USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 805 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 187 HIS : no HE2:sc= -0.183 K(o=-0.26,f=-2.4) USER MOD Set 1.2: A 206 MET CE :methyl 159:sc= -0.0753 (180deg=-0.503) USER MOD Set 2.1: A 177 HIS : no HE2:sc= -0.873 K(o=-1.2,f=-1.8) USER MOD Set 2.2: A 181 ASN : amide:sc= -0.299 K(o=-1.2,f=-1.7) USER MOD Set 3.1: A 170 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 218 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 138 MET CE :methyl -152:sc= -1.08 (180deg=-2.63!) USER MOD Set 4.2: A 154 MET CE :methyl 174:sc= -0.311 (180deg=-0.474) USER MOD Single : A 128 TYR OH : rot 170:sc= 1.22 USER MOD Single : A 129 MET CE :methyl 164:sc= -2.16! (180deg=-2.81!) USER MOD Single : A 132 SER OG : rot 180:sc= -0.0682 USER MOD Single : A 134 MET CE :methyl -174:sc= -1.4 (180deg=-2) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.0525 X(o=-0.052,f=-0.54) USER MOD Single : A 143 ASN : amide:sc= 0.68 K(o=0.68,f=-0.073) USER MOD Single : A 149 TYR OH : rot 80:sc= -0.0094 USER MOD Single : A 150 TYR OH : rot 173:sc= 1.14 USER MOD Single : A 153 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 TYR OH : rot -110:sc= 0.67 USER MOD Single : A 157 TYR OH : rot 180:sc= -0.0468 USER MOD Single : A 159 ASN : amide:sc= -0.114 X(o=-0.11,f=0) USER MOD Single : A 160 GLN : amide:sc= 1.12 K(o=1.1,f=-0.021) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 75:sc= 1.21 USER MOD Single : A 168 GLN :FLIP amide:sc= 0 F(o=-0.59,f=0) USER MOD Single : A 171 ASN : amide:sc= 0.256 K(o=0.26,f=-3.9!) USER MOD Single : A 172 GLN : amide:sc= -0.0511 X(o=-0.051,f=-0.28) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 ASN : amide:sc= -1.12 K(o=-1.1,f=-3.2!) USER MOD Single : A 183 THR OG1 : rot 83:sc= 1 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -1.37 K(o=-1.4,f=-7.3!) USER MOD Single : A 188 THR OG1 : rot -64:sc= -0.806 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 15:sc= 0.136 USER MOD Single : A 192 THR OG1 : rot -179:sc= 0.0498 USER MOD Single : A 193 THR OG1 : rot -42:sc= 0.126 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 199 THR OG1 : rot -83:sc= 1.19 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 -135:sc= -0.322 (180deg=-2.41!) USER MOD Single : A 212 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 213 MET CE :methyl -179:sc= -0.411 (180deg=-0.423) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= -0.266 X(o=-0.27,f=-0.065) USER MOD Single : A 219 GLN : amide:sc= -0.422 X(o=-0.42,f=-0.037) USER MOD Single : A 220 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.11) USER MOD Single : A 222 SER OG : rot 84:sc= 0.0383 USER MOD Single : A 223 GLN :FLIP amide:sc= -0.245 F(o=-0.99,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 8.794 -13.455 -1.792 1.00 0.00 N ATOM 66 CA LEU A 125 9.021 -12.452 -2.825 1.00 0.00 C ATOM 67 C LEU A 125 10.495 -12.476 -3.218 1.00 0.00 C ATOM 68 O LEU A 125 11.293 -13.166 -2.575 1.00 0.00 O ATOM 69 CB LEU A 125 8.561 -11.076 -2.345 1.00 0.00 C ATOM 70 CG LEU A 125 7.065 -11.008 -1.995 1.00 0.00 C ATOM 71 CD1 LEU A 125 6.629 -9.556 -1.812 1.00 0.00 C ATOM 72 CD2 LEU A 125 6.134 -11.646 -3.036 1.00 0.00 C ATOM 0 HA LEU A 125 8.430 -12.680 -3.712 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.143 -10.795 -1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.777 -10.340 -3.120 1.00 0.00 H new ATOM 0 HG LEU A 125 6.970 -11.584 -1.074 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.568 -9.523 -1.565 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.204 -9.102 -1.005 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.803 -9.005 -2.736 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.100 -11.551 -2.706 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.257 -11.139 -3.993 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.384 -12.701 -3.149 1.00 0.00 H new ATOM 84 N GLY A 126 10.874 -11.670 -4.208 1.00 0.00 N ATOM 85 CA GLY A 126 12.237 -11.464 -4.681 1.00 0.00 C ATOM 86 C GLY A 126 13.039 -10.632 -3.688 1.00 0.00 C ATOM 87 O GLY A 126 13.486 -9.533 -4.013 1.00 0.00 O ATOM 0 H GLY A 126 10.198 -11.113 -4.730 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.724 -12.428 -4.830 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.218 -10.963 -5.649 1.00 0.00 H new ATOM 91 N GLY A 127 13.144 -11.119 -2.453 1.00 0.00 N ATOM 92 CA GLY A 127 13.864 -10.500 -1.352 1.00 0.00 C ATOM 93 C GLY A 127 13.348 -9.102 -1.026 1.00 0.00 C ATOM 94 O GLY A 127 14.160 -8.189 -0.840 1.00 0.00 O ATOM 0 H GLY A 127 12.706 -12.000 -2.184 1.00 0.00 H new ATOM 0 HA2 GLY A 127 13.779 -11.130 -0.467 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.923 -10.443 -1.602 1.00 0.00 H new ATOM 98 N TYR A 128 12.021 -8.948 -0.985 1.00 0.00 N ATOM 99 CA TYR A 128 11.334 -7.711 -0.654 1.00 0.00 C ATOM 100 C TYR A 128 11.370 -7.508 0.863 1.00 0.00 C ATOM 101 O TYR A 128 11.528 -8.466 1.627 1.00 0.00 O ATOM 102 CB TYR A 128 9.879 -7.792 -1.151 1.00 0.00 C ATOM 103 CG TYR A 128 9.641 -7.512 -2.625 1.00 0.00 C ATOM 104 CD1 TYR A 128 10.306 -8.279 -3.596 1.00 0.00 C ATOM 105 CD2 TYR A 128 8.668 -6.575 -3.028 1.00 0.00 C ATOM 106 CE1 TYR A 128 9.952 -8.191 -4.946 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.312 -6.466 -4.388 1.00 0.00 C ATOM 108 CZ TYR A 128 8.923 -7.316 -5.343 1.00 0.00 C ATOM 109 OH TYR A 128 8.532 -7.334 -6.642 1.00 0.00 O ATOM 0 H TYR A 128 11.379 -9.714 -1.190 1.00 0.00 H new ATOM 0 HA TYR A 128 11.826 -6.866 -1.136 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.500 -8.789 -0.929 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.282 -7.088 -0.571 1.00 0.00 H new ATOM 0 HD1 TYR A 128 11.101 -8.945 -3.296 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.195 -5.940 -2.294 1.00 0.00 H new ATOM 0 HE1 TYR A 128 10.466 -8.792 -5.681 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.577 -5.738 -4.700 1.00 0.00 H new ATOM 0 HH TYR A 128 7.714 -6.804 -6.745 1.00 0.00 H new ATOM 119 N MET A 129 11.161 -6.267 1.281 1.00 0.00 N ATOM 120 CA MET A 129 11.258 -5.748 2.631 1.00 0.00 C ATOM 121 C MET A 129 9.880 -5.228 2.998 1.00 0.00 C ATOM 122 O MET A 129 9.279 -4.516 2.204 1.00 0.00 O ATOM 123 CB MET A 129 12.293 -4.599 2.663 1.00 0.00 C ATOM 124 CG MET A 129 13.689 -4.895 2.077 1.00 0.00 C ATOM 125 SD MET A 129 14.916 -5.715 3.140 1.00 0.00 S ATOM 126 CE MET A 129 13.918 -7.066 3.799 1.00 0.00 C ATOM 0 H MET A 129 10.896 -5.536 0.621 1.00 0.00 H new ATOM 0 HA MET A 129 11.580 -6.515 3.336 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.873 -3.750 2.124 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.420 -4.287 3.700 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.552 -5.513 1.190 1.00 0.00 H new ATOM 0 HG3 MET A 129 14.117 -3.949 1.744 1.00 0.00 H new ATOM 0 HE1 MET A 129 14.571 -7.821 4.236 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.245 -6.681 4.565 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.334 -7.513 2.994 1.00 0.00 H new ATOM 136 N LEU A 130 9.350 -5.614 4.154 1.00 0.00 N ATOM 137 CA LEU A 130 8.076 -5.114 4.644 1.00 0.00 C ATOM 138 C LEU A 130 8.344 -3.913 5.543 1.00 0.00 C ATOM 139 O LEU A 130 9.050 -4.036 6.546 1.00 0.00 O ATOM 140 CB LEU A 130 7.320 -6.236 5.372 1.00 0.00 C ATOM 141 CG LEU A 130 5.935 -5.780 5.872 1.00 0.00 C ATOM 142 CD1 LEU A 130 4.900 -5.672 4.753 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.420 -6.742 6.932 1.00 0.00 C ATOM 0 H LEU A 130 9.796 -6.286 4.778 1.00 0.00 H new ATOM 0 HA LEU A 130 7.441 -4.789 3.820 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.199 -7.085 4.700 1.00 0.00 H new ATOM 0 HB3 LEU A 130 7.914 -6.581 6.218 1.00 0.00 H new ATOM 0 HG LEU A 130 6.071 -4.783 6.290 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.947 -5.347 5.169 1.00 0.00 H new ATOM 0 HD12 LEU A 130 5.239 -4.947 4.013 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.775 -6.645 4.278 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.441 -6.411 7.279 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.335 -7.742 6.506 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.114 -6.763 7.772 1.00 0.00 H new ATOM 155 N GLY A 131 7.760 -2.774 5.182 1.00 0.00 N ATOM 156 CA GLY A 131 7.730 -1.555 5.973 1.00 0.00 C ATOM 157 C GLY A 131 6.902 -1.727 7.236 1.00 0.00 C ATOM 158 O GLY A 131 6.194 -2.717 7.387 1.00 0.00 O ATOM 0 H GLY A 131 7.274 -2.675 4.290 1.00 0.00 H new ATOM 0 HA2 GLY A 131 8.747 -1.269 6.240 1.00 0.00 H new ATOM 0 HA3 GLY A 131 7.317 -0.743 5.375 1.00 0.00 H new ATOM 162 N SER A 132 6.965 -0.765 8.144 1.00 0.00 N ATOM 163 CA SER A 132 6.286 -0.878 9.423 1.00 0.00 C ATOM 164 C SER A 132 4.815 -0.519 9.243 1.00 0.00 C ATOM 165 O SER A 132 4.324 -0.184 8.163 1.00 0.00 O ATOM 166 CB SER A 132 6.991 -0.036 10.501 1.00 0.00 C ATOM 167 OG SER A 132 6.446 -0.210 11.798 1.00 0.00 O ATOM 0 H SER A 132 7.482 0.105 8.017 1.00 0.00 H new ATOM 0 HA SER A 132 6.333 -1.907 9.780 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.049 -0.298 10.522 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.929 1.017 10.227 1.00 0.00 H new ATOM 0 HG SER A 132 6.937 0.349 12.437 1.00 0.00 H new ATOM 173 N ALA A 133 4.107 -0.631 10.352 1.00 0.00 N ATOM 174 CA ALA A 133 2.732 -0.263 10.564 1.00 0.00 C ATOM 175 C ALA A 133 2.566 1.242 10.351 1.00 0.00 C ATOM 176 O ALA A 133 2.940 2.024 11.225 1.00 0.00 O ATOM 177 CB ALA A 133 2.406 -0.689 11.990 1.00 0.00 C ATOM 0 H ALA A 133 4.524 -1.017 11.199 1.00 0.00 H new ATOM 0 HA ALA A 133 2.050 -0.747 9.864 1.00 0.00 H new ATOM 0 HB1 ALA A 133 1.370 -0.437 12.217 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.548 -1.765 12.090 1.00 0.00 H new ATOM 0 HB3 ALA A 133 3.066 -0.170 12.685 1.00 0.00 H new ATOM 183 N MET A 134 2.041 1.661 9.196 1.00 0.00 N ATOM 184 CA MET A 134 1.954 3.064 8.811 1.00 0.00 C ATOM 185 C MET A 134 0.569 3.657 8.989 1.00 0.00 C ATOM 186 O MET A 134 -0.407 2.945 9.207 1.00 0.00 O ATOM 187 CB MET A 134 2.484 3.280 7.387 1.00 0.00 C ATOM 188 CG MET A 134 3.962 2.906 7.271 1.00 0.00 C ATOM 189 SD MET A 134 4.956 4.055 6.282 1.00 0.00 S ATOM 190 CE MET A 134 4.287 3.679 4.648 1.00 0.00 C ATOM 0 H MET A 134 1.661 1.024 8.496 1.00 0.00 H new ATOM 0 HA MET A 134 2.597 3.609 9.502 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.901 2.681 6.687 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.349 4.324 7.103 1.00 0.00 H new ATOM 0 HG2 MET A 134 4.388 2.847 8.273 1.00 0.00 H new ATOM 0 HG3 MET A 134 4.038 1.911 6.833 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.855 4.217 3.889 1.00 0.00 H new ATOM 0 HE2 MET A 134 4.359 2.607 4.463 1.00 0.00 H new ATOM 0 HE3 MET A 134 3.242 3.985 4.604 1.00 0.00 H new ATOM 200 N SER A 135 0.458 4.977 8.929 1.00 0.00 N ATOM 201 CA SER A 135 -0.795 5.659 9.201 1.00 0.00 C ATOM 202 C SER A 135 -1.565 5.875 7.910 1.00 0.00 C ATOM 203 O SER A 135 -0.993 6.016 6.822 1.00 0.00 O ATOM 204 CB SER A 135 -0.494 6.966 9.931 1.00 0.00 C ATOM 205 OG SER A 135 -1.650 7.750 10.157 1.00 0.00 O ATOM 0 H SER A 135 1.230 5.600 8.692 1.00 0.00 H new ATOM 0 HA SER A 135 -1.431 5.051 9.844 1.00 0.00 H new ATOM 0 HB2 SER A 135 -0.021 6.742 10.887 1.00 0.00 H new ATOM 0 HB3 SER A 135 0.223 7.545 9.349 1.00 0.00 H new ATOM 0 HG SER A 135 -1.401 8.572 10.628 1.00 0.00 H new ATOM 211 N ARG A 136 -2.892 5.886 8.039 1.00 0.00 N ATOM 212 CA ARG A 136 -3.754 5.743 6.893 1.00 0.00 C ATOM 213 C ARG A 136 -4.028 7.110 6.273 1.00 0.00 C ATOM 214 O ARG A 136 -4.422 8.026 7.005 1.00 0.00 O ATOM 215 CB ARG A 136 -5.011 4.941 7.231 1.00 0.00 C ATOM 216 CG ARG A 136 -6.115 5.609 8.083 1.00 0.00 C ATOM 217 CD ARG A 136 -7.260 4.634 8.460 1.00 0.00 C ATOM 218 NE ARG A 136 -7.543 3.636 7.413 1.00 0.00 N ATOM 219 CZ ARG A 136 -7.797 3.915 6.137 1.00 0.00 C ATOM 220 NH1 ARG A 136 -8.236 5.123 5.802 1.00 0.00 N ATOM 221 NH2 ARG A 136 -7.545 3.026 5.194 1.00 0.00 N ATOM 0 H ARG A 136 -3.381 5.993 8.928 1.00 0.00 H new ATOM 0 HA ARG A 136 -3.248 5.153 6.129 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -5.465 4.627 6.291 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.695 4.036 7.751 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.671 6.009 8.994 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.530 6.453 7.533 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -6.999 4.118 9.384 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -8.165 5.207 8.660 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.544 2.654 7.688 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.377 5.832 6.522 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -8.432 5.342 4.825 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.153 2.117 5.441 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -7.743 3.248 4.218 1.00 0.00 H new ATOM 235 N PRO A 137 -3.800 7.269 4.962 1.00 0.00 N ATOM 236 CA PRO A 137 -4.005 8.534 4.278 1.00 0.00 C ATOM 237 C PRO A 137 -5.490 8.839 4.163 1.00 0.00 C ATOM 238 O PRO A 137 -6.301 7.938 