USER MOD reduce.3.24.130724 H: found=0, std=0, add=620, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 621 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 Single : A 179 THR OG1 : rot -130:sc= -0.532 USER MOD Single : A 180 TYR OH : rot 110:sc= -0.0338 USER MOD Single : A 181 LYS NZ :NH3+ -168:sc= 0.648 (180deg=0.55) USER MOD Single : A 183 MET CE :methyl -155:sc= -2.81! (180deg=-3.46!) USER MOD Single : A 186 LYS NZ :NH3+ 167:sc= -0.0435 (180deg=-0.285) USER MOD Single : A 187 SER OG : rot -80:sc= -1.81! USER MOD Single : A 188 MET CE :methyl -139:sc= -0.676 (180deg=-2.22) USER MOD Single : A 190 GLN : amide:sc= -0.393 K(o=-0.39,f=-2!) USER MOD Single : A 192 ASN : amide:sc= -1.97! K(o=-2!,f=-0.65) USER MOD Single : A 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 SER OG : rot 180:sc= 0 USER MOD Single : A 198 SER OG : rot 180:sc= -0.186 USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 204 LYS NZ :NH3+ -165:sc= -0.0339 (180deg=-0.229) USER MOD Single : A 205 TYR OH : rot 88:sc= 1.07 USER MOD Single : A 207 LYS NZ :NH3+ 164:sc= -0.0383 (180deg=-0.277) USER MOD Single : A 209 THR OG1 : rot 84:sc= 1.15 USER MOD Single : A 211 SER OG : rot 180:sc= 0 USER MOD Single : A 212 SER OG : rot 180:sc= 0 USER MOD Single : A 213 LYS NZ :NH3+ 166:sc= -0.043 (180deg=-0.298) USER MOD Single : A 215 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 216 THR OG1 : rot 77:sc= 0.32 USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 218 SER OG : rot 180:sc= 0 USER MOD Single : A 219 ASN : amide:sc=-0.00409 X(o=-0.0041,f=-0.17) USER MOD Single : A 222 TYR OH : rot 180:sc= 0 USER MOD Single : A 225 ASN : amide:sc= -0.0335 K(o=-0.034,f=-1) USER MOD Single : A 226 SER OG : rot 180:sc= 0 USER MOD Single : A 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 230 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00335) USER MOD Single : A 231 CYS SG : rot 68:sc= 0.369 USER MOD Single : A 234 ASN : amide:sc= -1.71! K(o=-1.7!,f=-0.25) USER MOD Single : A 239 GLN : amide:sc= -2.39 X(o=-2.4,f=-2.6!) USER MOD Single : A 241 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot -56:sc= 0.0656 USER MOD Single : A 248 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 250 ASN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : A 251 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 178 -10.297 1.682 10.246 1.00 0.00 N ATOM 94 CA LEU A 178 -8.886 1.523 10.008 1.00 0.00 C ATOM 95 C LEU A 178 -8.461 2.358 8.808 1.00 0.00 C ATOM 96 O LEU A 178 -9.106 2.332 7.758 1.00 0.00 O ATOM 97 CB LEU A 178 -8.553 0.044 9.801 1.00 0.00 C ATOM 98 CG LEU A 178 -8.860 -0.546 8.418 1.00 0.00 C ATOM 99 CD1 LEU A 178 -8.133 -1.869 8.241 1.00 0.00 C ATOM 100 CD2 LEU A 178 -10.356 -0.745 8.229 1.00 0.00 C ATOM 0 HA LEU A 178 -8.332 1.876 10.878 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -7.491 -0.097 10.003 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -9.098 -0.535 10.546 1.00 0.00 H new ATOM 0 HG LEU A 178 -8.511 0.159 7.663 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -8.358 -2.279 7.256 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -7.059 -1.709 8.331 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -8.460 -2.570 9.009 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -10.545 -1.164 7.241 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -10.731 -1.428 8.991 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -10.865 0.215 8.320 1.00 0.00 H new ATOM 112 N THR A 179 -7.440 3.165 9.003 1.00 0.00 N ATOM 113 CA THR A 179 -6.966 4.047 7.956 1.00 0.00 C ATOM 114 C THR A 179 -6.210 3.264 6.889 1.00 0.00 C ATOM 115 O THR A 179 -5.777 2.132 7.129 1.00 0.00 O ATOM 116 CB THR A 179 -6.083 5.171 8.533 1.00 0.00 C ATOM 117 OG1 THR A 179 -5.115 4.628 9.441 1.00 0.00 O ATOM 118 CG2 THR A 179 -6.940 6.205 9.251 1.00 0.00 C ATOM 0 H THR A 179 -6.921 3.229 9.879 1.00 0.00 H new ATOM 0 HA THR A 179 -7.837 4.509 7.490 1.00 0.00 H new ATOM 0 HB THR A 179 -5.562 5.656 7.707 1.00 0.00 H new ATOM 0 HG1 THR A 179 -5.134 5.133 10.280 1.00 0.00 H new ATOM 0 HG21 THR A 179 -6.301 6.992 9.652 1.00 0.00 H new ATOM 0 HG22 THR A 179 -7.652 6.639 8.549 1.00 0.00 H new ATOM 0 HG23 THR A 179 -7.481 5.726 10.067 1.00 0.00 H new ATOM 126 N TYR A 180 -6.122 3.837 5.695 1.00 0.00 N ATOM 127 CA TYR A 180 -5.484 3.175 4.561 1.00 0.00 C ATOM 128 C TYR A 180 -4.075 2.702 4.901 1.00 0.00 C ATOM 129 O TYR A 180 -3.644 1.651 4.429 1.00 0.00 O ATOM 130 CB TYR A 180 -5.439 4.109 3.355 1.00 0.00 C ATOM 131 CG TYR A 180 -6.754 4.232 2.621 1.00 0.00 C ATOM 132 CD1 TYR A 180 -7.925 4.472 3.321 1.00 0.00 C ATOM 133 CD2 TYR A 180 -6.831 4.103 1.238 1.00 0.00 C ATOM 134 CE1 TYR A 180 -9.134 4.583 2.670 1.00 0.00 C ATOM 135 CE2 TYR A 180 -8.041 4.214 0.577 1.00 0.00 C ATOM 136 CZ TYR A 180 -9.157 4.468 1.242 1.00 0.00 C ATOM 137 OH TYR A 180 -10.400 4.564 0.653 1.00 0.00 O ATOM 0 H TYR A 180 -6.487 4.766 5.485 1.00 0.00 H new ATOM 0 HA TYR A 180 -6.084 2.298 4.318 1.00 0.00 H new ATOM 0 HB2 TYR A 180 -5.127 5.099 3.687 1.00 0.00 H new ATOM 0 HB3 TYR A 180 -4.679 3.751 2.660 1.00 0.00 H new ATOM 0 HD1 TYR A 180 -7.890 4.574 4.396 1.00 0.00 H new ATOM 0 HD2 TYR A 180 -5.931 3.913 0.671 1.00 0.00 H new ATOM 0 HE1 TYR A 180 -10.045 4.753 3.224 1.00 0.00 H new ATOM 0 HE2 TYR A 180 -8.076 4.092 -0.496 1.00 0.00 H new ATOM 0 HH TYR A 180 -10.463 5.408 0.159 1.00 0.00 H new ATOM 147 N LYS A 181 -3.363 3.475 5.717 1.00 0.00 N ATOM 148 CA LYS A 181 -2.000 3.125 6.108 1.00 0.00 C ATOM 149 C LYS A 181 -1.965 1.782 6.838 1.00 0.00 C ATOM 150 O LYS A 181 -1.020 1.011 6.680 1.00 0.00 O ATOM 151 CB LYS A 181 -1.383 4.224 6.981 1.00 0.00 C ATOM 152 CG LYS A 181 -2.015 4.354 8.355 1.00 0.00 C ATOM 153 CD LYS A 181 -1.424 5.512 9.134 1.00 0.00 C ATOM 154 CE LYS A 181 -1.920 5.521 10.570 1.00 0.00 C ATOM 155 NZ LYS A 181 -1.410 4.353 11.342 1.00 0.00 N ATOM 0 H LYS A 181 -3.707 4.347 6.120 1.00 0.00 H new ATOM 0 HA LYS A 181 -1.407 3.034 5.198 1.00 0.00 H new ATOM 0 HB2 LYS A 181 -0.318 4.023 7.100 1.00 0.00 H new ATOM 0 HB3 LYS A 181 -1.471 5.178 6.461 1.00 0.00 H new ATOM 0 HG2 LYS A 181 -3.090 4.497 8.249 1.00 0.00 H new ATOM 0 HG3 LYS A 181 -1.870 3.428 8.912 1.00 0.00 H new ATOM 0 HD2 LYS A 181 -0.336 5.443 9.123 1.00 0.00 H new ATOM 0 HD3 LYS A 181 -1.689 6.452 8.650 1.00 0.00 H new ATOM 0 HE2 LYS A 181 -1.605 6.444 11.057 1.00 0.00 H new ATOM 0 HE3 LYS A 181 -3.010 5.513 10.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 -1.924 4.281 12.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 -1.554 3.483 10.