USER MOD reduce.3.24.130724 H: found=0, std=0, add=741, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 738 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 162 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 186 GLN : amide:sc= -0.067 X(o=-0.067,f=-0.067) USER MOD Set 2.1: A 150 TYR OH : rot 60:sc= -0.0148 USER MOD Set 2.2: A 154 MET CE :methyl 178:sc= -2.31 (180deg=-2.27) USER MOD Single : A 128 TYR OH : rot 150:sc= 1.25 USER MOD Single : A 129 MET CE :methyl -165:sc= -2.1 (180deg=-3.51!) USER MOD Single : A 132 SER OG : rot 180:sc= 0.0757 USER MOD Single : A 134 MET CE :methyl -120:sc= -0.237 (180deg=-3.03!) USER MOD Single : A 135 SER OG : rot 180:sc= 0.0204 USER MOD Single : A 140 HIS : no HD1:sc= -0.874 K(o=-0.87,f=-0.11) USER MOD Single : A 143 SER OG : rot -177:sc= 1.35 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot -168:sc= 1.2 USER MOD Single : A 153 ASN : amide:sc= 0.558 K(o=0.56,f=0) USER MOD Single : A 155 HIS : no HD1:sc= -0.28 X(o=-0.28,f=-0.64) USER MOD Single : A 157 TYR OH : rot -164:sc= -0.519 USER MOD Single : A 159 ASN : amide:sc= -0.474 X(o=-0.47,f=-0.07) USER MOD Single : A 160 GLN : amide:sc= 1.19 K(o=1.2,f=-0.015) USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 TYR OH : rot 180:sc= 0 USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= 0.483 X(o=0.48,f=-0.0072) USER MOD Single : A 172 GLN : amide:sc= -0.639 K(o=-0.64,f=0) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 HIS : no HD1:sc= -0.321 X(o=-0.32,f=-0.14) USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 183 THR OG1 : rot 84:sc= 0.952 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 HIS : no HD1:sc= -0.345 X(o=-0.34,f=-0.086) USER MOD Single : A 188 THR OG1 : rot 77:sc= 1.17 USER MOD Single : A 190 THR OG1 : rot 78:sc= 1.26 USER MOD Single : A 191 THR OG1 : rot 168:sc= 0.877 USER MOD Single : A 192 THR OG1 : rot 92:sc= 1.27 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 199 THR OG1 : rot 170:sc= 0.011 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0.0131 USER MOD Single : A 204 LYS NZ :NH3+ 139:sc= 1.14 (180deg=0.0115) USER MOD Single : A 205 MET CE :methyl 142:sc= -0.779 (180deg=-2.7!) USER MOD Single : A 206 MET CE :methyl -159:sc= 0 (180deg=-0.591) USER MOD Single : A 212 GLN : amide:sc= -0.0125 X(o=-0.012,f=-0.012) USER MOD Single : A 213 MET CE :methyl -142:sc= -0.272 (180deg=-0.604) USER MOD Single : A 216 THR OG1 : rot 75:sc= 0.709 USER MOD Single : A 217 GLN : amide:sc= -0.883 K(o=-0.88,f=-7.9!) USER MOD Single : A 218 TYR OH : rot 11:sc= 1.22 USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 98 N TYR A 128 9.663 -8.090 -6.860 1.00 0.00 N ATOM 99 CA TYR A 128 9.520 -6.999 -5.911 1.00 0.00 C ATOM 100 C TYR A 128 10.374 -7.322 -4.679 1.00 0.00 C ATOM 101 O TYR A 128 10.828 -8.459 -4.506 1.00 0.00 O ATOM 102 CB TYR A 128 8.041 -6.871 -5.521 1.00 0.00 C ATOM 103 CG TYR A 128 7.258 -5.937 -6.413 1.00 0.00 C ATOM 104 CD1 TYR A 128 7.367 -4.558 -6.184 1.00 0.00 C ATOM 105 CD2 TYR A 128 6.445 -6.420 -7.453 1.00 0.00 C ATOM 106 CE1 TYR A 128 6.641 -3.640 -6.956 1.00 0.00 C ATOM 107 CE2 TYR A 128 5.717 -5.504 -8.237 1.00 0.00 C ATOM 108 CZ TYR A 128 5.791 -4.115 -7.970 1.00 0.00 C ATOM 109 OH TYR A 128 5.089 -3.216 -8.702 1.00 0.00 O ATOM 0 HA TYR A 128 9.851 -6.056 -6.345 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.580 -7.858 -5.549 1.00 0.00 H new ATOM 0 HB3 TYR A 128 7.975 -6.518 -4.492 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.019 -4.198 -5.402 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.379 -7.480 -7.648 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.734 -2.580 -6.774 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.099 -5.863 -9.047 1.00 0.00 H new ATOM 0 HH TYR A 128 4.943 -3.571 -9.604 1.00 0.00 H new ATOM 119 N MET A 129 10.535 -6.333 -3.801 1.00 0.00 N ATOM 120 CA MET A 129 11.206 -6.443 -2.509 1.00 0.00 C ATOM 121 C MET A 129 10.146 -6.250 -1.404 1.00 0.00 C ATOM 122 O MET A 129 8.955 -6.412 -1.678 1.00 0.00 O ATOM 123 CB MET A 129 12.359 -5.450 -2.455 1.00 0.00 C ATOM 124 CG MET A 129 13.347 -5.604 -3.625 1.00 0.00 C ATOM 125 SD MET A 129 14.571 -4.279 -3.760 1.00 0.00 S ATOM 126 CE MET A 129 13.462 -2.851 -3.637 1.00 0.00 C ATOM 0 H MET A 129 10.185 -5.392 -3.980 1.00 0.00 H new ATOM 0 HA MET A 129 11.654 -7.425 -2.355 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.958 -4.437 -2.458 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.896 -5.578 -1.515 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.870 -6.554 -3.518 1.00 0.00 H new ATOM 0 HG3 MET A 129 12.782 -5.654 -4.556 1.00 0.00 H new ATOM 0 HE1 MET A 129 13.987 -1.953 -3.963 1.00 0.00 H new ATOM 0 HE2 MET A 129 12.590 -3.012 -4.272 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.140 -2.728 -2.603 1.00 0.00 H new ATOM 136 N LEU A 130 10.526 -5.915 -0.168 1.00 0.00 N ATOM 137 CA LEU A 130 9.672 -5.493 0.946 1.00 0.00 C ATOM 138 C LEU A 130 10.482 -4.410 1.658 1.00 0.00 C ATOM 139 O LEU A 130 11.705 -4.537 1.734 1.00 0.00 O ATOM 140 CB LEU A 130 9.379 -6.677 1.882 1.00 0.00 C ATOM 141 CG LEU A 130 8.724 -6.281 3.222 1.00 0.00 C ATOM 142 CD1 LEU A 130 7.377 -5.571 3.050 1.00 0.00 C ATOM 143 CD2 LEU A 130 8.500 -7.525 4.084 1.00 0.00 C ATOM 0 H LEU A 130 11.510 -5.933 0.100 1.00 0.00 H new ATOM 0 HA LEU A 130 8.701 -5.125 0.615 1.00 0.00 H new ATOM 0 HB2 LEU A 130 8.726 -7.380 1.366 1.00 0.00 H new ATOM 0 HB3 LEU A 130 10.312 -7.201 2.088 1.00 0.00 H new ATOM 0 HG LEU A 130 9.413 -5.585 3.701 1.00 0.00 H new ATOM 0 HD11 LEU A 130 6.970 -5.320 4.030 1.00 0.00 H new ATOM 0 HD12 LEU A 130 7.518 -4.658 2.471 1.00 0.00 H new ATOM 0 HD13 LEU A 130 6.683 -6.229 2.527 1.00 0.00 H new ATOM 0 HD21 LEU A 130 8.037 -7.235 5.028 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.846 -8.220 3.557 1.00 0.00 H new ATOM 0 HD23 LEU A 130 9.457 -8.007 4.282 1.00 0.00 H new ATOM 155 N GLY A 131 9.869 -3.307 2.090 1.00 0.00 N ATOM 156 CA GLY A 131 10.585 -2.186 2.703 1.00 0.00 C ATOM 157 C GLY A 131 10.105 -1.907 4.112 1.00 0.00 C ATOM 158 O GLY A 131 9.125 -2.501 4.563 1.00 0.00 O ATOM 0 H GLY A 131 8.861 -3.165 2.025 1.00 0.00 H new ATOM 0 HA2 GLY A 131 11.653 -2.404 2.721 1.00 0.00 H new ATOM 0 HA3 GLY A 131 10.452 -1.293 2.092 1.00 0.00 H new ATOM 162 N SER A 132 10.806 -1.011 4.805 1.00 0.00 N ATOM 163 CA SER A 132 10.476 -0.610 6.158 1.00 0.00 C ATOM 164 C SER A 132 9.104 0.054 6.215 1.00 0.00 C ATOM 165 O SER A 132 8.665 0.719 5.272 1.00 0.00 O ATOM 166 CB SER A 132 11.587 0.279 6.724 1.00 0.00 C ATOM 167 OG SER A 132 12.266 1.032 5.724 1.00 0.00 O ATOM 0 H SER A 132 11.630 -0.540 4.431 1.00 0.00 H new ATOM 0 HA SER A 132 10.412 -1.496 6.789 1.00 0.00 H new ATOM 0 HB2 SER A 132 11.159 0.963 7.457 1.00 0.00 H new ATOM 0 HB3 SER A 132 12.308 -0.344 7.253 1.00 0.00 H new ATOM 0 HG SER A 132 12.961 1.581 6.143 1.00 0.00 H new ATOM 173 N ALA A 133 8.442 -0.142 7.349 1.00 0.00 N ATOM 174 CA ALA A 133 7.093 0.301 7.625 1.00 0.00 C ATOM 175 C ALA A 133 7.041 1.821 7.745 1.00 0.00 C ATOM 176 O ALA A 133 8.029 2.459 8.122 1.00 0.00 O ATOM 177 CB ALA A 133 6.668 -0.332 8.951 1.00 0.00 C ATOM 0 H ALA A 133 8.858 -0.640 8.136 1.00 0.00 H new ATOM 0 HA ALA A 133 6.427 0.005 6.815 1.00 0.00 H new ATOM 0 HB1 ALA A 133 5.652 -0.020 9.194 1.00 0.00 H new ATOM 0 HB2 ALA A 133 6.703 -1.418 8.864 1.00 0.00 H new ATOM 0 HB3 ALA A 133 7.345 -0.010 9.742 1.00 0.00 H new ATOM 183 N MET A 134 5.859 2.384 7.514 1.00 0.00 N ATOM 184 CA MET A 134 5.488 3.751 7.768 1.00 0.00 C ATOM 185 C MET A 134 4.194 3.774 8.574 1.00 0.00 C ATOM 186 O MET A 134 3.616 2.732 8.904 1.00 0.00 O ATOM 187 CB MET A 134 5.348 4.496 6.445 1.00 0.00 C ATOM 188 CG MET A 134 4.348 3.811 5.500 1.00 0.00 C ATOM 189 SD MET A 134 4.892 2.363 4.557 1.00 0.00 S ATOM 190 CE MET A 134 6.004 3.271 3.478 1.00 0.00 C ATOM 0 H MET A 134 5.088 1.849 7.116 1.00 0.00 H new ATOM 0 HA MET A 134 6.259 4.255 8.350 1.00 0.00 H new ATOM 0 HB2 MET A 134 5.023 5.518 6.638 1.00 0.00 H new ATOM 0 HB3 MET A 134 6.322 4.558 5.959 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.484 3.513 6.093 1.00 0.00 H new ATOM 0 HG3 MET A 134 4.002 4.559 4.787 1.00 0.00 H new ATOM 0 HE1 MET A 134 5.690 3.145 2.442 1.00 0.00 H new ATOM 0 HE2 MET A 134 5.980 4.329 3.738 1.00 0.00 H new ATOM 0 HE3 MET A 134 7.018 2.891 3.598 1.00 0.00 H new ATOM 200 N SER A 135 3.722 4.965 8.902 1.00 0.00 N ATOM 201 CA SER A 135 2.406 5.191 9.429 1.00 0.00 C ATOM 202 C SER A 135 1.385 5.108 8.286 1.00 0.00 C ATOM 203 O SER A 135 1.715 5.347 7.123 1.00 0.00 O ATOM 204 CB SER A 135 2.418 6.597 10.027 1.00 0.00 C ATOM 205 OG SER A 135 3.658 6.957 10.614 1.00 0.00 O ATOM 0 H SER A 135 4.268 5.821 8.802 1.00 0.00 H new ATOM 0 HA SER A 135 2.135 4.451 10.182 1.00 0.00 H new ATOM 0 HB2 SER A 135 2.174 7.317 9.246 1.00 0.00 H new ATOM 0 HB3 SER A 135 1.635 6.668 10.782 1.00 0.00 H new ATOM 0 HG SER A 135 3.597 7.866 10.975 1.00 0.00 H new ATOM 211 N ARG A 136 0.109 4.854 8.594 1.00 0.00 N ATOM 212 CA ARG A 136 -0.984 5.084 7.665 1.00 0.00 C ATOM 213 C ARG A 136 -0.917 6.544 7.180 1.00 0.00 C ATOM 214 O ARG A 136 -0.752 7.436 8.019 1.00 0.00 O ATOM 215 CB ARG A 136 -2.291 4.749 8.393 1.00 0.00 C ATOM 216 CG ARG A 136 -2.253 3.340 9.032 1.00 0.00 C ATOM 217 CD ARG A 136 -2.388 3.270 10.563 1.00 0.00 C ATOM 218 NE ARG A 136 -1.097 3.416 11.255 1.00 0.00 N ATOM 219 CZ ARG A 136 -0.625 4.533 11.818 1.00 0.00 C ATOM 220 NH1 ARG A 136 -1.333 5.652 11.767 1.00 0.00 N ATOM 221 NH2 ARG A 136 0.573 4.550 12.381 1.00 0.00 N ATOM 0 H ARG A 136 -0.187 4.483 9.497 1.00 0.00 H new ATOM 0 HA ARG A 136 -0.921 4.451 6.780 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -2.476 5.494 9.167 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.122 4.806 7.691 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -3.054 2.746 8.593 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -1.313 2.865 8.752 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -3.067 4.054 10.900 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -2.839 2.317 10.841 1.00 0.00 H new ATOM 0 HE ARG A 136 -0.506 2.586 11.310 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -2.239 5.662 11.298 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -0.972 6.504 12.197 1.00 0.00 H new ATOM 0 HH21 ARG A 136 1.145 3.706 12.388 1.00 0.00 H new ATOM 0 HH22 ARG A 136 0.924 5.407 12.808 1.00 0.00 H new ATOM 235 N PRO A 137 -1.073 6.840 5.878 1.00 0.00 N ATOM 236 CA PRO A 137 -1.050 8.209 5.355 1.00 0.00 C ATOM 237 C PRO A 137 -2.211 9.098 5.793 1.00 0.00 C ATOM 238 O PRO A 137 -2.175 10.288 5.477 1.00 0.00 O ATOM 239 CB PRO A 137 -0.991 8.098 3.821 1.00 0.00 C ATOM 240 CG PRO A 137 -1.293 6.638 3.507 1.00 0.00 C ATOM 241 CD PRO A 137 -1.018 5.875 4.797 1.00 0.00 C ATOM 0 HA PRO A 137 -0.177 8.710 5.773 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -1.719 8.759 3.351 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -0.010 8.386 3.444 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -2.328 6.511 3.190 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -0.664 6.274 2.695 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -1.757 5.087 4.945 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -0.041 5.393 4.759 1.00 0.00 H new ATOM 249 N ILE A 138 -3.207 8.571 6.517 1.00 0.00 N ATOM 250 CA ILE A 138 -4.398 9.279 6.962 1.00 0.00 C ATOM 251 C ILE A 138 -5.024 10.068 5.792 1.00 0.00 C ATOM 252 O ILE A 138 -4.875 11.283 5.672 1.00 0.00 O ATOM 253 CB ILE A 138 -3.979 10.059 8.222 1.00 0.00 C ATOM 254 CG1 ILE A 138 -3.494 9.111 9.346 1.00 0.00 C ATOM 255 CG2 ILE A 138 -5.093 10.958 8.770 1.00 0.00 C ATOM 256 CD1 ILE A 138 -4.568 8.300 10.073 1.00 0.00 C ATOM 0 H ILE A 138 -3.197 7.596 6.818 1.00 0.00 H new ATOM 0 HA ILE A 138 -5.227 8.636 7.259 1.00 0.00 H new ATOM 0 HB ILE A 138 -3.156 10.698 7.903 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -2.774 8.414 8.916 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -2.959 9.706 10.086 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.736 11.480 9.657 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -5.379 11.686 8.011 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -5.957 10.348 9.032 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -4.100 7.677 10.835 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -5.279 8.978 10.545 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.092 7.666 9.358 1.00 0.00 H new ATOM 268 N ILE A 139 -5.678 9.347 4.874 1.00 0.00 N ATOM 269 CA ILE A 139 -6.440 9.939 3.769 1.00 0.00 C ATOM 270 C ILE A 139 -7.817 10.276 4.350 1.00 0.00 C ATOM 271 O ILE A 139 -8.340 9.512 5.167 1.00 0.00 O ATOM 272 CB ILE A 139 -6.525 8.980 2.540 1.00 0.00 C ATOM 273 CG1 ILE A 139 -5.143 8.372 2.211 1.00 0.00 C ATOM 274 CG2 ILE A 139 -7.020 9.729 1.282 1.00 0.00 C ATOM 275 CD1 ILE A 139 -5.150 7.343 1.081 1.00 0.00 C ATOM 0 H ILE A 139 -5.693 8.327 4.878 1.00 0.00 H new ATOM 0 HA ILE A 139 -5.953 10.834 3.382 1.00 0.00 H new ATOM 0 HB ILE A 139 -7.228 8.191 2.808 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -4.460 9.179 1.945 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -4.745 7.901 3.110 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.069 9.036 0.442 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.011 10.142 1.471 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -6.329 10.538 1.045 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -4.138 6.972 0.921 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -5.803 6.513 1.349 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.514 7.810 0.166 1.00 0.00 H new ATOM 287 N HIS A 140 -8.420 11.389 3.935 1.00 0.00 N ATOM 288 CA HIS A 140 -9.716 11.837 4.443 1.00 0.00 C ATOM 289 C HIS A 140 -10.667 12.088 3.281 1.00 0.00 C ATOM 290 O HIS A 140 -10.549 13.104 2.593 1.00 0.00 O ATOM 291 CB HIS A 140 -9.550 13.069 5.338 1.00 0.00 C ATOM 292 CG HIS A 140 -8.887 12.776 6.662 1.00 0.00 C ATOM 293 ND1 HIS A 140 -7.929 13.553 7.266 1.00 0.00 N ATOM 294 CD2 HIS A 140 -9.137 11.715 7.493 1.00 0.00 C ATOM 295 CE1 HIS A 140 -7.620 12.977 8.435 1.00 0.00 C ATOM 296 NE2 HIS A 140 -8.340 11.859 8.631 1.00 0.00 N ATOM 0 H HIS A 140 -8.020 12.010 3.232 1.00 0.00 H new ATOM 0 HA HIS A 140 -10.153 11.055 5.064 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -8.962 13.817 4.806 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.531 13.507 5.523 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.829 10.909 7.301 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -6.888 13.361 9.130 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -8.310 11.243 9.443 1.00 0.00 H new ATOM 304 N PHE A 141 -11.552 11.128 3.001 1.00 0.00 N ATOM 305 CA PHE A 141 -12.369 11.103 1.788 1.00 0.00 C ATOM 306 C PHE A 141 -13.441 12.195 1.800 1.00 0.00 C ATOM 307 O PHE A 141 -13.868 12.646 0.743 1.00 0.00 O ATOM 308 CB PHE A 141 -12.974 9.697 1.626 1.00 0.00 C ATOM 309 CG PHE A 141 -12.025 8.638 1.067 1.00 0.00 C ATOM 310 CD1 PHE A 141 -10.625 8.744 1.220 1.00 0.00 C ATOM 311 CD2 PHE A 141 -12.548 7.509 0.402 1.00 0.00 C ATOM 312 CE1 PHE A 141 -9.779 7.724 0.773 1.00 0.00 C ATOM 313 CE2 PHE A 141 -11.689 6.483 -0.046 1.00 0.00 C ATOM 314 CZ PHE A 141 -10.301 6.586 0.164 1.00 0.00 C ATOM 0 H PHE A 141 -11.723 10.336 3.620 1.00 0.00 H new ATOM 0 HA PHE A 141 -11.738 11.318 0.925 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.335 9.361 2.598 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -13.842 9.766 0.970 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -10.203 9.622 1.687 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -13.612 7.430 0.235 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -8.711 7.820 0.901 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -12.096 5.619 -0.550 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.644 5.786 -0.146 1.00 0.00 H new ATOM 324 N GLY A 142 -13.832 12.674 2.981 1.00 0.00 N ATOM 325 CA GLY A 142 -14.818 13.727 3.175 1.00 0.00 C ATOM 326 C GLY A 142 -16.181 13.160 3.564 1.00 0.00 C ATOM 327 O GLY A 142 -16.970 13.864 4.199 1.00 0.00 O ATOM 0 H GLY A 142 -13.453 12.323 3.861 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.473 14.410 3.951 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.914 14.309 2.258 1.00 0.00 H new ATOM 331 N SER A 143 -16.462 11.899 3.253 1.00 0.00 N ATOM 332 CA SER A 143 -17.721 11.229 3.511 1.00 0.00 C ATOM 333 C SER A 143 -17.677 10.648 4.912 1.00 0.00 C ATOM 334 O SER A 143 -16.724 9.959 5.257 1.00 0.00 O ATOM 335 CB SER A 143 -17.986 10.169 2.431 1.00 0.00 C ATOM 336 OG SER A 143 -16.975 10.169 1.426 1.00 0.00 O ATOM 0 H SER A 143 -15.783 11.293 2.793 1.00 0.00 H new ATOM 0 HA SER A 143 -18.554 11.930 3.462 1.00 0.00 H new ATOM 0 HB2 SER A 143 -18.037 9.184 2.894 1.00 0.00 H new ATOM 0 HB3 SER A 143 -18.956 10.355 1.970 1.00 0.00 H new ATOM 0 HG SER A 143 -17.206 9.519 0.729 1.00 0.00 H new ATOM 342 N ASP A 144 -18.709 10.886 5.716 1.00 0.00 N ATOM 343 CA ASP A 144 -18.788 10.345 7.085 1.00 0.00 C ATOM 344 C ASP A 144 -18.829 8.830 7.025 1.00 0.00 C ATOM 345 O ASP A 144 -18.210 8.127 7.826 1.00 0.00 O ATOM 346 CB ASP A 144 -20.059 10.764 7.831 1.00 0.00 C ATOM 347 CG ASP A 144 -20.365 12.236 7.719 1.00 0.00 C ATOM 348 OD1 ASP A 144 -19.576 13.055 8.243 1.00 0.00 O ATOM 349 OD2 ASP A 144 -21.381 12.574 7.074 1.00 0.00 O ATOM 0 H ASP A 144 -19.513 11.454 5.447 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.915 10.735 7.608 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.903 10.195 7.442 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -19.956 10.502 8.884 1.00 0.00 H new ATOM 354 N TYR A 145 -19.599 8.351 6.050 1.00 0.00 N ATOM 355 CA TYR A 145 -19.798 6.963 5.714 1.00 0.00 C ATOM 356 C TYR A 145 -18.449 6.297 5.464 1.00 0.00 C ATOM 357 O TYR A 145 -18.265 5.164 5.894 1.00 0.00 O ATOM 358 CB TYR A 145 -20.712 6.941 4.477 1.00 0.00 C ATOM 359 CG TYR A 145 -21.145 5.583 3.967 1.00 0.00 C ATOM 360 CD1 TYR A 145 -20.346 4.886 3.043 1.00 0.00 C ATOM 361 CD2 TYR A 145 -22.382 5.038 4.361 1.00 0.00 C ATOM 362 CE1 TYR A 145 -20.781 3.661 2.514 1.00 0.00 C ATOM 363 CE2 TYR A 145 -22.799 3.787 3.870 1.00 0.00 C ATOM 364 CZ TYR A 145 -21.998 3.094 2.939 1.00 0.00 C ATOM 365 OH TYR A 145 -22.358 1.859 2.494 1.00 0.00 O ATOM 0 H TYR A 145 -20.131 8.972 5.440 1.00 0.00 H new ATOM 0 HA TYR A 145 -20.268 6.401 6.521 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -21.608 7.518 4.707 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -20.199 7.459 3.667 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -19.394 5.295 2.739 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -23.015 5.584 5.045 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -20.179 3.150 1.777 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -23.732 3.358 4.206 1.00 0.00 H new ATOM 0 HH TYR A 145 -23.224 1.611 2.881 1.00 0.00 H new ATOM 375 N GLU A 146 -17.521 7.002 4.812 1.00 0.00 N ATOM 376 CA GLU A 146 -16.225 6.501 4.379 1.00 0.00 C ATOM 377 C GLU A 146 -15.142 6.780 5.428 1.00 0.00 C ATOM 378 O GLU A 146 -14.131 6.089 5.482 1.00 0.00 O ATOM 379 CB GLU A 146 -15.926 7.159 3.017 1.00 0.00 C ATOM 380 CG GLU A 146 -16.917 6.559 2.009 1.00 0.00 C ATOM 381 CD GLU A 146 -16.635 6.876 0.547 1.00 0.00 C ATOM 382 OE1 GLU A 146 -17.056 7.964 0.094 1.00 0.00 O ATOM 383 OE2 GLU A 146 -16.120 5.999 -0.185 1.00 0.00 O ATOM 0 H GLU A 146 -17.664 7.981 4.563 1.00 0.00 H new ATOM 0 HA GLU A 146 -16.236 5.417 4.267 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -16.042 8.241 3.076 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.898 6.965 2.711 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -16.924 5.476 2.133 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -17.918 6.915 2.254 1.00 0.00 H new ATOM 390 N ASP A 147 -15.388 7.737 6.316 1.00 0.00 N ATOM 391 CA ASP A 147 -14.511 8.159 7.396 1.00 0.00 C ATOM 392 C ASP A 147 -14.556 7.101 8.478 1.00 0.00 C ATOM 393 O ASP A 147 -13.537 6.480 8.759 1.00 0.00 O ATOM 394 CB ASP A 147 -14.929 9.527 7.950 1.00 0.00 C ATOM 395 CG ASP A 147 -14.029 9.953 9.108 1.00 0.00 C ATOM 396 OD1 ASP A 147 -14.248 9.497 10.249 1.00 0.00 O ATOM 397 OD2 ASP A 147 -13.100 10.776 8.906 1.00 0.00 O ATOM 0 H ASP A 147 -16.258 8.269 6.298 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.493 8.268 7.022 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -14.883 10.273 7.157 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.965 9.485 8.288 1.00 0.00 H new ATOM 402 N ARG A 148 -15.753 6.795 8.992 1.00 0.00 N ATOM 403 CA ARG A 148 -15.961 5.630 9.849 1.00 0.00 C ATOM 404 C ARG A 148 -15.506 4.349 9.156 1.00 0.00 C ATOM 405 O ARG A 148 -15.157 3.404 9.858 1.00 0.00 O ATOM 406 CB ARG A 148 -17.452 5.495 10.194 1.00 0.00 C ATOM 407 CG ARG A 148 -17.934 6.430 11.312 1.00 0.00 C ATOM 408 CD ARG A 148 -17.724 5.857 12.724 1.00 0.00 C ATOM 409 NE ARG A 148 -18.654 6.488 13.680 1.00 0.00 N ATOM 410 CZ ARG A 148 -18.456 7.594 14.402 1.00 0.00 C ATOM 411 NH1 ARG A 148 -17.237 8.105 14.558 1.00 0.00 N ATOM 412 NH2 ARG A 148 -19.494 8.207 14.963 1.00 0.00 N ATOM 0 H ARG A 148 -16.596 7.345 8.825 1.00 0.00 H new ATOM 0 HA ARG A 148 -15.373 5.774 10.755 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -18.039 5.690 9.296 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -17.652 4.465 10.488 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -17.407 7.381 11.232 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -18.994 6.640 11.168 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -17.881 4.778 12.712 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -16.695 6.026 13.042 1.00 0.00 H new ATOM 0 HE ARG A 148 -19.554 6.025 13.804 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -16.434 7.651 14.122 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -17.106 8.951 15.113 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -20.435 7.832 14.841 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -19.350 9.052 15.516 1.00 0.00 H new ATOM 426 N TYR A 149 -15.519 4.294 7.818 1.00 0.00 N ATOM 427 CA TYR A 149 -15.178 3.047 7.134 1.00 0.00 C ATOM 428 C TYR A 149 -13.687 2.811 7.278 1.00 0.00 C ATOM 429 O TYR A 149 -13.250 1.794 7.812 1.00 0.00 O ATOM 430 CB TYR A 149 -15.572 3.068 5.653 1.00 0.00 C ATOM 431 CG TYR A 149 -15.641 1.692 5.039 1.00 0.00 C ATOM 432 CD1 TYR A 149 -16.845 0.981 5.141 1.00 0.00 C ATOM 433 CD2 TYR A 149 -14.548 1.127 4.352 1.00 0.00 C ATOM 434 CE1 TYR A 149 -16.979 -0.270 4.529 1.00 0.00 C ATOM 435 CE2 TYR A 149 -14.675 -0.143 3.754 1.00 0.00 C ATOM 436 CZ TYR A 149 -15.901 -0.844 3.830 1.00 0.00 C ATOM 437 OH TYR A 149 -16.084 -2.042 3.215 1.00 0.00 O ATOM 0 H TYR A 149 -15.755 5.075 7.206 1.00 0.00 H new ATOM 0 HA TYR A 149 -15.741 2.235 7.595 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -16.541 3.555 5.548 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -14.851 3.670 5.100 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -17.672 1.401 5.694 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -13.615 1.666 4.284 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -17.918 -0.800 4.594 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -13.834 -0.582 3.237 1.00 0.00 H new ATOM 0 HH TYR A 149 -15.216 -2.404 2.939 1.00 0.00 H new ATOM 447 N TYR A 150 -12.922 3.790 