3.917 1.00 0.00 O ATOM 239 CB PRO A 137 -3.298 8.388 2.914 1.00 0.00 C ATOM 240 CG PRO A 137 -3.177 6.879 2.697 1.00 0.00 C ATOM 241 CD PRO A 137 -3.242 6.260 4.080 1.00 0.00 C ATOM 0 HA PRO A 137 -3.586 9.382 4.820 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.875 8.857 2.117 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.319 8.866 2.923 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -3.983 6.508 2.064 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.240 6.629 2.199 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -3.863 5.364 4.074 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.250 5.958 4.416 1.00 0.00 H new ATOM 249 N MET A 138 -5.871 10.100 4.350 1.00 0.00 N ATOM 250 CA MET A 138 -7.190 10.558 4.028 1.00 0.00 C ATOM 251 C MET A 138 -7.237 10.803 2.527 1.00 0.00 C ATOM 252 O MET A 138 -6.301 11.360 1.955 1.00 0.00 O ATOM 253 CB MET A 138 -7.409 11.829 4.825 1.00 0.00 C ATOM 254 CG MET A 138 -8.832 12.331 4.790 1.00 0.00 C ATOM 255 SD MET A 138 -9.997 11.638 6.007 1.00 0.00 S ATOM 256 CE MET A 138 -10.252 9.955 5.389 1.00 0.00 C ATOM 0 H MET A 138 -5.261 10.823 4.731 1.00 0.00 H new ATOM 0 HA MET A 138 -7.974 9.843 4.276 1.00 0.00 H new ATOM 0 HB2 MET A 138 -7.121 11.651 5.861 1.00 0.00 H new ATOM 0 HB3 MET A 138 -6.749 12.607 4.440 1.00 0.00 H new ATOM 0 HG2 MET A 138 -8.811 13.413 4.923 1.00 0.00 H new ATOM 0 HG3 MET A 138 -9.232 12.140 3.794 1.00 0.00 H new ATOM 0 HE1 MET A 138 -11.240 9.604 5.687 1.00 0.00 H new ATOM 0 HE2 MET A 138 -10.178 9.952 4.302 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.492 9.295 5.806 1.00 0.00 H new ATOM 266 N ILE A 139 -8.321 10.352 1.910 1.00 0.00 N ATOM 267 CA ILE A 139 -8.575 10.353 0.479 1.00 0.00 C ATOM 268 C ILE A 139 -10.034 10.800 0.396 1.00 0.00 C ATOM 269 O ILE A 139 -10.823 10.443 1.278 1.00 0.00 O ATOM 270 CB ILE A 139 -8.330 8.938 -0.126 1.00 0.00 C ATOM 271 CG1 ILE A 139 -7.092 8.270 0.519 1.00 0.00 C ATOM 272 CG2 ILE A 139 -8.173 9.003 -1.655 1.00 0.00 C ATOM 273 CD1 ILE A 139 -6.582 7.009 -0.167 1.00 0.00 C ATOM 0 H ILE A 139 -9.098 9.949 2.434 1.00 0.00 H new ATOM 0 HA ILE A 139 -7.916 11.005 -0.095 1.00 0.00 H new ATOM 0 HB ILE A 139 -9.206 8.328 0.096 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -6.282 8.999 0.545 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -7.333 8.025 1.553 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -8.003 8.000 -2.046 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -9.080 9.416 -2.097 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -7.324 9.639 -1.907 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.713 6.628 0.370 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -7.367 6.253 -0.169 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -6.300 7.242 -1.194 1.00 0.00 H new ATOM 285 N HIS A 140 -10.398 11.586 -0.613 1.00 0.00 N ATOM 286 CA HIS A 140 -11.768 12.019 -0.860 1.00 0.00 C ATOM 287 C HIS A 140 -12.207 11.738 -2.295 1.00 0.00 C ATOM 288 O HIS A 140 -13.393 11.882 -2.590 1.00 0.00 O ATOM 289 CB HIS A 140 -11.917 13.506 -0.528 1.00 0.00 C ATOM 290 CG HIS A 140 -11.300 14.431 -1.553 1.00 0.00 C ATOM 291 ND1 HIS A 140 -11.885 14.829 -2.734 1.00 0.00 N ATOM 292 CD2 HIS A 140 -10.059 14.999 -1.494 1.00 0.00 C ATOM 293 CE1 HIS A 140 -11.003 15.605 -3.387 1.00 0.00 C ATOM 294 NE2 HIS A 140 -9.884 15.760 -2.660 1.00 0.00 N ATOM 0 H HIS A 140 -9.733 11.947 -1.297 1.00 0.00 H new ATOM 0 HA HIS A 140 -12.422 11.441 -0.207 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -12.977 13.742 -0.433 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -11.459 13.699 0.442 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.342 14.883 -0.695 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -11.170 16.043 -4.360 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -9.068 16.320 -2.907 1.00 0.00 H new ATOM 302 N PHE A 141 -11.271 11.326 -3.161 1.00 0.00 N ATOM 303 CA PHE A 141 -11.430 10.959 -4.563 1.00 0.00 C ATOM 304 C PHE A 141 -11.893 12.125 -5.425 1.00 0.00 C ATOM 305 O PHE A 141 -11.124 12.632 -6.240 1.00 0.00 O ATOM 306 CB PHE A 141 -12.332 9.730 -4.728 1.00 0.00 C ATOM 307 CG PHE A 141 -11.672 8.459 -4.254 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.574 8.171 -2.879 1.00 0.00 C ATOM 309 CD2 PHE A 141 -11.105 7.589 -5.200 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.834 7.058 -2.449 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.393 6.462 -4.767 1.00 0.00 C ATOM 312 CZ PHE A 141 -10.216 6.223 -3.395 1.00 0.00 C ATOM 0 H PHE A 141 -10.299 11.235 -2.865 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.440 10.686 -4.927 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.256 9.885 -4.171 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.606 9.623 -5.778 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -12.067 8.805 -2.157 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.217 7.788 -6.256 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.740 6.844 -1.395 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -9.979 5.776 -5.491 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.604 5.396 -3.066 1.00 0.00 H new ATOM 322 N GLY A 142 -13.144 12.524 -5.245 1.00 0.00 N ATOM 323 CA GLY A 142 -13.856 13.537 -5.984 1.00 0.00 C ATOM 324 C GLY A 142 -15.330 13.291 -5.714 1.00 0.00 C ATOM 325 O GLY A 142 -15.973 14.155 -5.110 1.00 0.00 O ATOM 0 H GLY A 142 -13.727 12.109 -4.518 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -13.561 14.536 -5.661 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -13.638 13.469 -7.050 1.00 0.00 H new ATOM 329 N ASN A 143 -15.848 12.102 -6.059 1.00 0.00 N ATOM 330 CA ASN A 143 -17.236 11.754 -5.776 1.00 0.00 C ATOM 331 C ASN A 143 -17.351 11.518 -4.275 1.00 0.00 C ATOM 332 O ASN A 143 -16.524 10.785 -3.726 1.00 0.00 O ATOM 333 CB ASN A 143 -17.679 10.447 -6.452 1.00 0.00 C ATOM 334 CG ASN A 143 -17.226 10.199 -7.877 1.00 0.00 C ATOM 335 OD1 ASN A 143 -17.885 10.547 -8.854 1.00 0.00 O ATOM 336 ND2 ASN A 143 -16.122 9.507 -8.064 1.00 0.00 N ATOM 0 H ASN A 143 -15.321 11.370 -6.534 1.00 0.00 H new ATOM 0 HA ASN A 143 -17.859 12.567 -6.148 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -17.327 9.617 -5.839 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.768 10.415 -6.437 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -15.825 9.267 -9.010 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -15.564 9.211 -7.263 1.00 0.00 H new ATOM 343 N ASP A 144 -18.382 12.037 -3.603 1.00 0.00 N ATOM 344 CA ASP A 144 -18.492 11.754 -2.171 1.00 0.00 C ATOM 345 C ASP A 144 -18.932 10.311 -1.910 1.00 0.00 C ATOM 346 O ASP A 144 -18.687 9.832 -0.814 1.00 0.00 O ATOM 347 CB ASP A 144 -19.363 12.763 -1.407 1.00 0.00 C ATOM 348 CG ASP A 144 -18.945 12.812 0.073 1.00 0.00 C ATOM 349 OD1 ASP A 144 -17.841 13.351 0.350 1.00 0.00 O ATOM 350 OD2 ASP A 144 -19.690 12.345 0.965 1.00 0.00 O ATOM 0 H ASP A 144 -19.116 12.624 -4.000 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.486 11.873 -1.770 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -19.263 13.752 -1.854 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.413 12.482 -1.487 1.00 0.00 H new ATOM 355 N TRP A 145 -19.511 9.584 -2.885 1.00 0.00 N ATOM 356 CA TRP A 145 -19.833 8.158 -2.712 1.00 0.00 C ATOM 357 C TRP A 145 -18.571 7.306 -2.581 1.00 0.00 C ATOM 358 O TRP A 145 -18.590 6.306 -1.863 1.00 0.00 O ATOM 359 CB TRP A 145 -20.721 7.612 -3.841 1.00 0.00 C ATOM 360 CG TRP A 145 -20.129 7.562 -5.220 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.363 8.488 -6.172 1.00 0.00 C ATOM 362 CD2 TRP A 145 -19.266 6.549 -5.846 1.00 0.00 C ATOM 363 NE1 TRP A 145 -19.691 8.149 -7.328 1.00 0.00 N ATOM 364 CE2 TRP A 145 -18.982 6.979 -7.180 1.00 0.00 C ATOM 365 CE3 TRP A 145 -18.679 5.320 -5.447 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -18.170 6.246 -8.058 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -17.912 4.550 -6.343 1.00 0.00 C ATOM 368 CH2 TRP A 145 -17.649 5.013 -7.642 1.00 0.00 C ATOM 0 H TRP A 145 -19.764 9.962 -3.798 1.00 0.00 H new ATOM 0 HA TRP A 145 -20.399 8.090 -1.783 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -21.029 6.602 -3.569 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -21.624 8.220 -3.884 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -20.983 9.363 -6.048 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -19.717 8.698 -8.187 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.823 4.968 -4.436 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -17.949 6.627 -9.044 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -17.522 3.594 -6.027 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -17.048 4.422 -8.317 1.00 0.00 H new ATOM 379 N GLU A 146 -17.495 7.683 -3.279 1.00 0.00 N ATOM 380 CA GLU A 146 -16.183 7.074 -3.132 1.00 0.00 C ATOM 381 C GLU A 146 -15.646 7.365 -1.735 1.00 0.00 C ATOM 382 O GLU A 146 -15.249 6.434 -1.044 1.00 0.00 O ATOM 383 CB GLU A 146 -15.219 7.566 -4.228 1.00 0.00 C ATOM 384 CG GLU A 146 -15.581 6.937 -5.575 1.00 0.00 C ATOM 385 CD GLU A 146 -14.464 6.959 -6.614 1.00 0.00 C ATOM 386 OE1 GLU A 146 -14.059 8.066 -7.028 1.00 0.00 O ATOM 387 OE2 GLU A 146 -14.064 5.872 -7.099 1.00 0.00 O ATOM 0 H GLU A 146 -17.519 8.432 -3.971 1.00 0.00 H new ATOM 0 HA GLU A 146 -16.271 5.994 -3.252 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.266 8.652 -4.302 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.194 7.308 -3.962 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.882 5.903 -5.408 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.447 7.459 -5.982 1.00 0.00 H new ATOM 394 N ASP A 147 -15.677 8.626 -1.289 1.00 0.00 N ATOM 395 CA ASP A 147 -15.225 8.979 0.067 1.00 0.00 C ATOM 396 C ASP A 147 -16.044 8.249 1.146 1.00 0.00 C ATOM 397 O ASP A 147 -15.487 7.696 2.095 1.00 0.00 O ATOM 398 CB ASP A 147 -15.287 10.496 0.272 1.00 0.00 C ATOM 399 CG ASP A 147 -14.466 10.992 1.466 1.00 0.00 C ATOM 400 OD1 ASP A 147 -13.821 10.219 2.199 1.00 0.00 O ATOM 401 OD2 ASP A 147 -14.412 12.229 1.657 1.00 0.00 O ATOM 0 H ASP A 147 -16.008 9.417 -1.842 1.00 0.00 H new ATOM 0 HA ASP A 147 -14.189 8.654 0.168 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -14.931 10.990 -0.632 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -16.327 10.793 0.410 1.00 0.00 H new ATOM 406 N ARG A 148 -17.368 8.157 0.970 1.00 0.00 N ATOM 407 CA ARG A 148 -18.271 7.358 1.792 1.00 0.00 C ATOM 408 C ARG A 148 -17.767 5.929 1.837 1.00 0.00 C ATOM 409 O ARG A 148 -17.473 5.447 2.922 1.00 0.00 O ATOM 410 CB ARG A 148 -19.714 7.402 1.240 1.00 0.00 C ATOM 411 CG ARG A 148 -20.759 7.843 2.261 1.00 0.00 C ATOM 412 CD ARG A 148 -20.700 9.346 2.581 1.00 0.00 C ATOM 413 NE ARG A 148 -20.234 9.613 3.954 1.00 0.00 N ATOM 414 CZ ARG A 148 -19.417 10.607 4.324 1.00 0.00 C ATOM 415 NH1 ARG A 148 -18.924 11.454 3.432 1.00 0.00 N ATOM 416 NH2 ARG A 148 -19.097 10.763 5.606 1.00 0.00 N ATOM 0 H ARG A 148 -17.852 8.656 0.224 1.00 0.00 H new ATOM 0 HA ARG A 148 -18.291 7.773 2.800 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.745 8.081 0.388 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.980 6.412 0.869 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -21.752 7.598 1.884 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -20.619 7.277 3.182 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -20.034 9.839 1.873 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.690 9.782 2.445 1.00 0.00 H new ATOM 0 HE ARG A 148 -20.563 8.985 4.687 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -19.166 11.354 2.446 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -18.303 12.206 3.731 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -19.474 10.125 6.307 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -18.475 11.520 5.888 1.00 0.00 H new ATOM 430 N TYR A 149 -17.682 5.258 0.688 1.00 0.00 N ATOM 431 CA TYR A 149 -17.331 3.847 0.610 1.00 0.00 C ATOM 432 C TYR A 149 -15.968 3.588 1.239 1.00 0.00 C ATOM 433 O TYR A 149 -15.786 2.587 1.939 1.00 0.00 O ATOM 434 CB TYR A 149 -17.303 3.392 -0.851 1.00 0.00 C ATOM 435 CG TYR A 149 -16.853 1.956 -1.040 1.00 0.00 C ATOM 436 CD1 TYR A 149 -17.587 0.885 -0.491 1.00 0.00 C ATOM 437 CD2 TYR A 149 -15.666 1.694 -1.742 1.00 0.00 C ATOM 438 CE1 TYR A 149 -17.161 -0.442 -0.687 1.00 0.00 C ATOM 439 CE2 TYR A 149 -15.220 0.377 -1.914 1.00 0.00 C ATOM 440 CZ TYR A 149 -15.983 -0.697 -1.423 1.00 0.00 C ATOM 441 OH TYR A 149 -15.564 -1.955 -1.690 1.00 0.00 O ATOM 0 H TYR A 149 -17.857 5.686 -0.221 1.00 0.00 H new ATOM 0 HA TYR A 149 -18.086 3.283 1.158 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.300 3.509 -1.277 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.638 4.048 -1.413 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -18.480 1.084 0.083 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -15.093 2.513 -2.152 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -17.732 -1.261 -0.276 