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 -0.395 4.479 11.532 1.00 0.00 H new ATOM 169 N GLU A 182 -3.023 1.484 7.592 1.00 0.00 N ATOM 170 CA GLU A 182 -3.134 0.200 8.277 1.00 0.00 C ATOM 171 C GLU A 182 -3.389 -0.902 7.257 1.00 0.00 C ATOM 172 O GLU A 182 -2.811 -1.988 7.335 1.00 0.00 O ATOM 173 CB GLU A 182 -4.272 0.221 9.305 1.00 0.00 C ATOM 174 CG GLU A 182 -4.213 1.379 10.290 1.00 0.00 C ATOM 175 CD GLU A 182 -2.931 1.418 11.099 1.00 0.00 C ATOM 176 OE1 GLU A 182 -1.879 1.786 10.537 1.00 0.00 O ATOM 177 OE2 GLU A 182 -2.965 1.065 12.294 1.00 0.00 O ATOM 0 H GLU A 182 -3.812 2.113 7.743 1.00 0.00 H new ATOM 0 HA GLU A 182 -2.199 0.009 8.803 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -5.223 0.261 8.774 1.00 0.00 H new ATOM 0 HB3 GLU A 182 -4.257 -0.715 9.863 1.00 0.00 H new ATOM 0 HG2 GLU A 182 -4.318 2.316 9.744 1.00 0.00 H new ATOM 0 HG3 GLU A 182 -5.061 1.310 10.971 1.00 0.00 H new ATOM 184 N MET A 183 -4.233 -0.589 6.280 1.00 0.00 N ATOM 185 CA MET A 183 -4.563 -1.520 5.209 1.00 0.00 C ATOM 186 C MET A 183 -3.332 -1.863 4.391 1.00 0.00 C ATOM 187 O MET A 183 -3.037 -3.030 4.168 1.00 0.00 O ATOM 188 CB MET A 183 -5.635 -0.919 4.296 1.00 0.00 C ATOM 189 CG MET A 183 -6.995 -0.777 4.958 1.00 0.00 C ATOM 190 SD MET A 183 -8.009 0.508 4.200 1.00 0.00 S ATOM 191 CE MET A 183 -7.851 0.090 2.469 1.00 0.00 C ATOM 0 H MET A 183 -4.705 0.312 6.209 1.00 0.00 H new ATOM 0 HA MET A 183 -4.946 -2.434 5.663 1.00 0.00 H new ATOM 0 HB2 MET A 183 -5.302 0.062 3.957 1.00 0.00 H new ATOM 0 HB3 MET A 183 -5.736 -1.545 3.409 1.00 0.00 H new ATOM 0 HG2 MET A 183 -7.522 -1.729 4.903 1.00 0.00 H new ATOM 0 HG3 MET A 183 -6.858 -0.549 6.015 1.00 0.00 H new ATOM 0 HE1 MET A 183 -8.019 0.980 1.863 1.00 0.00 H new ATOM 0 HE2 MET A 183 -6.849 -0.295 2.278 1.00 0.00 H new ATOM 0 HE3 MET A 183 -8.588 -0.670 2.210 1.00 0.00 H new ATOM 201 N ILE A 184 -2.606 -0.837 3.972 1.00 0.00 N ATOM 202 CA ILE A 184 -1.388 -1.018 3.196 1.00 0.00 C ATOM 203 C ILE A 184 -0.340 -1.775 4.009 1.00 0.00 C ATOM 204 O ILE A 184 0.319 -2.684 3.501 1.00 0.00 O ATOM 205 CB ILE A 184 -0.814 0.339 2.744 1.00 0.00 C ATOM 206 CG1 ILE A 184 -1.864 1.114 1.945 1.00 0.00 C ATOM 207 CG2 ILE A 184 0.443 0.136 1.912 1.00 0.00 C ATOM 208 CD1 ILE A 184 -1.454 2.530 1.615 1.00 0.00 C ATOM 0 H ILE A 184 -2.842 0.138 4.159 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.642 -1.601 2.311 1.00 0.00 H new ATOM 0 HB ILE A 184 -0.549 0.918 3.629 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -2.069 0.579 1.018 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.795 1.138 2.512 1.00 0.00 H new ATOM 0 HG21 ILE A 184 0.834 1.105 1.602 1.00 0.00 H new ATOM 0 HG22 ILE A 184 1.193 -0.385 2.507 1.00 0.00 H new ATOM 0 HG23 ILE A 184 0.204 -0.458 1.030 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -2.248 3.016 1.048 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -1.277 3.082 2.538 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -0.541 2.515 1.020 1.00 0.00 H new ATOM 220 N LEU A 185 -0.267 -1.446 5.296 1.00 0.00 N ATOM 221 CA LEU A 185 0.632 -2.117 6.226 1.00 0.00 C ATOM 222 C LEU A 185 0.382 -3.623 6.215 1.00 0.00 C ATOM 223 O LEU A 185 1.321 -4.417 6.238 1.00 0.00 O ATOM 224 CB LEU A 185 0.436 -1.531 7.637 1.00 0.00 C ATOM 225 CG LEU A 185 1.342 -2.076 8.754 1.00 0.00 C ATOM 226 CD1 LEU A 185 0.815 -3.400 9.291 1.00 0.00 C ATOM 227 CD2 LEU A 185 2.773 -2.226 8.262 1.00 0.00 C ATOM 0 H LEU A 185 -0.829 -0.708 5.721 1.00 0.00 H new ATOM 0 HA LEU A 185 1.664 -1.951 5.918 1.00 0.00 H new ATOM 0 HB2 LEU A 185 0.582 -0.452 7.579 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -0.600 -1.697 7.931 1.00 0.00 H new ATOM 0 HG LEU A 185 1.335 -1.356 9.572 1.00 0.00 H new ATOM 0 HD11 LEU A 185 1.475 -3.762 10.079 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -0.187 -3.256 9.695 1.00 0.00 H new ATOM 0 HD13 LEU A 185 0.779 -4.132 8.484 1.00 0.00 H new ATOM 0 HD21 LEU A 185 3.396 -2.613 9.068 1.00 0.00 H new ATOM 0 HD22 LEU A 185 2.798 -2.918 7.420 1.00 0.00 H new ATOM 0 HD23 LEU A 185 3.152 -1.255 7.944 1.00 0.00 H new ATOM 239 N LYS A 186 -0.883 -4.013 6.195 1.00 0.00 N ATOM 240 CA LYS A 186 -1.235 -5.425 6.179 1.00 0.00 C ATOM 241 C LYS A 186 -1.129 -5.999 4.772 1.00 0.00 C ATOM 242 O LYS A 186 -0.640 -7.106 4.580 1.00 0.00 O ATOM 243 CB LYS A 186 -2.652 -5.637 6.711 1.00 0.00 C ATOM 244 CG LYS A 186 -2.819 -5.271 8.176 1.00 0.00 C ATOM 245 CD LYS A 186 -4.197 -5.654 8.699 1.00 0.00 C ATOM 246 CE LYS A 186 -4.429 -7.156 8.627 1.00 0.00 C ATOM 247 NZ LYS A 186 -3.401 -7.914 9.386 1.00 0.00 N ATOM 0 H LYS A 186 -1.680 -3.376 6.189 1.00 0.00 H new ATOM 0 HA LYS A 186 -0.529 -5.946 6.826 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -3.346 -5.043 6.116 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -2.929 -6.682 6.574 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -2.053 -5.774 8.766 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -2.667 -4.199 8.303 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -4.301 -5.319 9.731 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -4.963 -5.139 8.118 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -5.417 -7.390 9.022 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -4.419 -7.475 7.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -3.710 -8.901 9.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -2.500 -7.891 8.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -3.273 -7.482 10.323 1.00 0.00 H new ATOM 261 N SER A 187 -1.665 -5.262 3.811 1.00 0.00 N ATOM 262 CA SER A 187 -1.756 -5.712 2.430 1.00 0.00 C ATOM 263 C SER A 187 -0.393 -6.071 1.839 1.00 0.00 C ATOM 264 O SER A 187 -0.315 -6.922 0.956 1.00 0.00 O ATOM 265 CB SER A 187 -2.423 -4.628 1.579 1.00 0.00 C ATOM 266 OG SER A 187 -2.617 -5.059 0.245 1.00 0.00 O ATOM 0 H SER A 187 -2.051 -4.331 3.968 1.00 0.00 H new ATOM 0 HA SER A 187 -2.358 -6.620 2.423 1.00 0.00 H new ATOM 0 HB2 SER A 187 -3.384 -4.359 2.019 1.00 0.00 H new ATOM 0 HB3 SER A 187 -1.807 -3.729 1.586 1.00 0.00 H new ATOM 0 HG SER A 187 -1.777 -4.971 -0.252 1.00 0.00 H new ATOM 272 N MET A 188 0.656 -5.365 2.248 1.00 0.00 N ATOM 273 CA MET A 188 1.976 -5.578 1.653 1.00 0.00 C ATOM 274 C MET A 188 2.523 -6.976 1.984 1.00 0.00 C ATOM 275 O MET A 188 2.723 -7.784 1.079 1.00 0.00 O ATOM 276 CB MET A 188 2.951 -4.479 2.094 1.00 0.00 C ATOM 277 CG MET A 188 4.289 -4.536 1.385 1.00 0.00 C ATOM 278 SD MET A 188 4.128 -4.414 -0.404 1.00 0.00 S ATOM 279 CE MET A 188 5.840 -4.554 -0.893 1.00 0.00 C ATOM 0 H MET A 188 0.623 -4.652 2.976 1.00 0.00 H new ATOM 0 HA MET A 188 1.869 -5.522 0.570 1.00 0.00 H new ATOM 0 HB2 MET A 188 2.495 -3.506 1.913 1.00 0.00 H new ATOM 0 HB3 MET A 188 3.115 -4.560 3.169 1.00 0.00 H new ATOM 0 HG2 MET A 188 4.922 -3.725 1.746 1.00 0.00 H new ATOM 0 HG3 MET A 188 4.791 -5.470 1.638 1.00 0.00 H new ATOM 0 HE1 MET A 188 6.048 -3.848 -1.697 1.00 0.00 H new ATOM 0 HE2 MET A 188 6.481 -4.331 -0.040 1.00 0.00 H new ATOM 0 HE3 MET A 188 6.037 -5.568 -1.240 1.00 0.00 H new ATOM 289 N PRO A 189 2.728 -7.322 3.278 1.00 0.00 N ATOM 290 CA PRO A 189 3.198 -8.659 3.668 1.00 0.00 C ATOM 291 C PRO A 189 2.206 -9.758 3.284 1.00 0.00 C ATOM 292 O PRO A 189 2.598 -10.858 2.890 1.00 0.00 O ATOM 293 CB PRO A 189 3.329 -8.573 5.191 1.00 0.00 C ATOM 294 CG PRO A 189 2.437 -7.451 5.587 1.00 0.00 C ATOM 295 CD PRO A 189 2.488 -6.471 4.457 1.00 0.00 C ATOM 0 HA PRO A 189 4.129 -8.920 3.164 1.00 0.00 H new ATOM 0 HB2 PRO A 189 3.026 -9.506 5.667 1.00 0.00 H new ATOM 0 HB3 PRO A 189 4.360 -8.383 5.489 1.00 0.00 H new ATOM 0 HG2 PRO A 189 1.419 -7.802 5.755 1.00 0.00 H new ATOM 0 HG3 PRO A 189 2.774 -6.993 6.517 1.00 0.00 H new ATOM 0 HD2 PRO A 189 1.556 -5.913 4.367 1.00 0.00 H new ATOM 0 HD3 PRO A 189 3.285 -5.740 4.594 1.00 0.00 H new ATOM 303 N GLN A 190 0.917 -9.458 3.417 1.00 0.00 N ATOM 304 CA GLN A 190 -0.139 -10.420 3.102 1.00 0.00 C ATOM 305 C GLN A 190 -0.205 -10.714 1.606 1.00 0.00 C ATOM 306 O GLN A 190 -0.760 -11.737 1.201 1.00 0.00 O ATOM 307 CB GLN A 190 -1.499 -9.910 3.577 1.00 0.00 C ATOM 308 CG GLN A 190 -1.647 -9.840 5.089 1.00 0.00 C ATOM 309 CD GLN A 190 -1.698 -11.201 5.750 1.00 0.00 C ATOM 310 OE1 GLN A 190 -0.718 -11.947 5.756 1.00 0.00 O ATOM 311 NE2 GLN A 190 -2.842 -11.531 6.320 1.00 0.00 N ATOM 0 H GLN A 190 0.576 -8.553 3.742 1.00 0.00 H new ATOM 0 HA GLN A 190 0.105 -11.343 3.627 1.00 0.00 H new ATOM 0 HB2 GLN A 190 -1.667 -8.917 3.161 1.00 0.00 H new ATOM 0 HB3 GLN A 190 -2.278 -10.559 3.177 1.00 0.00 H new ATOM 0 HG2 GLN A 190 -0.812 -9.274 5.503 1.00 0.00 H new ATOM 0 HG3 GLN A 190 -2.557 -9.291 5.333 1.00 0.00 H new ATOM 0 HE21 GLN A 190 -3.630 -10.884 6.293 1.00 0.00 H new ATOM 0 HE22 GLN A 190 -2.937 -12.432 6.788 