6.807 1.00 0.00 N ATOM 448 CA TYR A 150 -11.485 3.843 6.889 1.00 0.00 C ATOM 449 C TYR A 150 -11.038 3.703 8.342 1.00 0.00 C ATOM 450 O TYR A 150 -10.224 2.840 8.653 1.00 0.00 O ATOM 451 CB TYR A 150 -11.058 5.180 6.280 1.00 0.00 C ATOM 452 CG TYR A 150 -9.589 5.464 6.467 1.00 0.00 C ATOM 453 CD1 TYR A 150 -8.642 4.901 5.596 1.00 0.00 C ATOM 454 CD2 TYR A 150 -9.179 6.239 7.563 1.00 0.00 C ATOM 455 CE1 TYR A 150 -7.266 5.085 5.827 1.00 0.00 C ATOM 456 CE2 TYR A 150 -7.817 6.406 7.830 1.00 0.00 C ATOM 457 CZ TYR A 150 -6.859 5.817 6.975 1.00 0.00 C ATOM 458 OH TYR A 150 -5.547 5.969 7.291 1.00 0.00 O ATOM 0 H TYR A 150 -13.317 4.604 6.336 1.00 0.00 H new ATOM 0 HA TYR A 150 -11.017 3.024 6.343 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -11.291 5.180 5.215 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.639 5.983 6.733 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -8.971 4.324 4.745 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -9.916 6.706 8.200 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -6.534 4.678 5.145 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -7.499 6.983 8.686 1.00 0.00 H new ATOM 0 HH TYR A 150 -5.085 6.427 6.558 1.00 0.00 H new ATOM 468 N ARG A 151 -11.571 4.538 9.237 1.00 0.00 N ATOM 469 CA ARG A 151 -11.111 4.632 10.624 1.00 0.00 C ATOM 470 C ARG A 151 -11.258 3.302 11.364 1.00 0.00 C ATOM 471 O ARG A 151 -10.418 2.993 12.205 1.00 0.00 O ATOM 472 CB ARG A 151 -11.900 5.739 11.341 1.00 0.00 C ATOM 473 CG ARG A 151 -11.426 7.146 10.952 1.00 0.00 C ATOM 474 CD ARG A 151 -10.046 7.518 11.519 1.00 0.00 C ATOM 475 NE ARG A 151 -10.122 8.618 12.501 1.00 0.00 N ATOM 476 CZ ARG A 151 -9.129 9.471 12.804 1.00 0.00 C ATOM 477 NH1 ARG A 151 -7.938 9.387 12.213 1.00 0.00 N ATOM 478 NH2 ARG A 151 -9.337 10.429 13.696 1.00 0.00 N ATOM 0 H ARG A 151 -12.339 5.172 9.018 1.00 0.00 H new ATOM 0 HA ARG A 151 -10.049 4.878 10.620 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -12.959 5.638 11.104 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -11.801 5.611 12.419 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -11.393 7.220 9.865 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -12.159 7.874 11.299 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -9.602 6.642 11.992 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -9.386 7.808 10.702 1.00 0.00 H new ATOM 0 HE ARG A 151 -11.007 8.741 12.993 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -7.765 8.664 11.514 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -7.199 10.046 12.459 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -10.247 10.516 14.148 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -8.587 11.079 13.930 1.00 0.00 H new ATOM 492 N GLU A 152 -12.306 2.532 11.067 1.00 0.00 N ATOM 493 CA GLU A 152 -12.528 1.214 11.664 1.00 0.00 C ATOM 494 C GLU A 152 -11.686 0.126 10.984 1.00 0.00 C ATOM 495 O GLU A 152 -11.258 -0.827 11.640 1.00 0.00 O ATOM 496 CB GLU A 152 -14.003 0.847 11.587 1.00 0.00 C ATOM 497 CG GLU A 152 -14.796 1.730 12.557 1.00 0.00 C ATOM 498 CD GLU A 152 -15.034 1.093 13.925 1.00 0.00 C ATOM 499 OE1 GLU A 152 -15.882 0.180 14.041 1.00 0.00 O ATOM 500 OE2 GLU A 152 -14.458 1.575 14.930 1.00 0.00 O ATOM 0 H GLU A 152 -13.029 2.807 10.402 1.00 0.00 H new ATOM 0 HA GLU A 152 -12.217 1.272 12.707 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -14.371 0.983 10.570 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -14.142 -0.205 11.838 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -14.263 2.671 12.694 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -15.759 1.971 12.108 1.00 0.00 H new ATOM 507 N ASN A 153 -11.481 0.217 9.665 1.00 0.00 N ATOM 508 CA ASN A 153 -10.792 -0.829 8.901 1.00 0.00 C ATOM 509 C ASN A 153 -9.278 -0.656 8.915 1.00 0.00 C ATOM 510 O ASN A 153 -8.564 -1.626 8.677 1.00 0.00 O ATOM 511 CB ASN A 153 -11.293 -0.897 7.452 1.00 0.00 C ATOM 512 CG ASN A 153 -12.597 -1.674 7.365 1.00 0.00 C ATOM 513 OD1 ASN A 153 -12.611 -2.890 7.516 1.00 0.00 O ATOM 514 ND2 ASN A 153 -13.721 -1.003 7.181 1.00 0.00 N ATOM 0 H ASN A 153 -11.785 1.011 9.101 1.00 0.00 H new ATOM 0 HA ASN A 153 -11.029 -1.769 9.399 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -11.440 0.112 7.066 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -10.539 -1.372 6.824 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -14.613 -1.497 7.164 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -13.696 0.009 7.057 1.00 0.00 H new ATOM 521 N MET A 154 -8.756 0.532 9.237 1.00 0.00 N ATOM 522 CA MET A 154 -7.322 0.828 9.230 1.00 0.00 C ATOM 523 C MET A 154 -6.508 -0.058 10.178 1.00 0.00 C ATOM 524 O MET A 154 -5.286 -0.139 10.084 1.00 0.00 O ATOM 525 CB MET A 154 -7.090 2.307 9.531 1.00 0.00 C ATOM 526 CG MET A 154 -7.377 2.664 10.999 1.00 0.00 C ATOM 527 SD MET A 154 -7.431 4.436 11.382 1.00 0.00 S ATOM 528 CE MET A 154 -5.991 4.951 10.430 1.00 0.00 C ATOM 0 H MET A 154 -9.330 1.328 9.515 1.00 0.00 H new ATOM 0 HA MET A 154 -6.961 0.598 8.228 1.00 0.00 H new ATOM 0 HB2 MET A 154 -6.058 2.565 9.293 1.00 0.00 H new ATOM 0 HB3 MET A 154 -7.726 2.910 8.883 1.00 0.00 H new ATOM 0 HG2 MET A 154 -8.332 2.221 11.281 1.00 0.00 H new ATOM 0 HG3 MET A 154 -6.613 2.199 11.623 1.00 0.00 H new ATOM 0 HE1 MET A 154 -5.871 6.032 10.507 1.00 0.00 H new ATOM 0 HE2 MET A 154 -5.101 4.458 10.821 1.00 0.00 H new ATOM 0 HE3 MET A 154 -6.128 4.675 9.385 1.00 0.00 H new ATOM 538 N HIS A 155 -7.175 -0.733 11.101 1.00 0.00 N ATOM 539 CA HIS A 155 -6.586 -1.756 11.949 1.00 0.00 C ATOM 540 C HIS A 155 -6.072 -2.929 11.091 1.00 0.00 C ATOM 541 O HIS A 155 -4.962 -3.420 11.295 1.00 0.00 O ATOM 542 CB HIS A 155 -7.639 -2.155 12.995 1.00 0.00 C ATOM 543 CG HIS A 155 -8.244 -0.956 13.707 1.00 0.00 C ATOM 544 ND1 HIS A 155 -7.690 0.310 13.791 1.00 0.00 N ATOM 545 CD2 HIS A 155 -9.510 -0.881 14.227 1.00 0.00 C ATOM 546 CE1 HIS A 155 -8.626 1.133 14.292 1.00 0.00 C ATOM 547 NE2 HIS A 155 -9.731 0.444 14.617 1.00 0.00 N ATOM 0 H HIS A 155 -8.166 -0.580 11.285 1.00 0.00 H new ATOM 0 HA HIS A 155 -5.709 -1.389 12.482 1.00 0.00 H new ATOM 0 HB2 HIS A 155 -8.433 -2.721 12.508 1.00 0.00 H new ATOM 0 HB3 HIS A 155 -7.181 -2.816 13.731 1.00 0.00 H new ATOM 0 HD2 HIS A 155 -10.211 -1.698 14.319 1.00 0.00 H new ATOM 0 HE1 HIS A 155 -8.506 2.199 14.416 1.00 0.00 H new ATOM 0 HE2 HIS A 155 -10.570 0.815 15.063 1.00 0.00 H new ATOM 555 N ARG A 156 -6.824 -3.327 10.061 1.00 0.00 N ATOM 556 CA ARG A 156 -6.505 -4.401 9.119 1.00 0.00 C ATOM 557 C ARG A 156 -5.667 -3.914 7.925 1.00 0.00 C ATOM 558 O ARG A 156 -5.480 -4.677 6.977 1.00 0.00 O ATOM 559 CB ARG A 156 -7.824 -5.005 8.596 1.00 0.00 C ATOM 560 CG ARG A 156 -8.799 -5.548 9.658 1.00 0.00 C ATOM 561 CD ARG A 156 -8.700 -7.068 9.840 1.00 0.00 C ATOM 562 NE ARG A 156 -7.640 -7.444 10.785 1.00 0.00 N ATOM 563 CZ ARG A 156 -7.537 -8.638 11.374 1.00 0.00 C ATOM 564 NH1 ARG A 156 -8.120 -9.709 10.844 1.00 0.00 N ATOM 565 NH2 ARG A 156 -6.860 -8.716 12.515 1.00 0.00 N ATOM 0 H ARG A 156 -7.719 -2.885 9.852 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.910 -5.143 9.651 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -8.342 -4.242 8.015 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -7.580 -5.816 7.910 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -8.598 -5.059 10.611 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -9.819 -5.287 9.375 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -9.656 -7.453 10.196 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -8.507 -7.536 8.875 1.00 0.00 H new ATOM 0 HE ARG A 156 -6.933 -6.743 11.007 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -8.653 -9.624 9.978 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -8.034 -10.616 11.303 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -6.438 -7.878 12.916 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -6.763 -9.613 12.990 1.00 0.00 H new ATOM 579 N TYR A 157 -5.208 -2.658 7.899 1.00 0.00 N ATOM 580 CA TYR A 157 -4.584 -2.065 6.708 1.00 0.00 C ATOM 581 C TYR A 157 -3.129 -2.522 6.522 1.00 0.00 C ATOM 582 O TYR A 157 -2.572 -3.146 7.439 1.00 0.00 O ATOM 583 CB TYR A 157 -4.664 -0.532 6.800 1.00 0.00 C ATOM 584 CG TYR A 157 -5.772 0.078 5.975 1.00 0.00 C ATOM 585 CD1 TYR A 157 -7.060 -0.493 5.965 1.00 0.00 C ATOM 586 CD2 TYR A 157 -5.514 1.238 5.228 1.00 0.00 C ATOM 587 CE1 TYR A 157 -8.092 0.110 5.234 1.00 0.00 C ATOM 588 CE2 TYR A 157 -6.528 1.808 4.443 1.00 0.00 C ATOM 589 CZ TYR A 157 -7.818 1.250 4.453 1.00 0.00 C ATOM 590 OH TYR A 157 -8.784 1.802 3.684 1.00 0.00 O ATOM 0 H TYR A 157 -5.257 -2.026 8.698 1.00 0.00 H new ATOM 0 HA TYR A 157 -5.134 -2.411 5.833 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -4.804 -0.248 7.843 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -3.712 -0.109 6.479 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -7.252 -1.398 6.522 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -4.535 1.692 5.257 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -9.092 -0.297 5.269 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -6.318 2.674 3.832 1.00 0.00 H new ATOM 0 HH TYR A 157 -8.375 2.402 3.026 1.00 0.00 H new ATOM 600 N PRO A 158 -2.505 -2.218 5.362 1.00 0.00 N ATOM 601 CA PRO A 158 -1.089 -2.485 5.150 1.00 0.00 C ATOM 602 C PRO A 158 -0.260 -1.657 6.126 1.00 0.00 C ATOM 603 O PRO A 158 -0.670 -0.570 6.543 1.00 0.00 O ATOM 604 CB PRO A 158 -0.767 -2.126 3.690 1.00 0.00 C ATOM 605 CG PRO A 158 -2.057 -1.563 3.105 1.00 0.00 C ATOM 606 CD PRO A 158 -3.063 -1.466 4.242 1.00 0.00 C ATOM 0 HA PRO A 158 -0.850 -3.533 5.329 1.00 0.00 H new ATOM 0 HB2 PRO A 158 0.039 -1.394 3.636 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -0.437 -3.004 3.135 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -1.882 -0.583 2.661 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.434 -2.209 2.312 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -3.233 -0.426 4.521 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.027 -1.877 3.942 1.00 0.00 H new ATOM 614 N ASN A 159 0.927 -2.152 6.457 1.00 0.00 N ATOM 615 CA ASN A 159 1.862 -1.521 7.384 1.00 0.00 C ATOM 616 C ASN A 159 3.248 -1.384 6.744 1.00 0.00 C ATOM 617 O ASN A 159 4.034 -0.538 7.164 1.00 0.00 O ATOM 618 CB ASN A 159 1.920 -2.350 8.682 1.00 0.00 C ATOM 619 CG ASN A 159 2.279 -1.505 9.901 1.00 0.00 C ATOM 620 OD1 ASN A 159 1.525 -1.445 10.873 1.00 0.00 O ATOM 621 ND2 ASN A 159 3.409 -0.834 9.880 1.00 0.00 N ATOM 0 H ASN A 159 1.277 -3.031 6.076 1.00 0.00 H new ATOM 0 HA ASN A 159 1.518 -0.515 7.624 1.00 0.00 H new ATOM 0 HB2 ASN A 159 0.954 -2.828 8.847 1.00 0.00 H new ATOM 0 HB3 ASN A 159 2.655 -3.147 8.568 1.00 0.00 H new ATOM 0 HD21 ASN A 159 3.672 -0.253 10.676 1.00 0.00 H new ATOM 0 HD22 ASN A 159 4.023 -0.894 9.068 1.00 0.00 H new ATOM 628 N GLN A 160 3.547 -2.181 5.718 1.00 0.00 N ATOM 629 CA GLN A 160 4.670 -2.039 4.798 1.00 0.00 C ATOM 630 C GLN A 160 4.127 -2.334 3.400 1.00 0.00 C ATOM 631 O GLN A 160 2.924 -2.547 3.229 1.00 0.00 O ATOM 632 CB GLN A 160 5.783 -3.050 5.082 1.00 0.00 C ATOM 633 CG GLN A 160 6.314 -3.101 6.520 1.00 0.00 C ATOM 634 CD GLN A 160 7.123 -4.357 6.839 1.00 0.00 C ATOM 635 OE1 GLN A 160 6.735 -5.173 7.670 1.00 0.00 O ATOM 636 NE2 GLN A 160 8.304 -4.510 6.270 1.00 0.00 N ATOM 0 H GLN A 160 2.973 -2.994 5.495 1.00 0.00 H new ATOM 0 HA GLN A 160 5.089 -1.038 4.901 1.00 0.00 H new ATOM 0 HB2 GLN A 160 5.417 -4.042 4.819 1.00 0.00 H new ATOM 0 HB3 GLN A 160 6.619 -2.832 4.418 1.00 0.00 H new ATOM 0 HG2 GLN A 160 6.938 -2.225 6.698 1.00 0.00 H new ATOM 0 HG3 GLN A 160 5.472 -3.038 7.210 1.00 0.00 H new ATOM 0 HE21 GLN A 160 8.629 -3.833 