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -14.288 0.186 -2.425 1.00 0.00 H new ATOM 0 HH TYR A 149 -16.071 -2.315 -2.447 1.00 0.00 H new ATOM 451 N TYR A 150 -15.008 4.474 0.973 1.00 0.00 N ATOM 452 CA TYR A 150 -13.687 4.465 1.564 1.00 0.00 C ATOM 453 C TYR A 150 -13.847 4.443 3.080 1.00 0.00 C ATOM 454 O TYR A 150 -13.481 3.458 3.721 1.00 0.00 O ATOM 455 CB TYR A 150 -12.895 5.682 1.046 1.00 0.00 C ATOM 456 CG TYR A 150 -11.478 5.774 1.561 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.567 4.751 1.242 1.00 0.00 C ATOM 458 CD2 TYR A 150 -11.070 6.872 2.348 1.00 0.00 C ATOM 459 CE1 TYR A 150 -9.264 4.784 1.756 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.765 6.915 2.864 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.870 5.862 2.577 1.00 0.00 C ATOM 462 OH TYR A 150 -7.644 5.838 3.154 1.00 0.00 O ATOM 0 H TYR A 150 -15.143 5.242 0.315 1.00 0.00 H new ATOM 0 HA TYR A 150 -13.116 3.580 1.281 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.870 5.646 -0.043 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -13.428 6.591 1.323 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.872 3.938 0.600 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.760 7.677 2.553 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.567 3.991 1.526 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.449 7.747 3.476 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.474 6.696 3.596 1.00 0.00 H new ATOM 472 N ARG A 151 -14.462 5.484 3.644 1.00 0.00 N ATOM 473 CA ARG A 151 -14.686 5.633 5.080 1.00 0.00 C ATOM 474 C ARG A 151 -15.506 4.497 5.681 1.00 0.00 C ATOM 475 O ARG A 151 -15.295 4.173 6.849 1.00 0.00 O ATOM 476 CB ARG A 151 -15.383 6.975 5.320 1.00 0.00 C ATOM 477 CG ARG A 151 -14.403 8.145 5.191 1.00 0.00 C ATOM 478 CD ARG A 151 -15.197 9.447 5.103 1.00 0.00 C ATOM 479 NE ARG A 151 -14.303 10.593 4.925 1.00 0.00 N ATOM 480 CZ ARG A 151 -14.009 11.545 5.813 1.00 0.00 C ATOM 481 NH1 ARG A 151 -14.536 11.546 7.037 1.00 0.00 N ATOM 482 NH2 ARG A 151 -13.159 12.501 5.477 1.00 0.00 N ATOM 0 H ARG A 151 -14.827 6.266 3.100 1.00 0.00 H new ATOM 0 HA ARG A 151 -13.717 5.599 5.578 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -16.195 7.098 4.604 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -15.831 6.981 6.314 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.731 8.170 6.049 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.782 8.021 4.304 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -15.898 9.395 4.270 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -15.788 9.579 6.009 1.00 0.00 H new ATOM 0 HE ARG A 151 -13.851 10.673 4.014 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.181 10.807 7.315 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -14.294 12.286 7.696 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -12.737 12.505 4.549 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -12.926 13.234 6.146 1.00 0.00 H new ATOM 496 N GLU A 152 -16.431 3.899 4.932 1.00 0.00 N ATOM 497 CA GLU A 152 -17.293 2.835 5.416 1.00 0.00 C ATOM 498 C GLU A 152 -16.446 1.671 5.884 1.00 0.00 C ATOM 499 O GLU A 152 -16.656 1.218 7.004 1.00 0.00 O ATOM 500 CB GLU A 152 -18.301 2.367 4.348 1.00 0.00 C ATOM 501 CG GLU A 152 -19.430 3.365 4.054 1.00 0.00 C ATOM 502 CD GLU A 152 -20.815 2.747 4.251 1.00 0.00 C ATOM 503 OE1 GLU A 152 -21.206 2.513 5.417 1.00 0.00 O ATOM 504 OE2 GLU A 152 -21.547 2.597 3.247 1.00 0.00 O ATOM 0 H GLU A 152 -16.601 4.148 3.958 1.00 0.00 H new ATOM 0 HA GLU A 152 -17.873 3.230 6.250 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.762 2.165 3.422 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.742 1.424 4.672 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -19.325 4.232 4.706 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.337 3.724 3.029 1.00 0.00 H new ATOM 511 N ASN A 153 -15.492 1.209 5.071 1.00 0.00 N ATOM 512 CA ASN A 153 -14.822 -0.074 5.305 1.00 0.00 C ATOM 513 C ASN A 153 -13.364 0.093 5.707 1.00 0.00 C ATOM 514 O ASN A 153 -12.748 -0.915 6.039 1.00 0.00 O ATOM 515 CB ASN A 153 -14.932 -0.967 4.058 1.00 0.00 C ATOM 516 CG ASN A 153 -16.369 -1.283 3.673 1.00 0.00 C ATOM 517 OD1 ASN A 153 -17.001 -2.157 4.267 1.00 0.00 O ATOM 518 ND2 ASN A 153 -16.919 -0.573 2.700 1.00 0.00 N ATOM 0 H ASN A 153 -15.165 1.706 4.242 1.00 0.00 H new ATOM 0 HA ASN A 153 -15.331 -0.553 6.142 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -14.438 -0.473 3.221 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -14.397 -1.900 4.238 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -17.887 -0.745 2.428 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -16.375 0.146 2.223 1.00 0.00 H new ATOM 525 N MET A 154 -12.843 1.330 5.722 1.00 0.00 N ATOM 526 CA MET A 154 -11.429 1.723 5.781 1.00 0.00 C ATOM 527 C MET A 154 -10.542 0.890 6.711 1.00 0.00 C ATOM 528 O MET A 154 -9.358 0.692 6.440 1.00 0.00 O ATOM 529 CB MET A 154 -11.334 3.217 6.159 1.00 0.00 C ATOM 530 CG MET A 154 -11.684 3.555 7.618 1.00 0.00 C ATOM 531 SD MET A 154 -12.257 5.253 7.934 1.00 0.00 S ATOM 532 CE MET A 154 -11.130 6.294 6.975 1.00 0.00 C ATOM 0 H MET A 154 -13.452 2.148 5.691 1.00 0.00 H new ATOM 0 HA MET A 154 -11.033 1.531 4.784 1.00 0.00 H new ATOM 0 HB2 MET A 154 -10.319 3.561 5.958 1.00 0.00 H new ATOM 0 HB3 MET A 154 -11.997 3.782 5.504 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.458 2.864 7.954 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.803 3.371 8.233 1.00 0.00 H new ATOM 0 HE1 MET A 154 -11.465 7.330 7.020 1.00 0.00 H new ATOM 0 HE2 MET A 154 -10.125 6.219 7.389 1.00 0.00 H new ATOM 0 HE3 MET A 154 -11.121 5.960 5.937 1.00 0.00 H new ATOM 542 N TYR A 155 -11.124 0.426 7.809 1.00 0.00 N ATOM 543 CA TYR A 155 -10.570 -0.373 8.881 1.00 0.00 C ATOM 544 C TYR A 155 -10.228 -1.817 8.473 1.00 0.00 C ATOM 545 O TYR A 155 -9.908 -2.629 9.344 1.00 0.00 O ATOM 546 CB TYR A 155 -11.583 -0.300 10.038 1.00 0.00 C ATOM 547 CG TYR A 155 -13.066 -0.395 9.671 1.00 0.00 C ATOM 548 CD1 TYR A 155 -13.579 -1.512 8.985 1.00 0.00 C ATOM 549 CD2 TYR A 155 -13.938 0.669 9.978 1.00 0.00 C ATOM 550 CE1 TYR A 155 -14.954 -1.636 8.734 1.00 0.00 C ATOM 551 CE2 TYR A 155 -15.308 0.588 9.665 1.00 0.00 C ATOM 552 CZ TYR A 155 -15.828 -0.601 9.106 1.00 0.00 C ATOM 553 OH TYR A 155 -17.157 -0.747 8.869 1.00 0.00 O ATOM 0 H TYR A 155 -12.109 0.627 7.984 1.00 0.00 H new ATOM 0 HA TYR A 155 -9.602 0.028 9.182 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -11.355 -1.103 10.739 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -11.425 0.639 10.568 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -12.905 -2.285 8.647 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -13.551 1.556 10.458 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -15.339 -2.525 8.256 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -15.958 1.430 9.851 1.00 0.00 H new ATOM 0 HH TYR A 155 -17.432 -0.130 8.159 1.00 0.00 H new ATOM 563 N ARG A 156 -10.307 -2.177 7.184 1.00 0.00 N ATOM 564 CA ARG A 156 -9.830 -3.469 6.678 1.00 0.00 C ATOM 565 C ARG A 156 -8.641 -3.310 5.737 1.00 0.00 C ATOM 566 O ARG A 156 -8.082 -4.318 5.319 1.00 0.00 O ATOM 567 CB ARG A 156 -10.969 -4.240 5.989 1.00 0.00 C ATOM 568 CG ARG A 156 -12.114 -4.609 6.943 1.00 0.00 C ATOM 569 CD ARG A 156 -13.487 -4.273 6.337 1.00 0.00 C ATOM 570 NE ARG A 156 -14.080 -5.417 5.633 1.00 0.00 N ATOM 571 CZ ARG A 156 -14.701 -6.439 6.231 1.00 0.00 C ATOM 572 NH1 ARG A 156 -14.778 -6.505 7.559 1.00 0.00 N ATOM 573 NH2 ARG A 156 -15.241 -7.389 5.482 1.00 0.00 N ATOM 0 H ARG A 156 -10.705 -1.577 6.462 1.00 0.00 H new ATOM 0 HA ARG A 156 -9.489 -4.046 7.538 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.365 -3.636 5.172 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -10.566 -5.151 5.546 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.068 -5.673 7.173 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -11.991 -4.074 7.885 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.161 -3.947 7.129 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.382 -3.438 5.644 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.013 -5.433 4.615 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -14.361 -5.771 8.131 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -15.254 -7.290 8.004 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.179 -7.334 4.465 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -15.718 -8.176 5.922 1.00 0.00 H new ATOM 587 N TYR A 157 -8.256 -2.096 5.340 1.00 0.00 N ATOM 588 CA TYR A 157 -7.050 -1.934 4.537 1.00 0.00 C ATOM 589 C TYR A 157 -5.821 -2.036 5.449 1.00 0.00 C ATOM 590 O TYR A 157 -5.921 -1.696 6.633 1.00 0.00 O ATOM 591 CB TYR A 157 -7.092 -0.604 3.782 1.00 0.00 C ATOM 592 CG TYR A 157 -8.234 -0.452 2.789 1.00 0.00 C ATOM 593 CD1 TYR A 157 -8.581 -1.504 1.918 1.00 0.00 C ATOM 594 CD2 TYR A 157 -8.986 0.738 2.764 1.00 0.00 C ATOM 595 CE1 TYR A 157 -9.692 -1.387 1.068 1.00 0.00 C ATOM 596 CE2 TYR A 157 -10.100 0.866 1.917 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.479 -0.218 1.089 1.00 0.00 C ATOM 598 OH TYR A 157 -11.628 -0.203 0.368 1.00 0.00 O ATOM 0 H TYR A 157 -8.751 -1.231 5.557 1.00 0.00 H new ATOM 0 HA TYR A 157 -6.989 -2.726 3.791 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.156 0.205 4.509 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.150 -0.479 3.248 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -7.988 -2.407 1.904 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.704 1.562 3.403 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -9.944 -2.194 0.397 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.664 1.787 1.898 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.070 0.665 0.475 1.00 0.00 H new ATOM 608 N PRO A 158 -4.659 -2.468 4.925 1.00 0.00 N ATOM 609 CA PRO A 158 -3.469 -2.684 5.736 1.00 0.00 C ATOM 610 C PRO A 158 -2.867 -1.363 6.231 1.00 0.00 C ATOM 611 O PRO A 158 -3.223 -0.274 5.767 1.00 0.00 O ATOM 612 CB PRO A 158 -2.497 -3.463 4.836 1.00 0.00 C ATOM 613 CG PRO A 158 -2.909 -3.079 3.419 1.00 0.00 C ATOM 614 CD PRO A 158 -4.415 -2.868 3.545 1.00 0.00 C ATOM 0 HA PRO A 158 -3.699 -3.241 6.644 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.461 -3.189 5.038 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -2.580 -4.538 4.997 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.402 -2.175 3.082 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.670 -3.865 2.702 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.759 -2.101 2.851 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.957 -3.782 3.304 1.00 0.00 H new ATOM 622 N ASN A 159 -1.882 -1.477 7.124 1.00 0.00 N ATOM 623 CA ASN A 159 -0.937 -0.416 7.454 1.00 0.00 C ATOM 624 C ASN A 159 0.437 -0.668 6.843 1.00 0.00 C ATOM 625 O ASN A 159 1.178 0.299 6.700 1.00 0.00 O ATOM 626 CB ASN A 159 -0.713 -0.188 8.963 1.00 0.00 C ATOM 627 CG ASN A 159 -1.173 -1.167 10.019 1.00 0.00 C ATOM 628 OD1 ASN A 159 -1.706 -0.737 11.035 1.00 0.00 O ATOM 629 ND2 ASN A 159 -0.833 -2.437 9.927 1.00 0.00 N ATOM 0 H ASN A 159 -1.718 -2.335 7.651 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.412 0.471 7.035 1.00 0.00 H new ATOM 0 HB2 ASN A 159 0.361 -0.065 9.102 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -1.177 0.768 9.204 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -1.013 -3.071 10.706 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.390 -2.786 9.077 1.00 0.00 H new ATOM 636 N GLN A 160 0.842 -1.914 6.585 1.00 0.00 N ATOM 637 CA GLN A 160 2.211 -2.210 6.169 1.00 0.00 C ATOM 638 C GLN A 160 2.241 -2.366 4.652 1.00 0.00 C ATOM 639 O GLN A 160 1.216 -2.671 4.035 1.00 0.00 O ATOM 640 CB GLN A 160 2.736 -3.472 6.886 1.00 0.00 C ATOM 641 CG GLN A 160 2.626 -3.382 8.415 1.00 0.00 C ATOM 642 CD GLN A 160 3.462 -4.408 9.182 1.00 0.00 C ATOM 643 OE1 GLN A 160 2.943 -5.203 9.955 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.777 -4.378 9.073 1.00 0.00 N ATOM 0 H GLN A 160 0.239 -2.733 6.658 1.00 0.00 H new ATOM 0 HA GLN A 160 2.871 -1.389 6.450 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.177 -4.340 6.537 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.778 -3.632 6.611 1.00 0.00 H new ATOM 0 HG2 GLN A 160 2.927 -2.382 8.728 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.580 -3.503 8.697 1.00 0.00 H new ATOM 0 HE21 GLN A 160 5.221 -3.720 8.432 1.00 0.00 H new ATOM 0 HE22 GLN A 160 5.349 -5.013 9.629 1.00 0.00 H new ATOM 653 N VAL A 161 3.415 -2.180 4.052 1.00 0.00 N ATOM 654 CA VAL A 161 3.614 -2.303 2.603 1.00 0.00 C ATOM 655 C VAL A 161 4.964 -2.983 2.323 1.00 0.00 C ATOM 656 O VAL A 161 5.940 -2.662 3.007 1.00 0.00 O ATOM 657 CB VAL A 161 3.500 -0.910 1.935 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.125 -0.247 2.112 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.547 0.100 2.435 1.00 0.00 C ATOM 0 H VAL A 161 4.265 -1.937 4.560 1.00 0.00 H new ATOM 0 HA VAL A 161 2.837 -2.931 2.169 1.00 0.00 H new ATOM 0 