1.00 0.00 H new ATOM 320 N LEU A 191 0.282 -9.777 0.791 1.00 0.00 N ATOM 321 CA LEU A 191 0.215 -9.898 -0.664 1.00 0.00 C ATOM 322 C LEU A 191 0.819 -11.223 -1.115 1.00 0.00 C ATOM 323 O LEU A 191 0.133 -12.052 -1.723 1.00 0.00 O ATOM 324 CB LEU A 191 0.957 -8.730 -1.332 1.00 0.00 C ATOM 325 CG LEU A 191 0.294 -8.148 -2.587 1.00 0.00 C ATOM 326 CD1 LEU A 191 1.097 -6.968 -3.111 1.00 0.00 C ATOM 327 CD2 LEU A 191 0.147 -9.201 -3.673 1.00 0.00 C ATOM 0 H LEU A 191 0.730 -8.921 1.118 1.00 0.00 H new ATOM 0 HA LEU A 191 -0.832 -9.868 -0.964 1.00 0.00 H new ATOM 0 HB2 LEU A 191 1.071 -7.930 -0.600 1.00 0.00 H new ATOM 0 HB3 LEU A 191 1.960 -9.065 -1.596 1.00 0.00 H new ATOM 0 HG LEU A 191 -0.703 -7.806 -2.309 1.00 0.00 H new ATOM 0 HD11 LEU A 191 0.614 -6.566 -4.002 1.00 0.00 H new ATOM 0 HD12 LEU A 191 1.148 -6.194 -2.345 1.00 0.00 H new ATOM 0 HD13 LEU A 191 2.105 -7.297 -3.362 1.00 0.00 H new ATOM 0 HD21 LEU A 191 -0.326 -8.757 -4.549 1.00 0.00 H new ATOM 0 HD22 LEU A 191 1.131 -9.582 -3.946 1.00 0.00 H new ATOM 0 HD23 LEU A 191 -0.470 -10.021 -3.304 1.00 0.00 H new ATOM 339 N ASN A 192 2.068 -11.462 -0.725 1.00 0.00 N ATOM 340 CA ASN A 192 2.740 -12.723 -1.019 1.00 0.00 C ATOM 341 C ASN A 192 4.123 -12.767 -0.372 1.00 0.00 C ATOM 342 O ASN A 192 4.401 -12.038 0.583 1.00 0.00 O ATOM 343 CB ASN A 192 2.868 -12.948 -2.536 1.00 0.00 C ATOM 344 CG ASN A 192 3.748 -11.921 -3.229 1.00 0.00 C ATOM 345 OD1 ASN A 192 3.454 -10.728 -3.230 1.00 0.00 O ATOM 346 ND2 ASN A 192 4.832 -12.384 -3.835 1.00 0.00 N ATOM 0 H ASN A 192 2.637 -10.796 -0.203 1.00 0.00 H new ATOM 0 HA ASN A 192 2.128 -13.522 -0.601 1.00 0.00 H new ATOM 0 HB2 ASN A 192 3.275 -13.943 -2.715 1.00 0.00 H new ATOM 0 HB3 ASN A 192 1.875 -12.925 -2.984 1.00 0.00 H new ATOM 0 HD21 ASN A 192 5.456 -11.742 -4.324 1.00 0.00 H new ATOM 0 HD22 ASN A 192 5.042 -13.382 -3.812 1.00 0.00 H new ATOM 353 N ASP A 193 4.967 -13.646 -0.891 1.00 0.00 N ATOM 354 CA ASP A 193 6.323 -13.843 -0.387 1.00 0.00 C ATOM 355 C ASP A 193 7.226 -12.663 -0.731 1.00 0.00 C ATOM 356 O ASP A 193 8.204 -12.395 -0.030 1.00 0.00 O ATOM 357 CB ASP A 193 6.917 -15.118 -0.994 1.00 0.00 C ATOM 358 CG ASP A 193 7.025 -15.030 -2.506 1.00 0.00 C ATOM 359 OD1 ASP A 193 5.973 -14.913 -3.177 1.00 0.00 O ATOM 360 OD2 ASP A 193 8.158 -15.036 -3.031 1.00 0.00 O ATOM 0 H ASP A 193 4.731 -14.248 -1.680 1.00 0.00 H new ATOM 0 HA ASP A 193 6.266 -13.929 0.698 1.00 0.00 H new ATOM 0 HB2 ASP A 193 7.905 -15.296 -0.569 1.00 0.00 H new ATOM 0 HB3 ASP A 193 6.296 -15.972 -0.724 1.00 0.00 H new ATOM 365 N GLY A 194 6.974 -12.061 -1.885 1.00 0.00 N ATOM 366 CA GLY A 194 7.843 -11.020 -2.395 1.00 0.00 C ATOM 367 C GLY A 194 7.944 -9.827 -1.471 1.00 0.00 C ATOM 368 O GLY A 194 6.931 -9.308 -0.999 1.00 0.00 O ATOM 0 H GLY A 194 6.176 -12.278 -2.482 1.00 0.00 H new ATOM 0 HA2 GLY A 194 8.839 -11.433 -2.556 1.00 0.00 H new ATOM 0 HA3 GLY A 194 7.474 -10.690 -3.366 1.00 0.00 H new ATOM 372 N LYS A 195 9.167 -9.378 -1.236 1.00 0.00 N ATOM 373 CA LYS A 195 9.403 -8.223 -0.387 1.00 0.00 C ATOM 374 C LYS A 195 9.122 -6.938 -1.154 1.00 0.00 C ATOM 375 O LYS A 195 8.609 -5.976 -0.591 1.00 0.00 O ATOM 376 CB LYS A 195 10.837 -8.211 0.149 1.00 0.00 C ATOM 377 CG LYS A 195 11.133 -9.288 1.190 1.00 0.00 C ATOM 378 CD LYS A 195 11.274 -10.676 0.574 1.00 0.00 C ATOM 379 CE LYS A 195 12.519 -10.782 -0.298 1.00 0.00 C ATOM 380 NZ LYS A 195 12.645 -12.123 -0.928 1.00 0.00 N ATOM 0 H LYS A 195 10.013 -9.798 -1.623 1.00 0.00 H new ATOM 0 HA LYS A 195 8.724 -8.288 0.463 1.00 0.00 H new ATOM 0 HB2 LYS A 195 11.525 -8.333 -0.687 1.00 0.00 H new ATOM 0 HB3 LYS A 195 11.039 -7.234 0.588 1.00 0.00 H new ATOM 0 HG2 LYS A 195 12.052 -9.034 1.719 1.00 0.00 H new ATOM 0 HG3 LYS A 195 10.333 -9.303 1.930 1.00 0.00 H new ATOM 0 HD2 LYS A 195 11.320 -11.423 1.367 1.00 0.00 H new ATOM 0 HD3 LYS A 195 10.391 -10.900 -0.024 1.00 0.00 H new ATOM 0 HE2 LYS A 195 12.484 -10.018 -1.075 1.00 0.00 H new ATOM 0 HE3 LYS A 195 13.403 -10.581 0.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 13.505 -12.153 -1.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 12.705 -12.850 -0.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 11.814 -12.305 -1.526 1.00 0.00 H new ATOM 394 N GLY A 196 9.408 -6.951 -2.448 1.00 0.00 N ATOM 395 CA GLY A 196 9.129 -5.799 -3.280 1.00 0.00 C ATOM 396 C GLY A 196 7.944 -6.034 -4.192 1.00 0.00 C ATOM 397 O GLY A 196 7.966 -6.947 -5.019 1.00 0.00 O ATOM 0 H GLY A 196 9.829 -7.741 -2.937 1.00 0.00 H new ATOM 0 HA2 GLY A 196 8.934 -4.933 -2.647 1.00 0.00 H new ATOM 0 HA3 GLY A 196 10.008 -5.564 -3.880 1.00 0.00 H new ATOM 401 N SER A 197 6.951 -5.163 -4.098 1.00 0.00 N ATOM 402 CA SER A 197 5.770 -5.242 -4.943 1.00 0.00 C ATOM 403 C SER A 197 5.214 -3.844 -5.185 1.00 0.00 C ATOM 404 O SER A 197 5.014 -3.072 -4.248 1.00 0.00 O ATOM 405 CB SER A 197 4.696 -6.129 -4.299 1.00 0.00 C ATOM 406 OG SER A 197 5.162 -7.458 -4.111 1.00 0.00 O ATOM 0 H SER A 197 6.941 -4.386 -3.438 1.00 0.00 H new ATOM 0 HA SER A 197 6.056 -5.688 -5.896 1.00 0.00 H new ATOM 0 HB2 SER A 197 4.402 -5.706 -3.338 1.00 0.00 H new ATOM 0 HB3 SER A 197 3.806 -6.140 -4.929 1.00 0.00 H new ATOM 0 HG SER A 197 4.456 -7.997 -3.698 1.00 0.00 H new ATOM 412 N SER A 198 5.025 -3.504 -6.449 1.00 0.00 N ATOM 413 CA SER A 198 4.548 -2.185 -6.828 1.00 0.00 C ATOM 414 C SER A 198 3.194 -1.881 -6.198 1.00 0.00 C ATOM 415 O SER A 198 2.353 -2.772 -6.044 1.00 0.00 O ATOM 416 CB SER A 198 4.453 -2.086 -8.348 1.00 0.00 C ATOM 417 OG SER A 198 5.729 -2.242 -8.944 1.00 0.00 O ATOM 0 H SER A 198 5.196 -4.130 -7.236 1.00 0.00 H new ATOM 0 HA SER A 198 5.261 -1.448 -6.459 1.00 0.00 H new ATOM 0 HB2 SER A 198 3.775 -2.852 -8.725 1.00 0.00 H new ATOM 0 HB3 SER A 198 4.031 -1.121 -8.628 1.00 0.00 H new ATOM 0 HG SER A 198 5.645 -2.177 -9.918 1.00 0.00 H new ATOM 423 N ARG A 199 2.971 -0.606 -5.882 1.00 0.00 N ATOM 424 CA ARG A 199 1.698 -0.163 -5.315 1.00 0.00 C ATOM 425 C ARG A 199 0.549 -0.427 -6.284 1.00 0.00 C ATOM 426 O ARG A 199 -0.602 -0.532 -5.876 1.00 0.00 O ATOM 427 CB ARG A 199 1.746 1.314 -4.911 1.00 0.00 C ATOM 428 CG ARG A 199 2.310 2.251 -5.966 1.00 0.00 C ATOM 429 CD ARG A 199 2.477 3.655 -5.401 1.00 0.00 C ATOM 430 NE ARG A 199 3.214 4.549 -6.293 1.00 0.00 N ATOM 431 CZ ARG A 199 3.548 5.803 -5.972 1.00 0.00 C ATOM 432 NH1 ARG A 199 3.217 6.293 -4.780 1.00 0.00 N ATOM 433 NH2 ARG A 199 4.218 6.565 -6.832 1.00 0.00 N ATOM 0 H ARG A 199 3.656 0.139 -6.009 1.00 0.00 H new ATOM 0 HA ARG A 199 1.520 -0.745 -4.410 1.00 0.00 H new ATOM 0 HB2 ARG A 199 0.736 1.639 -4.660 1.00 0.00 H new ATOM 0 HB3 ARG A 199 2.345 1.408 -4.005 1.00 0.00 H new ATOM 0 HG2 ARG A 199 3.272 1.877 -6.315 1.00 0.00 H new ATOM 0 HG3 ARG A 199 1.645 2.277 -6.830 1.00 0.00 H new ATOM 0 HD2 ARG A 199 1.493 4.080 -5.203 1.00 0.00 H new ATOM 0 HD3 ARG A 199 2.997 3.596 -4.445 1.00 0.00 H new ATOM 0 HE ARG A 199 3.488 4.197 -7.210 1.00 0.00 H new ATOM 0 HH11 ARG A 199 2.709 5.712 -4.113 1.00 0.00 H new ATOM 0 HH12 ARG A 199 3.471 7.250 -4.533 1.00 0.00 H new ATOM 0 HH21 ARG A 199 4.481 6.194 -7.745 1.00 0.00 H new ATOM 0 HH22 ARG A 199 4.469 7.521 -6.579 1.00 0.00 H new ATOM 447 N ILE A 200 0.903 -0.678 -7.539 1.00 0.00 N ATOM 448 CA ILE A 200 -0.056 -1.101 -8.547 1.00 0.00 C ATOM 449 C ILE A 200 -0.712 -2.426 -8.132 1.00 0.00 C ATOM 450 O ILE A 200 -1.941 -2.541 -8.091 1.00 0.00 O ATOM 451 CB ILE A 200 0.632 -1.267 -9.928 1.00 0.00 C ATOM 452 CG1 ILE A 200 1.002 0.096 -10.527 1.00 0.00 C ATOM 453 CG2 ILE A 200 -0.259 -2.037 -10.891 1.00 0.00 C ATOM 454 CD1 ILE A 200 2.215 0.745 -9.896 1.00 0.00 C ATOM 0 H ILE A 200 1.859 -0.594 -7.883 1.00 0.00 H new