5.579 1.00 0.00 H new ATOM 0 HE22 GLN A 160 8.892 -5.305 6.521 1.00 0.00 H new ATOM 645 N VAL A 161 5.012 -2.354 2.405 1.00 0.00 N ATOM 646 CA VAL A 161 4.671 -2.405 1.000 1.00 0.00 C ATOM 647 C VAL A 161 5.762 -3.147 0.228 1.00 0.00 C ATOM 648 O VAL A 161 6.931 -3.176 0.645 1.00 0.00 O ATOM 649 CB VAL A 161 4.495 -0.960 0.494 1.00 0.00 C ATOM 650 CG1 VAL A 161 3.288 -0.280 1.156 1.00 0.00 C ATOM 651 CG2 VAL A 161 5.719 -0.085 0.786 1.00 0.00 C ATOM 0 H VAL A 161 6.018 -2.334 2.569 1.00 0.00 H new ATOM 0 HA VAL A 161 3.739 -2.949 0.846 1.00 0.00 H new ATOM 0 HB VAL A 161 4.351 -1.046 -0.583 1.00 0.00 H new ATOM 0 HG11 VAL A 161 3.191 0.738 0.778 1.00 0.00 H new ATOM 0 HG12 VAL A 161 2.382 -0.841 0.925 1.00 0.00 H new ATOM 0 HG13 VAL A 161 3.432 -0.254 2.236 1.00 0.00 H new ATOM 0 HG21 VAL A 161 5.544 0.923 0.410 1.00 0.00 H new ATOM 0 HG22 VAL A 161 5.890 -0.046 1.862 1.00 0.00 H new ATOM 0 HG23 VAL A 161 6.595 -0.509 0.295 1.00 0.00 H new ATOM 661 N TYR A 162 5.394 -3.712 -0.917 1.00 0.00 N ATOM 662 CA TYR A 162 6.327 -4.364 -1.822 1.00 0.00 C ATOM 663 C TYR A 162 6.597 -3.380 -2.949 1.00 0.00 C ATOM 664 O TYR A 162 5.679 -3.018 -3.680 1.00 0.00 O ATOM 665 CB TYR A 162 5.742 -5.683 -2.336 1.00 0.00 C ATOM 666 CG TYR A 162 5.215 -6.599 -1.248 1.00 0.00 C ATOM 667 CD1 TYR A 162 6.072 -7.157 -0.283 1.00 0.00 C ATOM 668 CD2 TYR A 162 3.839 -6.851 -1.174 1.00 0.00 C ATOM 669 CE1 TYR A 162 5.563 -7.981 0.733 1.00 0.00 C ATOM 670 CE2 TYR A 162 3.315 -7.658 -0.153 1.00 0.00 C ATOM 671 CZ TYR A 162 4.175 -8.226 0.808 1.00 0.00 C ATOM 672 OH TYR A 162 3.674 -8.989 1.816 1.00 0.00 O ATOM 0 H TYR A 162 4.428 -3.729 -1.244 1.00 0.00 H new ATOM 0 HA TYR A 162 7.260 -4.623 -1.321 1.00 0.00 H new ATOM 0 HB2 TYR A 162 4.932 -5.461 -3.031 1.00 0.00 H new ATOM 0 HB3 TYR A 162 6.510 -6.212 -2.900 1.00 0.00 H new ATOM 0 HD1 TYR A 162 7.131 -6.950 -0.324 1.00 0.00 H new ATOM 0 HD2 TYR A 162 3.176 -6.420 -1.909 1.00 0.00 H new ATOM 0 HE1 TYR A 162 6.231 -8.426 1.455 1.00 0.00 H new ATOM 0 HE2 TYR A 162 2.252 -7.844 -0.104 1.00 0.00 H new ATOM 0 HH TYR A 162 2.701 -9.058 1.721 1.00 0.00 H new ATOM 682 N TYR A 163 7.838 -2.916 -3.075 1.00 0.00 N ATOM 683 CA TYR A 163 8.240 -1.885 -4.029 1.00 0.00 C ATOM 684 C TYR A 163 9.587 -2.308 -4.673 1.00 0.00 C ATOM 685 O TYR A 163 10.143 -3.343 -4.279 1.00 0.00 O ATOM 686 CB TYR A 163 8.143 -0.507 -3.329 1.00 0.00 C ATOM 687 CG TYR A 163 9.342 -0.054 -2.525 1.00 0.00 C ATOM 688 CD1 TYR A 163 9.564 -0.578 -1.248 1.00 0.00 C ATOM 689 CD2 TYR A 163 10.252 0.879 -3.045 1.00 0.00 C ATOM 690 CE1 TYR A 163 10.791 -0.355 -0.602 1.00 0.00 C ATOM 691 CE2 TYR A 163 11.407 1.234 -2.327 1.00 0.00 C ATOM 692 CZ TYR A 163 11.702 0.599 -1.105 1.00 0.00 C ATOM 693 OH TYR A 163 12.823 0.929 -0.404 1.00 0.00 O ATOM 0 H TYR A 163 8.611 -3.255 -2.502 1.00 0.00 H new ATOM 0 HA TYR A 163 7.579 -1.775 -4.889 1.00 0.00 H new ATOM 0 HB2 TYR A 163 7.944 0.246 -4.091 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.279 -0.525 -2.665 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.792 -1.154 -0.759 1.00 0.00 H new ATOM 0 HD2 TYR A 163 10.063 1.330 -4.008 1.00 0.00 H new ATOM 0 HE1 TYR A 163 11.039 -0.917 0.286 1.00 0.00 H new ATOM 0 HE2 TYR A 163 12.069 1.995 -2.713 1.00 0.00 H new ATOM 0 HH TYR A 163 13.334 1.601 -0.902 1.00 0.00 H new ATOM 703 N ARG A 164 10.056 -1.622 -5.722 1.00 0.00 N ATOM 704 CA ARG A 164 11.326 -1.874 -6.422 1.00 0.00 C ATOM 705 C ARG A 164 12.328 -0.809 -5.960 1.00 0.00 C ATOM 706 O ARG A 164 11.879 0.182 -5.390 1.00 0.00 O ATOM 707 CB ARG A 164 11.221 -1.825 -7.958 1.00 0.00 C ATOM 708 CG ARG A 164 9.926 -2.306 -8.610 1.00 0.00 C ATOM 709 CD ARG A 164 8.937 -1.160 -8.884 1.00 0.00 C ATOM 710 NE ARG A 164 8.432 -1.146 -10.267 1.00 0.00 N ATOM 711 CZ ARG A 164 7.869 -2.151 -10.956 1.00 0.00 C ATOM 712 NH1 ARG A 164 7.612 -3.329 -10.404 1.00 0.00 N ATOM 713 NH2 ARG A 164 7.545 -1.992 -12.230 1.00 0.00 N ATOM 0 H ARG A 164 9.539 -0.841 -6.126 1.00 0.00 H new ATOM 0 HA ARG A 164 11.640 -2.888 -6.173 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.388 -0.794 -8.270 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.039 -2.418 -8.366 1.00 0.00 H new ATOM 0 HG2 ARG A 164 10.161 -2.809 -9.548 1.00 0.00 H new ATOM 0 HG3 ARG A 164 9.451 -3.044 -7.963 1.00 0.00 H new ATOM 0 HD2 ARG A 164 8.094 -1.244 -8.198 1.00 0.00 H new ATOM 0 HD3 ARG A 164 9.426 -0.209 -8.673 1.00 0.00 H new ATOM 0 HE ARG A 164 8.521 -0.260 -10.765 1.00 0.00 H new ATOM 0 HH11 ARG A 164 7.843 -3.495 -9.424 1.00 0.00 H new ATOM 0 HH12 ARG A 164 7.183 -4.070 -10.959 1.00 0.00 H new ATOM 0 HH21 ARG A 164 7.723 -1.101 -12.694 1.00 0.00 H new ATOM 0 HH22 ARG A 164 7.118 -2.760 -12.747 1.00 0.00 H new ATOM 727 N PRO A 165 13.647 -0.952 -6.184 1.00 0.00 N ATOM 728 CA PRO A 165 14.607 0.047 -5.736 1.00 0.00 C ATOM 729 C PRO A 165 14.434 1.366 -6.503 1.00 0.00 C ATOM 730 O PRO A 165 13.555 1.522 -7.359 1.00 0.00 O ATOM 731 CB PRO A 165 16.005 -0.565 -5.924 1.00 0.00 C ATOM 732 CG PRO A 165 15.796 -1.931 -6.569 1.00 0.00 C ATOM 733 CD PRO A 165 14.311 -2.015 -6.917 1.00 0.00 C ATOM 0 HA PRO A 165 14.452 0.301 -4.687 1.00 0.00 H new ATOM 0 HB2 PRO A 165 16.625 0.071 -6.555 1.00 0.00 H new ATOM 0 HB3 PRO A 165 16.518 -0.662 -4.967 1.00 0.00 H new ATOM 0 HG2 PRO A 165 16.412 -2.038 -7.462 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.082 -2.732 -5.887 1.00 0.00 H new ATOM 0 HD2 PRO A 165 14.158 -1.898 -7.990 1.00 0.00 H new ATOM 0 HD3 PRO A 165 13.904 -2.988 -6.641 1.00 0.00 H new ATOM 741 N CYS A 166 15.358 2.302 -6.263 1.00 0.00 N ATOM 742 CA CYS A 166 15.483 3.516 -7.071 1.00 0.00 C ATOM 743 C CYS A 166 15.889 3.161 -8.516 1.00 0.00 C ATOM 744 O CYS A 166 15.891 4.021 -9.397 1.00 0.00 O ATOM 745 CB CYS A 166 16.459 4.519 -6.434 1.00 0.00 C ATOM 746 SG CYS A 166 16.240 4.967 -4.681 1.00 0.00 S ATOM 0 H CYS A 166 16.038 2.238 -5.505 1.00 0.00 H new ATOM 0 HA CYS A 166 14.509 4.004 -7.106 1.00 0.00 H new ATOM 0 HB2 CYS A 166 17.466 4.117 -6.548 1.00 0.00 H new ATOM 0 HB3 CYS A 166 16.414 5.439 -7.017 1.00 0.00 H new ATOM 751 N ASP A 167 16.216 1.898 -8.792 1.00 0.00 N ATOM 752 CA ASP A 167 16.167 1.264 -10.105 1.00 0.00 C ATOM 753 C ASP A 167 14.699 1.003 -10.452 1.00 0.00 C ATOM 754 O ASP A 167 14.233 -0.133 -10.518 1.00 0.00 O ATOM 755 CB ASP A 167 17.053 0.007 -10.146 1.00 0.00 C ATOM 756 CG ASP A 167 18.486 0.397 -10.498 1.00 0.00 C ATOM 757 OD1 ASP A 167 19.129 1.104 -9.685 1.00 0.00 O ATOM 758 OD2 ASP A 167 18.924 0.102 -11.633 1.00 0.00 O ATOM 0 H ASP A 167 16.539 1.258 -8.066 1.00 0.00 H new ATOM 0 HA ASP A 167 16.581 1.919 -10.871 1.00 0.00 H new ATOM 0 HB2 ASP A 167 17.030 -0.497 -9.180 1.00 0.00 H new ATOM 0 HB3 ASP A 167 16.667 -0.698 -10.882 1.00 0.00 H new ATOM 763 N GLU A 168 13.964 2.096 -10.630 1.00 0.00 N ATOM 764 CA GLU A 168 12.645 2.166 -11.243 1.00 0.00 C ATOM 765 C GLU A 168 12.747 1.881 -12.740 1.00 0.00 C ATOM 766 O GLU A 168 12.357 0.799 -13.196 1.00 0.00 O ATOM 767 CB GLU A 168 11.944 3.524 -10.991 1.00 0.00 C ATOM 768 CG GLU A 168 12.906 4.723 -10.884 1.00 0.00 C ATOM 769 CD GLU A 168 12.536 5.930 -11.745 1.00 0.00 C ATOM 770 OE1 GLU A 168 12.953 5.977 -12.922 1.00 0.00 O ATOM 771 OE2 GLU A 168 11.970 6.914 -11.214 1.00 0.00 O ATOM 0 H GLU A 168 14.296 3.013 -10.331 1.00 0.00 H new ATOM 0 HA GLU A 168 12.027 1.402 -10.771 1.00 0.00 H new ATOM 0 HB2 GLU A 168 11.238 3.711 -11.800 1.00 0.00 H new ATOM 0 HB3 GLU A 168 11.364 3.455 -10.071 1.00 0.00 H new ATOM 0 HG2 GLU A 168 12.952 5.040 -9.842 1.00 0.00 H new ATOM 0 HG3 GLU A 168 13.907 4.392 -11.161 1.00 0.00 H new ATOM 778 N TYR A 169 13.260 2.883 -13.465 1.00 0.00 N ATOM 779 CA TYR A 169 13.074 3.161 -14.879 1.00 0.00 C ATOM 780 C TYR A 169 11.645 3.534 -15.243 1.00 0.00 C ATOM 781 O TYR A 169 10.718 3.358 -14.461 1.00 0.00 O ATOM 782 CB TYR A 169 13.552 2.005 -15.762 1.00 0.00 C ATOM 783 CG TYR A 169 14.884 2.272 -16.439 1.00 0.00 C ATOM 784 CD1 TYR A 169 15.919 2.916 -15.730 1.00 0.00 C ATOM 785 CD2 TYR A 169 15.105 1.858 -17.765 1.00 0.00 C ATOM 786 CE1 TYR A 169 17.157 3.170 -16.342 1.00 0.00 C ATOM 787 CE2 TYR A 169 16.343 2.099 -18.383 1.00 0.00 C ATOM 788 CZ TYR A 169 17.377 2.749 -17.668 1.00 0.00 C ATOM 789 OH TYR A 169 18.596 2.942 -18.233 1.00 0.00 O ATOM 0 H TYR A 169 13.869 3.577 -13.030 1.00 0.00 H new ATOM 0 HA TYR A 169 13.696 4.034 -15.075 1.00 0.00 H new ATOM 0 HB2 TYR A 169 13.636 1.104 -15.154 1.00 0.00 H new ATOM 0 HB3 TYR A 169 12.799 1.805 -16.525 1.00 0.00 H new ATOM 0 HD1 TYR A 169 15.758 3.217 -14.705 1.00 0.00 H new ATOM 0 HD2 TYR A 169 14.321 1.353 -18.309 1.00 0.00 H new ATOM 0 HE1 TYR A 169 17.936 3.685 -15.799 1.00 0.00 H new ATOM 0 HE2 TYR A 169 16.506 1.788 -19.404 1.00 0.00 H new ATOM 0 HH TYR A 169 18.590 2.597 -19.150 1.00 0.00 H new ATOM 799 N SER A 170 11.487 3.967 -16.498 1.00 0.00 N ATOM 800 CA SER A 170 10.249 4.204 -17.204 1.00 0.00 C ATOM 801 C SER A 170 9.532 5.373 -16.544 1.00 0.00 C ATOM 802 O SER A 170 9.604 6.491 -17.056 1.00 0.00 O ATOM 803 CB SER A 170 9.441 2.897 -17.312 1.00 0.00 C ATOM 804 OG SER A 170 8.475 2.918 -18.355 1.00 0.00 O ATOM 0 H SER A 170 12.296 4.174 -17.084 1.00 0.00 H new ATOM 0 HA SER A 170 10.418 4.501 -18.239 1.00 0.00 H new ATOM 0 HB2 SER A 170 10.127 2.066 -17.478 1.00 0.00 H new ATOM 0 HB3 SER A 170 8.938 2.710 -16.364 1.00 0.00 H new ATOM 0 HG SER A 170 7.997 2.063 -18.375 1.00 0.00 H new ATOM 810 N ASN A 171 8.855 5.105 -15.434 1.00 0.00 N ATOM 811 CA ASN A 171 8.091 6.079 -14.635 1.00 0.00 C ATOM 812 C ASN A 171 7.407 5.400 -13.443 1.00 0.00 C ATOM 813 O ASN A 171 7.250 4.183 -13.429 1.00 0.00 O ATOM 814 CB ASN A 171 7.028 6.828 -15.481 1.00 0.00 C ATOM 815 CG ASN A 171 7.250 8.335 -15.478 1.00 0.00 C ATOM 816 OD1 ASN A 171 6.335 9.113 -15.215 1.00 0.00 O ATOM 817 ND2 ASN A 171 8.463 8.769 -15.777 1.00 0.00 N ATOM 0 H ASN A 171 8.816 4.164 -15.042 1.00 0.00 H new ATOM 0 HA ASN A 171 8.812 6.810 -14.270 1.00 0.00 H new ATOM 0 HB2 ASN A 171 7.057 6.460 -16.507 1.00 0.00 H new ATOM 0 HB3 ASN A 171 6.034 6.608 -15.091 1.00 0.00 H new ATOM 0 HD21 ASN A 171 8.657 9.770 -15.793 1.00 0.00 H new ATOM 0 HD22 ASN A 171 9.205 8.102 -15.991 1.00 0.00 H new ATOM 824 N GLN A 172 6.921 6.177 -12.473 1.00 0.00 N ATOM 825 CA GLN A 172 6.489 5.710 -11.153 1.00 0.00 C ATOM 826 C GLN A 172 4.968 5.551 -11.015 1.00 0.00 C ATOM 827 O GLN A 172 4.519 4.673 -10.284 1.00 0.00 O ATOM 828 CB GLN A 172 7.050 6.721 -10.143 1.00 0.00 C ATOM 829 CG GLN A 172 6.623 6.539 -8.684 1.00 0.00 C ATOM 830 CD GLN A 172 5.710 7.671 -8.215 1.00 0.00 C ATOM 831 OE1 GLN A 172 6.161 8.650 -7.630 1.00 0.00 O ATOM 832 NE2 GLN A 172 4.425 7.589 -8.510 1.00 0.00 N ATOM 0 H GLN A 172 6.813 7.185 -12.589 1.00 0.00 H new ATOM 0 HA GLN A 172 6.869 4.704 -10.977 1.00 0.00 H new ATOM 0 HB2 GLN A 172 8.138 6.679 -10.188 1.00 0.00 H new ATOM 0 HB3 GLN A 172 6.756 7.721 -10.462 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.107 5.586 -8.573 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.508 6.499 -8.049 1.00 0.00 H new ATOM 0 HE21 GLN A 172 4.065 6.768 -8.997 1.00 0.00 H new ATOM 0 HE22 GLN A 172 3.793 8.346 -8.251 1.00 0.00 H new ATOM 841 N ASN A 173 4.143 6.403 -11.620 1.00 0.00 N ATOM 842 CA ASN A 173 2.687 6.391 -11.356 1.00 0.00 C ATOM 843 C ASN A 173 1.998 5.045 -11.631 1.00 0.00 C ATOM 844 O ASN A 173 1.150 4.597 -10.857 1.00 0.00 O ATOM 845 CB ASN A 173 1.967 7.479 -12.151 1.00 0.00 C ATOM 846 CG ASN A 173 0.617 7.778 -11.507 1.00 0.00 C ATOM 847 OD1 ASN A 173 0.561 8.209 -10.362 1.00 0.00 O ATOM 848 ND2 ASN A 173 -0.484 7.563 -12.200 1.00 0.00 N ATOM 0 H ASN A 173 4.444 7.108 -12.292 1.00 0.00 H new ATOM 0 HA ASN A 173 