HB VAL A 161 3.670 -1.138 0.883 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.123 0.724 1.617 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.356 -0.881 1.670 1.00 0.00 H new ATOM 0 HG13 VAL A 161 1.919 -0.114 3.174 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.407 1.053 1.924 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.430 0.244 3.509 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.547 -0.280 2.227 1.00 0.00 H new ATOM 669 N TYR A 162 5.036 -3.926 1.374 1.00 0.00 N ATOM 670 CA TYR A 162 6.297 -4.560 0.971 1.00 0.00 C ATOM 671 C TYR A 162 6.934 -3.801 -0.195 1.00 0.00 C ATOM 672 O TYR A 162 6.217 -3.384 -1.104 1.00 0.00 O ATOM 673 CB TYR A 162 6.061 -5.994 0.496 1.00 0.00 C ATOM 674 CG TYR A 162 5.551 -6.999 1.506 1.00 0.00 C ATOM 675 CD1 TYR A 162 6.454 -7.778 2.254 1.00 0.00 C ATOM 676 CD2 TYR A 162 4.169 -7.217 1.638 1.00 0.00 C ATOM 677 CE1 TYR A 162 5.967 -8.732 3.174 1.00 0.00 C ATOM 678 CE2 TYR A 162 3.681 -8.216 2.487 1.00 0.00 C ATOM 679 CZ TYR A 162 4.571 -8.970 3.286 1.00 0.00 C ATOM 680 OH TYR A 162 4.077 -9.896 4.162 1.00 0.00 O ATOM 0 H TYR A 162 4.222 -4.270 0.865 1.00 0.00 H new ATOM 0 HA TYR A 162 6.950 -4.549 1.844 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.351 -5.960 -0.330 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.001 -6.372 0.093 1.00 0.00 H new ATOM 0 HD1 TYR A 162 7.518 -7.646 2.124 1.00 0.00 H new ATOM 0 HD2 TYR A 162 3.476 -6.607 1.078 1.00 0.00 H new ATOM 0 HE1 TYR A 162 6.658 -9.283 3.795 1.00 0.00 H new ATOM 0 HE2 TYR A 162 2.620 -8.412 2.532 1.00 0.00 H new ATOM 0 HH TYR A 162 3.099 -9.918 4.098 1.00 0.00 H new ATOM 690 N TYR A 163 8.268 -3.727 -0.252 1.00 0.00 N ATOM 691 CA TYR A 163 8.998 -3.009 -1.298 1.00 0.00 C ATOM 692 C TYR A 163 10.331 -3.705 -1.585 1.00 0.00 C ATOM 693 O TYR A 163 10.818 -4.448 -0.736 1.00 0.00 O ATOM 694 CB TYR A 163 9.213 -1.556 -0.838 1.00 0.00 C ATOM 695 CG TYR A 163 9.911 -1.368 0.506 1.00 0.00 C ATOM 696 CD1 TYR A 163 11.318 -1.281 0.565 1.00 0.00 C ATOM 697 CD2 TYR A 163 9.164 -1.272 1.700 1.00 0.00 C ATOM 698 CE1 TYR A 163 11.975 -1.081 1.795 1.00 0.00 C ATOM 699 CE2 TYR A 163 9.816 -1.073 2.927 1.00 0.00 C ATOM 700 CZ TYR A 163 11.220 -0.966 2.983 1.00 0.00 C ATOM 701 OH TYR A 163 11.820 -0.740 4.183 1.00 0.00 O ATOM 0 H TYR A 163 8.877 -4.170 0.436 1.00 0.00 H new ATOM 0 HA TYR A 163 8.424 -3.008 -2.225 1.00 0.00 H new ATOM 0 HB2 TYR A 163 9.795 -1.038 -1.601 1.00 0.00 H new ATOM 0 HB3 TYR A 163 8.241 -1.065 -0.790 1.00 0.00 H new ATOM 0 HD1 TYR A 163 11.897 -1.369 -0.342 1.00 0.00 H new ATOM 0 HD2 TYR A 163 8.087 -1.352 1.669 1.00 0.00 H new ATOM 0 HE1 TYR A 163 13.052 -1.016 1.829 1.00 0.00 H new ATOM 0 HE2 TYR A 163 9.237 -1.001 3.836 1.00 0.00 H new ATOM 0 HH TYR A 163 12.110 0.195 4.233 1.00 0.00 H new ATOM 711 N ARG A 164 10.968 -3.481 -2.741 1.00 0.00 N ATOM 712 CA ARG A 164 12.371 -3.883 -2.912 1.00 0.00 C ATOM 713 C ARG A 164 13.240 -2.732 -2.433 1.00 0.00 C ATOM 714 O ARG A 164 12.878 -1.580 -2.690 1.00 0.00 O ATOM 715 CB ARG A 164 12.711 -4.219 -4.367 1.00 0.00 C ATOM 716 CG ARG A 164 12.093 -5.566 -4.750 1.00 0.00 C ATOM 717 CD ARG A 164 12.127 -5.821 -6.262 1.00 0.00 C ATOM 718 NE ARG A 164 13.489 -6.001 -6.774 1.00 0.00 N ATOM 719 CZ ARG A 164 13.817 -6.129 -8.062 1.00 0.00 C ATOM 720 NH1 ARG A 164 12.879 -6.178 -9.002 1.00 0.00 N ATOM 721 NH2 ARG A 164 15.094 -6.219 -8.404 1.00 0.00 N ATOM 0 H ARG A 164 10.547 -3.034 -3.555 1.00 0.00 H new ATOM 0 HA ARG A 164 12.551 -4.789 -2.333 1.00 0.00 H new ATOM 0 HB2 ARG A 164 12.336 -3.437 -5.027 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.793 -4.255 -4.498 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.628 -6.366 -4.238 1.00 0.00 H new ATOM 0 HG3 ARG A 164 11.060 -5.600 -4.403 1.00 0.00 H new ATOM 0 HD2 ARG A 164 11.537 -6.709 -6.490 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.657 -4.984 -6.778 1.00 0.00 H new ATOM 0 HE ARG A 164 14.247 -6.031 -6.092 1.00 0.00 H new ATOM 0 HH11 ARG A 164 11.894 -6.118 -8.743 1.00 0.00 H new ATOM 0 HH12 ARG A 164 13.144 -6.276 -9.982 1.00 0.00 H new ATOM 0 HH21 ARG A 164 15.818 -6.190 -7.686 1.00 0.00 H new ATOM 0 HH22 ARG A 164 15.353 -6.317 -9.386 1.00 0.00 H new ATOM 735 N PRO A 165 14.381 -3.011 -1.789 1.00 0.00 N ATOM 736 CA PRO A 165 15.221 -1.965 -1.238 1.00 0.00 C ATOM 737 C PRO A 165 15.790 -1.121 -2.381 1.00 0.00 C ATOM 738 O PRO A 165 16.241 -1.690 -3.383 1.00 0.00 O ATOM 739 CB PRO A 165 16.279 -2.684 -0.396 1.00 0.00 C ATOM 740 CG PRO A 165 16.314 -4.121 -0.924 1.00 0.00 C ATOM 741 CD PRO A 165 14.966 -4.331 -1.618 1.00 0.00 C ATOM 0 HA PRO A 165 14.687 -1.259 -0.601 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.253 -2.205 -0.497 1.00 0.00 H new ATOM 0 HB3 PRO A 165 16.020 -2.661 0.663 1.00 0.00 H new ATOM 0 HG2 PRO A 165 17.141 -4.264 -1.620 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.454 -4.835 -0.112 1.00 0.00 H new ATOM 0 HD2 PRO A 165 15.098 -4.825 -2.581 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.316 -4.969 -1.019 1.00 0.00 H new ATOM 749 N VAL A 166 15.702 0.209 -2.282 1.00 0.00 N ATOM 750 CA VAL A 166 16.072 1.163 -3.320 1.00 0.00 C ATOM 751 C VAL A 166 17.551 1.074 -3.684 1.00 0.00 C ATOM 752 O VAL A 166 18.390 1.722 -3.059 1.00 0.00 O ATOM 753 CB VAL A 166 15.678 2.604 -2.929 1.00 0.00 C ATOM 754 CG1 VAL A 166 14.229 2.848 -3.327 1.00 0.00 C ATOM 755 CG2 VAL A 166 15.869 2.994 -1.458 1.00 0.00 C ATOM 0 H VAL A 166 15.355 0.665 -1.438 1.00 0.00 H new ATOM 0 HA VAL A 166 15.507 0.893 -4.212 1.00 0.00 H new ATOM 0 HB VAL A 166 16.378 3.238 -3.473 1.00 0.00 H new ATOM 0 HG11 VAL A 166 13.943 3.864 -3.054 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.120 2.717 -4.404 1.00 0.00 H new ATOM 0 HG13 VAL A 166 13.585 2.138 -2.808 1.00 0.00 H new ATOM 0 HG21 VAL A 166 15.557 4.028 -1.312 1.00 0.00 H new ATOM 0 HG22 VAL A 166 15.266 2.341 -0.827 1.00 0.00 H new ATOM 0 HG23 VAL A 166 16.920 2.891 -1.188 1.00 0.00 H new ATOM 765 N ASP A 167 17.871 0.320 -4.738 1.00 0.00 N ATOM 766 CA ASP A 167 19.166 0.423 -5.400 1.00 0.00 C ATOM 767 C ASP A 167 19.136 -0.102 -6.830 1.00 0.00 C ATOM 768 O ASP A 167 19.846 0.437 -7.671 1.00 0.00 O ATOM 769 CB ASP A 167 20.275 -0.325 -4.632 1.00 0.00 C ATOM 770 CG ASP A 167 20.987 0.542 -3.598 1.00 0.00 C ATOM 771 OD1 ASP A 167 21.439 1.661 -3.949 1.00 0.00 O ATOM 772 OD2 ASP A 167 21.082 0.098 -2.434 1.00 0.00 O ATOM 0 H ASP A 167 17.245 -0.371 -5.151 1.00 0.00 H new ATOM 0 HA ASP A 167 19.390 1.490 -5.416 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.840 -1.190 -4.132 1.00 0.00 H new ATOM 0 HB3 ASP A 167 21.008 -0.704 -5.344 1.00 0.00 H new ATOM 777 N GLN A 168 18.379 -1.169 -7.124 1.00 0.00 N ATOM 778 CA GLN A 168 18.343 -1.761 -8.468 1.00 0.00 C ATOM 779 C GLN A 168 17.152 -1.266 -9.294 1.00 0.00 C ATOM 780 O GLN A 168 17.120 -1.504 -10.502 1.00 0.00 O ATOM 781 CB GLN A 168 18.305 -3.301 -8.396 1.00 0.00 C ATOM 782 CG GLN A 168 19.674 -3.961 -8.159 1.00 0.00 C ATOM 783 CD GLN A 168 19.942 -4.286 -6.696 1.00 0.00 C ATOM 784 OE1 GLN A 168 20.263 -3.297 -5.880 1.00 0.00 O flip ATOM 785 NE2 GLN A 168 19.897 -5.439 -6.278 1.00 0.00 N flip ATOM 0 H GLN A 168 17.781 -1.641 -6.445 1.00 0.00 H new ATOM 0 HA GLN A 168 19.259 -1.440 -8.965 1.00 0.00 H new ATOM 0 HB2 GLN A 168 17.629 -3.598 -7.595 1.00 0.00 H new ATOM 0 HB3 GLN A 168 17.886 -3.686 -9.326 1.00 0.00 H new ATOM 0 HG2 GLN A 168 19.733 -4.879 -8.744 1.00 0.00 H new ATOM 0 HG3 GLN A 168 20.457 -3.298 -8.526 1.00 0.00 H new ATOM 0 HE21 GLN A 168 19.649 -6.201 -6.909 1.00 0.00 H new ATOM 0 HE22 GLN A 168 20.107 -5.635 -5.299 1.00 0.00 H new ATOM 794 N ALA A 169 16.155 -0.632 -8.675 1.00 0.00 N ATOM 795 CA ALA A 169 14.954 -0.172 -9.351 1.00 0.00 C ATOM 796 C ALA A 169 14.765 1.312 -9.045 1.00 0.00 C ATOM 797 O ALA A 169 15.167 2.136 -9.866 1.00 0.00 O ATOM 798 CB ALA A 169 13.772 -1.075 -8.981 1.00 0.00 C ATOM 0 H ALA A 169 16.165 -0.424 -7.677 1.00 0.00 H new ATOM 0 HA ALA A 169 15.036 -0.251 -10.435 1.00 0.00 H new ATOM 0 HB1 ALA A 169 12.874 -0.726 -9.490 1.00 0.00 H new ATOM 0 HB2 ALA A 169 13.987 -2.099 -9.286 1.00 0.00 H new ATOM 0 HB3 ALA A 169 13.613 -1.043 -7.903 1.00 0.00 H new ATOM 804 N SER A 170 14.235 1.653 -7.866 1.00 0.00 N ATOM 805 CA SER A 170 14.112 3.014 -7.348 1.00 0.00 C ATOM 806 C SER A 170 13.549 4.001 -8.374 1.00 0.00 C ATOM 807 O SER A 170 14.284 4.738 -9.030 1.00 0.00 O ATOM 808 CB SER A 170 15.461 3.461 -6.784 1.00 0.00 C ATOM 809 OG SER A 170 15.378 4.694 -6.097 1.00 0.00 O ATOM 0 H SER A 170 13.865 0.955 -7.221 1.00 0.00 H new ATOM 0 HA SER A 170 13.377 3.007 -6.543 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.840 2.696 -6.106 1.00 0.00 H new ATOM 0 HB3 SER A 170 16.180 3.550 -7.598 1.00 0.00 H new ATOM 0 HG SER A 170 16.263 4.937 -5.754 1.00 0.00 H new ATOM 815 N ASN A 171 12.225 4.047 -8.473 1.00 0.00 N ATOM 816 CA ASN A 171 11.507 5.149 -9.113 1.00 0.00 C ATOM 817 C ASN A 171 10.088 5.244 -8.557 1.00 0.00 C ATOM 818 O ASN A 171 9.503 4.235 -8.173 1.00 0.00 O ATOM 819 CB ASN A 171 11.409 4.897 -10.620 1.00 0.00 C ATOM 820 CG ASN A 171 11.027 6.120 -11.424 1.00 0.00 C ATOM 821 OD1 ASN A 171 10.930 7.224 -10.907 1.00 0.00 O ATOM 822 ND2 ASN A 171 10.735 5.917 -12.691 1.00 0.00 N ATOM 0 H ASN A 171 11.613 3.316 -8.109 1.00 0.00 H new ATOM 0 HA ASN A 171 12.050 6.073 -8.916 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.368 4.524 -10.979 1.00 0.00 H new ATOM 0 HB3 ASN A 171 10.674 4.112 -10.800 1.00 0.00 H new ATOM 0 HD21 ASN A 171 10.417 6.693 -13.272 1.00 0.00 H new ATOM 0 HD22 ASN A 171 10.826 4.984 -13.092 1.00 0.00 H new ATOM 829 N GLN A 172 9.468 6.410 -8.670 1.00 0.00 N ATOM 830 CA GLN A 172 8.143 6.760 -8.154 1.00 0.00 C ATOM 831 C GLN A 172 7.037 6.376 -9.152 1.00 0.00 C ATOM 832 O GLN A 172 5.863 6.703 -8.974 1.00 0.00 O ATOM 833 CB GLN A 172 8.163 8.249 -7.766 1.00 0.00 C ATOM 834 CG GLN A 172 6.824 8.807 -7.254 1.00 0.00 C ATOM 835 CD GLN A 172 6.962 9.926 -6.230 1.00 0.00 C ATOM 836 OE1 GLN A 172 7.980 10.595 -6.107 1.00 0.00 O ATOM 837 NE2 GLN A 172 5.937 10.110 -5.417 1.00 0.00 N ATOM 0 H GLN A 172 9.903 7.193 -9.157 1.00 0.00 H new ATOM 0 HA GLN A 172 7.905 6.187 -7.258 1.00 0.00 H new ATOM 0 HB2 GLN A 172 8.919 8.398 -6.995 1.00 0.00 H new ATOM 0 HB3 GLN A 172 8.473 8.831 -8.634 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.249 9.176 -8.103 1.00 0.00 H new ATOM 0 HG3 GLN A 172 6.250 7.993 -6.810 1.00 0.00 H new ATOM 0 HE21 GLN A 172 5.092 9.549 -5.526 1.00 0.00 H new ATOM 0 HE22 GLN A 172 5.990 10.813 -4.680 1.00 0.00 H new ATOM 846 N ASN A 173 7.394 5.637 -10.201 1.00 0.00 N ATOM 847 CA ASN A 173 6.452 4.843 -10.975 1.00 0.00 C ATOM 848 C ASN A 173 6.557 3.395 -10.539 1.00 0.00 C ATOM 849 O ASN A 173 5.551 2.781 -10.195 1.00 0.00 O ATOM 850 CB ASN A 173 6.742 4.959 -12.473 1.00 0.00 C ATOM 851 CG ASN A 173 5.550 5.562 -13.195 1.00 0.00 C ATOM 852 OD1 ASN A 173 4.645 4.854 -13.634 1.00 0.00 O ATOM 853 ND2 ASN A 173 5.515 6.871 -13.357 1.00 0.00 N ATOM 0 H ASN A 173 8.355 5.575 -10.538 1.00 0.00 H new ATOM 0 HA ASN A 173 5.443 5.215 -10.798 1.00 0.00 H new ATOM 0 HB2 ASN A 173 7.624 5.579 -12.633 1.00 0.00 H new ATOM 0 HB3 ASN A 173 6.965 3.975 -12.884 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.733 7.303 -13.849 1.00 0.00 H new ATOM 0 HD22 ASN A 173 6.270 7.451 -12.990 1.00 0.00 H new ATOM 860 N ASN A 174 7.770 2.833 -10.584 1.00 0.00 N ATOM 861 CA ASN A 174 7.908 1.393 -10.546 1.00 0.00 C ATOM 862 C ASN A 174 7.893 0.847 -9.130 1.00 0.00 C ATOM 863 O ASN A 174 7.191 -0.132 -8.904 1.00 0.00 O ATOM 864 CB ASN A 174 9.107 0.929 -11.368 1.00 0.00 C ATOM 865 CG ASN A 174 10.479 1.082 -10.736 1.00 0.00 C ATOM 866 OD1 ASN A 174 10.809 0.495 -9.718 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.328 1.844 -11.388 1.00 0.00 N ATOM 0 H ASN A 174 8.647 3.350 -10.645 1.00 0.00 H new ATOM 0 HA ASN A 174 7.027 0.964 -11.023 1.00 0.00 H new ATOM 0 HB2 ASN A 174 8.963 -0.123 -11.613 1.00 0.00 H new ATOM 0 HB3 ASN A 174 9.105 1.478 -12.309 1.00 0.00 H new ATOM 0 HD21 ASN A 174 12.282 1.953 -11.045 1.00 0.00 H new ATOM 0 HD22 ASN A 174 11.033 2.326 -12.237 1.00 0.00 H new ATOM 874 N PHE A 175 8.563 1.506 -8.177 1.00 0.00 N ATOM 875 CA PHE A 175 8.515 1.130 -6.770 1.00 0.00 C ATOM 876 C PHE A 175 7.054 1.155 -6.338 1.00 0.00 C ATOM 877 O PHE A 175 6.570 0.207 -5.732 1.00 0.00 O ATOM 878 CB PHE A 175 9.377 2.104 -5.946 1.00 0.00 C ATOM 879 CG PHE A 175 9.444 1.882 -4.447 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.323 2.170 -3.642 1.00 0.00 C ATOM 881 CD2 PHE A 175 10.663 1.531 -3.831 1.00 0.00 C ATOM 882 CE1 PHE A 175 8.424 2.094 -2.245 1.00 0.00 C ATOM 883 CE2 PHE A 175 10.756 1.447 -2.433 1.00 0.00 C ATOM 884 CZ PHE A 175 9.638 1.735 -1.635 1.00 0.00 C ATOM 0 H PHE A 175 9.153 2.316 -8.366 1.00 0.00 H new ATOM 0 HA PHE A 175 8.918 0.130 -6.608 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.394 2.067 -6.337 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.004 