ATOM 0 HA ILE A 200 -0.823 -0.331 -8.630 1.00 0.00 H new ATOM 0 HB ILE A 200 1.549 -1.836 -9.773 1.00 0.00 H new ATOM 0 HG12 ILE A 200 1.184 -0.027 -11.595 1.00 0.00 H new ATOM 0 HG13 ILE A 200 0.150 0.768 -10.424 1.00 0.00 H new ATOM 0 HG21 ILE A 200 0.246 -2.140 -11.851 1.00 0.00 H new ATOM 0 HG22 ILE A 200 -0.467 -3.026 -10.483 1.00 0.00 H new ATOM 0 HG23 ILE A 200 -1.196 -1.498 -11.030 1.00 0.00 H new ATOM 0 HD11 ILE A 200 2.407 1.704 -10.378 1.00 0.00 H new ATOM 0 HD12 ILE A 200 2.031 0.903 -8.833 1.00 0.00 H new ATOM 0 HD13 ILE A 200 3.082 0.096 -10.022 1.00 0.00 H new ATOM 466 N VAL A 201 0.121 -3.382 -7.730 1.00 0.00 N ATOM 467 CA VAL A 201 -0.353 -4.676 -7.244 1.00 0.00 C ATOM 468 C VAL A 201 -0.992 -4.532 -5.866 1.00 0.00 C ATOM 469 O VAL A 201 -2.032 -5.133 -5.581 1.00 0.00 O ATOM 470 CB VAL A 201 0.807 -5.695 -7.149 1.00 0.00 C ATOM 471 CG1 VAL A 201 0.286 -7.083 -6.812 1.00 0.00 C ATOM 472 CG2 VAL A 201 1.612 -5.725 -8.437 1.00 0.00 C ATOM 0 H VAL A 201 1.136 -3.284 -7.731 1.00 0.00 H new ATOM 0 HA VAL A 201 -1.093 -5.039 -7.957 1.00 0.00 H new ATOM 0 HB VAL A 201 1.467 -5.374 -6.343 1.00 0.00 H new ATOM 0 HG11 VAL A 201 1.121 -7.780 -6.751 1.00 0.00 H new ATOM 0 HG12 VAL A 201 -0.233 -7.054 -5.854 1.00 0.00 H new ATOM 0 HG13 VAL A 201 -0.404 -7.411 -7.589 1.00 0.00 H new ATOM 0 HG21 VAL A 201 2.421 -6.449 -8.344 1.00 0.00 H new ATOM 0 HG22 VAL A 201 0.963 -6.011 -9.265 1.00 0.00 H new ATOM 0 HG23 VAL A 201 2.030 -4.737 -8.628 1.00 0.00 H new ATOM 482 N LEU A 202 -0.339 -3.749 -5.012 1.00 0.00 N ATOM 483 CA LEU A 202 -0.786 -3.532 -3.640 1.00 0.00 C ATOM 484 C LEU A 202 -2.207 -2.970 -3.623 1.00 0.00 C ATOM 485 O LEU A 202 -3.053 -3.420 -2.851 1.00 0.00 O ATOM 486 CB LEU A 202 0.187 -2.575 -2.935 1.00 0.00 C ATOM 487 CG LEU A 202 0.360 -2.785 -1.425 1.00 0.00 C ATOM 488 CD1 LEU A 202 1.584 -2.032 -0.929 1.00 0.00 C ATOM 489 CD2 LEU A 202 -0.875 -2.331 -0.664 1.00 0.00 C ATOM 0 H LEU A 202 0.516 -3.247 -5.252 1.00 0.00 H new ATOM 0 HA LEU A 202 -0.797 -4.484 -3.109 1.00 0.00 H new ATOM 0 HB2 LEU A 202 1.164 -2.668 -3.409 1.00 0.00 H new ATOM 0 HB3 LEU A 202 -0.153 -1.553 -3.103 1.00 0.00 H new ATOM 0 HG LEU A 202 0.498 -3.851 -1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 202 1.697 -2.188 0.144 1.00 0.00 H new ATOM 0 HD12 LEU A 202 2.471 -2.400 -1.445 1.00 0.00 H new ATOM 0 HD13 LEU A 202 1.463 -0.968 -1.130 1.00 0.00 H new ATOM 0 HD21 LEU A 202 -0.724 -2.492 0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 202 -1.048 -1.271 -0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 202 -1.740 -2.904 -0.998 1.00 0.00 H new ATOM 501 N LYS A 203 -2.465 -2.025 -4.519 1.00 0.00 N ATOM 502 CA LYS A 203 -3.781 -1.407 -4.644 1.00 0.00 C ATOM 503 C LYS A 203 -4.848 -2.453 -4.950 1.00 0.00 C ATOM 504 O LYS A 203 -5.912 -2.473 -4.330 1.00 0.00 O ATOM 505 CB LYS A 203 -3.760 -0.359 -5.757 1.00 0.00 C ATOM 506 CG LYS A 203 -5.038 0.458 -5.863 1.00 0.00 C ATOM 507 CD LYS A 203 -5.071 1.273 -7.145 1.00 0.00 C ATOM 508 CE LYS A 203 -3.908 2.247 -7.227 1.00 0.00 C ATOM 509 NZ LYS A 203 -3.869 2.944 -8.537 1.00 0.00 N ATOM 0 H LYS A 203 -1.773 -1.666 -5.177 1.00 0.00 H new ATOM 0 HA LYS A 203 -4.024 -0.930 -3.695 1.00 0.00 H new ATOM 0 HB2 LYS A 203 -2.922 0.317 -5.589 1.00 0.00 H new ATOM 0 HB3 LYS A 203 -3.581 -0.859 -6.709 1.00 0.00 H new ATOM 0 HG2 LYS A 203 -5.901 -0.208 -5.831 1.00 0.00 H new ATOM 0 HG3 LYS A 203 -5.118 1.125 -5.004 1.00 0.00 H new ATOM 0 HD2 LYS A 203 -5.043 0.601 -8.003 1.00 0.00 H new ATOM 0 HD3 LYS A 203 -6.010 1.823 -7.201 1.00 0.00 H new ATOM 0 HE2 LYS A 203 -3.991 2.982 -6.426 1.00 0.00 H new ATOM 0 HE3 LYS A 203 -2.972 1.710 -7.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 203 -3.063 3.601 -8.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 203 -3.765 2.244 -9.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 203 -4.752 3.476 -8.674 1.00 0.00 H new ATOM 523 N LYS A 204 -4.560 -3.317 -5.916 1.00 0.00 N ATOM 524 CA LYS A 204 -5.496 -4.355 -6.315 1.00 0.00 C ATOM 525 C LYS A 204 -5.732 -5.340 -5.176 1.00 0.00 C ATOM 526 O LYS A 204 -6.870 -5.730 -4.906 1.00 0.00 O ATOM 527 CB LYS A 204 -4.974 -5.090 -7.551 1.00 0.00 C ATOM 528 CG LYS A 204 -5.921 -6.167 -8.064 1.00 0.00 C ATOM 529 CD LYS A 204 -5.387 -6.846 -9.317 1.00 0.00 C ATOM 530 CE LYS A 204 -5.308 -5.883 -10.495 1.00 0.00 C ATOM 531 NZ LYS A 204 -6.640 -5.321 -10.850 1.00 0.00 N ATOM 0 H LYS A 204 -3.683 -3.317 -6.437 1.00 0.00 H new ATOM 0 HA LYS A 204 -6.447 -3.882 -6.560 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -4.796 -4.366 -8.346 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -4.013 -5.546 -7.314 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -6.077 -6.914 -7.285 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -6.893 -5.723 -8.279 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -4.397 -7.254 -9.115 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -6.031 -7.686 -9.577 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -4.625 -5.069 -10.252 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -4.892 -6.401 -11.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -6.592 -4.882 -11.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -7.347 -6.083 -10.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -6.913 -4.604 -10.148 1.00 0.00 H new ATOM 545 N TYR A 205 -4.654 -5.725 -4.503 1.00 0.00 N ATOM 546 CA TYR A 205 -4.742 -6.683 -3.411 1.00 0.00 C ATOM 547 C TYR A 205 -5.544 -6.115 -2.244 1.00 0.00 C ATOM 548 O TYR A 205 -6.401 -6.802 -1.686 1.00 0.00 O ATOM 549 CB TYR A 205 -3.346 -7.091 -2.928 1.00 0.00 C ATOM 550 CG TYR A 205 -3.368 -8.188 -1.885 1.00 0.00 C ATOM 551 CD1 TYR A 205 -3.487 -9.523 -2.251 1.00 0.00 C ATOM 552 CD2 TYR A 205 -3.290 -7.886 -0.532 1.00 0.00 C ATOM 553 CE1 TYR A 205 -3.528 -10.521 -1.297 1.00 0.00 C ATOM 554 CE2 TYR A 205 -3.330 -8.876 0.426 1.00 0.00 C ATOM 555 CZ TYR A 205 -3.448 -10.192 0.039 1.00 0.00 C ATOM 556 OH TYR A 205 -3.483 -11.185 0.991 1.00 0.00 O ATOM 0 H TYR A 205 -3.711 -5.388 -4.695 1.00 0.00 H new ATOM 0 HA TYR A 205 -5.257 -7.565 -3.792 1.00 0.00 H new ATOM 0 HB2 TYR A 205 -2.757 -7.424 -3.782 1.00 0.00 H new ATOM 0 HB3 TYR A 205 -2.843 -6.217 -2.515 1.00 0.00 H new ATOM 0 HD1 TYR A 205 -3.548 -9.784 -3.297 1.00 0.00 H new ATOM 0 HD2 TYR A 205 -3.196 -6.855 -0.224 1.00 0.00 H new ATOM 0 HE1 TYR A 205 -3.622 -11.554 -1.597 1.00 0.00 H new ATOM 0 HE2 TYR A 205 -3.269 -8.621 1.474 1.00 0.00 H new ATOM 0 HH TYR A 205 -2.574 -11.515 1.154 1.00 0.00 H new ATOM 566 N VAL A 206 -5.205 -4.902 -1.817 1.00 0.00 N ATOM 567 CA VAL A 206 -5.836 -4.311 -0.648 1.00 0.00 C ATOM 568 C VAL A 206 -7.319 -4.052 -0.893 1.00 0.00 C ATOM 569 O VAL A 206 -8.143 -4.276 -0.013 1.00 0.00 O ATOM 570 CB VAL A 206 -5.125 -3.005 -0.205 1.00 0.00 C ATOM 571 CG1 VAL A 206 -5.418 -1.848 -1.128 1.00 0.00 C ATOM 572 CG2 VAL A 206 -5.519 -2.636 1.201 1.00 0.00 C ATOM 0 H VAL A 206 -4.500 -4.314 -2.262 1.00 0.00 H new ATOM 0 HA VAL A 206 -5.740 -5.033 0.163 1.00 0.00 H new ATOM 0 HB VAL A 206 -4.054 -3.204 -0.248 1.00 0.00 H new ATOM 0 HG11 VAL A 206 -4.897 -0.959 -0.773 1.00 0.00 H new ATOM 0 HG12 VAL A 206 -5.078 -2.091 -2.135 1.00 0.00 H new ATOM 0 HG13 VAL A 206 -6.491 -1.658 -1.143 1.00 0.00 H new ATOM 0 HG21 VAL A 206 -5.010 -1.717 1.492 1.00 0.00 H new ATOM 0 HG22 VAL A 206 -6.597 -2.484 1.249 1.00 0.00 H new ATOM 0 HG23 VAL A 206 -5.236 -3.439 1.881 1.00 0.00 H new ATOM 582 N LYS A 207 -7.659 -3.648 -2.107 1.00 0.00 N ATOM 583 CA LYS A 207 -9.053 -3.401 -2.461 1.00 0.00 C ATOM 584 C LYS A 207 -9.844 -4.704 -2.453 1.00 0.00 C ATOM 585 O LYS A 207 -10.998 -4.748 -2.025 1.00 0.00 O ATOM 586 CB LYS A 207 -9.151 -2.734 -3.835 1.00 0.00 C ATOM 587 CG LYS A 207 -10.536 -2.183 -4.148 1.00 0.00 C ATOM 588 CD LYS A 207 -10.575 -1.480 -5.495 1.00 0.00 C ATOM 589 CE LYS A 207 -10.406 -2.457 -6.646 1.00 0.00 C ATOM 590 NZ LYS A 207 -11.524 -3.434 -6.716 1.00 0.00 N ATOM 0 H LYS A 207 -6.994 -3.484 -2.863 1.00 0.00 H new ATOM 0 HA LYS A 207 -9.479 -2.728 -1.717 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -8.426 -1.922 -3.888 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -8.875 -3.458 -4.602 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -11.260 -2.997 -4.142 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -10.835 -1.485 -3.366 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -11.523 -0.952 -5.602 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -9.786 -0.729 -5.536 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -10.347 -1.905 -7.584 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -9.463 -2.992 -6.