2.609 6.581 -10.286 1.00 0.00 H new ATOM 0 HB2 ASN A 173 2.575 8.383 -12.181 1.00 0.00 H new ATOM 0 HB3 ASN A 173 1.825 7.156 -13.182 1.00 0.00 H new ATOM 0 HD21 ASN A 173 -1.395 7.756 -11.783 1.00 0.00 H new ATOM 0 HD22 ASN A 173 -0.425 7.204 -13.153 1.00 0.00 H new ATOM 855 N ASN A 174 2.331 4.387 -12.743 1.00 0.00 N ATOM 856 CA ASN A 174 1.790 3.058 -13.055 1.00 0.00 C ATOM 857 C ASN A 174 2.467 1.963 -12.230 1.00 0.00 C ATOM 858 O ASN A 174 1.827 0.959 -11.920 1.00 0.00 O ATOM 859 CB ASN A 174 1.862 2.732 -14.560 1.00 0.00 C ATOM 860 CG ASN A 174 0.465 2.638 -15.148 1.00 0.00 C ATOM 861 OD1 ASN A 174 0.035 3.543 -15.862 1.00 0.00 O ATOM 862 ND2 ASN A 174 -0.284 1.600 -14.830 1.00 0.00 N ATOM 0 H ASN A 174 2.974 4.752 -13.446 1.00 0.00 H new ATOM 0 HA ASN A 174 0.736 3.086 -12.779 1.00 0.00 H new ATOM 0 HB2 ASN A 174 2.431 3.503 -15.079 1.00 0.00 H new ATOM 0 HB3 ASN A 174 2.391 1.791 -14.710 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -1.241 1.536 -15.178 1.00 0.00 H new ATOM 0 HD22 ASN A 174 0.094 0.861 -14.237 1.00 0.00 H new ATOM 869 N PHE A 175 3.736 2.135 -11.853 1.00 0.00 N ATOM 870 CA PHE A 175 4.450 1.243 -10.940 1.00 0.00 C ATOM 871 C PHE A 175 3.725 1.187 -9.607 1.00 0.00 C ATOM 872 O PHE A 175 3.468 0.101 -9.106 1.00 0.00 O ATOM 873 CB PHE A 175 5.892 1.727 -10.733 1.00 0.00 C ATOM 874 CG PHE A 175 6.885 1.414 -11.824 1.00 0.00 C ATOM 875 CD1 PHE A 175 6.504 0.852 -13.060 1.00 0.00 C ATOM 876 CD2 PHE A 175 8.233 1.718 -11.583 1.00 0.00 C ATOM 877 CE1 PHE A 175 7.469 0.593 -14.045 1.00 0.00 C ATOM 878 CE2 PHE A 175 9.186 1.458 -12.572 1.00 0.00 C ATOM 879 CZ PHE A 175 8.814 0.908 -13.806 1.00 0.00 C ATOM 0 H PHE A 175 4.306 2.914 -12.181 1.00 0.00 H new ATOM 0 HA PHE A 175 4.480 0.245 -11.377 1.00 0.00 H new ATOM 0 HB2 PHE A 175 5.870 2.808 -10.596 1.00 0.00 H new ATOM 0 HB3 PHE A 175 6.263 1.296 -9.804 1.00 0.00 H new ATOM 0 HD1 PHE A 175 5.466 0.620 -13.249 1.00 0.00 H new ATOM 0 HD2 PHE A 175 8.533 2.150 -10.640 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.176 0.152 -14.986 1.00 0.00 H new ATOM 0 HE2 PHE A 175 10.225 1.684 -12.382 1.00 0.00 H new ATOM 0 HZ PHE A 175 9.558 0.728 -14.568 1.00 0.00 H new ATOM 889 N VAL A 176 3.351 2.343 -9.066 1.00 0.00 N ATOM 890 CA VAL A 176 2.547 2.477 -7.863 1.00 0.00 C ATOM 891 C VAL A 176 1.260 1.653 -7.991 1.00 0.00 C ATOM 892 O VAL A 176 0.884 0.999 -7.025 1.00 0.00 O ATOM 893 CB VAL A 176 2.352 3.985 -7.612 1.00 0.00 C ATOM 894 CG1 VAL A 176 1.190 4.341 -6.683 1.00 0.00 C ATOM 895 CG2 VAL A 176 3.666 4.554 -7.050 1.00 0.00 C ATOM 0 H VAL A 176 3.611 3.243 -9.471 1.00 0.00 H new ATOM 0 HA VAL A 176 3.034 2.065 -6.979 1.00 0.00 H new ATOM 0 HB VAL A 176 2.090 4.430 -8.572 1.00 0.00 H new ATOM 0 HG11 VAL A 176 1.134 5.424 -6.568 1.00 0.00 H new ATOM 0 HG12 VAL A 176 0.257 3.973 -7.110 1.00 0.00 H new ATOM 0 HG13 VAL A 176 1.350 3.881 -5.708 1.00 0.00 H new ATOM 0 HG21 VAL A 176 3.550 5.622 -6.865 1.00 0.00 H new ATOM 0 HG22 VAL A 176 3.912 4.048 -6.116 1.00 0.00 H new ATOM 0 HG23 VAL A 176 4.469 4.396 -7.770 1.00 0.00 H new ATOM 905 N HIS A 177 0.600 1.619 -9.152 1.00 0.00 N ATOM 906 CA HIS A 177 -0.642 0.863 -9.307 1.00 0.00 C ATOM 907 C HIS A 177 -0.415 -0.652 -9.343 1.00 0.00 C ATOM 908 O HIS A 177 -1.218 -1.406 -8.787 1.00 0.00 O ATOM 909 CB HIS A 177 -1.380 1.344 -10.565 1.00 0.00 C ATOM 910 CG HIS A 177 -2.863 1.587 -10.401 1.00 0.00 C ATOM 911 ND1 HIS A 177 -3.751 1.728 -11.442 1.00 0.00 N ATOM 912 CD2 HIS A 177 -3.556 1.811 -9.238 1.00 0.00 C ATOM 913 CE1 HIS A 177 -4.951 2.037 -10.924 1.00 0.00 C ATOM 914 NE2 HIS A 177 -4.874 2.118 -9.583 1.00 0.00 N ATOM 0 H HIS A 177 0.905 2.105 -9.995 1.00 0.00 H new ATOM 0 HA HIS A 177 -1.259 1.052 -8.428 1.00 0.00 H new ATOM 0 HB2 HIS A 177 -0.914 2.269 -10.906 1.00 0.00 H new ATOM 0 HB3 HIS A 177 -1.236 0.605 -11.353 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -3.155 1.759 -8.237 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -5.850 2.198 -11.501 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -5.631 2.357 -8.943 1.00 0.00 H new ATOM 922 N ASP A 178 0.676 -1.096 -9.971 1.00 0.00 N ATOM 923 CA ASP A 178 1.085 -2.503 -9.992 1.00 0.00 C ATOM 924 C ASP A 178 1.459 -2.949 -8.577 1.00 0.00 C ATOM 925 O ASP A 178 0.981 -3.970 -8.092 1.00 0.00 O ATOM 926 CB ASP A 178 2.254 -2.677 -10.972 1.00 0.00 C ATOM 927 CG ASP A 178 2.769 -4.113 -11.038 1.00 0.00 C ATOM 928 OD1 ASP A 178 2.035 -5.006 -11.514 1.00 0.00 O ATOM 929 OD2 ASP A 178 3.959 -4.334 -10.716 1.00 0.00 O ATOM 0 H ASP A 178 1.308 -0.482 -10.485 1.00 0.00 H new ATOM 0 HA ASP A 178 0.262 -3.132 -10.333 1.00 0.00 H new ATOM 0 HB2 ASP A 178 1.936 -2.365 -11.967 1.00 0.00 H new ATOM 0 HB3 ASP A 178 3.070 -2.018 -10.676 1.00 0.00 H new ATOM 934 N CYS A 179 2.259 -2.136 -7.892 1.00 0.00 N ATOM 935 CA CYS A 179 2.654 -2.258 -6.498 1.00 0.00 C ATOM 936 C CYS A 179 1.429 -2.350 -5.587 1.00 0.00 C ATOM 937 O CYS A 179 1.422 -3.187 -4.680 1.00 0.00 O ATOM 938 CB CYS A 179 3.501 -1.018 -6.175 1.00 0.00 C ATOM 939 SG CYS A 179 3.797 -0.568 -4.448 1.00 0.00 S ATOM 0 H CYS A 179 2.677 -1.316 -8.332 1.00 0.00 H new ATOM 0 HA CYS A 179 3.226 -3.170 -6.330 1.00 0.00 H new ATOM 0 HB2 CYS A 179 4.473 -1.154 -6.649 1.00 0.00 H new ATOM 0 HB3 CYS A 179 3.027 -0.164 -6.659 1.00 0.00 H new ATOM 944 N VAL A 180 0.398 -1.527 -5.820 1.00 0.00 N ATOM 945 CA VAL A 180 -0.875 -1.626 -5.120 1.00 0.00 C ATOM 946 C VAL A 180 -1.443 -3.015 -5.330 1.00 0.00 C ATOM 947 O VAL A 180 -1.654 -3.707 -4.341 1.00 0.00 O ATOM 948 CB VAL A 180 -1.870 -0.527 -5.549 1.00 0.00 C ATOM 949 CG1 VAL A 180 -3.285 -0.816 -5.029 1.00 0.00 C ATOM 950 CG2 VAL A 180 -1.466 0.844 -5.010 1.00 0.00 C ATOM 0 H VAL A 180 0.431 -0.772 -6.505 1.00 0.00 H new ATOM 0 HA VAL A 180 -0.703 -1.464 -4.056 1.00 0.00 H new ATOM 0 HB VAL A 180 -1.856 -0.524 -6.639 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -3.960 -0.022 -5.350 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -3.631 -1.770 -5.428 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -3.270 -0.862 -3.940 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -2.191 1.590 -5.334 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -1.439 0.813 -3.921 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.479 1.108 -5.390 1.00 0.00 H new ATOM 960 N ASN A 181 -1.711 -3.404 -6.583 1.00 0.00 N ATOM 961 CA ASN A 181 -2.383 -4.660 -6.913 1.00 0.00 C ATOM 962 C ASN A 181 -1.716 -5.799 -6.166 1.00 0.00 C ATOM 963 O ASN A 181 -2.360 -6.523 -5.422 1.00 0.00 O ATOM 964 CB ASN A 181 -2.309 -4.906 -8.422 1.00 0.00 C ATOM 965 CG ASN A 181 -2.919 -6.235 -8.853 1.00 0.00 C ATOM 966 OD1 ASN A 181 -3.788 -6.817 -8.212 1.00 0.00 O ATOM 967 ND2 ASN A 181 -2.469 -6.759 -9.975 1.00 0.00 N ATOM 0 H ASN A 181 -1.464 -2.848 -7.402 1.00 0.00 H new ATOM 0 HA ASN A 181 -3.430 -4.602 -6.617 1.00 0.00 H new ATOM 0 HB2 ASN A 181 -2.822 -4.095 -8.940 1.00 0.00 H new ATOM 0 HB3 ASN A 181 -1.266 -4.875 -8.736 1.00 0.00 H new ATOM 0 HD21 ASN A 181 -2.843 -7.647 -10.309 1.00 0.00 H new ATOM 0 HD22 ASN A 181 -1.746 -6.277 -10.509 1.00 0.00 H new ATOM 974 N ILE A 182 -0.399 -5.878 -6.303 1.00 0.00 N ATOM 975 CA ILE A 182 0.476 -6.815 -5.619 1.00 0.00 C ATOM 976 C ILE A 182 0.286 -6.791 -4.102 1.00 0.00 C ATOM 977 O ILE A 182 -0.025 -7.826 -3.519 1.00 0.00 O ATOM 978 CB ILE A 182 1.920 -6.502 -6.063 1.00 0.00 C ATOM 979 CG1 ILE A 182 2.111 -6.879 -7.541 1.00 0.00 C ATOM 980 CG2 ILE A 182 3.013 -7.125 -5.189 1.00 0.00 C ATOM 981 CD1 ILE A 182 2.133 -8.381 -7.829 1.00 0.00 C ATOM 0 H ILE A 182 0.113 -5.256 -6.928 1.00 0.00 H new ATOM 0 HA ILE A 182 0.227 -7.839 -5.896 1.00 0.00 H new ATOM 0 HB ILE A 182 2.044 -5.427 -5.933 1.00 0.00 H new ATOM 0 HG12 ILE A 182 1.309 -6.425 -8.122 1.00 0.00 H new ATOM 0 HG13 ILE A 182 3.046 -6.443 -7.893 1.00 0.00 H new ATOM 0 HG21 ILE A 182 3.993 -6.849 -5.580 1.00 0.00 H new ATOM 0 HG22 ILE A 182 2.914 -6.760 -4.167 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.911 -8.210 -5.198 1.00 0.00 H new ATOM 0 HD11 ILE A 182 2.272 -8.545 -8.898 1.00 0.00 H new ATOM 0 HD12 ILE A 182 2.953 -8.845 -7.281 1.00 0.00 H new ATOM 0 HD13 ILE A 182 1.189 -8.826 -7.514 1.00 0.00 H new ATOM 993 N THR A 183 0.511 -5.655 -3.456 1.00 0.00 N ATOM 994 CA THR A 183 0.460 -5.524 -1.997 1.00 0.00 C ATOM 995 C THR A 183 -0.943 -5.830 -1.443 1.00 0.00 C ATOM 996 O THR A 183 -1.097 -6.485 -0.407 1.00 0.00 O ATOM 997 CB THR A 183 0.984 -4.122 -1.634 1.00 0.00 C ATOM 998 OG1 THR A 183 2.295 -3.945 -2.140 1.00 0.00 O ATOM 999 CG2 THR A 183 1.019 -3.839 -0.132 1.00 0.00 C ATOM 0 H THR A 183 0.738 -4.783 -3.933 1.00 0.00 H new ATOM 0 HA THR A 183 1.100 -6.266 -1.520 1.00 0.00 H new ATOM 0 HB THR A 183 0.278 -3.425 -2.086 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.249 -3.662 -3.077 1.00 0.00 H new ATOM 0 HG21 THR A 183 1.400 -2.832 0.040 1.00 0.00 H new ATOM 0 HG22 THR A 183 0.012 -3.921 0.277 1.00 0.00 H new ATOM 0 HG23 THR A 183 1.670 -4.562 0.359 1.00 0.00 H new ATOM 1007 N ILE A 184 -1.982 -5.410 -2.156 1.00 0.00 N ATOM 1008 CA ILE A 184 -3.386 -5.649 -1.857 1.00 0.00 C ATOM 1009 C ILE A 184 -3.590 -7.146 -1.973 1.00 0.00 C ATOM 1010 O ILE A 184 -3.994 -7.774 -0.998 1.00 0.00 O ATOM 1011 CB ILE A 184 -4.271 -4.797 -2.796 1.00 0.00 C ATOM 1012 CG1 ILE A 184 -4.207 -3.390 -2.185 1.00 0.00 C ATOM 1013 CG2 ILE A 184 -5.697 -5.370 -2.931 1.00 0.00 C ATOM 1014 CD1 ILE A 184 -5.160 -2.418 -2.836 1.00 0.00 C ATOM 0 H ILE A 184 -1.858 -4.862 -3.007 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.677 -5.341 -0.853 1.00 0.00 H new ATOM 0 HB ILE A 184 -3.922 -4.790 -3.829 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.432 -3.452 -1.120 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -3.190 -3.008 -2.274 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -6.281 -4.738 -3.600 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -5.646 -6.380 -3.338 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -6.172 -5.397 -1.951 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -5.066 -1.442 -2.359 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -4.921 -2.329 -3.896 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -6.182 -2.780 -2.724 1.00 0.00 H new ATOM 1026 N LYS A 185 -3.279 -7.746 -3.123 1.00 0.00 N ATOM 1027 CA LYS A 185 -3.409 -9.166 -3.343 1.00 0.00 C ATOM 1028 C LYS A 185 -2.688 -9.957 -2.275 1.00 0.00 C ATOM 1029 O LYS A 185 -3.297 -10.858 -1.720 1.00 0.00 O ATOM 1030 CB LYS A 185 -2.918 -9.548 -4.742 1.00 0.00 C ATOM 1031 CG LYS A 185 -3.622 -10.831 -5.154 1.00 0.00 C ATOM 1032 CD LYS A 185 -3.412 -11.168 -6.629 1.00 0.00 C ATOM 1033 CE LYS A 185 -2.571 -12.430 -6.821 1.00 0.00 C ATOM 1034 NZ LYS A 185 -2.983 -13.148 -8.044 1.00 0.00 N ATOM 0 H LYS A 185 -2.925 -7.240 -3.935 1.00 0.00 H new ATOM 0 HA LYS A 185 -4.467 -9.418 -3.278 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -3.134 -8.750 -5.452 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -1.837 -9.690 -4.741 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -3.256 -11.655 -4.541 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -4.689 -10.735 -4.955 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -4.381 -11.303 -7.110 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -2.924 -10.329 -7.125 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -1.516 -12.164 -6.887 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -2.682 -13.083 -5.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -2.401 -14.002 -8.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -3.984 -13.419 -7.