3.113 -6.120 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.386 2.449 -4.101 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.531 1.325 -4.439 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.562 2.313 -1.633 1.00 0.00 H new ATOM 0 HE2 PHE A 175 11.689 1.160 -1.971 1.00 0.00 H new ATOM 0 HZ PHE A 175 9.710 1.681 -0.559 1.00 0.00 H new ATOM 894 N VAL A 176 6.357 2.237 -6.690 1.00 0.00 N ATOM 895 CA VAL A 176 4.963 2.490 -6.388 1.00 0.00 C ATOM 896 C VAL A 176 4.094 1.357 -6.948 1.00 0.00 C ATOM 897 O VAL A 176 3.443 0.653 -6.177 1.00 0.00 O ATOM 898 CB VAL A 176 4.601 3.892 -6.930 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.095 4.164 -6.903 1.00 0.00 C ATOM 900 CG2 VAL A 176 5.359 4.977 -6.147 1.00 0.00 C ATOM 0 H VAL A 176 6.781 2.997 -7.222 1.00 0.00 H new ATOM 0 HA VAL A 176 4.775 2.498 -5.314 1.00 0.00 H new ATOM 0 HB VAL A 176 4.907 3.920 -7.976 1.00 0.00 H new ATOM 0 HG11 VAL A 176 2.898 5.162 -7.294 1.00 0.00 H new ATOM 0 HG12 VAL A 176 2.581 3.425 -7.518 1.00 0.00 H new ATOM 0 HG13 VAL A 176 2.732 4.099 -5.877 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.095 5.959 -6.539 1.00 0.00 H new ATOM 0 HG22 VAL A 176 5.087 4.922 -5.093 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.432 4.820 -6.254 1.00 0.00 H new ATOM 910 N HIS A 177 4.083 1.162 -8.267 1.00 0.00 N ATOM 911 CA HIS A 177 3.260 0.171 -8.950 1.00 0.00 C ATOM 912 C HIS A 177 3.504 -1.219 -8.356 1.00 0.00 C ATOM 913 O HIS A 177 2.573 -1.916 -7.965 1.00 0.00 O ATOM 914 CB HIS A 177 3.599 0.252 -10.450 1.00 0.00 C ATOM 915 CG HIS A 177 3.016 -0.799 -11.368 1.00 0.00 C ATOM 916 ND1 HIS A 177 3.359 -0.963 -12.693 1.00 0.00 N ATOM 917 CD2 HIS A 177 2.070 -1.740 -11.070 1.00 0.00 C ATOM 918 CE1 HIS A 177 2.653 -1.994 -13.185 1.00 0.00 C ATOM 919 NE2 HIS A 177 1.872 -2.512 -12.222 1.00 0.00 N ATOM 0 H HIS A 177 4.664 1.706 -8.905 1.00 0.00 H new ATOM 0 HA HIS A 177 2.196 0.369 -8.817 1.00 0.00 H new ATOM 0 HB2 HIS A 177 3.277 1.228 -10.813 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.684 0.217 -10.549 1.00 0.00 H new ATOM 0 HD1 HIS A 177 4.033 -0.399 -13.211 1.00 0.00 H new ATOM 0 HD2 HIS A 177 1.568 -1.865 -10.122 1.00 0.00 H new ATOM 0 HE1 HIS A 177 2.705 -2.353 -14.202 1.00 0.00 H new ATOM 927 N ASP A 178 4.758 -1.646 -8.317 1.00 0.00 N ATOM 928 CA ASP A 178 5.173 -2.959 -7.838 1.00 0.00 C ATOM 929 C ASP A 178 4.791 -3.178 -6.374 1.00 0.00 C ATOM 930 O ASP A 178 4.275 -4.241 -6.031 1.00 0.00 O ATOM 931 CB ASP A 178 6.679 -3.100 -8.030 1.00 0.00 C ATOM 932 CG ASP A 178 7.097 -4.549 -8.191 1.00 0.00 C ATOM 933 OD1 ASP A 178 7.025 -5.338 -7.222 1.00 0.00 O ATOM 934 OD2 ASP A 178 7.609 -4.903 -9.275 1.00 0.00 O ATOM 0 H ASP A 178 5.541 -1.070 -8.628 1.00 0.00 H new ATOM 0 HA ASP A 178 4.652 -3.723 -8.416 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.987 -2.534 -8.909 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.196 -2.666 -7.174 1.00 0.00 H new ATOM 939 N CYS A 179 4.997 -2.163 -5.528 1.00 0.00 N ATOM 940 CA CYS A 179 4.586 -2.172 -4.124 1.00 0.00 C ATOM 941 C CYS A 179 3.065 -2.315 -4.000 1.00 0.00 C ATOM 942 O CYS A 179 2.604 -3.096 -3.165 1.00 0.00 O ATOM 943 CB CYS A 179 5.078 -0.910 -3.394 1.00 0.00 C ATOM 944 SG CYS A 179 4.522 -0.805 -1.673 1.00 0.00 S ATOM 0 H CYS A 179 5.462 -1.299 -5.806 1.00 0.00 H new ATOM 0 HA CYS A 179 5.048 -3.036 -3.647 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.168 -0.889 -3.417 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.730 -0.029 -3.934 1.00 0.00 H new ATOM 949 N VAL A 180 2.285 -1.594 -4.819 1.00 0.00 N ATOM 950 CA VAL A 180 0.838 -1.776 -4.937 1.00 0.00 C ATOM 951 C VAL A 180 0.576 -3.241 -5.282 1.00 0.00 C ATOM 952 O VAL A 180 -0.029 -3.943 -4.480 1.00 0.00 O ATOM 953 CB VAL A 180 0.219 -0.716 -5.894 1.00 0.00 C ATOM 954 CG1 VAL A 180 -0.974 -1.200 -6.720 1.00 0.00 C ATOM 955 CG2 VAL A 180 -0.314 0.488 -5.100 1.00 0.00 C ATOM 0 H VAL A 180 2.650 -0.859 -5.425 1.00 0.00 H new ATOM 0 HA VAL A 180 0.319 -1.586 -3.997 1.00 0.00 H new ATOM 0 HB VAL A 180 1.044 -0.473 -6.563 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.332 -0.388 -7.353 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -0.668 -2.039 -7.344 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.774 -1.518 -6.052 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.742 1.217 -5.788 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -1.082 0.153 -4.402 1.00 0.00 H new ATOM 0 HG23 VAL A 180 0.504 0.949 -4.546 1.00 0.00 H new ATOM 965 N ASN A 181 1.086 -3.728 -6.414 1.00 0.00 N ATOM 966 CA ASN A 181 0.869 -5.075 -6.929 1.00 0.00 C ATOM 967 C ASN A 181 1.088 -6.140 -5.875 1.00 0.00 C ATOM 968 O ASN A 181 0.277 -7.060 -5.771 1.00 0.00 O ATOM 969 CB ASN A 181 1.846 -5.382 -8.074 1.00 0.00 C ATOM 970 CG ASN A 181 1.280 -5.093 -9.440 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.093 -5.257 -9.694 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.154 -4.793 -10.377 1.00 0.00 N ATOM 0 H ASN A 181 1.686 -3.169 -7.020 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.167 -5.098 -7.268 1.00 0.00 H new ATOM 0 HB2 ASN A 181 2.754 -4.795 -7.934 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.134 -6.432 -8.023 1.00 0.00 H new ATOM 0 HD21 ASN A 181 1.849 -4.691 -11.345 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.136 -4.662 -10.135 1.00 0.00 H new ATOM 979 N ILE A 182 2.223 -6.057 -5.184 1.00 0.00 N ATOM 980 CA ILE A 182 2.624 -6.989 -4.157 1.00 0.00 C ATOM 981 C ILE A 182 1.699 -6.841 -2.952 1.00 0.00 C ATOM 982 O ILE A 182 1.051 -7.817 -2.597 1.00 0.00 O ATOM 983 CB ILE A 182 4.138 -6.802 -3.866 1.00 0.00 C ATOM 984 CG1 ILE A 182 5.077 -7.624 -4.785 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.517 -7.174 -2.446 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.554 -8.962 -5.312 1.00 0.00 C ATOM 0 H ILE A 182 2.903 -5.312 -5.336 1.00 0.00 H new ATOM 0 HA ILE A 182 2.515 -8.026 -4.476 1.00 0.00 H new ATOM 0 HB ILE A 182 4.279 -5.737 -4.052 1.00 0.00 H new ATOM 0 HG12 ILE A 182 5.337 -7.003 -5.642 1.00 0.00 H new ATOM 0 HG13 ILE A 182 6.000 -7.815 -4.238 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.587 -7.022 -2.303 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.965 -6.547 -1.746 1.00 0.00 H new ATOM 0 HG23 ILE A 182 4.272 -8.221 -2.266 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.313 -9.428 -5.940 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.324 -9.619 -4.473 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.651 -8.794 -5.899 1.00 0.00 H new ATOM 998 N THR A 183 1.608 -5.670 -2.326 1.00 0.00 N ATOM 999 CA THR A 183 0.875 -5.531 -1.071 1.00 0.00 C ATOM 1000 C THR A 183 -0.589 -5.950 -1.301 1.00 0.00 C ATOM 1001 O THR A 183 -1.156 -6.665 -0.471 1.00 0.00 O ATOM 1002 CB THR A 183 1.030 -4.085 -0.570 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.402 -3.728 -0.471 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.388 -3.842 0.794 1.00 0.00 C ATOM 0 H THR A 183 2.031 -4.807 -2.666 1.00 0.00 H new ATOM 0 HA THR A 183 1.271 -6.183 -0.293 1.00 0.00 H new ATOM 0 HB THR A 183 0.515 -3.471 -1.309 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.732 -3.451 -1.351 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.535 -2.802 1.085 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.679 -4.055 0.737 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.849 -4.495 1.535 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.158 -5.612 -2.466 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.440 -6.102 -2.957 1.00 0.00 C ATOM 1014 C ILE A 184 -2.447 -7.614 -2.952 1.00 0.00 C ATOM 1015 O ILE A 184 -3.265 -8.165 -2.234 1.00 0.00 O ATOM 1016 CB ILE A 184 -2.762 -5.501 -4.342 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.187 -4.056 -4.078 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -3.860 -6.218 -5.128 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.675 -3.266 -5.286 1.00 0.00 C ATOM 0 H ILE A 184 -0.714 -4.962 -3.114 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.237 -5.773 -2.290 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.875 -5.599 -4.968 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -3.980 -4.064 -3.331 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.342 -3.525 -3.640 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.009 -5.717 -6.085 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.566 -7.253 -5.302 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -4.789 -6.195 -4.559 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.948 -2.257 -4.975 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.881 -3.214 -6.031 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.545 -3.761 -5.717 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.536 -8.283 -3.671 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.411 -9.736 -3.706 1.00 0.00 C ATOM 1033 C LYS A 185 -1.474 -10.321 -2.296 1.00 0.00 C ATOM 1034 O LYS A 185 -2.129 -11.336 -2.060 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.082 -10.067 -4.393 1.00 0.00 C ATOM 1036 CG LYS A 185 0.059 -11.521 -4.804 1.00 0.00 C ATOM 1037 CD LYS A 185 -0.152 -11.709 -6.309 1.00 0.00 C ATOM 1038 CE LYS A 185 0.365 -13.088 -6.725 1.00 0.00 C ATOM 1039 NZ LYS A 185 0.978 -13.042 -8.064 1.00 0.00 N ATOM 0 H LYS A 185 -0.849 -7.810 -4.259 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.237 -10.179 -4.262 1.00 0.00 H new ATOM 0 HB2 LYS A 185 0.023 -9.439 -5.278 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.736 -9.810 -3.720 1.00 0.00 H new ATOM 0 HG2 LYS A 185 1.050 -11.882 -4.528 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.665 -12.125 -4.257 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -1.210 -11.616 -6.554 1.00 0.00 H new ATOM 0 HD3 LYS A 185 0.373 -10.930 -6.861 1.00 0.00 H new ATOM 0 HE2 LYS A 185 1.097 -13.440 -5.998 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -0.457 -13.804 -6.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 1.320 -13.990 -8.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 0.271 -12.728 -8.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 1.776 -12.376 -8.058 1.00 0.00 H new ATOM 1053 N GLN A 186 -0.802 -9.714 -1.322 1.00 0.00 N ATOM 1054 CA GLN A 186 -0.790 -10.279 0.005 1.00 0.00 C ATOM 1055 C GLN A 186 -2.160 -10.122 0.650 1.00 0.00 C ATOM 1056 O GLN A 186 -2.631 -11.024 1.335 1.00 0.00 O ATOM 1057 CB GLN A 186 0.312 -9.646 0.861 1.00 0.00 C ATOM 1058 CG GLN A 186 1.652 -10.328 0.603 1.00 0.00 C ATOM 1059 CD GLN A 186 2.396 -9.678 -0.546 1.00 0.00 C ATOM 1060 OE1 GLN A 186 2.711 -8.508 -0.471 1.00 0.00 O ATOM 1061 NE2 GLN A 186 2.693 -10.394 -1.618 1.00 0.00 N ATOM 0 H GLN A 186 -0.272 -8.849 -1.431 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.568 -11.344 -0.068 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.390 -8.583 0.635 1.00 0.00 H new ATOM 0 HB3 GLN A 186 0.053 -9.729 1.916 1.00 0.00 H new ATOM 0 HG2 GLN A 186 2.263 -10.284 1.504 1.00 0.00 H new ATOM 0 HG3 GLN A 186 1.488 -11.382 0.381 1.00 0.00 H new ATOM 0 HE21 GLN A 186 2.422 -11.376 -1.667 1.00 0.00 H new ATOM 0 HE22 GLN A 186 3.193 -9.964 -2.396 1.00 0.00 H new ATOM 1070 N HIS A 187 -2.829 -9.012 0.381 1.00 0.00 N ATOM 1071 CA HIS A 187 -4.175 -8.771 0.831 1.00 0.00 C ATOM 1072 C HIS A 187 -5.239 -9.486 -0.027 1.00 0.00 C ATOM 1073 O HIS A 187 -6.401 -9.464 0.377 1.00 0.00 O ATOM 1074 CB HIS A 187 -4.393 -7.253 0.939 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.690 -6.838 2.359 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -5.894 -6.405 2.868 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -3.813 -6.935 3.405 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -5.737 -6.246 4.194 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -4.486 -6.551 4.567 1.00 0.00 N ATOM 0 H HIS A 187 -2.438 -8.245 -0.166 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.303 -9.212 1.819 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -3.505 -6.730 0.584 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.218 -6.956 0.292 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -6.748 -6.236 2.337 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -2.783 -7.252 3.343 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -6.514 -5.917 4.868 1.00 0.00 H new ATOM 1087 N THR A 188 -4.908 -10.136 -1.155 1.00 0.00 N ATOM 1088 CA THR A 188 -5.870 -10.756 -2.068 1.00 0.00 C ATOM 1089 C THR A 188 -5.744 -12.273 -2.031 1.00 0.00 C ATOM 1090 O THR A 188 -6.717 -12.967 -2.322 1.00 0.00 O ATOM 1091 CB THR A 188 -5.713 -10.239 -3.514 1.00 0.00 C ATOM 1092 OG1 THR A 188 -4.403 -10.111 -3.946 1.00 0.00 O ATOM 1093 CG2 THR A 188 -6.409 -8.898 -3.750 1.00 0.00 C ATOM 0 H THR A 188 -3.941 -10.245 -1.460 1.00 0.00 H new ATOM 0 HA THR A 188 -6.866 -10.474 -1.726 1.00 0.00 H new ATOM 0 HB THR A 188 -6.194 -11.024 -4.097 1.00 0.00 H new ATOM 0 HG1 THR A 188 -3.945 -9.434 -3.405 1.00 0.00 H new ATOM 0 HG21 THR A 188 -6.262 -8.589 -4.785 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.476 -9.002 -3.550 1.00 0.00 H new ATOM 0 HG23 THR A 188 -5.986 -8.146 -3.083 1.00 0.00 H new ATOM 1101 N VAL A 189 -4.587 -12.795 -1.624 1.00 0.00 N ATOM 1102 CA VAL A 189 -4.374 -14.212 -1.372 1.00 0.00 C ATOM 1103 C VAL A 189 -4.030 -14.409 0.101 1.00 0.00 C ATOM 1104 O VAL A 189 -4.772 -15.049 0.840 1.00 0.00 O ATOM 1105 CB VAL A 189 -3.280 -14.808 -2.294 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -3.670 -16.247 -2.603 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -3.020 -14.075 -3.616 1.00 0.00 C ATOM 0 H VAL A 189 -3.756 -12.228 -1.458 1.00 0.00 H new ATOM 0 HA VAL A 189 -5.293 -14.751 -1.603 1.00 0.00 H new ATOM 0 HB VAL A 189 -2.346 -14.711 -1.740 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -2.918 -16.696 -3.252 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -3.734 -16.814 -1.674 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -4.638 -16.262 -3.104 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -2.234 -14.590 -4.169 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -3.933 -14.062 -4.211 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -2.707 -13.052 -3.409 1.00 0.00 H new ATOM 1117 N THR A 190 -2.917 -13.828 0.550 1.00 0.00 N ATOM 1118 CA THR A 190 -2.225 -14.132 1.811 1.00 0.00 C ATOM 1119 C THR A 190 -2.960 -13.552 3.043 1.00 0.00 C ATOM 1120 O THR A 190 -2.414 -13.515 4.147 1.00 0.00 O ATOM 1121 CB THR A 190 -0.777 -13.645 1.600 1.00 0.00 C ATOM 1122 OG1 THR A 190 -0.141 -14.467 0.628 1.00 0.00 O ATOM 1123 CG2 THR A 190 0.135 -13.460 2.806 1.00 0.00 C ATOM 0 H THR A 190 -2.447 -13.095 0.020 1.00 0.00 H new ATOM 0 HA THR A 190 -2.217 -15.196 2.046 1.00 0.00 H new ATOM 0 HB THR A 190 -0.919 -12.615 1.273 1.00 0.00 H new ATOM 0 HG1 THR A 190 0.779 -14.159 0.490 1.00 0.00 H new ATOM 0 HG21 THR A 190 1.113 -13.114 2.473 1.00 0.00 H new ATOM 0 HG22 THR A 190 -0.300 -12.723 3.481 1.00 0.00 H new ATOM 0 HG23 THR A 190 0.245 -14.410 3.328 1.00 0.00 H new ATOM 1131 N THR A 191 -4.215 -13.147 2.873 1.00 0.00 N ATOM 1132 CA THR A 191 -5.119 -12.629 3.880 1.00 0.00 C ATOM 1133 C THR A 191 -6.525 -13.148 3.544 1.00 0.00 C ATOM 1134 O THR A 191 -7.147 -13.760 4.410 1.00 0.00 O ATOM 1135 CB THR A 191 -4.941 -11.103 3.905 1.00 0.00 C ATOM 1136 OG1 THR A 191 -3.766 -10.779 4.629 1.00 0.00 O ATOM 1137 CG2 THR A 191 -6.086 -10.315 4.517 1.00 0.00 C ATOM 0 H THR A 191 -4.655 -13.177 1.953 1.00 0.00 H new ATOM 0 HA THR A 191 -4.920 -12.966 4.897 1.00 0.00 H new ATOM 0 HB THR A 191 -4.893 -10.815 2.855 1.00 0.00 H new ATOM 0 HG1 THR A 191 -3.217 -11.583 4.738 1.00 0.00 H new ATOM 0 HG21 THR A 191 -5.854 -9.250 4.482 1.00 0.00 H new ATOM 0 HG22 THR A 191 -7.000 -10.506 3.955 1.00 0.00 H new ATOM 0 HG23 THR A 191 -6.226 -10.622 5.553 1.00 0.00 H new ATOM 1145 N THR A 192 -6.982 -13.064 2.284 1.00 0.00 N ATOM 1146 CA THR A 192 -8.261 -13.629 1.830 1.00 0.00 C ATOM 1147 C THR A 192 -8.449 -15.083 2.298 1.00 0.00 C ATOM 1148 O THR A 192 -9.488 -15.477 2.822 1.00 0.00 O ATOM 1149 CB THR A 192 -8.352 -13.457 0.302 1.00 0.00 C ATOM 1150 OG1 THR A 192 -8.199 -12.090 -0.013 1.00 0.00 O ATOM 1151 CG2 THR A 192 -9.588 -13.973 -0.432 1.00 0.00 C ATOM 0 H THR A 192 -6.464 -12.594 1.541 1.00 0.00 H new ATOM 0 HA THR A 192 -9.090 -13.089 2.286 1.00 0.00 H new ATOM 0 HB THR A 192 -7.552 -14.104 -0.057 1.00 0.00 H new ATOM 0 HG1 THR A 192 -8.270 -11.968 -0.983 1.00 0.00 H new ATOM 0 HG21 THR A 192 -9.489 -13.771 -1.499 1.00 0.00 H new ATOM 0 HG22 THR A 192 -9.683 -15.047 -0.273 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.475 -13.469 -0.049 1.00 0.00 H new ATOM 1159 N THR A 193 -7.386 -15.872 2.235 1.00 0.00 N ATOM 1160 CA THR A 193 -7.380 -17.296 2.561 1.00 0.00 C ATOM 1161 C THR A 193 -7.556 -17.575 4.064 1.00 0.00 C ATOM 1162 O THR A 193 -7.705 -18.735 4.457 1.00 0.00 O ATOM 1163 CB THR A 193 -6.108 -17.930 1.974 1.00 0.00 C ATOM 1164 OG1 THR A 193 -6.222 -19.340 1.950 1.00 0.00 O ATOM 1165 CG2 THR A 193 -4.825 -17.555 2.725 1.00 0.00 C ATOM 0 H THR A 193 -6.470 -15.529 1.946 1.00 0.00 H new ATOM 0 HA THR A 193 -8.251 -17.765 2.104 1.00 0.00 H new ATOM 0 HB THR A 193 -6.024 -17.529 0.964 1.00 0.00 H new ATOM 0 HG1 THR A 193 -6.629 -19.650 2.786 1.00 0.00 H new ATOM 0 HG21 THR A 193 -3.971 -18.040 2.252 1.00 0.00 H new ATOM 0 HG22 THR A 193 -4.689 -16.474 2.696 1.00 0.00 H new ATOM 0 HG23 THR A 193 -4.901 -17.884 3.761 1.00 0.00 H new ATOM 1173 N LYS A 194 -7.533 -16.547 4.913 1.00 0.00 N ATOM 1174 CA LYS A 194 -7.699 -16.646 6.360 1.00 0.00 C ATOM 1175 C LYS A 194 -9.079 -16.130 6.784 1.00 0.00 C ATOM 1176 O LYS A 194 -9.466 -16.302 7.939 1.00 0.00 O ATOM 1177 CB LYS A 194 -6.544 -15.902 7.059 1.00 0.00 C ATOM 1178 CG LYS A 194 -5.165 -16.338 6.518 1.00 0.00 C ATOM 1179 CD LYS A 194 -3.998 -15.603 7.183 1.00 0.00 C ATOM 1180 CE LYS A 194 -2.766 -15.590 6.270 1.00 0.00 C ATOM 1181 NZ LYS A 194 -2.135 -16.909 6.061 1.00 0.00 N ATOM 0 H LYS A 194 -7.393 -15.587 4.598 1.00 0.00 H new ATOM 0 HA LYS A 194 -7.655 -17.691 6.668 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.666 -14.828 6.918 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -6.589 -16.089 8.132 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -5.045 -17.411 6.670 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.131 -16.163 5.443 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -4.293 -14.580 7.416 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -3.750 -16.086 8.128 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -3.054 -15.183 5.301 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -2.025 -14.912 6.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -1.313 -16.805 5.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -1.825 -17.295 6.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -2.822 -17.558 5.627 1.00 0.00 H new ATOM 1195 N GLY A 195 -9.849 -15.578 5.844 1.00 0.00 N ATOM 1196 CA GLY A 195 -11.206 -15.106 6.050 1.00 0.00 C ATOM 1197 C GLY A 195 -11.493 -13.777 5.364 1.00 0.00 C ATOM 1198 O GLY A 195 -12.608 -13.275 5.517 1.00 0.00 O ATOM 0 H GLY A 195 -9.526 -15.446 4.886 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -11.904 -15.856 5.679 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -11.388 -15.002 7.120 1.00 0.00 H new ATOM 1202 N GLU A 196 -10.542 -13.169 4.638 1.00 0.00 N ATOM 1203 CA GLU A 196 -10.857 -11.914 3.950 1.00 0.00 C ATOM 1204 C GLU A 196 -11.486 -12.236 2.596 1.00 0.00 C ATOM 1205 O GLU A 196 -11.330 -13.344 2.094 1.00 0.00 O ATOM 1206 CB GLU A 196 -9.600 -11.027 3.854 1.00 0.00 C ATOM 1207 CG GLU A 196 -9.598 -9.916 4.915 1.00 0.00 C ATOM 1208 CD GLU A 196 -9.783 -10.416 6.347 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -8.784 -10.809 6.978 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -10.932 -10.292 6.840 1.00 0.00 O ATOM 0 H GLU A 196 -9.588 -13.510 4.516 1.00 0.00 H new ATOM 0 HA GLU A 196 -11.587 -11.334 4.515 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -8.710 -11.645 3.974 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -9.546 -10.580 2.861 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -8.657 -9.370 4.852 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -10.393 -9.207 4.684 1.00 0.00 H new ATOM 1217 N ASN A 197 -12.161 -11.269 1.975 1.00 0.00 N ATOM 1218 CA ASN A 197 -12.445 -11.274 0.549 1.00 0.00 C ATOM 1219 C ASN A 197 -12.830 -9.863 0.131 1.00 0.00 C ATOM 1220 O ASN A 197 -13.999 -9.481 0.093 1.00 0.00 O ATOM 1221 CB ASN A 197 -13.560 -12.244 0.184 1.00 0.00 C ATOM 1222 CG ASN A 197 -13.758 -12.222 -1.325 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -12.820 -12.496 -2.074 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -14.939 -11.855 -1.795 1.00 0.00 N ATOM 0 H ASN A 197 -12.529 -10.450 2.460 1.00 0.00 H new ATOM 0 HA ASN A 197 -11.551 -11.606 0.022 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -13.308 -13.251 0.516 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -14.484 -11.964 0.690 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -15.090 -11.793 -2.802 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -15.698 -11.634 -1.151 1.00 0.00 H new ATOM 1231 N PHE A 198 -11.804 -9.074 -0.140 1.00 0.00 N ATOM 1232 CA PHE A 198 -11.947 -7.764 -0.758 1.00 0.00 C ATOM 1233 C PHE A 198 -12.425 -7.941 -2.198 1.00 0.00 C ATOM 1234 O PHE A 198 -11.933 -8.829 -2.907 1.00 0.00 O ATOM 1235 CB PHE A 198 -10.597 -7.054 -0.731 1.00 0.00 C ATOM 1236 CG PHE A 198 -10.054 -6.856 0.666 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -10.404 -5.713 1.405 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -9.230 -7.838 1.243 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -9.926 -5.553 2.715 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -8.752 -7.675 2.547 1.00 0.00 C ATOM 1241 CZ PHE A 198 -9.119 -6.546 3.294 1.00 0.00 C ATOM 0 H PHE A 198 -10.837 -9.327 0.065 1.00 0.00 H new ATOM 0 HA PHE A 198 -12.677 -7.165 -0.213 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -9.879 -7.631 -1.314 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -10.695 -6.083 -1.216 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -11.040 -4.959 0.966 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -8.966 -8.720 0.678 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -10.179 -4.666 3.278 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -8.100 -8.419 2.979 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.781 -6.440 4.314 1.00 0.00 H new ATOM 1251 N THR A 199 -13.340 -7.081 -2.627 1.00 0.00 N ATOM 1252 CA THR A 199 -13.887 -7.043 -3.979 1.00 0.00 C ATOM 1253 C THR A 199 -13.034 -6.154 -4.874 1.00 0.00 C ATOM 1254 O THR A 199 -12.111 -5.506 -4.390 1.00 0.00 O ATOM 1255 CB THR A 199 -15.324 -6.513 -3.932 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.410 -5.186 -3.443 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.200 -7.450 -3.103 1.00 0.00 C ATOM 0 H THR A 199 -13.737 -6.363 -2.021 1.00 0.00 H new ATOM 0 HA THR A 199 -13.884 -8.052 -4.392 1.00 0.00 H new ATOM 0 HB THR A 199 -15.688 -6.486 -4.959 1.00 0.00 H new ATOM 0 HG1 THR A 199 -15.416 -5.198 -2.463 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.219 -7.065 -3.075 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.199 -8.443 -3.553 1.00 0.00 H new ATOM 0 HG23 THR A 199 -15.808 -7.512 -2.088 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.353 -6.051 -6.164 1.00 0.00 N ATOM 1266 CA GLU A 200 -12.635 -5.147 -7.025 1.00 0.00 C ATOM 1267 C GLU A 200 -12.813 -3.688 -6.611 1.00 0.00 C ATOM 1268 O GLU A 200 -11.824 -2.972 -6.624 1.00 0.00 O ATOM 1269 CB GLU A 200 -12.991 -5.391 -8.493 1.00 0.00 C ATOM 1270 CG GLU A 200 -11.663 -5.434 -9.250 1.00 0.00 C ATOM 1271 CD GLU A 200 -11.804 -5.449 -10.770 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -12.179 -4.415 -11.361 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -11.503 -6.500 -11.389 1.00 0.00 O ATOM 0 H GLU A 200 -14.096 -6.580 -6.620 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.572 -5.358 -6.912 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.537 -6.327 -8.611 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -13.632 -4.597 -8.876 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.066 -4.569 -8.961 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.110 -6.321 -8.940 1.00 0.00 H new ATOM 1280 N THR A 201 -13.997 -3.225 -6.193 1.00 0.00 N ATOM 1281 CA THR A 201 -14.116 -1.844 -5.701 1.00 0.00 C ATOM 1282 C THR A 201 -13.298 -1.675 -4.405 1.00 0.00 C ATOM 1283 O THR A 201 -12.672 -0.625 -4.236 1.00 0.00 O ATOM 1284 CB THR A 201 -15.589 -1.406 -5.528 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.326 -1.712 -6.701 1.00 0.00 O ATOM 1286 CG2 THR A 201 -15.778 0.120 -5.342 1.00 0.00 C ATOM 0 H THR A 201 -14.862 -3.765 -6.184 1.00 0.00 H new ATOM 0 HA THR A 201 -13.699 -1.177 -6.456 1.00 0.00 H new ATOM 0 HB THR A 201 -15.927 -1.935 -4.637 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.258 -1.433 -6.584 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.839 0.344 -5.228 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.240 0.448 -4.452 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.389 0.644 -6.215 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.216 -2.697 -3.530 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.355 -2.623 -2.343 1.00 0.00 C ATOM 1296 C ASP A 202 -10.900 -2.494 -2.793 1.00 0.00 C ATOM 1297 O ASP A 202 -10.132 -1.733 -2.214 1.00 0.00 O ATOM 1298 CB ASP A 202 -12.416 -3.873 -1.450 1.00 0.00 C ATOM 1299 CG ASP A 202 -13.669 -4.115 -0.611 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -13.729 -3.626 0.538 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -14.516 -4.927 -1.050 1.00 0.00 O ATOM 0 H ASP A 202 -13.731 -3.572 -3.625 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.713 -1.768 -1.770 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.274 -4.744 -2.090 