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -11.522 -3.898 -7.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -11.406 -4.151 -5.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -12.428 -2.938 -6.579 1.00 0.00 H new ATOM 604 N ASP A 208 -9.206 -5.763 -2.934 1.00 0.00 N ATOM 605 CA ASP A 208 -9.821 -7.083 -2.989 1.00 0.00 C ATOM 606 C ASP A 208 -9.970 -7.674 -1.587 1.00 0.00 C ATOM 607 O ASP A 208 -11.047 -8.132 -1.199 1.00 0.00 O ATOM 608 CB ASP A 208 -8.961 -8.008 -3.861 1.00 0.00 C ATOM 609 CG ASP A 208 -9.556 -9.392 -4.067 1.00 0.00 C ATOM 610 OD1 ASP A 208 -10.711 -9.627 -3.661 1.00 0.00 O ATOM 611 OD2 ASP A 208 -8.862 -10.251 -4.654 1.00 0.00 O ATOM 0 H ASP A 208 -8.253 -5.732 -3.295 1.00 0.00 H new ATOM 0 HA ASP A 208 -10.816 -6.989 -3.424 1.00 0.00 H new ATOM 0 HB2 ASP A 208 -8.812 -7.539 -4.834 1.00 0.00 H new ATOM 0 HB3 ASP A 208 -7.977 -8.111 -3.403 1.00 0.00 H new ATOM 616 N THR A 209 -8.873 -7.696 -0.849 1.00 0.00 N ATOM 617 CA THR A 209 -8.844 -8.299 0.475 1.00 0.00 C ATOM 618 C THR A 209 -9.662 -7.496 1.487 1.00 0.00 C ATOM 619 O THR A 209 -10.385 -8.064 2.309 1.00 0.00 O ATOM 620 CB THR A 209 -7.393 -8.430 0.976 1.00 0.00 C ATOM 621 OG1 THR A 209 -6.574 -8.962 -0.073 1.00 0.00 O ATOM 622 CG2 THR A 209 -7.312 -9.333 2.197 1.00 0.00 C ATOM 0 H THR A 209 -7.982 -7.299 -1.147 1.00 0.00 H new ATOM 0 HA THR A 209 -9.292 -9.289 0.386 1.00 0.00 H new ATOM 0 HB THR A 209 -7.036 -7.440 1.262 1.00 0.00 H new ATOM 0 HG1 THR A 209 -6.291 -8.236 -0.667 1.00 0.00 H new ATOM 0 HG21 THR A 209 -6.276 -9.406 2.527 1.00 0.00 H new ATOM 0 HG22 THR A 209 -7.920 -8.915 2.999 1.00 0.00 H new ATOM 0 HG23 THR A 209 -7.682 -10.326 1.941 1.00 0.00 H new ATOM 630 N PHE A 210 -9.532 -6.177 1.444 1.00 0.00 N ATOM 631 CA PHE A 210 -10.224 -5.312 2.390 1.00 0.00 C ATOM 632 C PHE A 210 -11.513 -4.749 1.797 1.00 0.00 C ATOM 633 O PHE A 210 -11.883 -3.623 2.101 1.00 0.00 O ATOM 634 CB PHE A 210 -9.327 -4.140 2.819 1.00 0.00 C ATOM 635 CG PHE A 210 -8.046 -4.534 3.507 1.00 0.00 C ATOM 636 CD1 PHE A 210 -7.039 -5.156 2.794 1.00 0.00 C ATOM 637 CD2 PHE A 210 -7.857 -4.305 4.863 1.00 0.00 C ATOM 638 CE1 PHE A 210 -5.866 -5.539 3.412 1.00 0.00 C ATOM 639 CE2 PHE A 210 -6.685 -4.685 5.487 1.00 0.00 C ATOM 640 CZ PHE A 210 -5.679 -5.211 4.796 1.00 0.00 C ATOM 0 H PHE A 210 -8.954 -5.683 0.764 1.00 0.00 H new ATOM 0 HA PHE A 210 -10.469 -5.926 3.257 1.00 0.00 H new ATOM 0 HB2 PHE A 210 -9.081 -3.550 1.937 1.00 0.00 H new ATOM 0 HB3 PHE A 210 -9.896 -3.493 3.487 1.00 0.00 H new ATOM 0 HD1 PHE A 210 -7.172 -5.345 1.739 1.00 0.00 H new ATOM 0 HD2 PHE A 210 -8.635 -3.824 5.437 1.00 0.00 H new ATOM 0 HE1 PHE A 210 -5.104 -6.075 2.865 1.00 0.00 H new ATOM 0 HE2 PHE A 210 -6.584 -4.553 6.554 1.00 0.00 H new ATOM 0 HZ PHE A 210 -4.727 -5.390 5.273 1.00 0.00 H new ATOM 650 N SER A 211 -12.195 -5.527 0.965 1.00 0.00 N ATOM 651 CA SER A 211 -13.424 -5.062 0.325 1.00 0.00 C ATOM 652 C SER A 211 -14.494 -4.705 1.360 1.00 0.00 C ATOM 653 O SER A 211 -15.197 -3.700 1.221 1.00 0.00 O ATOM 654 CB SER A 211 -13.958 -6.123 -0.644 1.00 0.00 C ATOM 655 OG SER A 211 -15.082 -5.642 -1.365 1.00 0.00 O ATOM 0 H SER A 211 -11.922 -6.478 0.717 1.00 0.00 H new ATOM 0 HA SER A 211 -13.184 -4.158 -0.235 1.00 0.00 H new ATOM 0 HB2 SER A 211 -13.171 -6.411 -1.342 1.00 0.00 H new ATOM 0 HB3 SER A 211 -14.235 -7.019 -0.089 1.00 0.00 H new ATOM 0 HG SER A 211 -15.401 -6.338 -1.976 1.00 0.00 H new ATOM 661 N SER A 212 -14.614 -5.528 2.397 1.00 0.00 N ATOM 662 CA SER A 212 -15.586 -5.286 3.454 1.00 0.00 C ATOM 663 C SER A 212 -15.233 -4.027 4.246 1.00 0.00 C ATOM 664 O SER A 212 -16.105 -3.217 4.563 1.00 0.00 O ATOM 665 CB SER A 212 -15.660 -6.495 4.388 1.00 0.00 C ATOM 666 OG SER A 212 -15.979 -7.678 3.670 1.00 0.00 O ATOM 0 H SER A 212 -14.050 -6.368 2.527 1.00 0.00 H new ATOM 0 HA SER A 212 -16.561 -5.133 2.992 1.00 0.00 H new ATOM 0 HB2 SER A 212 -14.706 -6.622 4.899 1.00 0.00 H new ATOM 0 HB3 SER A 212 -16.412 -6.319 5.157 1.00 0.00 H new ATOM 0 HG SER A 212 -16.018 -8.436 4.290 1.00 0.00 H new ATOM 672 N LYS A 213 -13.960 -3.892 4.599 1.00 0.00 N ATOM 673 CA LYS A 213 -13.496 -2.765 5.408 1.00 0.00 C ATOM 674 C LYS A 213 -13.471 -1.461 4.613 1.00 0.00 C ATOM 675 O LYS A 213 -13.775 -0.392 5.146 1.00 0.00 O ATOM 676 CB LYS A 213 -12.101 -3.053 5.955 1.00 0.00 C ATOM 677 CG LYS A 213 -12.046 -4.244 6.895 1.00 0.00 C ATOM 678 CD LYS A 213 -10.626 -4.515 7.364 1.00 0.00 C ATOM 679 CE LYS A 213 -10.573 -5.701 8.314 1.00 0.00 C ATOM 680 NZ LYS A 213 -11.080 -6.944 7.678 1.00 0.00 N ATOM 0 H LYS A 213 -13.226 -4.550 4.338 1.00 0.00 H new ATOM 0 HA LYS A 213 -14.201 -2.644 6.230 1.00 0.00 H new ATOM 0 HB2 LYS A 213 -11.423 -3.229 5.120 1.00 0.00 H new ATOM 0 HB3 LYS A 213 -11.737 -2.170 6.480 1.00 0.00 H new ATOM 0 HG2 LYS A 213 -12.686 -4.059 7.757 1.00 0.00 H new ATOM 0 HG3 LYS A 213 -12.439 -5.127 6.390 1.00 0.00 H new ATOM 0 HD2 LYS A 213 -9.987 -4.708 6.502 1.00 0.00 H new ATOM 0 HD3 LYS A 213 -10.230 -3.630 7.862 1.00 0.00 H new ATOM 0 HE2 LYS A 213 -9.546 -5.855 8.645 1.00 0.00 H new ATOM 0 HE3 LYS A 213 -11.164 -5.481 9.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 213 -10.813 -7.765 8.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 213 -12.116 -6.897 7.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 213 -10.666 -7.042 6.729 1.00 0.00 H new ATOM 694 N LEU A 214 -13.006 -1.548 3.379 1.00 0.00 N ATOM 695 CA LEU A 214 -12.813 -0.378 2.535 1.00 0.00 C ATOM 696 C LEU A 214 -14.133 0.320 2.228 1.00 0.00 C ATOM 697 O LEU A 214 -15.115 -0.324 1.848 1.00 0.00 O ATOM 698 CB LEU A 214 -12.137 -0.792 1.226 1.00 0.00 C ATOM 699 CG LEU A 214 -11.842 0.344 0.251 1.00 0.00 C ATOM 700 CD1 LEU A 214 -10.824 1.301 0.847 1.00 0.00 C ATOM 701 CD2 LEU A 214 -11.352 -0.213 -1.074 1.00 0.00 C ATOM 0 H LEU A 214 -12.751 -2.429 2.933 1.00 0.00 H new ATOM 0 HA LEU A 214 -12.179 0.324 3.078 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -11.200 -1.295 1.465 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -12.772 -1.522 0.724 1.00 0.00 H new ATOM 0 HG LEU A 214 -12.763 0.898 0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -10.624 2.106 0.140 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -11.218 1.721 1.773 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -9.899 0.764 1.057 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -11.145 0.609 -1.760 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -10.441 -0.788 -0.912 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -12.118 -0.860 -1.502 1.00 0.00 H new ATOM 713 N LYS A 215 -14.127 1.644 2.352 1.00 0.00 N ATOM 714 CA LYS A 215 -15.284 2.465 2.023 1.00 0.00 C ATOM 715 C LYS A 215 -15.677 2.254 0.564 1.00 0.00 C ATOM 716 O LYS A 215 -16.826 1.933 0.265 1.00 0.00 O ATOM 717 CB LYS A 215 -14.958 3.944 2.268 1.00 0.00 C ATOM 718 CG LYS A 215 -16.138 4.883 2.058 1.00 0.00 C ATOM 719 CD LYS A 215 -17.295 4.561 2.995 1.00 0.00 C ATOM 720 CE LYS A 215 -16.889 4.687 4.455 1.00 0.00 C ATOM 721 NZ LYS A 215 -18.016 4.377 5.377 1.00 0.00 N ATOM 0 H LYS A 215 -13.321 2.175 2.683 1.00 0.00 H new ATOM 0 HA LYS A 215 -16.119 2.173 2.659 1.00 0.00 H new ATOM 0 HB2 LYS A 215 -14.592 4.060 3.288 1.00 0.00 H new ATOM 0 HB3 LYS A 215 -14.148 4.242 1.603 1.00 0.00 H new ATOM 0 HG2 LYS A 215 -15.816 5.912 2.219 1.00 0.00 H new ATOM 0 HG3 LYS A 215 -16.478 4.813 1.025 1.00 0.00 H new ATOM 0 HD2 LYS A 215 -18.128 5.234 2.790 1.00 0.00 H new ATOM 0 HD3 LYS A 215 -17.649 3.548 2.802 1.00 0.00 H new ATOM 0 HE2 LYS A 215 -16.058 4.012 4.659 1.00 0.00 H new ATOM 0 HE3 LYS A 215 -16.533 5.699 4.