ATOM 1034 O LYS A 185 -2.998 -11.713 -0.928 1.00 0.00 O ATOM 1035 CB LYS A 185 -1.211 -10.496 -3.249 1.00 0.00 C ATOM 1036 CG LYS A 185 -1.487 -10.519 -4.734 1.00 0.00 C ATOM 1037 CD LYS A 185 -0.228 -11.012 -5.443 1.00 0.00 C ATOM 1038 CE LYS A 185 -0.472 -10.752 -6.911 1.00 0.00 C ATOM 1039 NZ LYS A 185 0.686 -11.118 -7.743 1.00 0.00 N ATOM 0 H LYS A 185 -1.702 -8.171 -3.057 1.00 0.00 H new ATOM 0 HA LYS A 185 -3.352 -10.435 -2.965 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.376 -9.828 -3.036 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -0.919 -11.490 -2.909 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -2.329 -11.175 -4.954 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -1.757 -9.524 -5.086 1.00 0.00 H new ATOM 0 HD2 LYS A 185 0.656 -10.480 -5.091 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -0.059 -12.072 -5.254 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -1.345 -11.318 -7.238 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -0.703 -9.697 -7.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 0.354 -11.509 -8.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 1.265 -10.273 -7.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 1.258 -11.831 -7.247 1.00 0.00 H new ATOM 1053 N GLN A 186 -2.156 -9.820 -0.038 1.00 0.00 N ATOM 1054 CA GLN A 186 -2.181 -10.282 1.344 1.00 0.00 C ATOM 1055 C GLN A 186 -3.234 -9.635 2.251 1.00 0.00 C ATOM 1056 O GLN A 186 -3.192 -9.841 3.470 1.00 0.00 O ATOM 1057 CB GLN A 186 -0.809 -10.275 2.033 1.00 0.00 C ATOM 1058 CG GLN A 186 0.445 -10.698 1.255 1.00 0.00 C ATOM 1059 CD GLN A 186 0.185 -11.827 0.268 1.00 0.00 C ATOM 1060 OE1 GLN A 186 0.559 -11.776 -0.895 1.00 0.00 O ATOM 1061 NE2 GLN A 186 -0.493 -12.871 0.702 1.00 0.00 N ATOM 0 H GLN A 186 -1.835 -8.857 -0.142 1.00 0.00 H new ATOM 0 HA GLN A 186 -2.493 -11.318 1.216 1.00 0.00 H new ATOM 0 HB2 GLN A 186 -0.636 -9.263 2.400 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -0.882 -10.923 2.906 1.00 0.00 H new ATOM 0 HG2 GLN A 186 0.838 -9.836 0.716 1.00 0.00 H new ATOM 0 HG3 GLN A 186 1.214 -11.011 1.961 1.00 0.00 H new ATOM 0 HE21 GLN A 186 -0.803 -12.910 1.673 1.00 0.00 H new ATOM 0 HE22 GLN A 186 -0.707 -13.640 0.067 1.00 0.00 H new ATOM 1070 N HIS A 187 -4.194 -8.904 1.696 1.00 0.00 N ATOM 1071 CA HIS A 187 -5.397 -8.508 2.428 1.00 0.00 C ATOM 1072 C HIS A 187 -6.639 -8.695 1.561 1.00 0.00 C ATOM 1073 O HIS A 187 -7.655 -9.217 2.018 1.00 0.00 O ATOM 1074 CB HIS A 187 -5.249 -7.083 2.982 1.00 0.00 C ATOM 1075 CG HIS A 187 -6.217 -6.088 2.412 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -7.427 -5.741 2.969 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -6.104 -5.447 1.210 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -8.000 -4.846 2.151 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -7.203 -4.603 1.099 1.00 0.00 N ATOM 0 H HIS A 187 -4.164 -8.570 0.733 1.00 0.00 H new ATOM 0 HA HIS A 187 -5.525 -9.160 3.292 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -5.374 -7.113 4.064 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -4.234 -6.735 2.788 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -7.816 -6.098 3.842 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -5.313 -5.572 0.486 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -8.964 -4.387 2.315 1.00 0.00 H new ATOM 1087 N THR A 188 -6.543 -8.326 0.286 1.00 0.00 N ATOM 1088 CA THR A 188 -7.615 -8.468 -0.665 1.00 0.00 C ATOM 1089 C THR A 188 -7.774 -9.961 -0.857 1.00 0.00 C ATOM 1090 O THR A 188 -8.855 -10.488 -0.609 1.00 0.00 O ATOM 1091 CB THR A 188 -7.312 -7.760 -1.999 1.00 0.00 C ATOM 1092 OG1 THR A 188 -6.854 -6.438 -1.819 1.00 0.00 O ATOM 1093 CG2 THR A 188 -8.567 -7.735 -2.857 1.00 0.00 C ATOM 0 H THR A 188 -5.699 -7.914 -0.111 1.00 0.00 H new ATOM 0 HA THR A 188 -8.530 -8.000 -0.301 1.00 0.00 H new ATOM 0 HB THR A 188 -6.517 -8.323 -2.488 1.00 0.00 H new ATOM 0 HG1 THR A 188 -6.977 -5.933 -2.650 1.00 0.00 H new ATOM 0 HG21 THR A 188 -8.352 -7.234 -3.801 1.00 0.00 H new ATOM 0 HG22 THR A 188 -8.893 -8.756 -3.054 1.00 0.00 H new ATOM 0 HG23 THR A 188 -9.356 -7.197 -2.332 1.00 0.00 H new ATOM 1101 N VAL A 189 -6.712 -10.677 -1.253 1.00 0.00 N ATOM 1102 CA VAL A 189 -6.932 -12.061 -1.649 1.00 0.00 C ATOM 1103 C VAL A 189 -7.138 -12.912 -0.401 1.00 0.00 C ATOM 1104 O VAL A 189 -7.871 -13.897 -0.448 1.00 0.00 O ATOM 1105 CB VAL A 189 -5.857 -12.544 -2.637 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -6.215 -13.915 -3.228 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -5.763 -11.523 -3.790 1.00 0.00 C ATOM 0 H VAL A 189 -5.750 -10.341 -1.305 1.00 0.00 H new ATOM 0 HA VAL A 189 -7.852 -12.161 -2.225 1.00 0.00 H new ATOM 0 HB VAL A 189 -4.910 -12.634 -2.105 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -5.435 -14.227 -3.922 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -6.300 -14.647 -2.425 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -7.165 -13.846 -3.758 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -5.005 -11.848 -4.503 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -6.727 -11.452 -4.293 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -5.490 -10.546 -3.390 1.00 0.00 H new ATOM 1117 N THR A 190 -6.659 -12.450 0.753 1.00 0.00 N ATOM 1118 CA THR A 190 -6.802 -13.186 2.002 1.00 0.00 C ATOM 1119 C THR A 190 -8.210 -13.022 2.596 1.00 0.00 C ATOM 1120 O THR A 190 -8.391 -13.315 3.775 1.00 0.00 O ATOM 1121 CB THR A 190 -5.678 -12.812 2.988 1.00 0.00 C ATOM 1122 OG1 THR A 190 -5.859 -11.523 3.521 1.00 0.00 O ATOM 1123 CG2 THR A 190 -4.290 -12.815 2.333 1.00 0.00 C ATOM 0 H THR A 190 -6.165 -11.562 0.846 1.00 0.00 H new ATOM 0 HA THR A 190 -6.692 -14.250 1.792 1.00 0.00 H new ATOM 0 HB THR A 190 -5.731 -13.573 3.767 1.00 0.00 H new ATOM 0 HG1 THR A 190 -5.129 -11.321 4.143 1.00 0.00 H new ATOM 0 HG21 THR A 190 -3.538 -12.545 3.074 1.00 0.00 H new ATOM 0 HG22 THR A 190 -4.074 -13.810 1.943 1.00 0.00 H new ATOM 0 HG23 THR A 190 -4.271 -12.093 1.517 1.00 0.00 H new ATOM 1131 N THR A 191 -9.199 -12.549 1.829 1.00 0.00 N ATOM 1132 CA THR A 191 -10.560 -12.408 2.310 1.00 0.00 C ATOM 1133 C THR A 191 -11.518 -12.446 1.119 1.00 0.00 C ATOM 1134 O THR A 191 -12.521 -13.131 1.197 1.00 0.00 O ATOM 1135 CB THR A 191 -10.754 -11.101 3.130 1.00 0.00 C ATOM 1136 OG1 THR A 191 -9.543 -10.459 3.520 1.00 0.00 O ATOM 1137 CG2 THR A 191 -11.410 -11.457 4.471 1.00 0.00 C ATOM 0 H THR A 191 -9.069 -12.256 0.861 1.00 0.00 H new ATOM 0 HA THR A 191 -10.776 -13.237 2.983 1.00 0.00 H new ATOM 0 HB THR A 191 -11.330 -10.446 2.477 1.00 0.00 H new ATOM 0 HG1 THR A 191 -9.079 -10.125 2.724 1.00 0.00 H new ATOM 0 HG21 THR A 191 -11.553 -10.550 5.058 1.00 0.00 H new ATOM 0 HG22 THR A 191 -12.376 -11.928 4.290 1.00 0.00 H new ATOM 0 HG23 THR A 191 -10.767 -12.146 5.019 1.00 0.00 H new ATOM 1145 N THR A 192 -11.196 -11.828 -0.019 1.00 0.00 N ATOM 1146 CA THR A 192 -11.995 -11.839 -1.254 1.00 0.00 C ATOM 1147 C THR A 192 -12.082 -13.238 -1.902 1.00 0.00 C ATOM 1148 O THR A 192 -12.730 -13.414 -2.932 1.00 0.00 O ATOM 1149 CB THR A 192 -11.503 -10.716 -2.199 1.00 0.00 C ATOM 1150 OG1 THR A 192 -12.566 -10.035 -2.805 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.601 -11.151 -3.354 1.00 0.00 C ATOM 0 H THR A 192 -10.338 -11.284 -0.113 1.00 0.00 H new ATOM 0 HA THR A 192 -13.033 -11.616 -1.008 1.00 0.00 H new ATOM 0 HB THR A 192 -10.926 -10.095 -1.514 1.00 0.00 H new ATOM 0 HG1 THR A 192 -12.213 -9.334 -3.392 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.321 -10.279 -3.945 1.00 0.00 H new ATOM 0 HG22 THR A 192 -9.703 -11.623 -2.956 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.135 -11.861 -3.985 1.00 0.00 H new ATOM 1159 N THR A 193 -11.417 -14.242 -1.327 1.00 0.00 N ATOM 1160 CA THR A 193 -11.635 -15.651 -1.628 1.00 0.00 C ATOM 1161 C THR A 193 -12.067 -16.417 -0.373 1.00 0.00 C ATOM 1162 O THR A 193 -12.403 -17.593 -0.467 1.00 0.00 O ATOM 1163 CB THR A 193 -10.352 -16.194 -2.300 1.00 0.00 C ATOM 1164 OG1 THR A 193 -10.613 -17.224 -3.230 1.00 0.00 O ATOM 1165 CG2 THR A 193 -9.328 -16.695 -1.276 1.00 0.00 C ATOM 0 H THR A 193 -10.695 -14.090 -0.623 1.00 0.00 H new ATOM 0 HA THR A 193 -12.460 -15.788 -2.327 1.00 0.00 H new ATOM 0 HB THR A 193 -9.934 -15.342 -2.836 1.00 0.00 H new ATOM 0 HG1 THR A 193 -9.770 -17.529 -3.625 1.00 0.00 H new ATOM 0 HG21 THR A 193 -8.445 -17.066 -1.796 1.00 0.00 H new ATOM 0 HG22 THR A 193 -9.043 -15.876 -0.616 1.00 0.00 H new ATOM 0 HG23 THR A 193 -9.767 -17.500 -0.686 1.00 0.00 H new ATOM 1173 N LYS A 194 -12.047 -15.785 0.803 1.00 0.00 N ATOM 1174 CA LYS A 194 -12.408 -16.359 2.088 1.00 0.00 C ATOM 1175 C LYS A 194 -13.558 -15.538 2.671 1.00 0.00 C ATOM 1176 O LYS A 194 -13.376 -14.840 3.674 1.00 0.00 O ATOM 1177 CB LYS A 194 -11.172 -16.387 2.998 1.00 0.00 C ATOM 1178 CG LYS A 194 -9.929 -16.929 2.303 1.00 0.00 C ATOM 1179 CD LYS A 194 -8.853 -17.422 3.264 1.00 0.00 C ATOM 1180 CE LYS A 194 -8.204 -16.249 4.000 1.00 0.00 C ATOM 1181 NZ LYS A 194 -8.927 -15.839 5.225 1.00 0.00 N ATOM 0 H LYS A 194 -11.763 -14.809 0.881 1.00 0.00 H new ATOM 0 HA LYS A 194 -12.748 -17.390 1.987 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -10.969 -15.378 3.356 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -11.387 -16.999 3.874 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -10.220 -17.749 1.646 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -9.508 -16.148 1.670 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -9.291 -18.112 3.985 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -8.093 -17.977 2.713 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -7.182 -16.520 4.266 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -8.142 -15.397 3.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -9.140 -14.822 5.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -9.815 -16.376 5.