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -2.855 -12.529 -8.870 1.00 0.00 H new ATOM 1048 N GLN A 186 -1.441 -9.638 -1.929 1.00 0.00 N ATOM 1049 CA GLN A 186 -0.720 -10.439 -0.951 1.00 0.00 C ATOM 1050 C GLN A 186 -1.446 -10.446 0.387 1.00 0.00 C ATOM 1051 O GLN A 186 -1.596 -11.511 0.989 1.00 0.00 O ATOM 1052 CB GLN A 186 0.722 -9.938 -0.784 1.00 0.00 C ATOM 1053 CG GLN A 186 1.694 -11.046 -1.180 1.00 0.00 C ATOM 1054 CD GLN A 186 1.665 -12.254 -0.237 1.00 0.00 C ATOM 1055 OE1 GLN A 186 1.431 -13.391 -0.645 1.00 0.00 O ATOM 1056 NE2 GLN A 186 1.912 -12.059 1.045 1.00 0.00 N ATOM 0 H GLN A 186 -0.921 -8.846 -2.305 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.681 -11.463 -1.322 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.886 -9.057 -1.404 1.00 0.00 H new ATOM 0 HB3 GLN A 186 0.897 -9.638 0.249 1.00 0.00 H new ATOM 0 HG2 GLN A 186 1.460 -11.379 -2.191 1.00 0.00 H new ATOM 0 HG3 GLN A 186 2.705 -10.639 -1.205 1.00 0.00 H new ATOM 0 HE21 GLN A 186 2.107 -11.119 1.390 1.00 0.00 H new ATOM 0 HE22 GLN A 186 1.908 -12.848 1.691 1.00 0.00 H new ATOM 1065 N HIS A 187 -1.912 -9.282 0.848 1.00 0.00 N ATOM 1066 CA HIS A 187 -2.684 -9.208 2.079 1.00 0.00 C ATOM 1067 C HIS A 187 -4.006 -9.955 1.893 1.00 0.00 C ATOM 1068 O HIS A 187 -4.214 -10.923 2.606 1.00 0.00 O ATOM 1069 CB HIS A 187 -2.834 -7.754 2.530 1.00 0.00 C ATOM 1070 CG HIS A 187 -2.748 -7.511 4.021 1.00 0.00 C ATOM 1071 ND1 HIS A 187 -3.385 -6.490 4.689 1.00 0.00 N ATOM 1072 CD2 HIS A 187 -1.856 -8.074 4.899 1.00 0.00 C ATOM 1073 CE1 HIS A 187 -2.910 -6.447 5.944 1.00 0.00 C ATOM 1074 NE2 HIS A 187 -1.958 -7.381 6.111 1.00 0.00 N ATOM 0 H HIS A 187 -1.766 -8.385 0.385 1.00 0.00 H new ATOM 0 HA HIS A 187 -2.161 -9.707 2.895 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -2.062 -7.161 2.040 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -3.795 -7.382 2.176 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -1.195 -8.902 4.692 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -3.244 -5.761 6.709 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -1.415 -7.552 6.957 1.00 0.00 H new ATOM 1082 N THR A 188 -4.811 -9.639 0.876 1.00 0.00 N ATOM 1083 CA THR A 188 -6.037 -10.327 0.472 1.00 0.00 C ATOM 1084 C THR A 188 -5.881 -11.850 0.514 1.00 0.00 C ATOM 1085 O THR A 188 -6.736 -12.548 1.041 1.00 0.00 O ATOM 1086 CB THR A 188 -6.441 -9.841 -0.937 1.00 0.00 C ATOM 1087 OG1 THR A 188 -6.591 -8.431 -0.986 1.00 0.00 O ATOM 1088 CG2 THR A 188 -7.758 -10.436 -1.416 1.00 0.00 C ATOM 0 H THR A 188 -4.609 -8.842 0.273 1.00 0.00 H new ATOM 0 HA THR A 188 -6.828 -10.083 1.182 1.00 0.00 H new ATOM 0 HB THR A 188 -5.628 -10.172 -1.583 1.00 0.00 H new ATOM 0 HG1 THR A 188 -5.707 -8.009 -1.012 1.00 0.00 H new ATOM 0 HG21 THR A 188 -7.988 -10.057 -2.412 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.675 -11.522 -1.452 1.00 0.00 H new ATOM 0 HG23 THR A 188 -8.556 -10.156 -0.728 1.00 0.00 H new ATOM 1096 N VAL A 189 -4.790 -12.393 -0.011 1.00 0.00 N ATOM 1097 CA VAL A 189 -4.536 -13.816 -0.133 1.00 0.00 C ATOM 1098 C VAL A 189 -4.282 -14.378 1.268 1.00 0.00 C ATOM 1099 O VAL A 189 -4.831 -15.420 1.636 1.00 0.00 O ATOM 1100 CB VAL A 189 -3.343 -13.957 -1.106 1.00 0.00 C ATOM 1101 CG1 VAL A 189 -2.606 -15.286 -1.017 1.00 0.00 C ATOM 1102 CG2 VAL A 189 -3.794 -13.750 -2.561 1.00 0.00 C ATOM 0 H VAL A 189 -4.027 -11.825 -0.379 1.00 0.00 H new ATOM 0 HA VAL A 189 -5.371 -14.388 -0.538 1.00 0.00 H new ATOM 0 HB VAL A 189 -2.645 -13.180 -0.795 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -1.786 -15.296 -1.735 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -2.209 -15.415 -0.010 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -3.295 -16.100 -1.243 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -2.937 -13.854 -3.226 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -4.546 -14.496 -2.819 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -4.220 -12.753 -2.672 1.00 0.00 H new ATOM 1112 N THR A 190 -3.499 -13.661 2.069 1.00 0.00 N ATOM 1113 CA THR A 190 -3.162 -14.011 3.427 1.00 0.00 C ATOM 1114 C THR A 190 -4.431 -13.957 4.301 1.00 0.00 C ATOM 1115 O THR A 190 -4.617 -14.792 5.187 1.00 0.00 O ATOM 1116 CB THR A 190 -2.061 -13.017 3.841 1.00 0.00 C ATOM 1117 OG1 THR A 190 -0.910 -13.116 3.018 1.00 0.00 O ATOM 1118 CG2 THR A 190 -1.616 -13.192 5.273 1.00 0.00 C ATOM 0 H THR A 190 -3.069 -12.786 1.768 1.00 0.00 H new ATOM 0 HA THR A 190 -2.786 -15.027 3.544 1.00 0.00 H new ATOM 0 HB THR A 190 -2.523 -12.037 3.724 1.00 0.00 H new ATOM 0 HG1 THR A 190 -1.075 -12.655 2.169 1.00 0.00 H new ATOM 0 HG21 THR A 190 -0.839 -12.463 5.504 1.00 0.00 H new ATOM 0 HG22 THR A 190 -2.465 -13.041 5.939 1.00 0.00 H new ATOM 0 HG23 THR A 190 -1.221 -14.199 5.411 1.00 0.00 H new ATOM 1126 N THR A 191 -5.338 -13.015 4.047 1.00 0.00 N ATOM 1127 CA THR A 191 -6.522 -12.766 4.863 1.00 0.00 C ATOM 1128 C THR A 191 -7.705 -13.630 4.417 1.00 0.00 C ATOM 1129 O THR A 191 -8.493 -14.057 5.252 1.00 0.00 O ATOM 1130 CB THR A 191 -6.818 -11.258 4.856 1.00 0.00 C ATOM 1131 OG1 THR A 191 -6.973 -10.785 3.538 1.00 0.00 O ATOM 1132 CG2 THR A 191 -5.684 -10.481 5.534 1.00 0.00 C ATOM 0 H THR A 191 -5.266 -12.388 3.246 1.00 0.00 H new ATOM 0 HA THR A 191 -6.336 -13.063 5.895 1.00 0.00 H new ATOM 0 HB THR A 191 -7.745 -11.102 5.407 1.00 0.00 H new ATOM 0 HG1 THR A 191 -7.349 -9.880 3.557 1.00 0.00 H new ATOM 0 HG21 THR A 191 -5.913 -9.415 5.518 1.00 0.00 H new ATOM 0 HG22 THR A 191 -5.581 -10.815 6.566 1.00 0.00 H new ATOM 0 HG23 THR A 191 -4.751 -10.659 5.000 1.00 0.00 H new ATOM 1140 N THR A 192 -7.780 -14.015 3.144 1.00 0.00 N ATOM 1141 CA THR A 192 -8.661 -15.040 2.617 1.00 0.00 C ATOM 1142 C THR A 192 -8.437 -16.352 3.375 1.00 0.00 C ATOM 1143 O THR A 192 -9.398 -17.029 3.730 1.00 0.00 O ATOM 1144 CB THR A 192 -8.365 -15.155 1.114 1.00 0.00 C ATOM 1145 OG1 THR A 192 -8.832 -14.014 0.433 1.00 0.00 O ATOM 1146 CG2 THR A 192 -8.998 -16.364 0.454 1.00 0.00 C ATOM 0 H THR A 192 -7.196 -13.595 2.421 1.00 0.00 H new ATOM 0 HA THR A 192 -9.713 -14.790 2.751 1.00 0.00 H new ATOM 0 HB THR A 192 -7.282 -15.256 1.046 1.00 0.00 H new ATOM 0 HG1 THR A 192 -8.112 -13.351 0.373 1.00 0.00 H new ATOM 0 HG21 THR A 192 -8.743 -16.375 -0.606 1.00 0.00 H new ATOM 0 HG22 THR A 192 -8.626 -17.273 0.926 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.081 -16.314 0.566 1.00 0.00 H new ATOM 1154 N THR A 193 -7.191 -16.686 3.721 1.00 0.00 N ATOM 1155 CA THR A 193 -6.900 -17.814 4.597 1.00 0.00 C ATOM 1156 C THR A 193 -7.662 -17.659 5.928 1.00 0.00 C ATOM 1157 O THR A 193 -8.243 -18.612 6.441 1.00 0.00 O ATOM 1158 CB THR A 193 -5.364 -17.956 4.710 1.00 0.00 C ATOM 1159 OG1 THR A 193 -4.964 -19.074 3.948 1.00 0.00 O ATOM 1160 CG2 THR A 193 -4.817 -18.082 6.135 1.00 0.00 C ATOM 0 H THR A 193 -6.363 -16.183 3.402 1.00 0.00 H new ATOM 0 HA THR A 193 -7.261 -18.759 4.192 1.00 0.00 H new ATOM 0 HB THR A 193 -4.944 -17.024 4.332 1.00 0.00 H new ATOM 0 HG1 THR A 193 -3.991 -19.179 4.007 1.00 0.00 H new ATOM 0 HG21 THR A 193 -3.732 -18.176 6.101 1.00 0.00 H new ATOM 0 HG22 THR A 193 -5.087 -17.195 6.708 1.00 0.00 H new ATOM 0 HG23 THR A 193 -5.243 -18.965 6.612 1.00 0.00 H new ATOM 1168 N LYS A 194 -7.721 -16.445 6.480 1.00 0.00 N ATOM 1169 CA LYS A 194 -8.408 -16.144 7.737 1.00 0.00 C ATOM 1170 C LYS A 194 -9.932 -16.069 7.570 1.00 0.00 C ATOM 1171 O LYS A 194 -10.649 -16.032 8.569 1.00 0.00 O ATOM 1172 CB LYS A 194 -7.850 -14.846 8.346 1.00 0.00 C ATOM 1173 CG LYS A 194 -6.314 -14.787 8.360 1.00 0.00 C ATOM 1174 CD LYS A 194 -5.791 -13.529 9.052 1.00 0.00 C ATOM 1175 CE LYS A 194 -4.279 -13.411 8.807 1.00 0.00 C ATOM 1176 NZ LYS A 194 -3.701 -12.151 9.322 1.00 0.00 N ATOM 0 H LYS A 194 -7.283 -15.627 6.056 1.00 0.00 H new ATOM 0 HA LYS A 194 -8.215 -16.969 8.423 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -8.233 -13.995 7.783 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -8.219 -14.745 9.367 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -5.923 -15.668 8.868 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.942 -14.818 7.336 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -6.304 -12.648 8.667 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -5.996 -13.576 10.122 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -3.774 -14.254 9.279 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -4.084 -13.481 7.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -2.680 -12.132 9.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -4.158 -11.343 8.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -3.858 -12.091 10.348 1.00 0.00 H new ATOM 1190 N GLY A 195 -10.445 -16.063 6.341 1.00 0.00 N ATOM 1191 CA GLY A 195 -11.860 -15.856 6.057 1.00 0.00 C ATOM 1192 C GLY A 195 -12.241 -14.379 6.101 1.00 0.00 C ATOM 1193 O GLY A 195 -13.381 -14.030 6.415 1.00 0.00 O ATOM 0 H GLY A 195 -9.880 -16.204 5.504 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -12.096 -16.262 5.073 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -12.460 -16.407 6.781 1.00 0.00 H new ATOM 1197 N GLU A 196 -11.287 -13.495 5.822 1.00 0.00 N ATOM 1198 CA GLU A 196 -11.602 -12.133 5.432 1.00 0.00 C ATOM 1199 C GLU A 196 -12.051 -12.140 3.986 1.00 0.00 C ATOM 1200 O GLU A 196 -11.690 -13.021 3.194 1.00 0.00 O ATOM 1201 CB GLU A 196 -10.376 -11.237 5.555 1.00 0.00 C ATOM 1202 CG GLU A 196 -10.015 -11.074 7.029 1.00 0.00 C ATOM 1203 CD GLU A 196 -9.152 -9.849 7.329 1.00 0.00 C ATOM 1204 OE1 GLU A 196 -9.520 -8.744 6.873 1.00 0.00 O ATOM 1205 OE2 GLU A 196 -8.133 -9.989 8.050 1.00 0.00 O ATOM 0 H GLU A 196 -10.289 -13.703 5.860 1.00 0.00 H new ATOM 0 HA GLU A 196 -12.385 -11.750 6.086 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -9.538 -11.671 5.010 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.577 -10.263 5.108 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.934 -11.009 7.612 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -9.488 -11.967 7.364 1.00 0.00 H new ATOM 1212 N ASN A 197 -12.758 -11.086 3.615 1.00 0.00 N ATOM 1213 CA ASN A 197 -13.206 -10.839 2.255 1.00 0.00 C ATOM 1214 C ASN A 197 -13.308 -9.341 2.058 1.00 0.00 C ATOM 1215 O ASN A 197 -14.115 -8.673 2.705 1.00 0.00 O ATOM 1216 CB ASN A 197 -14.546 -11.507 1.960 1.00 0.00 C ATOM 1217 CG ASN A 197 -14.750 -11.774 0.478 1.00 0.00 C ATOM 1218 OD1 ASN A 197 -14.175 -11.120 -0.394 1.00 0.00 O ATOM 1219 ND2 ASN A 197 -15.594 -12.732 0.149 1.00 0.00 N ATOM 0 H ASN A 197 -13.044 -10.358 4.270 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.485 -11.271 1.561 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.607 -12.448 2.507 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.353 -10.872 2.326 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -15.775 -12.937 -0.834 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -16.066 -13.268 0.877 1.00 0.00 H new ATOM 1226 N PHE A 198 -12.438 -8.829 1.206 1.00 0.00 N ATOM 1227 CA PHE A 198 -12.360 -7.420 0.869 1.00 0.00 C ATOM 1228 C PHE A 198 -13.320 -7.148 -0.285 1.00 0.00 C ATOM 1229 O PHE A 198 -13.149 -7.680 -1.389 1.00 0.00 O ATOM 1230 CB PHE A 198 -10.912 -7.034 0.542 1.00 0.00 C ATOM 1231 CG PHE A 198 -9.955 -7.118 1.722 1.00 0.00 C ATOM 1232 CD1 PHE A 198 -10.245 -6.443 2.924 1.00 0.00 C ATOM 1233 CD2 PHE A 198 -8.755 -7.848 1.621 1.00 0.00 C ATOM 1234 CE1 PHE A 198 -9.351 -6.488 4.005 1.00 0.00 C ATOM 1235 CE2 PHE A 198 -7.856 -7.891 2.703 1.00 0.00 C ATOM 1236 CZ PHE A 198 -8.157 -7.216 3.897 1.00 0.00 C ATOM 0 H PHE A 198 -11.748 -9.398 0.716 1.00 0.00 H new ATOM 0 HA PHE A 198 -12.659 -6.800 1.714 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.547 -7.684 -0.253 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -10.900 -6.016 0.152 