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 215 -17.696 4.475 6.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 215 -18.800 5.037 5.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 215 -18.340 3.402 5.214 1.00 0.00 H new ATOM 735 N THR A 216 -14.677 2.324 -0.316 1.00 0.00 N ATOM 736 CA THR A 216 -14.856 2.058 -1.742 1.00 0.00 C ATOM 737 C THR A 216 -15.663 3.167 -2.431 1.00 0.00 C ATOM 738 O THR A 216 -16.710 3.590 -1.937 1.00 0.00 O ATOM 739 CB THR A 216 -15.545 0.693 -1.968 1.00 0.00 C ATOM 740 OG1 THR A 216 -14.902 -0.312 -1.168 1.00 0.00 O ATOM 741 CG2 THR A 216 -15.485 0.285 -3.431 1.00 0.00 C ATOM 0 H THR A 216 -13.720 2.567 -0.059 1.00 0.00 H new ATOM 0 HA THR A 216 -13.862 2.033 -2.188 1.00 0.00 H new ATOM 0 HB THR A 216 -16.591 0.788 -1.677 1.00 0.00 H new ATOM 0 HG1 THR A 216 -15.191 -0.222 -0.236 1.00 0.00 H new ATOM 0 HG21 THR A 216 -15.977 -0.679 -3.560 1.00 0.00 H new ATOM 0 HG22 THR A 216 -15.991 1.035 -4.039 1.00 0.00 H new ATOM 0 HG23 THR A 216 -14.444 0.206 -3.744 1.00 0.00 H new ATOM 749 N SER A 217 -15.161 3.623 -3.582 1.00 0.00 N ATOM 750 CA SER A 217 -15.826 4.661 -4.372 1.00 0.00 C ATOM 751 C SER A 217 -15.969 5.961 -3.577 1.00 0.00 C ATOM 752 O SER A 217 -17.079 6.458 -3.362 1.00 0.00 O ATOM 753 CB SER A 217 -17.194 4.167 -4.860 1.00 0.00 C ATOM 754 OG SER A 217 -17.065 2.955 -5.593 1.00 0.00 O ATOM 0 H SER A 217 -14.289 3.286 -3.989 1.00 0.00 H new ATOM 0 HA SER A 217 -15.203 4.874 -5.241 1.00 0.00 H new ATOM 0 HB2 SER A 217 -17.854 4.012 -4.007 1.00 0.00 H new ATOM 0 HB3 SER A 217 -17.657 4.928 -5.487 1.00 0.00 H new ATOM 0 HG SER A 217 -17.950 2.658 -5.893 1.00 0.00 H new ATOM 760 N SER A 218 -14.838 6.523 -3.175 1.00 0.00 N ATOM 761 CA SER A 218 -14.827 7.776 -2.439 1.00 0.00 C ATOM 762 C SER A 218 -13.497 8.503 -2.630 1.00 0.00 C ATOM 763 O SER A 218 -13.448 9.573 -3.236 1.00 0.00 O ATOM 764 CB SER A 218 -15.080 7.507 -0.952 1.00 0.00 C ATOM 765 OG SER A 218 -15.055 8.705 -0.194 1.00 0.00 O ATOM 0 H SER A 218 -13.914 6.128 -3.348 1.00 0.00 H new ATOM 0 HA SER A 218 -15.621 8.415 -2.825 1.00 0.00 H new ATOM 0 HB2 SER A 218 -16.046 7.018 -0.829 1.00 0.00 H new ATOM 0 HB3 SER A 218 -14.324 6.819 -0.572 1.00 0.00 H new ATOM 0 HG SER A 218 -15.221 8.499 0.749 1.00 0.00 H new ATOM 771 N ASN A 219 -12.415 7.891 -2.159 1.00 0.00 N ATOM 772 CA ASN A 219 -11.078 8.469 -2.287 1.00 0.00 C ATOM 773 C ASN A 219 -10.025 7.384 -2.152 1.00 0.00 C ATOM 774 O ASN A 219 -9.044 7.550 -1.430 1.00 0.00 O ATOM 775 CB ASN A 219 -10.831 9.543 -1.215 1.00 0.00 C ATOM 776 CG ASN A 219 -11.163 10.949 -1.687 1.00 0.00 C ATOM 777 OD1 ASN A 219 -10.648 11.417 -2.703 1.00 0.00 O ATOM 778 ND2 ASN A 219 -12.008 11.642 -0.941 1.00 0.00 N ATOM 0 H ASN A 219 -12.437 6.990 -1.682 1.00 0.00 H new ATOM 0 HA ASN A 219 -11.010 8.933 -3.271 1.00 0.00 H new ATOM 0 HB2 ASN A 219 -11.430 9.312 -0.334 1.00 0.00 H new ATOM 0 HB3 ASN A 219 -9.786 9.507 -0.908 1.00 0.00 H new ATOM 0 HD21 ASN A 219 -12.253 12.597 -1.201 1.00 0.00 H new ATOM 0 HD22 ASN A 219 -12.415 11.221 -0.106 1.00 0.00 H new ATOM 785 N PHE A 220 -10.266 6.246 -2.795 1.00 0.00 N ATOM 786 CA PHE A 220 -9.373 5.102 -2.668 1.00 0.00 C ATOM 787 C PHE A 220 -7.983 5.426 -3.195 1.00 0.00 C ATOM 788 O PHE A 220 -7.005 5.341 -2.460 1.00 0.00 O ATOM 789 CB PHE A 220 -9.934 3.884 -3.407 1.00 0.00 C ATOM 790 CG PHE A 220 -9.127 2.633 -3.183 1.00 0.00 C ATOM 791 CD1 PHE A 220 -8.789 2.224 -1.903 1.00 0.00 C ATOM 792 CD2 PHE A 220 -8.723 1.858 -4.257 1.00 0.00 C ATOM 793 CE1 PHE A 220 -8.058 1.065 -1.705 1.00 0.00 C ATOM 794 CE2 PHE A 220 -7.996 0.700 -4.064 1.00 0.00 C ATOM 795 CZ PHE A 220 -7.617 0.342 -2.748 1.00 0.00 C ATOM 0 H PHE A 220 -11.068 6.093 -3.406 1.00 0.00 H new ATOM 0 HA PHE A 220 -9.297 4.867 -1.606 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -10.960 3.710 -3.082 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -9.970 4.099 -4.475 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -9.098 2.814 -1.053 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -8.980 2.164 -5.260 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -7.839 0.738 -0.699 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -7.721 0.078 -4.903 1.00 0.00 H new ATOM 0 HZ PHE A 220 -6.975 -0.510 -2.583 1.00 0.00 H new ATOM 805 N ASP A 221 -7.897 5.787 -4.470 1.00 0.00 N ATOM 806 CA ASP A 221 -6.607 6.082 -5.090 1.00 0.00 C ATOM 807 C ASP A 221 -5.943 7.285 -4.432 1.00 0.00 C ATOM 808 O ASP A 221 -4.719 7.315 -4.268 1.00 0.00 O ATOM 809 CB ASP A 221 -6.738 6.314 -6.603 1.00 0.00 C ATOM 810 CG ASP A 221 -7.531 7.555 -6.964 1.00 0.00 C ATOM 811 OD1 ASP A 221 -8.759 7.564 -6.757 1.00 0.00 O ATOM 812 OD2 ASP A 221 -6.927 8.529 -7.455 1.00 0.00 O ATOM 0 H ASP A 221 -8.699 5.883 -5.093 1.00 0.00 H new ATOM 0 HA ASP A 221 -5.976 5.206 -4.937 1.00 0.00 H new ATOM 0 HB2 ASP A 221 -5.741 6.392 -7.037 1.00 0.00 H new ATOM 0 HB3 ASP A 221 -7.216 5.445 -7.055 1.00 0.00 H new ATOM 817 N TYR A 222 -6.750 8.257 -4.026 1.00 0.00 N ATOM 818 CA TYR A 222 -6.236 9.444 -3.360 1.00 0.00 C ATOM 819 C TYR A 222 -5.586 9.081 -2.030 1.00 0.00 C ATOM 820 O TYR A 222 -4.422 9.409 -1.785 1.00 0.00 O ATOM 821 CB TYR A 222 -7.360 10.459 -3.124 1.00 0.00 C ATOM 822 CG TYR A 222 -6.946 11.620 -2.245 1.00 0.00 C ATOM 823 CD1 TYR A 222 -5.919 12.475 -2.622 1.00 0.00 C ATOM 824 CD2 TYR A 222 -7.579 11.851 -1.029 1.00 0.00 C ATOM 825 CE1 TYR A 222 -5.536 13.527 -1.815 1.00 0.00 C ATOM 826 CE2 TYR A 222 -7.199 12.898 -0.216 1.00 0.00 C ATOM 827 CZ TYR A 222 -6.176 13.733 -0.612 1.00 0.00 C ATOM 828 OH TYR A 222 -5.791 14.774 0.202 1.00 0.00 O ATOM 0 H TYR A 222 -7.763 8.246 -4.147 1.00 0.00 H new ATOM 0 HA TYR A 222 -5.483 9.891 -4.009 1.00 0.00 H new ATOM 0 HB2 TYR A 222 -7.700 10.844 -4.085 1.00 0.00 H new ATOM 0 HB3 TYR A 222 -8.209 9.951 -2.666 1.00 0.00 H new ATOM 0 HD1 TYR A 222 -5.412 12.314 -3.562 1.00 0.00 H new ATOM 0 HD2 TYR A 222 -8.382 11.200 -0.716 1.00 0.00 H new ATOM 0 HE1 TYR A 222 -4.738 14.186 -2.125 1.00 0.00 H new ATOM 0 HE2 TYR A 222 -7.700 13.063 0.726 1.00 0.00 H new ATOM 0 HH TYR A 222 -6.344 14.779 1.011 1.00 0.00 H new ATOM 838 N LEU A 223 -6.349 8.426 -1.168 1.00 0.00 N ATOM 839 CA LEU A 223 -5.871 8.074 0.157 1.00 0.00 C ATOM 840 C LEU A 223 -4.804 6.998 0.109 1.00 0.00 C ATOM 841 O LEU A 223 -3.909 6.986 0.945 1.00 0.00 O ATOM 842 CB LEU A 223 -7.021 7.642 1.060 1.00 0.00 C ATOM 843 CG LEU A 223 -7.755 8.796 1.736 1.00 0.00 C ATOM 844 CD1 LEU A 223 -8.861 8.276 2.644 1.00 0.00 C ATOM 845 CD2 LEU A 223 -6.764 9.645 2.515 1.00 0.00 C ATOM 0 H LEU A 223 -7.304 8.128 -1.365 1.00 0.00 H new ATOM 0 HA LEU A 223 -5.417 8.971 0.578 1.00 0.00 H new ATOM 0 HB2 LEU A 223 -7.735 7.068 0.470 1.00 0.00 H new ATOM 0 HB3 