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -8.335 -16.031 6.058 1.00 0.00 H new ATOM 1195 N GLY A 195 -14.705 -15.569 1.995 1.00 0.00 N ATOM 1196 CA GLY A 195 -15.954 -14.983 2.464 1.00 0.00 C ATOM 1197 C GLY A 195 -16.195 -13.606 1.892 1.00 0.00 C ATOM 1198 O GLY A 195 -17.293 -13.304 1.425 1.00 0.00 O ATOM 0 H GLY A 195 -14.791 -16.015 1.082 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -16.783 -15.636 2.192 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -15.938 -14.924 3.552 1.00 0.00 H new ATOM 1202 N GLU A 196 -15.200 -12.738 2.010 1.00 0.00 N ATOM 1203 CA GLU A 196 -15.254 -11.367 1.542 1.00 0.00 C ATOM 1204 C GLU A 196 -15.316 -11.303 0.022 1.00 0.00 C ATOM 1205 O GLU A 196 -15.275 -12.312 -0.682 1.00 0.00 O ATOM 1206 CB GLU A 196 -14.072 -10.579 2.123 1.00 0.00 C ATOM 1207 CG GLU A 196 -14.504 -9.379 2.962 1.00 0.00 C ATOM 1208 CD GLU A 196 -15.212 -9.771 4.266 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -14.607 -10.458 5.119 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -16.352 -9.302 4.498 1.00 0.00 O ATOM 0 H GLU A 196 -14.310 -12.978 2.446 1.00 0.00 H new ATOM 0 HA GLU A 196 -16.172 -10.900 1.898 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -13.467 -11.245 2.738 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -13.437 -10.234 1.307 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -13.627 -8.777 3.200 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -15.170 -8.752 2.370 1.00 0.00 H new ATOM 1217 N ASN A 197 -15.410 -10.076 -0.477 1.00 0.00 N ATOM 1218 CA ASN A 197 -15.582 -9.764 -1.888 1.00 0.00 C ATOM 1219 C ASN A 197 -15.398 -8.263 -2.091 1.00 0.00 C ATOM 1220 O ASN A 197 -16.310 -7.537 -2.489 1.00 0.00 O ATOM 1221 CB ASN A 197 -16.913 -10.246 -2.460 1.00 0.00 C ATOM 1222 CG ASN A 197 -16.862 -10.284 -3.988 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -17.091 -11.315 -4.608 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -16.501 -9.201 -4.656 1.00 0.00 N ATOM 0 H ASN A 197 -15.367 -9.244 0.111 1.00 0.00 H new ATOM 0 HA ASN A 197 -14.820 -10.310 -2.444 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -17.142 -11.239 -2.074 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -17.716 -9.584 -2.134 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -16.417 -9.233 -5.672 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -16.307 -8.334 -4.155 1.00 0.00 H new ATOM 1231 N PHE A 198 -14.188 -7.802 -1.834 1.00 0.00 N ATOM 1232 CA PHE A 198 -13.707 -6.478 -2.190 1.00 0.00 C ATOM 1233 C PHE A 198 -14.083 -6.097 -3.625 1.00 0.00 C ATOM 1234 O PHE A 198 -13.578 -6.682 -4.585 1.00 0.00 O ATOM 1235 CB PHE A 198 -12.193 -6.431 -1.988 1.00 0.00 C ATOM 1236 CG PHE A 198 -11.802 -6.049 -0.580 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -12.074 -4.741 -0.142 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -11.247 -6.990 0.308 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -11.824 -4.379 1.194 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -10.994 -6.626 1.644 1.00 0.00 C ATOM 1241 CZ PHE A 198 -11.308 -5.330 2.090 1.00 0.00 C ATOM 0 H PHE A 198 -13.484 -8.362 -1.352 1.00 0.00 H new ATOM 0 HA PHE A 198 -14.187 -5.746 -1.541 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -11.769 -7.406 -2.226 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.760 -5.716 -2.687 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -12.475 -4.014 -0.832 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -11.016 -7.988 -0.035 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -12.028 -3.373 1.530 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -10.559 -7.342 2.326 1.00 0.00 H new ATOM 0 HZ PHE A 198 -11.152 -5.065 3.125 1.00 0.00 H new ATOM 1251 N THR A 199 -14.985 -5.131 -3.751 1.00 0.00 N ATOM 1252 CA THR A 199 -15.476 -4.548 -4.993 1.00 0.00 C ATOM 1253 C THR A 199 -14.408 -3.711 -5.681 1.00 0.00 C ATOM 1254 O THR A 199 -13.511 -3.212 -5.014 1.00 0.00 O ATOM 1255 CB THR A 199 -16.709 -3.680 -4.652 1.00 0.00 C ATOM 1256 OG1 THR A 199 -16.755 -3.287 -3.288 1.00 0.00 O ATOM 1257 CG2 THR A 199 -17.912 -4.590 -4.825 1.00 0.00 C ATOM 0 H THR A 199 -15.422 -4.706 -2.933 1.00 0.00 H new ATOM 0 HA THR A 199 -15.746 -5.344 -5.687 1.00 0.00 H new ATOM 0 HB THR A 199 -16.682 -2.791 -5.282 1.00 0.00 H new ATOM 0 HG1 THR A 199 -17.553 -2.740 -3.132 1.00 0.00 H new ATOM 0 HG21 THR A 199 -18.823 -4.036 -4.598 1.00 0.00 H new ATOM 0 HG22 THR A 199 -17.952 -4.949 -5.854 1.00 0.00 H new ATOM 0 HG23 THR A 199 -17.826 -5.440 -4.148 1.00 0.00 H new ATOM 1265 N GLU A 200 -14.535 -3.460 -6.985 1.00 0.00 N ATOM 1266 CA GLU A 200 -13.597 -2.651 -7.737 1.00 0.00 C ATOM 1267 C GLU A 200 -13.553 -1.229 -7.163 1.00 0.00 C ATOM 1268 O GLU A 200 -12.468 -0.705 -6.947 1.00 0.00 O ATOM 1269 CB GLU A 200 -14.000 -2.730 -9.216 1.00 0.00 C ATOM 1270 CG GLU A 200 -13.403 -1.589 -10.025 1.00 0.00 C ATOM 1271 CD GLU A 200 -13.610 -1.773 -11.527 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -12.784 -2.444 -12.182 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -14.577 -1.184 -12.069 1.00 0.00 O ATOM 0 H GLU A 200 -15.305 -3.821 -7.548 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.574 -3.019 -7.655 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.671 -3.682 -9.632 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -15.087 -2.705 -9.299 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -13.855 -0.648 -9.711 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -12.336 -1.516 -9.814 1.00 0.00 H new ATOM 1280 N THR A 201 -14.696 -0.617 -6.832 1.00 0.00 N ATOM 1281 CA THR A 201 -14.697 0.698 -6.187 1.00 0.00 C ATOM 1282 C THR A 201 -14.052 0.641 -4.791 1.00 0.00 C ATOM 1283 O THR A 201 -13.591 1.668 -4.303 1.00 0.00 O ATOM 1284 CB THR A 201 -16.130 1.260 -6.151 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.583 1.453 -7.480 1.00 0.00 O ATOM 1286 CG2 THR A 201 -16.275 2.638 -5.469 1.00 0.00 C ATOM 0 H THR A 201 -15.623 -1.008 -6.999 1.00 0.00 H new ATOM 0 HA THR A 201 -14.084 1.381 -6.775 1.00 0.00 H new ATOM 0 HB THR A 201 -16.700 0.529 -5.578 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.496 1.809 -7.466 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.320 2.948 -5.494 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.942 2.568 -4.434 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.666 3.371 -5.998 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.989 -0.508 -4.114 1.00 0.00 N ATOM 1295 CA ASP A 202 -13.288 -0.612 -2.832 1.00 0.00 C ATOM 1296 C ASP A 202 -11.795 -0.734 -3.129 1.00 0.00 C ATOM 1297 O ASP A 202 -10.993 0.018 -2.577 1.00 0.00 O ATOM 1298 CB ASP A 202 -13.806 -1.779 -1.968 1.00 0.00 C ATOM 1299 CG ASP A 202 -15.213 -1.573 -1.391 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -16.055 -0.904 -2.037 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -15.500 -2.105 -0.291 1.00 0.00 O ATOM 0 H ASP A 202 -14.415 -1.379 -4.432 1.00 0.00 H new ATOM 0 HA ASP A 202 -13.478 0.282 -2.238 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -13.804 -2.688 -2.570 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -13.110 -1.941 -1.145 1.00 0.00 H new ATOM 1306 N VAL A 203 -11.423 -1.614 -4.064 1.00 0.00 N ATOM 1307 CA VAL A 203 -10.048 -1.810 -4.494 1.00 0.00 C ATOM 1308 C VAL A 203 -9.450 -0.497 -4.989 1.00 0.00 C ATOM 1309 O VAL A 203 -8.304 -0.216 -4.665 1.00 0.00 O ATOM 1310 CB VAL A 203 -9.935 -2.900 -5.576 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -8.498 -2.989 -6.121 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -10.314 -4.273 -5.013 1.00 0.00 C ATOM 0 H VAL A 203 -12.087 -2.218 -4.548 1.00 0.00 H new ATOM 0 HA VAL A 203 -9.480 -2.151 -3.629 1.00 0.00 H new ATOM 0 HB VAL A 203 -10.620 -2.624 -6.377 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -8.446 -3.766 -6.883 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -8.215 -2.032 -6.559 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -7.815 -3.232 -5.307 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -10.226 -5.025 -5.797 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.645 -4.526 -4.191 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -11.341 -4.246 -4.650 1.00 0.00 H new ATOM 1322 N LYS A 204 -10.197 0.320 -5.736 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.770 1.639 -6.198 1.00 0.00 C ATOM 1324 C LYS A 204 -9.163 2.423 -5.047 1.00 0.00 C ATOM 1325 O LYS A 204 -8.058 2.952 -5.183 1.00 0.00 O ATOM 1326 CB LYS A 204 -10.988 2.401 -6.755 1.00 0.00 C ATOM 1327 CG LYS A 204 -11.359 2.001 -8.190 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.843 3.043 -9.188 1.00 0.00 C ATOM 1329 CE LYS A 204 -11.282 2.685 -10.608 1.00 0.00 C ATOM 1330 NZ LYS A 204 -10.136 2.420 -11.498 1.00 0.00 N ATOM 0 H LYS A 204 -11.138 0.075 -6.043 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.020 1.520 -6.980 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.845 2.225 -6.105 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -10.781 3.471 -6.727 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.935 1.024 -8.423 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.441 1.908 -8.280 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.222 4.030 -8.921 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -9.755 3.095 -9.139 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -11.925 1.806 -10.576 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -11.877 3.501 -11.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -10.483 2.182 -12.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -9.534 3.267 -11.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -9.581 1.624 -11.122 1.00 0.00 H new ATOM 1344 N MET A 205 -9.882 2.471 -3.929 1.00 0.00 N ATOM 1345 CA MET A 205 -9.489 3.187 -2.738 1.00 0.00 C ATOM 1346 C MET A 205 -8.260 2.512 -2.132 1.00 0.00 C ATOM 1347 O MET A 205 -7.310 3.220 -1.797 1.00 0.00 O ATOM 1348 CB MET A 205 -10.656 3.289 -1.753 1.00 0.00 C ATOM 1349 CG MET A 205 -11.955 3.806 -2.389 1.00 0.00 C ATOM 1350 SD MET A 205 -11.838 4.928 -3.811 1.00 0.00 S ATOM 1351 CE MET A 205 -13.113 6.126 -3.367 1.00 0.00 C ATOM 0 H MET A 205 -10.779 1.996 -3.833 1.00 0.00 H new ATOM 0 HA MET A 205 -9.218 4.212 -2.992 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.840 2.307 -1.318 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.373 3.952 -0.935 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.540 2.940 -2.698 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.525 4.315 -1.612 1.00 0.00 H new ATOM 0 HE1 MET A 205 -13.997 5.962 -3.983 1.00 0.00 H new ATOM 0 HE2 MET A 205 -13.376 6.005 -2.316 1.00 0.00 H new ATOM 0 HE3 MET A 205 -12.737 7.136 -3.533 1.00 0.00 H new ATOM 1361 N MET A 206 -8.246 1.176 -2.016 1.00 0.00 N ATOM 1362 CA MET A 206 -7.091 