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -11.565 -3.835 -0.770 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.496 -3.248 -3.814 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.113 -3.294 -4.274 1.00 0.00 C ATOM 1308 C VAL A 203 -8.772 -2.026 -5.069 1.00 0.00 C ATOM 1309 O VAL A 203 -7.646 -1.551 -4.993 1.00 0.00 O ATOM 1310 CB VAL A 203 -8.856 -4.625 -5.015 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.502 -4.681 -5.735 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -8.869 -5.775 -3.989 1.00 0.00 C ATOM 0 H VAL A 203 -11.125 -3.848 -4.348 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.421 -3.289 -3.431 1.00 0.00 H new ATOM 0 HB VAL A 203 -9.641 -4.713 -5.766 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.394 -5.645 -6.232 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.451 -3.883 -6.476 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.699 -4.554 -5.009 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -8.689 -6.721 -4.500 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.088 -5.609 -3.247 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -9.839 -5.810 -3.494 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.729 -1.409 -5.764 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.550 -0.128 -6.449 1.00 0.00 C ATOM 1324 C LYS A 204 -9.349 0.984 -5.417 1.00 0.00 C ATOM 1325 O LYS A 204 -8.475 1.833 -5.582 1.00 0.00 O ATOM 1326 CB LYS A 204 -10.754 0.133 -7.370 1.00 0.00 C ATOM 1327 CG LYS A 204 -10.860 -0.892 -8.521 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.240 -0.399 -9.825 1.00 0.00 C ATOM 1329 CE LYS A 204 -10.096 -1.546 -10.840 1.00 0.00 C ATOM 1330 NZ LYS A 204 -10.807 -1.295 -12.111 1.00 0.00 N ATOM 0 H LYS A 204 -10.668 -1.793 -5.868 1.00 0.00 H new ATOM 0 HA LYS A 204 -8.658 -0.152 -7.075 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.670 0.106 -6.780 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -10.675 1.136 -7.789 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.370 -1.818 -8.220 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -11.910 -1.129 -8.692 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -10.860 0.391 -10.250 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -9.262 0.037 -9.624 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -9.038 -1.706 -11.049 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -10.476 -2.466 -10.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -10.671 -2.104 -12.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -11.822 -1.170 -11.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -10.429 -0.434 -12.556 1.00 0.00 H new ATOM 1344 N MET A 205 -10.104 0.953 -4.314 1.00 0.00 N ATOM 1345 CA MET A 205 -9.845 1.812 -3.161 1.00 0.00 C ATOM 1346 C MET A 205 -8.460 1.522 -2.585 1.00 0.00 C ATOM 1347 O MET A 205 -7.701 2.441 -2.268 1.00 0.00 O ATOM 1348 CB MET A 205 -10.897 1.562 -2.075 1.00 0.00 C ATOM 1349 CG MET A 205 -12.247 2.195 -2.358 1.00 0.00 C ATOM 1350 SD MET A 205 -12.200 3.988 -2.223 1.00 0.00 S ATOM 1351 CE MET A 205 -13.598 4.447 -3.264 1.00 0.00 C ATOM 0 H MET A 205 -10.907 0.334 -4.198 1.00 0.00 H new ATOM 0 HA MET A 205 -9.892 2.851 -3.488 1.00 0.00 H new ATOM 0 HB2 MET A 205 -11.031 0.487 -1.955 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.521 1.944 -1.126 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.574 1.916 -3.360 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.985 1.799 -1.660 1.00 0.00 H new ATOM 0 HE1 MET A 205 -13.311 5.273 -3.914 1.00 0.00 H new ATOM 0 HE2 MET A 205 -13.895 3.593 -3.872 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.434 4.753 -2.636 1.00 0.00 H new ATOM 1361 N MET A 206 -8.125 0.242 -2.430 1.00 0.00 N ATOM 1362 CA MET A 206 -6.858 -0.184 -1.873 1.00 0.00 C ATOM 1363 C MET A 206 -5.702 0.322 -2.725 1.00 0.00 C ATOM 1364 O MET A 206 -4.689 0.718 -2.146 1.00 0.00 O ATOM 1365 CB MET A 206 -6.823 -1.707 -1.746 1.00 0.00 C ATOM 1366 CG MET A 206 -5.592 -2.219 -0.997 1.00 0.00 C ATOM 1367 SD MET A 206 -5.931 -3.238 0.459 1.00 0.00 S ATOM 1368 CE MET A 206 -6.951 -4.534 -0.316 1.00 0.00 C ATOM 0 H MET A 206 -8.737 -0.530 -2.693 1.00 0.00 H new ATOM 0 HA MET A 206 -6.751 0.244 -0.876 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.721 -2.043 -1.228 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.845 -2.149 -2.742 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.982 -2.799 -1.690 1.00 0.00 H new ATOM 0 HG3 MET A 206 -4.995 -1.362 -0.687 1.00 0.00 H new ATOM 0 HE1 MET A 206 -6.945 -5.425 0.311 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.974 -4.175 -0.426 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.545 -4.778 -1.298 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.813 0.335 -4.061 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.747 0.792 -4.947 1.00 0.00 C ATOM 1380 C GLU A 207 -4.286 2.173 -4.475 1.00 0.00 C ATOM 1381 O GLU A 207 -3.092 2.404 -4.310 1.00 0.00 O ATOM 1382 CB GLU A 207 -5.192 0.896 -6.415 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.455 -0.451 -7.101 1.00 0.00 C ATOM 1384 CD GLU A 207 -4.857 -0.490 -8.507 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -5.496 0.003 -9.464 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -3.748 -1.042 -8.686 1.00 0.00 O ATOM 0 H GLU A 207 -6.651 0.026 -4.554 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.943 0.057 -4.903 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.100 1.497 -6.464 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.426 1.431 -6.976 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.029 -1.255 -6.501 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.529 -0.629 -7.156 1.00 0.00 H new ATOM 1393 N ARG A 208 -5.244 3.056 -4.158 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.965 4.398 -3.661 1.00 0.00 C ATOM 1395 C ARG A 208 -4.303 4.314 -2.303 1.00 0.00 C ATOM 1396 O ARG A 208 -3.297 4.967 -2.072 1.00 0.00 O ATOM 1397 CB ARG A 208 -6.252 5.216 -3.501 1.00 0.00 C ATOM 1398 CG ARG A 208 -7.018 5.519 -4.784 1.00 0.00 C ATOM 1399 CD ARG A 208 -6.266 6.502 -5.666 1.00 0.00 C ATOM 1400 NE ARG A 208 -7.192 7.350 -6.442 1.00 0.00 N ATOM 1401 CZ ARG A 208 -7.189 7.562 -7.764 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -6.331 6.926 -8.559 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -8.061 8.416 -8.290 1.00 0.00 N ATOM 0 H ARG A 208 -6.240 2.851 -4.242 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.313 4.884 -4.387 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -6.917 4.681 -2.823 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.000 6.161 -3.020 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.189 4.593 -5.334 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -7.997 5.928 -4.536 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -5.626 7.131 -5.048 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -5.614 5.956 -6.347 1.00 0.00 H new ATOM 0 HE ARG A 208 -7.918 7.830 -5.910 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -5.662 6.265 -8.163 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -6.342 7.099 -9.564 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -8.725 8.903 -7.688 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -8.067 8.584 -9.296 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.902 3.576 -1.376 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.464 3.567 0.009 1.00 0.00 C ATOM 1419 C VAL A 209 -3.017 3.078 0.128 1.00 0.00 C ATOM 1420 O VAL A 209 -2.220 3.699 0.827 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.500 2.808 0.865 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.156 1.370 1.251 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.790 3.554 2.164 1.00 0.00 C ATOM 0 H VAL A 209 -5.701 2.971 -1.565 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.428 4.579 0.413 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.360 2.760 0.196 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.964 0.951 1.850 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.026 0.772 0.349 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.232 1.360 1.830 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.523 2.997 2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.869 3.655 2.739 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.185 4.544 1.935 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.658 2.000 -0.569 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.308 1.464 -0.564 1.00 0.00 C ATOM 1435 C VAL A 210 -0.400 2.360 -1.402 1.00 0.00 C ATOM 1436 O VAL A 210 0.773 2.434 -1.073 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.348 0.031 -1.106 1.00 0.00 C ATOM 1438 CG1 VAL A 210 0.005 -0.581 -1.487 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -2.049 -0.950 -0.153 1.00 0.00 C ATOM 0 H VAL A 210 -3.305 1.474 -1.156 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.905 1.440 0.449 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.921 0.161 -2.024 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.146 -1.595 -1.857 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.472 0.024 -2.265 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.652 -0.607 -0.610 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.046 -1.948 -0.591 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.521 -0.971 0.801 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.078 -0.628 0.009 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.889 3.061 -2.431 1.00 0.00 N ATOM 1450 CA GLU A 211 -0.112 4.042 -3.164 1.00 0.00 C ATOM 1451 C GLU A 211 0.274 5.120 -2.157 1.00 0.00 C ATOM 1452 O GLU A 211 1.437 5.220 -1.794 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.893 4.576 -4.378 1.00 0.00 C ATOM 1454 CG GLU A 211 -0.187 5.751 -5.057 1.00 0.00 C ATOM 1455 CD GLU A 211 -1.084 6.431 -6.090 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -1.462 5.787 -7.099 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -1.420 7.625 -5.910 1.00 0.00 O ATOM 0 H GLU A 211 -1.844 2.956 -2.774 1.00 0.00 H new ATOM 0 HA GLU A 211 0.791 3.610 -3.595 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.030 3.772 -5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.887 4.889 -4.058 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.116 6.478 -4.303 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.723 5.397 -5.542 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.688 5.883 -1.646 1.00 0.00 N ATOM 1465 CA GLN A 212 -0.514 7.000 -0.731 1.00 0.00 C ATOM 1466 C GLN A 212 0.244 6.610 0.556 1.00 0.00 C ATOM 1467 O GLN A 212 0.820 7.485 1.204 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.916 7.541 -0.402 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.776 7.949 -1.612 1.00 0.00 C ATOM 1470 CD GLN A 212 -3.049 9.442 -1.691 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -4.148 9.917 -1.412 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -2.037 10.178 -2.099 1.00 0.00 N ATOM 0 H GLN A 212 -1.669 5.726 -1.876 1.00 0.00 H new ATOM 0 HA GLN A 212 0.102 7.763 -1.208 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -2.455 6.781 0.163 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.807 8.407 0.251 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.275 7.631 -2.526 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.726 7.417 -1.567 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.143 9.739 -2.319 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -2.147 11.188 -2.195 1.00 0.00 H new ATOM 1481 N MET A 213 0.264 5.328 0.940 1.00 0.00 N ATOM 1482 CA MET A 213 1.173 4.810 1.968 1.00 0.00 C ATOM 1483 C MET A 213 2.575 4.578 1.394 1.00 0.00 C ATOM 1484 O MET A 213 3.545 5.126 1.911 1.00 0.00 O ATOM 1485 CB MET A 213 0.647 3.517 2.616 1.00 0.00 C ATOM 1486 CG MET A 213 -0.478 3.780 3.626 1.00 0.00 C ATOM 1487 SD MET A 213 -0.947 2.379 4.689 1.00 0.00 S ATOM 1488 CE MET A 213 -1.103 1.020 3.493 1.00 0.00 C ATOM 0 H MET A 213 -0.353 4.618 0.544 1.00 0.00 H new ATOM 0 HA MET A 213 1.229 5.570 2.747 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.282 2.847 1.838 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.469 3.006 3.118 1.00 0.00 H new ATOM 0 HG2 MET A 213 -0.177 4.610 4.266 1.00 0.00 H new ATOM 0 HG3 MET A 213 -1.362 4.105 3.077 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.403 0.110 4.013 1.00 0.00 H new ATOM 0 HE2 MET A 213 -1.855 1.277 2.747 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.144 0.857 3.001 1.00 0.00 H new ATOM 1498 N CYS A 214 2.727 3.739 0.370 1.00 0.00 N ATOM 1499 CA CYS A 214 4.036 3.334 -0.123 1.00 0.00 C ATOM 1500 C CYS A 214 4.782 4.485 -0.815 1.00 0.00 C ATOM 1501 O CYS A 214 6.005 4.432 -0.891 1.00 0.00 O ATOM 1502 CB CYS A 214 3.948 2.087 -1.013 1.00 0.00 C ATOM 1503 SG CYS A 214 5.307 0.899 -0.873 1.00 0.00 S ATOM 0 H CYS A 214 1.946 3.324 -0.138 1.00 0.00 H new ATOM 0 HA CYS A 214 4.630 3.063 0.750 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.017 1.569 -0.784 