LEU A 223 -6.633 6.974 1.829 1.00 0.00 H new ATOM 0 HG LEU A 223 -8.222 9.416 0.971 1.00 0.00 H new ATOM 0 HD11 LEU A 223 -9.370 9.117 3.115 1.00 0.00 H new ATOM 0 HD12 LEU A 223 -9.576 7.703 2.054 1.00 0.00 H new ATOM 0 HD13 LEU A 223 -8.429 7.636 3.413 1.00 0.00 H new ATOM 0 HD21 LEU A 223 -7.291 10.469 2.997 1.00 0.00 H new ATOM 0 HD22 LEU A 223 -6.277 9.032 3.274 1.00 0.00 H new ATOM 0 HD23 LEU A 223 -6.012 10.044 1.834 1.00 0.00 H new ATOM 857 N PHE A 224 -4.897 6.103 -0.863 1.00 0.00 N ATOM 858 CA PHE A 224 -3.915 5.037 -1.012 1.00 0.00 C ATOM 859 C PHE A 224 -2.517 5.626 -1.136 1.00 0.00 C ATOM 860 O PHE A 224 -1.643 5.337 -0.327 1.00 0.00 O ATOM 861 CB PHE A 224 -4.231 4.189 -2.249 1.00 0.00 C ATOM 862 CG PHE A 224 -3.337 2.995 -2.410 1.00 0.00 C ATOM 863 CD1 PHE A 224 -3.341 1.978 -1.471 1.00 0.00 C ATOM 864 CD2 PHE A 224 -2.495 2.889 -3.507 1.00 0.00 C ATOM 865 CE1 PHE A 224 -2.521 0.877 -1.621 1.00 0.00 C ATOM 866 CE2 PHE A 224 -1.671 1.791 -3.660 1.00 0.00 C ATOM 867 CZ PHE A 224 -1.684 0.784 -2.716 1.00 0.00 C ATOM 0 H PHE A 224 -5.641 6.093 -1.560 1.00 0.00 H new ATOM 0 HA PHE A 224 -3.958 4.401 -0.128 1.00 0.00 H new ATOM 0 HB2 PHE A 224 -5.266 3.851 -2.192 1.00 0.00 H new ATOM 0 HB3 PHE A 224 -4.149 4.815 -3.138 1.00 0.00 H new ATOM 0 HD1 PHE A 224 -3.992 2.046 -0.612 1.00 0.00 H new ATOM 0 HD2 PHE A 224 -2.483 3.673 -4.249 1.00 0.00 H new ATOM 0 HE1 PHE A 224 -2.534 0.089 -0.883 1.00 0.00 H new ATOM 0 HE2 PHE A 224 -1.018 1.720 -4.517 1.00 0.00 H new ATOM 0 HZ PHE A 224 -1.041 -0.075 -2.833 1.00 0.00 H new ATOM 877 N ASN A 225 -2.339 6.512 -2.110 1.00 0.00 N ATOM 878 CA ASN A 225 -1.053 7.164 -2.336 1.00 0.00 C ATOM 879 C ASN A 225 -0.651 8.013 -1.131 1.00 0.00 C ATOM 880 O ASN A 225 0.511 8.020 -0.723 1.00 0.00 O ATOM 881 CB ASN A 225 -1.125 8.031 -3.600 1.00 0.00 C ATOM 882 CG ASN A 225 0.233 8.519 -4.073 1.00 0.00 C ATOM 883 OD1 ASN A 225 0.919 9.276 -3.385 1.00 0.00 O ATOM 884 ND2 ASN A 225 0.630 8.090 -5.260 1.00 0.00 N ATOM 0 H ASN A 225 -3.073 6.797 -2.759 1.00 0.00 H new ATOM 0 HA ASN A 225 -0.293 6.394 -2.473 1.00 0.00 H new ATOM 0 HB2 ASN A 225 -1.596 7.458 -4.399 1.00 0.00 H new ATOM 0 HB3 ASN A 225 -1.765 8.892 -3.406 1.00 0.00 H new ATOM 0 HD21 ASN A 225 1.532 8.386 -5.634 1.00 0.00 H new ATOM 0 HD22 ASN A 225 0.034 7.463 -5.801 1.00 0.00 H new ATOM 891 N SER A 226 -1.622 8.719 -0.562 1.00 0.00 N ATOM 892 CA SER A 226 -1.377 9.585 0.586 1.00 0.00 C ATOM 893 C SER A 226 -0.913 8.780 1.803 1.00 0.00 C ATOM 894 O SER A 226 0.035 9.168 2.490 1.00 0.00 O ATOM 895 CB SER A 226 -2.646 10.372 0.925 1.00 0.00 C ATOM 896 OG SER A 226 -2.407 11.339 1.934 1.00 0.00 O ATOM 0 H SER A 226 -2.591 8.708 -0.879 1.00 0.00 H new ATOM 0 HA SER A 226 -0.580 10.281 0.323 1.00 0.00 H new ATOM 0 HB2 SER A 226 -3.019 10.866 0.028 1.00 0.00 H new ATOM 0 HB3 SER A 226 -3.424 9.684 1.257 1.00 0.00 H new ATOM 0 HG SER A 226 -3.237 11.824 2.125 1.00 0.00 H new ATOM 902 N ALA A 227 -1.586 7.667 2.064 1.00 0.00 N ATOM 903 CA ALA A 227 -1.258 6.817 3.202 1.00 0.00 C ATOM 904 C ALA A 227 0.146 6.245 3.070 1.00 0.00 C ATOM 905 O ALA A 227 0.864 6.108 4.061 1.00 0.00 O ATOM 906 CB ALA A 227 -2.272 5.694 3.334 1.00 0.00 C ATOM 0 H ALA A 227 -2.366 7.330 1.500 1.00 0.00 H new ATOM 0 HA ALA A 227 -1.293 7.431 4.102 1.00 0.00 H new ATOM 0 HB1 ALA A 227 -2.013 5.068 4.188 1.00 0.00 H new ATOM 0 HB2 ALA A 227 -3.266 6.117 3.482 1.00 0.00 H new ATOM 0 HB3 ALA A 227 -2.266 5.090 2.427 1.00 0.00 H new ATOM 912 N ILE A 228 0.538 5.935 1.839 1.00 0.00 N ATOM 913 CA ILE A 228 1.868 5.391 1.570 1.00 0.00 C ATOM 914 C ILE A 228 2.962 6.360 2.037 1.00 0.00 C ATOM 915 O ILE A 228 4.013 5.935 2.524 1.00 0.00 O ATOM 916 CB ILE A 228 2.067 5.059 0.073 1.00 0.00 C ATOM 917 CG1 ILE A 228 0.993 4.079 -0.402 1.00 0.00 C ATOM 918 CG2 ILE A 228 3.450 4.470 -0.165 1.00 0.00 C ATOM 919 CD1 ILE A 228 1.021 3.809 -1.891 1.00 0.00 C ATOM 0 H ILE A 228 -0.045 6.050 1.010 1.00 0.00 H new ATOM 0 HA ILE A 228 1.948 4.462 2.135 1.00 0.00 H new ATOM 0 HB ILE A 228 1.978 5.984 -0.497 1.00 0.00 H new ATOM 0 HG12 ILE A 228 1.116 3.136 0.130 1.00 0.00 H new ATOM 0 HG13 ILE A 228 0.013 4.472 -0.133 1.00 0.00 H new ATOM 0 HG21 ILE A 228 3.571 4.243 -1.224 1.00 0.00 H new ATOM 0 HG22 ILE A 228 4.209 5.189 0.141 1.00 0.00 H new ATOM 0 HG23 ILE A 228 3.561 3.555 0.417 1.00 0.00 H new ATOM 0 HD11 ILE A 228 0.230 3.105 -2.148 1.00 0.00 H new ATOM 0 HD12 ILE A 228 0.867 4.742 -2.433 1.00 0.00 H new ATOM 0 HD13 ILE A 228 1.987 3.385 -2.166 1.00 0.00 H new ATOM 931 N LYS A 229 2.679 7.659 1.963 1.00 0.00 N ATOM 932 CA LYS A 229 3.617 8.671 2.440 1.00 0.00 C ATOM 933 C LYS A 229 3.827 8.540 3.947 1.00 0.00 C ATOM 934 O LYS A 229 4.942 8.684 4.442 1.00 0.00 O ATOM 935 CB LYS A 229 3.136 10.081 2.092 1.00 0.00 C ATOM 936 CG LYS A 229 4.138 11.161 2.473 1.00 0.00 C ATOM 937 CD LYS A 229 3.747 12.524 1.925 1.00 0.00 C ATOM 938 CE LYS A 229 2.468 13.047 2.554 1.00 0.00 C ATOM 939 NZ LYS A 229 2.155 14.427 2.101 1.00 0.00 N ATOM 0 H LYS A 229 1.811 8.034 1.579 1.00 0.00 H new ATOM 0 HA LYS A 229 4.570 8.505 1.937 1.00 0.00 H new ATOM 0 HB2 LYS A 229 2.938 10.138 1.022 1.00 0.00 H new ATOM 0 HB3 LYS A 229 2.192 10.273 2.601 1.00 0.00 H new ATOM 0 HG2 LYS A 229 4.215 11.216 3.559 1.00 0.00 H new ATOM 0 HG3 LYS A 229 5.124 10.889 2.097 1.00 0.00 H new ATOM 0 HD2 LYS A 229 4.555 13.232 2.106 1.00 0.00 H new ATOM 0 HD3 LYS A 229 3.618 12.457 0.845 1.00 0.00 H new ATOM 0 HE2 LYS A 229 1.641 12.385 2.300 1.00 0.00 H new ATOM 0 HE3 LYS A 229 2.565 13.034 3.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 229 1.275 14.749 2.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 229 2.933 15.064 2.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 229 2.037 14.435 1.068 1.00 0.00 H new ATOM 953 N LYS A 230 2.777 8.151 4.653 1.00 0.00 N ATOM 954 CA LYS A 230 2.890 7.854 6.075 1.00 0.00 C ATOM 955 C LYS A 230 3.662 6.553 6.278 1.00 0.00 C ATOM 956 O LYS A 230 4.551 6.474 7.122 1.00 0.00 O ATOM 957 CB LYS A 230 1.503 7.742 6.713 1.00 0.00 C ATOM 958 CG LYS A 230 0.782 9.071 6.874 1.00 0.00 C ATOM 959 CD LYS A 230 0.864 9.585 8.305 1.00 0.00 C ATOM 960 CE LYS A 230 2.268 10.042 8.675 1.00 0.00 C ATOM 961 NZ LYS A 230 2.608 11.349 8.059 1.00 0.00 N ATOM 0 H LYS A 230 1.840 8.033 4.268 1.00 0.00 H new ATOM 0 HA LYS A 230 3.430 8.669 6.556 1.00 0.00 H new ATOM 0 HB2 LYS A 230 0.888 7.079 6.104 1.00 0.00 H new ATOM 0 HB3 LYS A 230 1.603 7.274 7.693 1.00 0.00 H new ATOM 0 HG2 LYS A 230 1.218 9.806 6.197 1.00 0.00 H new ATOM 0 HG3 LYS A 230 -0.263 8.955 6.588 1.00 0.00 H new ATOM 0 HD2 LYS A 230 0.169 10.415 8.431 1.00 0.00 H new ATOM 0 HD3 LYS A 230 0.548 8.798 8.990 1.00 0.00 H new ATOM 0 HE2 LYS A 230 2.350 10.120 9.759 1.00 0.00 H new ATOM 0 HE3 LYS A 230 2.990 9.291 8.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 230 3.559 11.639 8.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 230 2.588 11.260 7.