0.411 -1.542 1.00 0.00 C ATOM 1363 C MET A 206 -5.838 0.715 -2.345 1.00 0.00 C ATOM 1364 O MET A 206 -4.818 0.985 -1.721 1.00 0.00 O ATOM 1365 CB MET A 206 -7.331 -1.106 -1.563 1.00 0.00 C ATOM 1366 CG MET A 206 -8.191 -1.558 -0.386 1.00 0.00 C ATOM 1367 SD MET A 206 -9.724 -2.411 -0.831 1.00 0.00 S ATOM 1368 CE MET A 206 -9.068 -4.008 -1.399 1.00 0.00 C ATOM 0 H MET A 206 -9.048 0.592 -2.253 1.00 0.00 H new ATOM 0 HA MET A 206 -6.948 0.727 -0.509 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.818 -1.384 -2.498 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.374 -1.626 -1.535 1.00 0.00 H new ATOM 0 HG2 MET A 206 -7.596 -2.219 0.244 1.00 0.00 H new ATOM 0 HG3 MET A 206 -8.442 -0.685 0.216 1.00 0.00 H new ATOM 0 HE1 MET A 206 -9.611 -4.329 -2.288 1.00 0.00 H new ATOM 0 HE2 MET A 206 -8.010 -3.902 -1.638 1.00 0.00 H new ATOM 0 HE3 MET A 206 -9.190 -4.752 -0.612 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.891 0.697 -3.683 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.747 0.986 -4.530 1.00 0.00 C ATOM 1380 C GLU A 207 -4.083 2.270 -4.062 1.00 0.00 C ATOM 1381 O GLU A 207 -2.898 2.253 -3.752 1.00 0.00 O ATOM 1382 CB GLU A 207 -5.138 1.156 -6.001 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.651 -0.085 -6.734 1.00 0.00 C ATOM 1384 CD GLU A 207 -5.494 0.098 -8.242 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -5.971 1.127 -8.784 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -4.830 -0.751 -8.883 1.00 0.00 O ATOM 0 H GLU A 207 -6.740 0.479 -4.204 1.00 0.00 H new ATOM 0 HA GLU A 207 -4.068 0.137 -4.452 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -5.908 1.926 -6.060 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.269 1.532 -6.541 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.098 -0.966 -6.407 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.699 -0.256 -6.487 1.00 0.00 H new ATOM 1393 N ARG A 208 -4.850 3.363 -3.978 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.330 4.647 -3.538 1.00 0.00 C ATOM 1395 C ARG A 208 -3.863 4.605 -2.090 1.00 0.00 C ATOM 1396 O ARG A 208 -2.855 5.228 -1.773 1.00 0.00 O ATOM 1397 CB ARG A 208 -5.372 5.753 -3.661 1.00 0.00 C ATOM 1398 CG ARG A 208 -5.560 6.360 -5.036 1.00 0.00 C ATOM 1399 CD ARG A 208 -6.032 5.419 -6.129 1.00 0.00 C ATOM 1400 NE ARG A 208 -6.210 6.174 -7.369 1.00 0.00 N ATOM 1401 CZ ARG A 208 -5.241 6.641 -8.165 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -3.959 6.389 -7.916 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -5.562 7.392 -9.211 1.00 0.00 N ATOM 0 H ARG A 208 -5.842 3.375 -4.213 1.00 0.00 H new ATOM 0 HA ARG A 208 -3.484 4.861 -4.192 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -6.331 5.355 -3.331 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.103 6.552 -2.970 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.278 7.176 -4.954 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -4.612 6.799 -5.348 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -5.305 4.620 -6.277 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -6.970 4.947 -5.839 1.00 0.00 H new ATOM 0 HE ARG A 208 -7.170 6.364 -7.656 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -3.698 5.829 -7.104 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -3.237 6.755 -8.537 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -6.540 7.609 -9.402 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -4.831 7.753 -9.824 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.599 3.952 -1.192 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.260 3.938 0.226 1.00 0.00 C ATOM 1419 C VAL A 209 -2.894 3.269 0.409 1.00 0.00 C ATOM 1420 O VAL A 209 -2.016 3.843 1.059 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.434 3.332 1.045 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.136 2.097 1.895 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -6.022 4.403 1.965 1.00 0.00 C ATOM 0 H VAL A 209 -5.439 3.423 -1.426 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.142 4.944 0.628 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.125 2.988 0.275 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -6.043 1.783 2.411 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -4.785 1.289 1.253 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.366 2.337 2.629 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.845 3.978 2.539 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -5.250 4.760 2.647 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.390 5.236 1.365 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.699 2.104 -0.208 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.466 1.348 -0.147 1.00 0.00 C ATOM 1435 C VAL A 210 -0.379 2.104 -0.912 1.00 0.00 C ATOM 1436 O VAL A 210 0.730 2.202 -0.397 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.718 -0.057 -0.723 1.00 0.00 C ATOM 1438 CG1 VAL A 210 -0.451 -0.912 -0.717 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -2.775 -0.841 0.072 1.00 0.00 C ATOM 0 H VAL A 210 -3.417 1.656 -0.776 1.00 0.00 H new ATOM 0 HA VAL A 210 -1.124 1.231 0.881 1.00 0.00 H new ATOM 0 HB VAL A 210 -2.065 0.121 -1.741 