1.00 0.00 H new ATOM 0 HB3 CYS A 214 3.885 2.412 -2.051 1.00 0.00 H new ATOM 1508 N VAL A 215 4.093 5.557 -1.229 1.00 0.00 N ATOM 1509 CA VAL A 215 4.696 6.791 -1.718 1.00 0.00 C ATOM 1510 C VAL A 215 5.559 7.350 -0.591 1.00 0.00 C ATOM 1511 O VAL A 215 6.708 7.734 -0.801 1.00 0.00 O ATOM 1512 CB VAL A 215 3.607 7.797 -2.194 1.00 0.00 C ATOM 1513 CG1 VAL A 215 4.160 9.219 -2.382 1.00 0.00 C ATOM 1514 CG2 VAL A 215 2.951 7.434 -3.536 1.00 0.00 C ATOM 0 H VAL A 215 3.073 5.584 -1.231 1.00 0.00 H new ATOM 0 HA VAL A 215 5.319 6.602 -2.592 1.00 0.00 H new ATOM 0 HB VAL A 215 2.871 7.747 -1.391 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.359 9.880 -2.714 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.560 9.582 -1.435 1.00 0.00 H new ATOM 0 HG13 VAL A 215 4.953 9.205 -3.130 1.00 0.00 H new ATOM 0 HG21 VAL A 215 2.205 8.187 -3.792 1.00 0.00 H new ATOM 0 HG22 VAL A 215 3.712 7.398 -4.315 1.00 0.00 H new ATOM 0 HG23 VAL A 215 2.469 6.460 -3.454 1.00 0.00 H new ATOM 1524 N THR A 216 5.010 7.382 0.623 1.00 0.00 N ATOM 1525 CA THR A 216 5.755 7.786 1.792 1.00 0.00 C ATOM 1526 C THR A 216 6.881 6.776 2.070 1.00 0.00 C ATOM 1527 O THR A 216 7.965 7.214 2.420 1.00 0.00 O ATOM 1528 CB THR A 216 4.764 7.934 2.958 1.00 0.00 C ATOM 1529 OG1 THR A 216 3.743 8.862 2.628 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.418 8.365 4.257 1.00 0.00 C ATOM 0 H THR A 216 4.040 7.128 0.813 1.00 0.00 H new ATOM 0 HA THR A 216 6.246 8.748 1.644 1.00 0.00 H new ATOM 0 HB THR A 216 4.344 6.941 3.117 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.120 8.944 3.380 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.660 8.449 5.036 1.00 0.00 H new ATOM 0 HG22 THR A 216 6.162 7.625 4.553 1.00 0.00 H new ATOM 0 HG23 THR A 216 5.903 9.331 4.117 1.00 0.00 H new ATOM 1538 N GLN A 217 6.702 5.457 1.896 1.00 0.00 N ATOM 1539 CA GLN A 217 7.826 4.521 2.058 1.00 0.00 C ATOM 1540 C GLN A 217 8.961 4.835 1.080 1.00 0.00 C ATOM 1541 O GLN A 217 10.113 4.854 1.503 1.00 0.00 O ATOM 1542 CB GLN A 217 7.412 3.044 1.902 1.00 0.00 C ATOM 1543 CG GLN A 217 7.226 2.262 3.203 1.00 0.00 C ATOM 1544 CD GLN A 217 8.352 2.418 4.204 1.00 0.00 C ATOM 1545 OE1 GLN A 217 8.163 3.032 5.247 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.517 1.878 3.920 1.00 0.00 N ATOM 0 H GLN A 217 5.813 5.022 1.649 1.00 0.00 H new ATOM 0 HA GLN A 217 8.176 4.662 3.081 1.00 0.00 H new ATOM 0 HB2 GLN A 217 6.478 3.006 1.341 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.166 2.537 1.300 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.295 2.580 3.672 1.00 0.00 H new ATOM 0 HG3 GLN A 217 7.116 1.205 2.962 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.645 1.372 3.043 1.00 0.00 H new ATOM 0 HE22 GLN A 217 10.293 1.965 4.576 1.00 0.00 H new ATOM 1555 N TYR A 218 8.657 5.073 -0.200 1.00 0.00 N ATOM 1556 CA TYR A 218 9.665 5.438 -1.188 1.00 0.00 C ATOM 1557 C TYR A 218 10.382 6.698 -0.721 1.00 0.00 C ATOM 1558 O TYR A 218 11.606 6.700 -0.633 1.00 0.00 O ATOM 1559 CB TYR A 218 9.039 5.658 -2.573 1.00 0.00 C ATOM 1560 CG TYR A 218 10.050 6.053 -3.639 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.155 5.222 -3.907 1.00 0.00 C ATOM 1562 CD2 TYR A 218 9.914 7.269 -4.335 1.00 0.00 C ATOM 1563 CE1 TYR A 218 12.122 5.608 -4.851 1.00 0.00 C ATOM 1564 CE2 TYR A 218 10.862 7.647 -5.301 1.00 0.00 C ATOM 1565 CZ TYR A 218 11.977 6.820 -5.559 1.00 0.00 C ATOM 1566 OH TYR A 218 12.902 7.194 -6.482 1.00 0.00 O ATOM 0 H TYR A 218 7.710 5.017 -0.574 1.00 0.00 H new ATOM 0 HA TYR A 218 10.379 4.620 -1.282 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.533 4.744 -2.884 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.278 6.435 -2.500 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.260 4.283 -3.384 1.00 0.00 H new ATOM 0 HD2 TYR A 218 9.075 7.916 -4.125 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.978 4.976 -5.035 1.00 0.00 H new ATOM 0 HE2 TYR A 218 10.738 8.571 -5.846 1.00 0.00 H new ATOM 0 HH TYR A 218 12.644 8.055 -6.874 1.00 0.00 H new ATOM 1576 N GLN A 219 9.622 7.743 -0.371 1.00 0.00 N ATOM 1577 CA GLN A 219 10.177 8.978 0.145 1.00 0.00 C ATOM 1578 C GLN A 219 11.105 8.719 1.338 1.00 0.00 C ATOM 1579 O GLN A 219 12.287 9.057 1.256 1.00 0.00 O ATOM 1580 CB GLN A 219 9.063 9.973 0.478 1.00 0.00 C ATOM 1581 CG GLN A 219 8.469 10.580 -0.791 1.00 0.00 C ATOM 1582 CD GLN A 219 7.424 11.651 -0.495 1.00 0.00 C ATOM 1583 OE1 GLN A 219 7.645 12.575 0.290 1.00 0.00 O ATOM 1584 NE2 GLN A 219 6.261 11.562 -1.126 1.00 0.00 N ATOM 0 H GLN A 219 8.604 7.745 -0.442 1.00 0.00 H new ATOM 0 HA GLN A 219 10.792 9.429 -0.633 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.280 9.470 1.045 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.458 10.766 1.114 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.269 11.014 -1.391 1.00 0.00 H new ATOM 0 HG3 GLN A 219 8.015 9.790 -1.389 1.00 0.00 H new ATOM 0 HE21 GLN A 219 6.090 10.793 -1.773 1.00 0.00 H new ATOM 0 HE22 GLN A 219 5.538 12.263 -0.964 1.00 0.00 H new ATOM 1593 N LYS A 220 10.613 8.075 2.398 1.00 0.00 N ATOM 1594 CA LYS A 220 11.332 7.722 3.613 1.00 0.00 C ATOM 1595 C LYS A 220 12.644 7.033 3.303 1.00 0.00 C ATOM 1596 O LYS A 220 13.678 7.530 3.732 1.00 0.00 O ATOM 1597 CB LYS A 220 10.499 6.814 4.522 1.00 0.00 C ATOM 1598 CG LYS A 220 9.341 7.536 5.219 1.00 0.00 C ATOM 1599 CD LYS A 220 8.343 6.522 5.789 1.00 0.00 C ATOM 1600 CE LYS A 220 8.789 5.918 7.107 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.682 6.914 8.196 1.00 0.00 N ATOM 0 H LYS A 220 9.640 7.769 2.428 1.00 0.00 H new ATOM 0 HA LYS A 220 11.532 8.659 4.132 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.099 5.991 3.930 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.150 6.376 5.278 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.727 8.166 6.021 1.00 0.00 H new ATOM 0 HG3 LYS A 220 8.836 8.194 4.512 1.00 0.00 H new ATOM 0 HD2 LYS A 220 7.379 7.011 5.929 1.00 0.00 H new ATOM 0 HD3 LYS A 220 8.193 5.723 5.063 1.00 0.00 H new ATOM 0 HE2 LYS A 220 8.176 5.048 7.341 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.819 5.570 7.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 8.759 6.433 9.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 9.448 7.612 8.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.764 7.398 8.135 1.00 0.00 H new ATOM 1615 N GLU A 221 12.592 5.914 2.591 1.00 0.00 N ATOM 1616 CA GLU A 221 13.727 5.060 2.284 1.00 0.00 C ATOM 1617 C GLU A 221 14.744 5.817 1.445 1.00 0.00 C ATOM 1618 O GLU A 221 15.926 5.797 1.777 1.00 0.00 O ATOM 1619 CB GLU A 221 13.237 3.873 1.468 1.00 0.00 C ATOM 1620 CG GLU A 221 12.445 2.830 2.254 1.00 0.00 C ATOM 1621 CD GLU A 221 13.362 1.819 2.940 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.213 1.218 2.245 1.00 0.00 O ATOM 1623 OE2 GLU A 221 13.109 1.522 4.127 1.00 0.00 O ATOM 0 H GLU A 221 11.719 5.564 2.196 1.00 0.00 H new ATOM 0 HA GLU A 221 14.189 4.735 3.216 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.613 4.244 0.655 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.098 3.385 1.012 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.830 3.329 3.003 1.00 0.00 H new ATOM 0 HG3 GLU A 221 11.766 2.306 1.581 1.00 0.00 H new ATOM 1630 N SER A 222 14.304 6.483 0.374 1.00 0.00 N ATOM 1631 CA SER A 222 15.179 7.290 -0.448 1.00 0.00 C ATOM 1632 C SER A 222 15.863 8.346 0.399 1.00 0.00 C ATOM 1633 O SER A 222 17.075 8.487 0.296 1.00 0.00 O ATOM 1634 CB SER A 222 14.401 7.992 -1.544 1.00 0.00 C ATOM 1635 OG SER A 222 13.987 7.125 -2.581 1.00 0.00 O ATOM 0 H SER A 222 13.333 6.472 0.062 1.00 0.00 H new ATOM 0 HA SER A 222 15.917 6.624 -0.895 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.524 8.470 -1.108 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.018 8.784 -1.967 1.00 0.00 H new ATOM 0 HG SER A 222 13.150 6.684 -2.324 1.00 0.00 H new ATOM 1641 N GLN A 223 15.136 9.065 1.259 1.00 0.00 N ATOM 1642 CA GLN A 223 15.725 10.066 2.100 1.00 0.00 C ATOM 1643 C GLN A 223 16.730 9.371 3.008 1.00 0.00 C ATOM 1644 O GLN A 223 17.879 9.770 3.086 1.00 0.00 O ATOM 1645 CB GLN A 223 14.564 10.721 2.843 1.00 0.00 C ATOM 1646 CG GLN A 223 14.841 11.287 4.235 1.00 0.00 C ATOM 1647 CD GLN A 223 13.492 11.497 4.913 1.00 0.00 C ATOM 1648 OE1 GLN A 223 12.833 10.385 5.203 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 12.980 12.596 5.103 1.00 0.00 N flip ATOM 0 H GLN A 223 14.129 8.957 1.378 1.00 0.00 H new ATOM 0 HA GLN A 223 16.273 10.843 1.568 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.182 11.531 2.221 1.00 0.00 H new ATOM 0 HB3 GLN A 223 13.765 9.985 2.933 1.00 0.00 H new ATOM 0 HG2 GLN A 223 15.459 10.601 4.813 1.00 0.00 H new ATOM 0 HG3 GLN A 223 15.388 12.228 4.166 1.00 0.00 H new ATOM 0 HE21 GLN A 223 13.497 13.446 4.876 1.00 0.00 H new ATOM 0 HE22 GLN A 223 12.038 12.660 5.488 1.00 0.00 H new ATOM 1658 N ALA A 224 16.344 8.291 3.669 1.00 0.00 N ATOM 1659 CA ALA A 224 17.221 7.587 4.570 1.00 0.00 C ATOM 1660 C ALA A 224 18.458 7.049 3.809 1.00 0.00 C ATOM 1661 O ALA A 224 19.515 6.929 4.415 1.00 0.00 O ATOM 1662 CB ALA A 224 16.365 6.544 5.323 1.00 0.00 C ATOM 0 H ALA A 224 15.412 7.884 3.591 1.00 0.00 H new ATOM 0 HA ALA A 224 17.661 8.232 5.331 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.996 5.989 6.017 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.576 7.053 5.877 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.919 5.854 4.607 1.00 0.00 H new ATOM 1668 N ALA A 225 18.412 6.863 2.484 1.00 0.00 N ATOM 1669 CA ALA A 225 19.555 6.499 1.645 1.00 0.00 C ATOM 1670 C ALA A 225 20.296 7.705 1.033 1.00 0.00 C ATOM 1671 O ALA A 225 21.398 7.526 0.510 1.00 0.00 O ATOM 1672 CB ALA A 225 19.057 5.592 0.510 1.00 0.00 C ATOM 0 H ALA A 225 17.548 6.966 1.951 1.00 0.00 H new ATOM 0 HA ALA A 225 20.272 5.993 2.291 1.00 0.00 H new ATOM 0 HB1 ALA A 225 19.896 5.311 -0.126 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.605 4.695 0.933 1.00 0.00 H new ATOM 0 HB3 ALA A 225 18.315 6.126 -0.084 1.00 0.00 H new ATOM 1678 N ALA A 226 19.731 8.919 1.022 1.00 0.00 N ATOM 1679 CA ALA A 226 20.216 10.064 0.243 1.00 0.00 C ATOM 1680 C ALA A 226 20.455 11.311 1.094 1.00 0.00 C ATOM 1681 O ALA A 226 21.374 12.077 0.810 1.00 0.00 O ATOM 1682 CB ALA A 226 19.238 10.377 -0.893 1.00 0.00 C ATOM 0 H ALA A 226 18.900 9.137 1.571 1.00 0.00 H new ATOM 0 HA ALA A 226 21.184 9.778 -0.169 1.00 0.00 H new ATOM 0 HB1 ALA A 226 19.606 11.228 -1.466 1.00 0.00 H new ATOM 0 HB2 ALA A 226 19.151 9.510 -1.547 1.00 0.00 H new ATOM 0 HB3 ALA A 226 18.260 10.616 -0.476 1.00 0.00 H new ATOM 1688 N ASP A 227 19.678 11.492 2.158 1.00 0.00 N ATOM 1689 CA ASP A 227 20.106 12.155 3.381 1.00 0.00 C ATOM 1690 C ASP A 227 21.106 11.271 4.123 1.00 0.00 C ATOM 1691 O ASP A 227 21.860 11.771 4.951 1.00 0.00 O ATOM 1692 CB ASP A 227 18.945 12.524 4.326 1.00 0.00 C ATOM 1693 CG ASP A 227 18.313 13.870 3.958 1.00 0.00 C ATOM 1694 OD1 ASP A 227 19.045 14.861 3.783 1.00 0.00 O ATOM 1695 OD2 ASP A 227 17.065 13.939 3.851 1.00 0.00 O ATOM 0 H ASP A 227 18.710 11.173 2.192 1.00 0.00 H new ATOM 0 HA ASP A 227 20.569 13.093 3.076 1.00 0.00 H new ATOM 0 HB2 ASP A 227 18.185 11.744 4.288 1.00 0.00 H new ATOM 0 HB3 ASP A 227 19.311 12.563 5.352 1.00 0.00 H new ATOM 1700 N GLY A 228 21.126 9.961 3.844 1.00 0.00 N ATOM 1701 CA GLY A 228 22.024 9.005 4.485 1.00 0.00 C ATOM 1702 C GLY A 228 21.558 8.595 5.884 1.00 0.00 C ATOM 1703 O GLY A 228 22.289 7.935 6.624 1.00 0.00 O ATOM 0 H GLY A 228 20.507 9.534 3.155 1.00 0.00 H new ATOM 0 HA2 GLY A 228 22.106 8.116 3.860 1.00 0.00 H new ATOM 0 HA3 GLY A 228 23.021 9.440 4.553 1.00 0.00 H new ATOM 1707 N ARG A 229 20.349 8.998 6.278 1.00 0.00 N ATOM 1708 CA ARG A 229 19.756 8.722 7.579 1.00 0.00 C ATOM 1709 C ARG A 229 19.156 7.315 7.593 1.00 0.00 C ATOM 1710 O ARG A 229 17.990 7.150 7.936 1.00 0.00 O ATOM 1711 CB ARG A 229 18.724 9.827 7.888 1.00 0.00 C ATOM 1712 CG ARG A 229 19.351 11.229 7.946 1.00 0.00 C ATOM 1713 CD ARG A 229 20.158 11.458 9.223 1.00 0.00 C ATOM 1714 NE ARG A 229 21.087 12.579 9.033 1.00 0.00 N ATOM 1715 CZ ARG A 229 22.206 12.804 9.723 1.00 0.00 C ATOM 1716 NH1 ARG A 229 22.478 12.121 10.833 1.00 0.00 N ATOM 1717 NH2 ARG A 229 23.051 13.733 9.300 1.00 0.00 N ATOM 0 H ARG A 229 19.736 9.546 5.674 1.00 0.00 H new ATOM 0 HA ARG A 229 20.509 8.738 8.367 1.00 0.00 H new ATOM 0 HB2 ARG A 229 17.945 9.814 7.126 1.00 0.00 H new ATOM 0 HB3 ARG A 229 18.241 9.610 8.841 1.00 0.00 H new ATOM 0 HG2 ARG A 229 19.999 11.370 7.081 1.00 0.00 H new ATOM 0 HG3 ARG A 229 18.563 11.979 7.879 1.00 0.00 H new ATOM 0 HD2 ARG A 229 19.486 11.668 10.055 1.00 0.00 H new ATOM 0 HD3 ARG A 229 20.712 10.555 9.480 1.00 0.00 H new ATOM 0 HE ARG A 229 20.854 13.251 8.302 1.00 0.00 H new ATOM 0 HH11 ARG A 229 21.826 11.412 11.168 1.00 0.00 H new ATOM 0 HH12 ARG A 229 23.339 12.306 11.348 1.00 0.00 H new ATOM 0 HH21 ARG A 229 22.842 14.266 8.456 1.00 0.00 H new ATOM 0 HH22 ARG A 229 23.910 13.915 9.819 1.00 0.00 H new