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -11.165 -5.885 3.015 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -8.523 -8.378 0.709 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -9.582 -5.962 4.920 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -6.933 -8.444 2.615 1.00 0.00 H new ATOM 0 HZ PHE A 198 -7.471 -7.257 4.730 1.00 0.00 H new ATOM 1246 N THR A 199 -14.347 -6.351 -0.009 1.00 0.00 N ATOM 1247 CA THR A 199 -15.378 -5.907 -0.934 1.00 0.00 C ATOM 1248 C THR A 199 -14.847 -4.786 -1.812 1.00 0.00 C ATOM 1249 O THR A 199 -13.742 -4.289 -1.607 1.00 0.00 O ATOM 1250 CB THR A 199 -16.568 -5.411 -0.083 1.00 0.00 C ATOM 1251 OG1 THR A 199 -16.125 -4.387 0.795 1.00 0.00 O ATOM 1252 CG2 THR A 199 -17.184 -6.530 0.763 1.00 0.00 C ATOM 0 H THR A 199 -14.488 -5.975 0.929 1.00 0.00 H new ATOM 0 HA THR A 199 -15.688 -6.720 -1.591 1.00 0.00 H new ATOM 0 HB THR A 199 -17.326 -5.043 -0.774 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.900 -3.961 1.218 1.00 0.00 H new ATOM 0 HG21 THR A 199 -18.016 -6.131 1.343 1.00 0.00 H new ATOM 0 HG22 THR A 199 -17.545 -7.324 0.109 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.430 -6.932 1.440 1.00 0.00 H new ATOM 1260 N GLU A 200 -15.651 -4.361 -2.784 1.00 0.00 N ATOM 1261 CA GLU A 200 -15.338 -3.264 -3.655 1.00 0.00 C ATOM 1262 C GLU A 200 -14.950 -2.028 -2.873 1.00 0.00 C ATOM 1263 O GLU A 200 -13.965 -1.383 -3.224 1.00 0.00 O ATOM 1264 CB GLU A 200 -16.583 -3.000 -4.527 1.00 0.00 C ATOM 1265 CG GLU A 200 -16.207 -2.420 -5.888 1.00 0.00 C ATOM 1266 CD GLU A 200 -16.637 -0.973 -6.191 1.00 0.00 C ATOM 1267 OE1 GLU A 200 -17.216 -0.262 -5.330 1.00 0.00 O ATOM 1268 OE2 GLU A 200 -16.434 -0.555 -7.361 1.00 0.00 O ATOM 0 H GLU A 200 -16.556 -4.789 -2.981 1.00 0.00 H new ATOM 0 HA GLU A 200 -14.480 -3.514 -4.279 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -17.133 -3.931 -4.667 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -17.250 -2.311 -4.009 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -15.123 -2.476 -5.989 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -16.633 -3.065 -6.657 1.00 0.00 H new ATOM 1275 N THR A 201 -15.679 -1.724 -1.801 1.00 0.00 N ATOM 1276 CA THR A 201 -15.337 -0.583 -0.983 1.00 0.00 C ATOM 1277 C THR A 201 -13.992 -0.797 -0.306 1.00 0.00 C ATOM 1278 O THR A 201 -13.129 0.067 -0.428 1.00 0.00 O ATOM 1279 CB THR A 201 -16.419 -0.257 0.045 1.00 0.00 C ATOM 1280 OG1 THR A 201 -17.717 -0.617 -0.389 1.00 0.00 O ATOM 1281 CG2 THR A 201 -16.365 1.249 0.268 1.00 0.00 C ATOM 0 H THR A 201 -16.496 -2.248 -1.489 1.00 0.00 H new ATOM 0 HA THR A 201 -15.264 0.279 -1.646 1.00 0.00 H new ATOM 0 HB THR A 201 -16.229 -0.826 0.955 1.00 0.00 H new ATOM 0 HG1 THR A 201 -18.369 -0.389 0.306 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.122 1.536 0.998 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.379 1.527 0.640 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.556 1.763 -0.674 1.00 0.00 H new ATOM 1289 N ASP A 202 -13.788 -1.941 0.352 1.00 0.00 N ATOM 1290 CA ASP A 202 -12.537 -2.268 1.023 1.00 0.00 C ATOM 1291 C ASP A 202 -11.371 -2.123 0.053 1.00 0.00 C ATOM 1292 O ASP A 202 -10.421 -1.423 0.399 1.00 0.00 O ATOM 1293 CB ASP A 202 -12.564 -3.667 1.655 1.00 0.00 C ATOM 1294 CG ASP A 202 -12.885 -3.630 3.150 1.00 0.00 C ATOM 1295 OD1 ASP A 202 -14.081 -3.590 3.509 1.00 0.00 O ATOM 1296 OD2 ASP A 202 -11.947 -3.684 3.972 1.00 0.00 O ATOM 0 H ASP A 202 -14.496 -2.670 0.432 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.404 -1.561 1.842 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -13.306 -4.279 1.143 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -11.597 -4.148 1.506 1.00 0.00 H new ATOM 1301 N VAL A 203 -11.446 -2.696 -1.154 1.00 0.00 N ATOM 1302 CA VAL A 203 -10.378 -2.623 -2.145 1.00 0.00 C ATOM 1303 C VAL A 203 -10.139 -1.168 -2.546 1.00 0.00 C ATOM 1304 O VAL A 203 -9.006 -0.697 -2.474 1.00 0.00 O ATOM 1305 CB VAL A 203 -10.700 -3.514 -3.362 1.00 0.00 C ATOM 1306 CG1 VAL A 203 -9.638 -3.361 -4.464 1.00 0.00 C ATOM 1307 CG2 VAL A 203 -10.738 -4.995 -2.960 1.00 0.00 C ATOM 0 H VAL A 203 -12.258 -3.227 -1.468 1.00 0.00 H new ATOM 0 HA VAL A 203 -9.455 -3.005 -1.707 1.00 0.00 H new ATOM 0 HB VAL A 203 -11.673 -3.194 -3.734 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -9.894 -4.002 -5.308 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -9.603 -2.323 -4.794 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -8.663 -3.650 -4.072 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -10.967 -5.604 -3.835 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.768 -5.288 -2.558 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -11.506 -5.147 -2.202 1.00 0.00 H new ATOM 1317 N LYS A 204 -11.169 -0.432 -2.969 1.00 0.00 N ATOM 1318 CA LYS A 204 -10.987 0.944 -3.431 1.00 0.00 C ATOM 1319 C LYS A 204 -10.404 1.819 -2.308 1.00 0.00 C ATOM 1320 O LYS A 204 -9.640 2.748 -2.567 1.00 0.00 O ATOM 1321 CB LYS A 204 -12.304 1.431 -4.070 1.00 0.00 C ATOM 1322 CG LYS A 204 -12.993 2.582 -3.334 1.00 0.00 C ATOM 1323 CD LYS A 204 -14.294 2.999 -4.029 1.00 0.00 C ATOM 1324 CE LYS A 204 -15.360 1.922 -3.803 1.00 0.00 C ATOM 1325 NZ LYS A 204 -16.686 2.287 -4.323 1.00 0.00 N ATOM 0 H LYS A 204 -12.133 -0.764 -3.001 1.00 0.00 H new ATOM 0 HA LYS A 204 -10.238 1.014 -4.220 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -12.099 1.745 -5.094 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -12.995 0.590 -4.127 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -13.208 2.282 -2.308 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.318 3.436 -3.281 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -14.639 3.955 -3.636 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -14.121 3.137 -5.096 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -15.035 0.996 -4.278 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -15.441 1.721 -2.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -17.120 1.459 -4.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -17.290 2.608 -3.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -16.587 3.053 -5.019 1.00 0.00 H new ATOM 1339 N MET A 205 -10.731 1.507 -1.055 1.00 0.00 N ATOM 1340 CA MET A 205 -10.307 2.238 0.124 1.00 0.00 C ATOM 1341 C MET A 205 -8.835 2.045 0.417 1.00 0.00 C ATOM 1342 O MET A 205 -8.150 2.994 0.812 1.00 0.00 O ATOM 1343 CB MET A 205 -11.141 1.715 1.299 1.00 0.00 C ATOM 1344 CG MET A 205 -12.450 2.444 1.353 1.00 0.00 C ATOM 1345 SD MET A 205 -12.287 3.881 2.430 1.00 0.00 S ATOM 1346 CE MET A 205 -13.949 4.516 2.271 1.00 0.00 C ATOM 0 H MET A 205 -11.322 0.706 -0.831 1.00 0.00 H new ATOM 0 HA MET A 205 -10.457 3.305 -0.038 1.00 0.00 H new ATOM 0 HB2 MET A 205 -11.314 0.645 1.187 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.598 1.854 2.234 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.747 2.757 0.352 1.00 0.00 H new ATOM 0 HG3 MET A 205 -13.233 1.783 1.725 1.00 0.00 H new ATOM 0 HE1 MET A 205 -14.283 4.905 3.233 1.00 0.00 H new ATOM 0 HE2 MET A 205 -13.964 5.316 1.531 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.616 3.715 1.952 1.00 0.00 H new ATOM 1356 N MET A 206 -8.360 0.809 0.309 1.00 0.00 N ATOM 1357 CA MET A 206 -6.966 0.502 0.451 1.00 0.00 C ATOM 1358 C MET A 206 -6.172 0.914 -0.778 1.00 0.00 C ATOM 1359 O MET A 206 -5.016 1.240 -0.579 1.00 0.00 O ATOM 1360 CB MET A 206 -6.793 -0.972 0.773 1.00 0.00 C ATOM 1361 CG MET A 206 -7.289 -1.876 -0.321 1.00 0.00 C ATOM 1362 SD MET A 206 -6.911 -3.622 -0.125 1.00 0.00 S ATOM 1363 CE MET A 206 -8.226 -4.101 0.996 1.00 0.00 C ATOM 0 H MET A 206 -8.946 -0.004 0.119 1.00 0.00 H new ATOM 0 HA MET A 206 -6.565 1.082 1.282 1.00 0.00 H new ATOM 0 HB2 MET A 206 -5.738 -1.177 0.955 1.00 0.00 H new ATOM 0 HB3 MET A 206 -7.326 -1.201 1.696 1.00 0.00 H new ATOM 0 HG2 MET A 206 -8.371 -1.764 -0.396 1.00 0.00 H new ATOM 0 HG3 MET A 206 -6.867 -1.536 -1.267 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.948 -5.020 1.512 1.00 0.00 H new ATOM 0 HE2 MET A 206 -8.387 -3.309 1.728 1.00 0.00 H new ATOM 0 HE3 MET A 206 -9.144 -4.265 0.431 1.00 0.00 H new ATOM 1373 N GLU A 207 -6.724 0.957 -1.997 1.00 0.00 N ATOM 1374 CA GLU A 207 -5.954 1.306 -3.198 1.00 0.00 C ATOM 1375 C GLU A 207 -5.347 2.681 -2.973 1.00 0.00 C ATOM 1376 O GLU A 207 -4.134 2.823 -3.067 1.00 0.00 O ATOM 1377 CB GLU A 207 -6.771 1.265 -4.508 1.00 0.00 C ATOM 1378 CG GLU A 207 -7.045 -0.157 -5.030 1.00 0.00 C ATOM 1379 CD GLU A 207 -6.591 -0.423 -6.472 1.00 0.00 C ATOM 1380 OE1 GLU A 207 -7.075 0.252 -7.408 1.00 0.00 O ATOM 1381 OE2 GLU A 207 -5.779 -1.351 -6.689 1.00 0.00 O ATOM 0 H GLU A 207 -7.707 0.753 -2.178 1.00 0.00 H new ATOM 0 HA GLU A 207 -5.182 0.549 -3.337 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -7.723 1.772 -4.347 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -6.237 1.826 -5.275 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -6.548 -0.870 -4.372 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -8.115 -0.352 -4.961 1.00 0.00 H new ATOM 1388 N ARG A 208 -6.171 3.642 -2.542 1.00 0.00 N ATOM 1389 CA ARG A 208 -5.765 4.972 -2.085 1.00 0.00 C ATOM 1390 C ARG A 208 -4.578 4.922 -1.119 1.00 0.00 C ATOM 1391 O ARG A 208 -3.640 5.705 -1.273 1.00 0.00 O ATOM 1392 CB ARG A 208 -7.010 5.624 -1.441 1.00 0.00 C ATOM 1393 CG ARG A 208 -7.818 6.523 -2.378 1.00 0.00 C ATOM 1394 CD ARG A 208 -7.409 7.991 -2.422 1.00 0.00 C ATOM 1395 NE ARG A 208 -6.311 8.232 -3.369 1.00 0.00 N ATOM 1396 CZ ARG A 208 -6.330 9.016 -4.455 1.00 0.00 C ATOM 1397 NH1 ARG A 208 -7.417 9.646 -4.886 1.00 0.00 N ATOM 1398 NH2 ARG A 208 -5.207 9.161 -5.129 1.00 0.00 N ATOM 0 H ARG A 208 -7.181 3.507 -2.501 1.00 0.00 H new ATOM 0 HA ARG A 208 -5.413 5.567 -2.927 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.662 4.836 -1.064 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.691 6.212 -0.581 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.747 6.117 -3.387 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -8.867 6.468 -2.085 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -8.269 8.598 -2.703 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -7.105 8.312 -1.426 1.00 0.00 H new ATOM 0 HE ARG A 208 -5.434 7.747 -3.177 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -8.298 9.545 -4.382 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -7.370 10.231 -5.721 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -4.361 8.684 -4.819 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -5.184 9.750 -5.961 1.00 0.00 H new ATOM 1412 N VAL A 209 -4.607 4.060 -0.098 1.00 0.00 N ATOM 1413 CA VAL A 209 -3.517 4.031 0.882 1.00 0.00 C ATOM 1414 C VAL A 209 -2.300 3.332 0.320 1.00 0.00 C ATOM 1415 O VAL A 209 -1.202 3.875 0.415 1.00 0.00 O ATOM 1416 CB VAL A 209 -3.958 3.423 2.229 1.00 0.00 C ATOM 1417 CG1 VAL A 209 -2.769 2.940 3.070 1.00 0.00 C ATOM 1418 CG2 VAL A 209 -4.649 4.484 3.049 1.00 0.00 C ATOM 0 H VAL A 209 -5.355 3.387 0.070 1.00 0.00 H new ATOM 0 HA VAL A 209 -3.240 5.065 1.088 1.00 0.00 H new ATOM 0 HB VAL A 209 -4.607 2.580 1.994 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -3.133 2.521 4.008 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -2.221 2.176 2.519 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -2.107 3.780 3.281 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -4.963 4.060 4.003 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -3.961 5.310 3.228 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.523 4.850 2.509 1.00 0.00 H new ATOM 1428 N VAL A 210 -2.465 2.120 -0.186 1.00 0.00 N ATOM 1429 CA VAL A 210 -1.367 1.300 -0.659 1.00 0.00 C ATOM 1430 C VAL A 210 -0.604 2.084 -1.750 1.00 0.00 C ATOM 1431 O VAL A 210 0.618 2.003 -1.817 1.00 0.00 O ATOM 1432 CB VAL A 210 -1.949 -0.057 -1.117 1.00 0.00 C ATOM 1433 CG1 VAL A 210 -0.847 -1.032 -1.484 1.00 0.00 C ATOM 1434 CG2 VAL A 210 -2.833 -0.787 -0.082 1.00 0.00 C ATOM 0 H VAL A 210 -3.378 1.675 -0.280 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.634 1.076 0.116 1.00 0.00 H new ATOM 0 HB VAL A 210 -2.572 0.222 -1.967 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -1.288 -1.977 -1.802 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -0.251 -0.618 -2.297 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -0.209 -1.203 -0.617 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -3.189 -1.726 -0.505 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -2.249 -0.991 0.815 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.686 -0.159 0.175 1.00 0.00 H new ATOM 1444 N GLU A 211 -1.296 2.919 -2.532 1.00 0.00 N ATOM 1445 CA GLU A 211 -0.756 3.866 -3.500 1.00 0.00 C ATOM 1446 C GLU A 211 0.058 4.924 -2.767 1.00 0.00 C ATOM 1447 O GLU A 211 1.259 5.019 -2.992 1.00 0.00 O ATOM 1448 CB GLU A 211 -1.967 4.474 -4.249 1.00 0.00 C ATOM 1449 CG GLU A 211 -1.833 5.811 -4.979 1.00 0.00 C ATOM 1450 CD GLU A 211 -3.215 6.306 -5.415 1.00 0.00 C ATOM 1451 OE1 GLU A 211 -3.941 6.867 -4.566 1.00 0.00 O ATOM 1452 OE2 GLU A 211 -3.563 6.198 -6.618 1.00 0.00 O ATOM 0 H GLU A 211 -2.315 2.949 -2.500 1.00 0.00 H new ATOM 0 HA GLU A 211 -0.086 3.391 -4.217 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -2.295 3.738 -4.983 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -2.773 4.582 -3.524 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -1.363 6.546 -4.326 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -1.186 5.697 -5.849 1.00 0.00 H new ATOM 1459 N GLN A 212 -0.561 5.691 -1.868 1.00 0.00 N ATOM 1460 CA GLN A 212 0.086 6.735 -1.080 1.00 0.00 C ATOM 1461 C GLN A 212 1.377 6.238 -0.415 1.00 0.00 C ATOM 1462 O GLN A 212 2.398 6.936 -0.417 1.00 0.00 O ATOM 1463 CB GLN A 212 -0.942 7.246 -0.055 1.00 0.00 C ATOM 1464 CG GLN A 212 -1.821 8.374 -0.615 1.00 0.00 C ATOM 1465 CD GLN A 212 -1.068 9.698 -0.606 1.00 0.00 C ATOM 1466 OE1 GLN A 212 -0.935 10.325 0.441 1.00 0.00 O ATOM 1467 NE2 GLN A 212 -0.535 10.143 -1.731 1.00 0.00 N ATOM 0 H GLN A 212 -1.556 5.598 -1.664 1.00 0.00 H new ATOM 0 HA GLN A 212 0.399 7.554 -1.728 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.577 6.418 0.261 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -0.419 7.604 0.832 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.128 8.132 -1.632 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -2.730 8.463 -0.020 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -0.652 9.614 -2.595 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -0.007 11.016 -1.735 1.00 0.00 H new ATOM 1476 N MET A 213 1.357 5.015 0.115 1.00 0.00 N ATOM 1477 CA MET A 213 2.520 4.397 0.734 1.00 0.00 C ATOM 1478 C MET A 213 3.530 3.916 -0.304 1.00 0.00 C ATOM 1479 O MET A 213 4.733 3.916 -0.024 1.00 0.00 O ATOM 1480 CB MET A 213 2.090 3.242 1.643 1.00 0.00 C ATOM 1481 CG MET A 213 1.226 3.812 2.775 1.00 0.00 C ATOM 1482 SD MET A 213 1.085 2.876 4.323 1.00 0.00 S ATOM 1483 CE MET A 213 0.612 1.249 3.719 1.00 0.00 C ATOM 0 H MET A 213 0.525 4.425 0.125 1.00 0.00 H new ATOM 0 HA MET A 213 3.014 5.158 1.338 1.00 0.00 H new ATOM 0 HB2 MET A 213 1.529 2.501 1.074 1.00 0.00 H new ATOM 0 HB3 MET A 213 2.964 2.735 2.052 1.00 0.00 H new ATOM 0 HG2 MET A 213 1.614 4.800 3.021 1.00 0.00 H new ATOM 0 HG3 MET A 213 0.219 3.954 2.382 1.00 0.00 H new ATOM 0 HE1 MET A 213 -0.114 0.805 4.400 1.00 0.00 H new ATOM 0 HE2 MET A 213 0.170 1.344 2.727 1.00 0.00 H new ATOM 0 HE3 MET A 213 1.494 0.611 3.663 1.00 0.00 H new ATOM 1493 N CYS A 214 3.075 3.539 -1.502 1.00 0.00 N ATOM 1494 CA CYS A 214 3.986 3.106 -2.550 1.00 0.00 C ATOM 1495 C CYS A 214 4.797 4.314 -3.036 1.00 0.00 C ATOM 1496 O CYS A 214 6.023 4.246 -3.156 1.00 0.00 O ATOM 1497 CB CYS A 214 3.272 2.422 -3.735 1.00 0.00 C ATOM 1498 SG CYS A 214 4.461 1.355 -4.609 1.00 0.00 S ATOM 0 H CYS A 214 2.089 3.527 -1.763 1.00 0.00 H new ATOM 0 HA CYS A 214 4.645 2.351 -2.122 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.429 1.831 -3.376 1.00 0.00 H new ATOM 0 HB3 CYS A 214 2.869 3.172 -4.415 1.00 0.00 H new ATOM 1503 N ILE A 215 4.106 5.433 -3.284 1.00 0.00 N ATOM 1504 CA ILE A 215 4.692 6.723 -3.643 1.00 0.00 C ATOM 1505 C ILE A 215 5.647 7.120 -2.519 1.00 0.00 C ATOM 1506 O ILE A 215 6.793 7.445 -2.818 1.00 0.00 O ATOM 1507 CB ILE A 215 3.593 7.798 -3.874 1.00 0.00 C ATOM 1508 CG1 ILE A 215 2.524 7.345 -4.894 1.00 0.00 C ATOM 1509 CG2 ILE A 215 4.227 9.111 -4.377 1.00 0.00 C ATOM 1510 CD1 ILE A 215 1.244 8.187 -4.870 1.00 0.00 C ATOM 0 H ILE A 215 3.087 5.463 -3.238 1.00 0.00 H new ATOM 0 HA ILE A 215 5.237 6.645 -4.584 1.00 0.00 H new ATOM 0 HB ILE A 215 3.103 7.951 -2.912 1.00 0.00 H new ATOM 0 HG12 ILE A 215 2.953 7.383 -5.895 1.00 0.00 H new ATOM 0 HG13 ILE A 215 2.266 6.304 -4.697 1.00 0.00 H new ATOM 0 HG21 ILE A 215 3.446 9.855 -4.535 1.00 0.00 H new ATOM 0 HG22 ILE A 215 4.936 9.480 -3.636 1.00 0.00 H new ATOM 0 HG23 ILE A 215 4.748 8.927 -5.317 1.00 0.00 H new ATOM 0 HD11 ILE A 215 0.544 7.806 -5.614 1.00 0.00 H new ATOM 0 HD12 ILE A 215 0.789 8.130 -3.881 1.00 0.00 H new ATOM 0 HD13 ILE A 215 1.487 9.225 -5.098 1.00 0.00 H new ATOM 1522 N THR A 216 5.225 7.031 -1.248 1.00 0.00 N ATOM 1523 CA THR A 216 6.092 7.318 -0.110 1.00 0.00 C ATOM 1524 C THR A 216 7.405 6.548 -0.240 1.00 0.00 C ATOM 1525 O THR A 216 8.452 7.185 -0.200 1.00 0.00 O ATOM 1526 CB THR A 216 5.375 7.029 1.220 1.00 0.00 C ATOM 1527 OG1 THR A 216 4.346 7.977 1.443 1.00 0.00 O ATOM 1528 CG2 THR A 216 6.316 6.988 2.434 1.00 0.00 C ATOM 0 H THR A 216 4.277 6.759 -0.988 1.00 0.00 H new ATOM 0 HA THR A 216 6.332 8.381 -0.109 1.00 0.00 H new ATOM 0 HB THR A 216 4.951 6.030 1.120 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.585 7.778 0.858 1.00 0.00 H new ATOM 0 HG21 THR A 216 5.739 6.780 3.335 1.00 0.00 H new ATOM 0 HG22 THR A 216 7.061 6.205 2.291 1.00 0.00 H new ATOM 0 HG23 THR A 216 6.817 7.950 2.539 1.00 0.00 H new ATOM 1536 N GLN A 217 7.414 5.218 -0.400 1.00 0.00 N ATOM 1537 CA GLN A 217 8.708 4.534 -0.424 1.00 0.00 C ATOM 1538 C GLN A 217 9.590 5.004 -1.598 1.00 0.00 C ATOM 1539 O GLN A 217 10.811 5.028 -1.437 1.00 0.00 O ATOM 1540 CB GLN A 217 8.573 3.004 -0.375 1.00 0.00 C ATOM 1541 CG GLN A 217 8.237 2.544 1.056 1.00 0.00 C ATOM 1542 CD GLN A 217 9.124 1.408 1.575 1.00 0.00 C ATOM 1543 OE1 GLN A 217 8.664 0.293 1.791 1.00 0.00 O ATOM 1544 NE2 GLN A 217 10.406 1.665 1.806 1.00 0.00 N ATOM 0 H GLN A 217 6.591 4.625 -0.509 1.00 0.00 H new ATOM 0 HA GLN A 217 9.222 4.821 0.493 1.00 0.00 H new ATOM 0 HB2 GLN A 217 7.792 2.679 -1.062 1.00 0.00 H new ATOM 0 HB3 GLN A 217 9.502 2.539 -0.705 1.00 0.00 H new ATOM 0 HG2 GLN A 217 8.326 3.396 1.730 1.00 0.00 H new ATOM 0 HG3 GLN A 217 7.197 2.221 1.087 1.00 0.00 H new ATOM 0 HE21 GLN A 217 10.780 2.596 1.623 1.00 0.00 H new ATOM 0 HE22 GLN A 217 11.016 0.931 2.166 1.00 0.00 H new ATOM 1553 N TYR A 218 9.011 5.442 -2.725 1.00 0.00 N ATOM 1554 CA TYR A 218 9.778 6.038 -3.820 1.00 0.00 C ATOM 1555 C TYR A 218 10.343 7.414 -3.432 1.00 0.00 C ATOM 1556 O TYR A 218 11.536 7.673 -3.590 1.00 0.00 O ATOM 1557 CB TYR A 218 8.945 6.078 -5.128 1.00 0.00 C ATOM 1558 CG TYR A 218 9.459 5.112 -6.190 1.00 0.00 C ATOM 1559 CD1 TYR A 218 10.847 4.982 -6.396 1.00 0.00 C ATOM 1560 CD2 TYR A 218 8.575 4.261 -6.891 1.00 0.00 C ATOM 1561 CE1 TYR A 218 11.351 3.890 -7.113 1.00 0.00 C ATOM 1562 CE2 TYR A 218 9.077 3.196 -7.665 1.00 0.00 C ATOM 1563 CZ TYR A 218 10.468 2.956 -7.689 1.00 0.00 C ATOM 1564 OH TYR A 218 10.947 1.802 -8.222 1.00 0.00 O ATOM 0 H TYR A 218 8.007 5.393 -2.899 1.00 0.00 H new ATOM 0 HA TYR A 218 10.640 5.400 -4.015 1.00 0.00 H new ATOM 0 HB2 TYR A 218 7.907 5.839 -4.899 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.957 7.091 -5.530 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.523 5.726 -6.000 1.00 0.00 H new ATOM 0 HD2 TYR A 218 7.510 4.428 -6.833 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.418 3.764 -7.224 1.00 0.00 H new ATOM 0 HE2 TYR A 218 8.405 2.570 -8.234 1.00 0.00 H new ATOM 0 HH TYR A 218 11.888 1.693 -7.973 1.00 0.00 H new ATOM 1574 N GLU A 219 9.513 8.264 -2.835 1.00 0.00 N ATOM 1575 CA GLU A 219 9.835 9.617 -2.390 1.00 0.00 C ATOM 1576 C GLU A 219 10.977 9.566 -1.378 1.00 0.00 C ATOM 1577 O GLU A 219 11.957 10.308 -1.474 1.00 0.00 O ATOM 1578 CB GLU A 219 8.609 10.245 -1.730 1.00 0.00 C ATOM 1579 CG GLU A 219 7.517 10.585 -2.742 1.00 0.00 C ATOM 1580 CD GLU A 219 7.580 12.026 -3.238 1.00 0.00 C ATOM 1581 OE1 GLU A 219 8.413 12.332 -4.116 1.00 0.00 O ATOM 1582 OE2 GLU A 219 6.745 12.848 -2.785 1.00 0.00 O ATOM 0 H GLU A 219 8.544 8.014 -2.638 1.00 0.00 H new ATOM 0 HA GLU A 219 10.135 10.215 -3.251 1.00 0.00 H new ATOM 0 HB2 GLU A 219 8.209 9.558 -0.984 1.00 0.00 H new ATOM 0 HB3 GLU A 219 8.907 11.151 -1.202 1.00 0.00 H new ATOM 0 HG2 GLU A 219 7.599 9.911 -3.595 1.00 0.00 H new ATOM 0 HG3 GLU A 219 6.542 10.407 -2.288 1.00 0.00 H new ATOM 1589 N ARG A 220 10.850 8.665 -0.402 1.00 0.00 N ATOM 1590 CA ARG A 220 11.847 8.417 0.626 1.00 0.00 C ATOM 1591 C ARG A 220 13.151 7.938 -0.012 1.00 0.00 C ATOM 1592 O ARG A 220 14.233 8.305 0.457 1.00 0.00 O ATOM 1593 CB ARG A 220 11.329 7.356 1.605 1.00 0.00 C ATOM 1594 CG ARG A 220 10.091 7.781 2.421 1.00 0.00 C ATOM 1595 CD ARG A 220 9.564 6.634 3.285 1.00 0.00 C ATOM 1596 NE ARG A 220 10.608 6.022 4.116 1.00 0.00 N ATOM 1597 CZ ARG A 220 11.163 6.518 5.224 1.00 0.00 C ATOM 1598 NH1 ARG A 220 10.778 7.688 5.724 1.00 0.00 N ATOM 1599 NH2 ARG A 220 12.099 5.807 5.830 1.00 0.00 N ATOM 0 H ARG A 220 10.024 8.074 -0.308 1.00 0.00 H new ATOM 0 HA ARG A 220 12.037 9.344 1.167 1.00 0.00 H new ATOM 0 HB2 ARG A 220 11.086 6.453 1.045 1.00 0.00 H new ATOM 0 HB3 ARG A 220 12.131 7.096 2.296 1.00 0.00 H new ATOM 0 HG2 ARG A 220 10.347 8.628 3.057 1.00 0.00 H new ATOM 0 HG3 ARG A 220 9.306 8.117 1.744 1.00 0.00 H new ATOM 0 HD2 ARG A 220 8.766 7.006 3.928 1.00 0.00 H new ATOM 0 HD3 ARG A 220 9.125 5.872 2.641 1.00 0.00 H new ATOM 0 HE ARG A 220 10.949 5.111 3.811 1.00 0.00 H new ATOM 0 HH11 ARG A 220 10.045 8.225 5.260 1.00 0.00 H new ATOM 0 HH12 ARG A 220 11.215 8.049 6.572 1.00 0.00 H new ATOM 0 HH21 ARG A 220 12.380 4.904 5.449 1.00 0.00 H new ATOM 0 HH22 ARG A 220 12.540 6.162 6.678 1.00 0.00 H new ATOM 1613 N CYS A 221 13.065 7.138 -1.082 1.00 0.00 N ATOM 1614 CA CYS A 221 14.241 6.610 -1.772 1.00 0.00 C ATOM 1615 C CYS A 221 15.063 7.751 -2.357 1.00 0.00 C ATOM 1616 O CYS A 221 16.279 7.818 -2.141 1.00 0.00 O ATOM 1617 CB CYS A 221 13.836 5.535 -2.806 1.00 0.00 C ATOM 1618 SG CYS A 221 14.351 5.719 -4.548 1.00 0.00 S ATOM 0 H CYS A 221 12.179 6.841 -1.490 1.00 0.00 H new ATOM 0 HA CYS A 221 14.888 6.100 -1.058 1.00 0.00 H new ATOM 0 HB2 CYS A 221 14.222 4.579 -2.451 1.00 0.00 H new ATOM 0 HB3 CYS A 221 12.748 5.464 -2.793 1.00 0.00 H new ATOM 1623 N SER A 222 14.375 8.669 -3.029 1.00 0.00 N ATOM 1624 CA SER A 222 14.935 9.879 -3.597 1.00 0.00 C ATOM 1625 C SER A 222 15.550 10.755 -2.506 1.00 0.00 C ATOM 1626 O SER A 222 16.633 11.301 -2.708 1.00 0.00 O ATOM 1627 CB SER A 222 13.816 10.597 -4.345 1.00 0.00 C ATOM 1628 OG SER A 222 14.289 11.632 -5.178 1.00 0.00 O ATOM 0 H SER A 222 13.373 8.582 -3.196 1.00 0.00 H new ATOM 0 HA SER A 222 15.743 9.644 -4.290 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.267 9.874 -4.948 1.00 0.00 H new ATOM 0 HB3 SER A 222 13.111 11.011 -3.624 1.00 0.00 H new ATOM 0 HG SER A 222 13.532 12.057 -5.634 1.00 0.00 H new