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.674 -1.895 -1.132 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.317 -0.429 -1.321 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -0.092 -1.023 0.306 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.913 -1.824 -0.378 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -2.442 -0.957 1.103 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.720 -0.298 0.055 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.681 2.663 -2.091 1.00 0.00 N ATOM 1450 CA GLU A 211 0.215 3.501 -2.881 1.00 0.00 C ATOM 1451 C GLU A 211 0.782 4.572 -1.964 1.00 0.00 C ATOM 1452 O GLU A 211 1.993 4.690 -1.846 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.541 4.090 -4.094 1.00 0.00 C ATOM 1454 CG GLU A 211 0.105 5.292 -4.802 1.00 0.00 C ATOM 1455 CD GLU A 211 -0.738 5.884 -5.949 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -1.890 5.467 -6.216 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -0.212 6.772 -6.666 1.00 0.00 O ATOM 0 H GLU A 211 -1.592 2.536 -2.533 1.00 0.00 H new ATOM 0 HA GLU A 211 1.043 2.921 -3.289 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -0.674 3.296 -4.828 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.536 4.387 -3.762 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.294 6.073 -4.066 1.00 0.00 H new ATOM 0 HG3 GLU A 211 1.073 4.987 -5.199 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.078 5.335 -1.294 1.00 0.00 N ATOM 1465 CA GLN A 212 0.326 6.492 -0.523 1.00 0.00 C ATOM 1466 C GLN A 212 1.094 6.113 0.734 1.00 0.00 C ATOM 1467 O GLN A 212 2.049 6.810 1.098 1.00 0.00 O ATOM 1468 CB GLN A 212 -0.913 7.318 -0.181 1.00 0.00 C ATOM 1469 CG GLN A 212 -1.423 8.059 -1.418 1.00 0.00 C ATOM 1470 CD GLN A 212 -0.618 9.326 -1.691 1.00 0.00 C ATOM 1471 OE1 GLN A 212 0.603 9.394 -1.531 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.294 10.379 -2.076 1.00 0.00 N ATOM 0 H GLN A 212 -1.083 5.160 -1.275 1.00 0.00 H new ATOM 0 HA GLN A 212 1.010 7.086 -1.129 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.695 6.666 0.208 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -0.674 8.034 0.606 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -1.369 7.400 -2.285 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -2.473 8.318 -1.280 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -2.304 10.317 -2.207 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -0.811 11.261 -2.245 1.00 0.00 H new ATOM 1481 N MET A 213 0.701 5.037 1.412 1.00 0.00 N ATOM 1482 CA MET A 213 1.471 4.565 2.554 1.00 0.00 C ATOM 1483 C MET A 213 2.823 4.004 2.103 1.00 0.00 C ATOM 1484 O MET A 213 3.819 4.273 2.771 1.00 0.00 O ATOM 1485 CB MET A 213 0.649 3.583 3.392 1.00 0.00 C ATOM 1486 CG MET A 213 -0.495 4.347 4.087 1.00 0.00 C ATOM 1487 SD MET A 213 -1.338 3.558 5.489 1.00 0.00 S ATOM 1488 CE MET A 213 -1.195 1.817 5.030 1.00 0.00 C ATOM 0 H MET A 213 -0.130 4.487 1.195 1.00 0.00 H new ATOM 0 HA MET A 213 1.697 5.407 3.208 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.244 2.795 2.757 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.284 3.099 4.135 1.00 0.00 H new ATOM 0 HG2 MET A 213 -0.094 5.299 4.434 1.00 0.00 H new ATOM 0 HG3 MET A 213 -1.248 4.574 3.333 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.987 1.247 5.515 1.00 0.00 H new ATOM 0 HE2 MET A 213 -1.286 1.717 3.948 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.225 1.435 5.349 1.00 0.00 H new ATOM 1498 N CYS A 214 2.920 3.315 0.963 1.00 0.00 N ATOM 1499 CA CYS A 214 4.209 2.909 0.402 1.00 0.00 C ATOM 1500 C CYS A 214 4.997 4.060 -0.216 1.00 0.00 C ATOM 1501 O CYS A 214 6.219 3.983 -0.250 1.00 0.00 O ATOM 1502 CB CYS A 214 4.073 1.737 -0.569 1.00 0.00 C ATOM 1503 SG CYS A 214 4.425 0.195 0.297 1.00 0.00 S ATOM 0 H CYS A 214 2.115 3.026 0.408 1.00 0.00 H new ATOM 0 HA CYS A 214 4.797 2.566 1.254 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.066 1.711 -0.986 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.761 1.862 -1.405 1.00 0.00 H new ATOM 1508 N VAL A 215 4.364 5.157 -0.618 1.00 0.00 N ATOM 1509 CA VAL A 215 5.055 6.387 -0.970 1.00 0.00 C ATOM 1510 C VAL A 215 5.816 6.889 0.266 1.00 0.00 C ATOM 1511 O VAL A 215 6.957 7.315 0.100 1.00 0.00 O ATOM 1512 CB VAL A 215 4.052 7.384 -1.597 1.00 0.00 C ATOM 1513 CG1 VAL A 215 4.466 8.854 -1.497 1.00 0.00 C ATOM 1514 CG2 VAL A 215 3.805 7.055 -3.079 1.00 0.00 C ATOM 0 H VAL A 215 3.350 5.215 -0.709 1.00 0.00 H new ATOM 0 HA VAL A 215 5.810 6.236 -1.741 1.00 0.00 H new ATOM 0 HB VAL A 215 3.144 7.262 -1.007 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.704 9.479 -1.962 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.572 9.132 -0.448 1.00 0.00 H new ATOM 0 HG13 VAL A 215 5.417 9.000 -2.009 1.00 0.00 H new ATOM 0 HG21 VAL A 215 3.096 7.770 -3.497 1.00 0.00 H new ATOM 0 HG22 VAL A 215 4.746 7.114 -3.626 1.00 0.00 H new ATOM 0 HG23 VAL A 215 3.398 6.048 -3.165 1.00 0.00 H new ATOM 1524 N THR A 216 5.255 6.779 1.478 1.00 0.00 N ATOM 1525 CA THR A 216 5.956 7.024 2.740 1.00 0.00 C ATOM 1526 C THR A 216 6.991 5.930 3.026 1.00 0.00 C ATOM 1527 O THR A 216 8.140 6.259 3.315 1.00 0.00 O ATOM 1528 CB THR A 216 4.925 7.185 3.872 1.00 0.00 C ATOM 1529 OG1 THR A 216 4.267 8.419 3.681 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.520 7.178 5.286 1.00 0.00 C ATOM 0 H THR A 216 4.279 6.511 1.608 1.00 0.00 H new ATOM 0 HA THR A 216 6.522 7.953 2.668 1.00 0.00 H new ATOM 0 HB THR A 216 4.259 6.324 3.814 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.601 8.548 4.389 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.721 7.297 6.018 1.00 0.00 H new ATOM 0 HG22 THR A 216 6.034 6.232 5.460 1.00 0.00 H new ATOM 0 HG23 THR A 216 6.229 8.000 5.387 1.00 0.00 H new ATOM 1538 N GLN A 217 6.613 4.647 2.989 1.00 0.00 N ATOM 1539 CA GLN A 217 7.512 3.551 3.359 1.00 0.00 C ATOM 1540 C GLN A 217 8.761 3.558 2.470 1.00 0.00 C ATOM 1541 O GLN A 217 9.862 3.413 2.989 1.00 0.00 O ATOM 1542 CB GLN A 217 6.775 2.193 3.350 1.00 0.00 C ATOM 1543 CG GLN A 217 6.795 1.475 4.710 1.00 0.00 C ATOM 1544 CD GLN A 217 8.184 1.068 5.198 1.00 0.00 C ATOM 1545 OE1 GLN A 217 9.135 0.990 4.437 1.00 0.00 O ATOM 1546 NE2 GLN A 217 8.325 0.810 6.489 1.00 0.00 N ATOM 0 H GLN A 217 5.682 4.342 2.704 1.00 0.00 H new ATOM 0 HA GLN A 217 7.849 3.705 4.384 1.00 0.00 H new ATOM 0 HB2 GLN A 217 5.740 2.352 3.047 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.230 1.546 2.600 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.339 2.126 5.456 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.173 0.583 4.643 1.00 0.00 H new ATOM 0 HE21 GLN A 217 7.522 0.879 7.114 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.237 0.542 6.859 1.00 0.00 H new ATOM 1555 N TYR A 218 8.621 3.860 1.173 1.00 0.00 N ATOM 1556 CA TYR A 218 9.753 4.032 0.275 1.00 0.00 C ATOM 1557 C TYR A 218 10.758 5.017 0.860 1.00 0.00 C ATOM 1558 O TYR A 218 11.938 4.701 0.891 1.00 0.00 O ATOM 1559 CB TYR A 218 9.319 4.496 -1.123 1.00 0.00 C ATOM 1560 CG TYR A 218 10.509 4.817 -2.006 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.399 3.788 -2.370 1.00 0.00 C ATOM 1562 CD2 TYR A 218 10.765 6.141 -2.408 1.00 0.00 C ATOM 1563 CE1 TYR A 218 12.544 4.061 -3.134 1.00 0.00 C ATOM 1564 CE2 TYR A 218 11.885 6.414 -3.220 1.00 0.00 C ATOM 1565 CZ TYR A 218 12.794 5.378 -3.568 1.00 0.00 C ATOM 1566 OH TYR A 218 13.906 5.600 -4.327 1.00 0.00 O ATOM 0 H TYR A 218 7.715 3.991 0.723 1.00 0.00 H new ATOM 0 HA TYR A 218 10.225 3.055 0.168 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.717 3.718 -1.593 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.685 5.378 -1.032 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.197 2.774 -2.057 1.00 0.00 H new ATOM 0 HD2 TYR A 218 10.109 6.941 -2.097 1.00 0.00 H new ATOM 0 HE1 TYR A 218 13.230 3.266 -3.388 1.00 0.00 H new ATOM 0 HE2 TYR A 218 12.054 7.418 -3.580 1.00 0.00 H new ATOM 0 HH TYR A 218 13.959 6.550 -4.560 1.00 0.00 H new ATOM 1576 N GLN A 219 10.320 6.178 1.363 1.00 0.00 N ATOM 1577 CA GLN A 219 11.239 7.155 1.942 1.00 0.00 C ATOM 1578 C GLN A 219 11.994 6.537 3.116 1.00 0.00 C ATOM 1579 O GLN A 219 13.206 6.722 3.214 1.00 0.00 O ATOM 1580 CB GLN A 219 10.536 8.431 2.424 1.00 0.00 C ATOM 1581 CG GLN A 219 9.454 8.969 1.493 1.00 0.00 C ATOM 1582 CD GLN A 219 9.887 9.239 0.060 1.00 0.00 C ATOM 1583 OE1 GLN A 219 10.950 9.793 -0.192 1.00 0.00 O ATOM 1584 NE2 GLN A 219 9.022 8.955 -0.893 1.00 0.00 N ATOM 0 H GLN A 219 9.340 6.459 1.379 1.00 0.00 H new ATOM 0 HA GLN A 219 11.927 7.436 1.145 1.00 0.00 H new ATOM 0 HB2 GLN A 219 10.089 8.234 3.398 1.00 0.00 H new ATOM 0 HB3 GLN A 219 11.287 9.208 2.569 1.00 0.00 H new ATOM 0 HG2 GLN A 219 8.629 8.256 1.475 1.00 0.00 H new ATOM 0 HG3 GLN A 219 9.065 9.895 1.916 1.00 0.00 H new ATOM 0 HE21 GLN A 219 8.142 8.493 -0.662 1.00 0.00 H new ATOM 0 HE22 GLN A 219 9.232 9.197 -1.861 1.00 0.00 H new ATOM 1593 N LYS A 220 11.273 5.839 4.001 1.00 0.00 N ATOM 1594 CA LYS A 220 11.790 5.249 5.232 1.00 0.00 C ATOM 1595 C LYS A 220 12.881 4.234 4.902 1.00 0.00 C ATOM 1596 O LYS A 220 14.027 4.384 5.319 1.00 0.00 O ATOM 1597 CB LYS A 220 10.652 4.599 6.043 1.00 0.00 C ATOM 1598 CG LYS A 220 9.623 5.628 6.522 1.00 0.00 C ATOM 1599 CD LYS A 220 8.436 4.984 7.240 1.00 0.00 C ATOM 1600 CE LYS A 220 7.735 6.065 8.068 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.282 6.140 9.441 1.00 0.00 N ATOM 0 H LYS A 220 10.276 5.666 3.871 1.00 0.00 H new ATOM 0 HA LYS A 220 12.226 6.036 5.847 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.154 3.848 5.430 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.072 4.080 6.904 1.00 0.00 H new ATOM 0 HG2 LYS A 220 10.108 6.336 7.194 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.260 6.198 5.667 1.00 0.00 H new ATOM 0 HD2 LYS A 220 7.745 4.550 6.518 1.00 0.00 H new ATOM 0 HD3 LYS A 220 8.776 4.172 7.884 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.849 7.031 7.577 1.00 0.00 H new ATOM 0 HE3 LYS A 220 6.666 5.854 8.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 7.784 6.882 9.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.150 5.225 9.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 9.296 6.366 9.399 1.00 0.00 H new ATOM 1615 N GLU A 221 12.524 3.201 4.141 1.00 0.00 N ATOM 1616 CA GLU A 221 13.430 2.132 3.746 1.00 0.00 C ATOM 1617 C GLU A 221 14.582 2.684 2.903 1.00 0.00 C ATOM 1618 O GLU A 221 15.727 2.295 3.138 1.00 0.00 O ATOM 1619 CB GLU A 221 12.649 1.061 2.973 1.00 0.00 C ATOM 1620 CG GLU A 221 12.539 -0.283 3.698 1.00 0.00 C ATOM 1621 CD GLU A 221 13.882 -1.010 3.823 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.460 -1.390 2.788 1.00 0.00 O ATOM 1623 OE2 GLU A 221 14.383 -1.203 4.955 1.00 0.00 O ATOM 0 H GLU A 221 11.579 3.084 3.777 1.00 0.00 H new ATOM 0 HA GLU A 221 13.862 1.680 4.639 1.00 0.00 H new ATOM 0 HB2 GLU A 221 11.645 1.435 2.771 1.00 0.00 H new ATOM 0 HB3 GLU A 221 13.131 0.902 2.008 1.00 0.00 H new ATOM 0 HG2 GLU A 221 12.127 -0.119 4.694 1.00 0.00 H new ATOM 0 HG3 GLU A 221 11.836 -0.921 3.163 1.00 0.00 H new ATOM 1630 N SER A 222 14.299 3.624 1.987 1.00 0.00 N ATOM 1631 CA SER A 222 15.299 4.330 1.197 1.00 0.00 C ATOM 1632 C SER A 222 16.320 4.926 2.152 1.00 0.00 C ATOM 1633 O SER A 222 17.487 4.588 2.034 1.00 0.00 O ATOM 1634 CB SER A 222 14.652 5.376 0.266 1.00 0.00 C ATOM 1635 OG SER A 222 15.590 6.137 -0.477 1.00 0.00 O ATOM 0 H SER A 222 13.344 3.915 1.776 1.00 0.00 H new ATOM 0 HA SER A 222 15.811 3.639 0.528 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.981 4.867 -0.426 1.00 0.00 H new ATOM 0 HB3 SER A 222 14.041 6.052 0.864 1.00 0.00 H new ATOM 0 HG SER A 222 15.114 6.778 -1.046 1.00 0.00 H new ATOM 1641 N GLN A 223 15.922 5.752 3.125 1.00 0.00 N ATOM 1642 CA GLN A 223 16.820 6.458 4.028 1.00 0.00 C ATOM 1643 C GLN A 223 17.785 5.511 4.734 1.00 0.00 C ATOM 1644 O GLN A 223 18.959 5.852 4.878 1.00 0.00 O ATOM 1645 CB GLN A 223 15.998 7.261 5.059 1.00 0.00 C ATOM 1646 CG GLN A 223 16.275 8.770 5.001 1.00 0.00 C ATOM 1647 CD GLN A 223 17.388 9.225 5.944 1.00 0.00 C ATOM 1648 OE1 GLN A 223 17.259 10.250 6.611 1.00 0.00 O ATOM 1649 NE2 GLN A 223 18.480 8.489 6.070 1.00 0.00 N ATOM 0 H GLN A 223 14.938 5.949 3.306 1.00 0.00 H new ATOM 0 HA GLN A 223 17.423 7.142 3.431 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.936 7.085 4.886 1.00 0.00 H new ATOM 0 HB3 GLN A 223 16.223 6.894 6.060 1.00 0.00 H new ATOM 0 HG2 GLN A 223 16.541 9.043 3.980 1.00 0.00 H new ATOM 0 HG3 GLN A 223 15.360 9.309 5.246 1.00 0.00 H new ATOM 0 HE21 GLN A 223 18.588 7.639 5.517 1.00 0.00 H new ATOM 0 HE22 GLN A 223 19.214 8.772 6.720 1.00 0.00 H new ATOM 1658 N ALA A 224 17.294 4.361 5.192 1.00 0.00 N ATOM 1659 CA ALA A 224 18.079 3.398 5.937 1.00 0.00 C ATOM 1660 C ALA A 224 19.000 2.614 5.002 1.00 0.00 C ATOM 1661 O ALA A 224 20.063 2.159 5.428 1.00 0.00 O ATOM 1662 CB ALA A 224 17.125 2.468 6.688 1.00 0.00 C ATOM 0 H ALA A 224 16.325 4.075 5.050 1.00 0.00 H new ATOM 0 HA ALA A 224 18.716 3.914 6.655 1.00 0.00 H new ATOM 0 HB1 ALA A 224 17.701 1.736 7.254 1.00 0.00 H new ATOM 0 HB2 ALA A 224 16.509 3.053 7.371 1.00 0.00 H new ATOM 0 HB3 ALA A 224 16.484 1.951 5.974 1.00 0.00 H new ATOM 1668 N TYR A 225 18.640 2.496 3.722 1.00 0.00 N ATOM 1669 CA TYR A 225 19.505 1.911 2.722 1.00 0.00 C ATOM 1670 C TYR A 225 20.640 2.901 2.439 1.00 0.00 C ATOM 1671 O TYR A 225 21.820 2.544 2.413 1.00 0.00 O ATOM 1672 CB TYR A 225 18.663 1.558 1.478 1.00 0.00 C ATOM 1673 CG TYR A 225 19.301 1.805 0.126 1.00 0.00 C ATOM 1674 CD1 TYR A 225 19.224 3.082 -0.471 1.00 0.00 C ATOM 1675 CD2 TYR A 225 19.895 0.738 -0.571 1.00 0.00 C ATOM 1676 CE1 TYR A 225 19.726 3.286 -1.766 1.00 0.00 C ATOM 1677 CE2 TYR A 225 20.390 0.939 -1.867 1.00 0.00 C ATOM 1678 CZ TYR A 225 20.301 2.209 -2.475 1.00 0.00 C ATOM 1679 OH TYR A 225 20.790 2.391 -3.729 1.00 0.00 O ATOM 0 H TYR A 225 17.738 2.806 3.360 1.00 0.00 H new ATOM 0 HA TYR A 225 19.961 0.981 3.061 1.00 0.00 H new ATOM 0 HB2 TYR A 225 18.394 0.503 1.539 1.00 0.00 H new ATOM 0 HB3 TYR A 225 17.735 2.127 1.524 1.00 0.00 H new ATOM 0 HD1 TYR A 225 18.778 3.904 0.070 1.00 0.00 H new ATOM 0 HD2 TYR A 225 19.970 -0.235 -0.108 1.00 0.00 H new ATOM 0 HE1 TYR A 225 19.672 4.265 -2.219 1.00 0.00 H new ATOM 0 HE2 TYR A 225 20.842 0.117 -2.403 1.00 0.00 H new ATOM 0 HH TYR A 225 21.531 1.768 -3.885 1.00 0.00 H new ATOM 1689 N TYR A 226 20.254 4.159 2.255 1.00 0.00 N ATOM 1690 CA TYR A 226 21.006 5.272 1.704 1.00 0.00 C ATOM 1691 C TYR A 226 22.200 5.629 2.547 1.00 0.00 C ATOM 1692 O TYR A 226 23.276 5.935 2.041 1.00 0.00 O ATOM 1693 CB TYR A 226 20.081 6.490 1.738 1.00 0.00 C ATOM 1694 CG TYR A 226 19.982 7.212 0.449 1.00 0.00 C ATOM 1695 CD1 TYR A 226 21.024 8.065 0.083 1.00 0.00 C ATOM 1696 CD2 TYR A 226 18.827 7.056 -0.325 1.00 0.00 C ATOM 1697 CE1 TYR A 226 20.882 8.834 -1.087 1.00 0.00 C ATOM 1698 CE2 TYR A 226 18.672 7.829 -1.485 1.00 0.00 C ATOM 1699 CZ TYR A 226 19.691 8.741 -1.851 1.00 0.00 C ATOM 1700 OH TYR A 226 19.511 9.561 -2.918 1.00 0.00 O ATOM 0 H TYR A 226 19.312 4.449 2.515 1.00 0.00 H new ATOM 0 HA TYR A 226 21.347 4.995 0.706 1.00 0.00 H new ATOM 0 HB2 TYR A 226 19.084 6.167 2.038 1.00 0.00 H new ATOM 0 HB3 TYR A 226 20.436 7.181 2.503 1.00 0.00 H new ATOM 0 HD1 TYR A 226 21.919 8.133 0.684 1.00 0.00 H new ATOM 0 HD2 TYR A 226 18.064 6.349 -0.033 1.00 0.00 H new ATOM 0 HE1 TYR A 226 21.678 9.493 -1.402 1.00 0.00 H new ATOM 0 HE2 TYR A 226 17.785 7.730 -2.093 1.00 0.00 H new ATOM 0 HH TYR A 226 18.645 9.370 -3.335 1.00 0.00 H new