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 230 1.915 12.065 8.358 1.00 0.00 H new ATOM 975 N CYS A 231 3.321 5.546 5.480 1.00 0.00 N ATOM 976 CA CYS A 231 3.953 4.230 5.565 1.00 0.00 C ATOM 977 C CYS A 231 5.465 4.300 5.353 1.00 0.00 C ATOM 978 O CYS A 231 6.227 3.608 6.035 1.00 0.00 O ATOM 979 CB CYS A 231 3.325 3.288 4.536 1.00 0.00 C ATOM 980 SG CYS A 231 1.557 2.999 4.782 1.00 0.00 S ATOM 0 H CYS A 231 2.603 5.616 4.759 1.00 0.00 H new ATOM 0 HA CYS A 231 3.783 3.848 6.572 1.00 0.00 H new ATOM 0 HB2 CYS A 231 3.479 3.701 3.539 1.00 0.00 H new ATOM 0 HB3 CYS A 231 3.847 2.331 4.569 1.00 0.00 H new ATOM 0 HG CYS A 231 0.901 4.097 4.548 1.00 0.00 H new ATOM 986 N VAL A 232 5.906 5.119 4.405 1.00 0.00 N ATOM 987 CA VAL A 232 7.331 5.247 4.127 1.00 0.00 C ATOM 988 C VAL A 232 8.049 5.937 5.293 1.00 0.00 C ATOM 989 O VAL A 232 9.196 5.617 5.611 1.00 0.00 O ATOM 990 CB VAL A 232 7.602 5.992 2.799 1.00 0.00 C ATOM 991 CG1 VAL A 232 7.156 7.438 2.867 1.00 0.00 C ATOM 992 CG2 VAL A 232 9.072 5.906 2.422 1.00 0.00 C ATOM 0 H VAL A 232 5.304 5.699 3.821 1.00 0.00 H new ATOM 0 HA VAL A 232 7.730 4.239 4.016 1.00 0.00 H new ATOM 0 HB VAL A 232 7.014 5.500 2.024 1.00 0.00 H new ATOM 0 HG11 VAL A 232 7.363 7.928 1.915 1.00 0.00 H new ATOM 0 HG12 VAL A 232 6.086 7.480 3.071 1.00 0.00 H new ATOM 0 HG13 VAL A 232 7.697 7.949 3.663 1.00 0.00 H new ATOM 0 HG21 VAL A 232 9.239 6.437 1.485 1.00 0.00 H new ATOM 0 HG22 VAL A 232 9.676 6.359 3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 232 9.356 4.861 2.302 1.00 0.00 H new ATOM 1002 N GLU A 233 7.330 6.810 5.992 1.00 0.00 N ATOM 1003 CA GLU A 233 7.856 7.447 7.194 1.00 0.00 C ATOM 1004 C GLU A 233 7.930 6.438 8.336 1.00 0.00 C ATOM 1005 O GLU A 233 8.820 6.504 9.189 1.00 0.00 O ATOM 1006 CB GLU A 233 6.982 8.634 7.609 1.00 0.00 C ATOM 1007 CG GLU A 233 6.975 9.783 6.611 1.00 0.00 C ATOM 1008 CD GLU A 233 8.347 10.388 6.380 1.00 0.00 C ATOM 1009 OE1 GLU A 233 9.330 9.934 7.004 1.00 0.00 O ATOM 1010 OE2 GLU A 233 8.450 11.327 5.564 1.00 0.00 O ATOM 0 H GLU A 233 6.381 7.092 5.746 1.00 0.00 H new ATOM 0 HA GLU A 233 8.858 7.814 6.972 1.00 0.00 H new ATOM 0 HB2 GLU A 233 5.959 8.285 7.752 1.00 0.00 H new ATOM 0 HB3 GLU A 233 7.329 9.007 8.573 1.00 0.00 H new ATOM 0 HG2 GLU A 233 6.578 9.426 5.660 1.00 0.00 H new ATOM 0 HG3 GLU A 233 6.299 10.560 6.967 1.00 0.00 H new ATOM 1017 N ASN A 234 6.967 5.525 8.352 1.00 0.00 N ATOM 1018 CA ASN A 234 6.874 4.498 9.385 1.00 0.00 C ATOM 1019 C ASN A 234 8.136 3.645 9.430 1.00 0.00 C ATOM 1020 O ASN A 234 8.698 3.411 10.499 1.00 0.00 O ATOM 1021 CB ASN A 234 5.649 3.611 9.130 1.00 0.00 C ATOM 1022 CG ASN A 234 4.337 4.328 9.399 1.00 0.00 C ATOM 1023 OD1 ASN A 234 3.263 3.818 9.081 1.00 0.00 O ATOM 1024 ND2 ASN A 234 4.408 5.508 10.003 1.00 0.00 N ATOM 0 H ASN A 234 6.228 5.475 7.650 1.00 0.00 H new ATOM 0 HA ASN A 234 6.768 4.994 10.350 1.00 0.00 H new ATOM 0 HB2 ASN A 234 5.664 3.267 8.096 1.00 0.00 H new ATOM 0 HB3 ASN A 234 5.710 2.725 9.762 1.00 0.00 H new ATOM 0 HD21 ASN A 234 3.554 6.023 10.218 1.00 0.00 H new ATOM 0 HD22 ASN A 234 5.316 5.900 10.252 1.00 0.00 H new ATOM 1031 N GLY A 235 8.596 3.217 8.261 1.00 0.00 N ATOM 1032 CA GLY A 235 9.808 2.427 8.188 1.00 0.00 C ATOM 1033 C GLY A 235 9.608 1.157 7.393 1.00 0.00 C ATOM 1034 O GLY A 235 10.483 0.752 6.631 1.00 0.00 O ATOM 0 H GLY A 235 8.151 3.403 7.362 1.00 0.00 H new ATOM 0 HA2 GLY A 235 10.600 3.020 7.731 1.00 0.00 H new ATOM 0 HA3 GLY A 235 10.138 2.176 9.196 1.00 0.00 H new ATOM 1038 N GLU A 236 8.465 0.515 7.604 1.00 0.00 N ATOM 1039 CA GLU A 236 8.144 -0.741 6.932 1.00 0.00 C ATOM 1040 C GLU A 236 8.179 -0.573 5.415 1.00 0.00 C ATOM 1041 O GLU A 236 8.673 -1.438 4.690 1.00 0.00 O ATOM 1042 CB GLU A 236 6.754 -1.225 7.354 1.00 0.00 C ATOM 1043 CG GLU A 236 6.717 -2.663 7.840 1.00 0.00 C ATOM 1044 CD GLU A 236 7.255 -2.823 9.249 1.00 0.00 C ATOM 1045 OE1 GLU A 236 6.712 -2.171 10.171 1.00 0.00 O ATOM 1046 OE2 GLU A 236 8.191 -3.625 9.452 1.00 0.00 O ATOM 0 H GLU A 236 7.739 0.846 8.240 1.00 0.00 H new ATOM 0 HA GLU A 236 8.893 -1.478 7.222 1.00 0.00 H new ATOM 0 HB2 GLU A 236 6.380 -0.576 8.146 1.00 0.00 H new ATOM 0 HB3 GLU A 236 6.073 -1.121 6.509 1.00 0.00 H new ATOM 0 HG2 GLU A 236 5.690 -3.027 7.805 1.00 0.00 H new ATOM 0 HG3 GLU A 236 7.299 -3.286 7.161 1.00 0.00 H new ATOM 1053 N LEU A 237 7.611 0.524 4.938 1.00 0.00 N ATOM 1054 CA LEU A 237 7.540 0.784 3.509 1.00 0.00 C ATOM 1055 C LEU A 237 8.639 1.722 3.057 1.00 0.00 C ATOM 1056 O LEU A 237 8.980 2.678 3.752 1.00 0.00 O ATOM 1057 CB LEU A 237 6.173 1.354 3.137 1.00 0.00 C ATOM 1058 CG LEU A 237 5.244 0.354 2.460 1.00 0.00 C ATOM 1059 CD1 LEU A 237 5.249 -0.955 3.221 1.00 0.00 C ATOM 1060 CD2 LEU A 237 3.836 0.902 2.354 1.00 0.00 C ATOM 0 H LEU A 237 7.192 1.249 5.521 1.00 0.00 H new ATOM 0 HA LEU A 237 7.681 -0.167 2.995 1.00 0.00 H new ATOM 0 HB2 LEU A 237 5.690 1.729 4.039 1.00 0.00 H new ATOM 0 HB3 LEU A 237 6.316 2.207 2.474 1.00 0.00 H new ATOM 0 HG LEU A 237 5.609 0.177 1.448 1.00 0.00 H new ATOM 0 HD11 LEU A 237 4.582 -1.664 2.730 1.00 0.00 H new ATOM 0 HD12 LEU A 237 6.260 -1.361 3.240 1.00 0.00 H new ATOM 0 HD13 LEU A 237 4.908 -0.784 4.242 1.00 0.00 H new ATOM 0 HD21 LEU A 237 3.195 0.167 1.867 1.00 0.00 H new ATOM 0 HD22 LEU A 237 3.452 1.114 3.352 1.00 0.00 H new ATOM 0 HD23 LEU A 237 3.846 1.820 1.767 1.00 0.00 H new ATOM 1072 N VAL A 238 9.158 1.460 1.874 1.00 0.00 N ATOM 1073 CA VAL A 238 10.190 2.301 1.284 1.00 0.00 C ATOM 1074 C VAL A 238 9.846 2.611 -0.172 1.00 0.00 C ATOM 1075 O VAL A 238 9.274 1.772 -0.872 1.00 0.00 O ATOM 1076 CB VAL A 238 11.589 1.637 1.370 1.00 0.00 C ATOM 1077 CG1 VAL A 238 11.714 0.457 0.415 1.00 0.00 C ATOM 1078 CG2 VAL A 238 12.691 2.651 1.107 1.00 0.00 C ATOM 0 H VAL A 238 8.882 0.666 1.296 1.00 0.00 H new ATOM 0 HA VAL A 238 10.227 3.230 1.854 1.00 0.00 H new ATOM 0 HB VAL A 238 11.702 1.257 2.385 1.00 0.00 H new ATOM 0 HG11 VAL A 238 12.708 0.019 0.506 1.00 0.00 H new ATOM 0 HG12 VAL A 238 10.963 -0.293 0.663 1.00 0.00 H new ATOM 0 HG13 VAL A 238 11.560 0.799 -0.608 1.00 0.00 H new ATOM 0 HG21 VAL A 238 13.661 2.159 1.173 1.00 0.00 H new ATOM 0 HG22 VAL A 238 12.566 3.074 0.110 1.00 0.00 H new ATOM 0 HG23 VAL A 238 12.637 3.448 1.849 1.00 0.00 H new ATOM 1088 N GLN A 239 10.174 3.819 -0.615 1.00 0.00 N ATOM 1089 CA GLN A 239 9.910 4.222 -1.986 1.00 0.00 C ATOM 1090 C GLN A 239 11.184 4.718 -2.658 1.00 0.00 C ATOM 1091 O GLN A 239 11.569 5.879 -2.500 1.00 0.00 O ATOM 1092 CB GLN A 239 8.847 5.323 -2.050 1.00 0.00 C ATOM 1093 CG GLN A 239 7.470 4.888 -1.589 1.00 0.00 C ATOM 1094 CD GLN A 239 6.395 5.896 -1.948 1.00 0.00 C ATOM 1095 OE1 GLN A 239 6.113 6.125 -3.125 1.00 0.00 O ATOM 1096 NE2 GLN A 239 5.804 6.518 -0.942 1.00 0.00 N ATOM 0 H GLN A 239 10.623 4.534 -0.043 1.00 0.00 H new ATOM 0 HA GLN A 239 9.539 3.343 -2.514 1.00 0.00 H new ATOM 0 HB2 GLN A 239 9.174 6.163 -1.438 1.00 0.00 H new ATOM 0 HB3 GLN A 239 8.777 5.685 -3.076 1.00 0.00 H new ATOM 0 HG2 GLN A 239 7.226 3.925 -2.039 1.00 0.00 H new ATOM 0 HG3 GLN A 239 7.481 4.742 -0.509 1.00 0.00 H new ATOM 0 HE21 GLN A 239 6.067 6.299 0.019 1.00 0.00 H new ATOM 0 HE22 GLN A 239 5.085 7.217 -1.127 1.00 0.00 H new ATOM 1105 N PRO A 240 11.882 3.826 -3.373 1.00 0.00 N ATOM 1106 CA PRO A 240 13.111 4.170 -4.090 1.00 0.00 C ATOM 1107 C PRO A 240 12.877 5.272 -5.117 1.00 0.00 C ATOM 1108 O PRO A 240 11.900 5.229 -5.872 1.00 0.00 O ATOM 1109 CB PRO A 240 13.501 2.868 -4.796 1.00 0.00 C ATOM 1110 CG PRO A 240 12.801 1.796 -4.036 1.00 0.00 C ATOM 1111 CD PRO A 240 11.525 2.411 -3.543 1.00 0.00 C ATOM 0 HA PRO A 240 13.881 4.548 -3.417 1.00 0.00 H new ATOM 0 HB2 PRO A 240 13.192 2.877 -5.841 1.00 0.00 H new ATOM 0 HB3 PRO A 240 14.581 2.720 -4.784 1.00 0.00 H new ATOM 0 HG2 PRO A 240 12.599 0.934 -4.672 1.00 0.00 H new ATOM 0 HG3 PRO A 240 13.412 1.443 -3.205 1.00 0.00 H new ATOM 0 HD2 PRO A 240 10.713 2.283 -4.259 1.00 0.00 H new ATOM 0 HD3 PRO A 240 11.197 1.962 -2.605 1.00 0.00 H new ATOM 1119 N LYS A 241 13.786 6.247 -5.140 1.00 0.00 N ATOM 1120 CA LYS A 241 13.714 7.384 -6.058 1.00 0.00 C ATOM 1121 C LYS A 241 12.522 8.280 -5.718 1.00 0.00 C ATOM 1122 O LYS A 241 11.839 8.799 -6.604 1.00 0.00 O ATOM 1123 CB LYS A 241 13.630 6.910 -7.515 1.00 0.00 C ATOM 1124 CG LYS A 241 14.747 5.954 -7.919 1.00 0.00 C ATOM 1125 CD LYS A 241 16.120 6.600 -7.816 1.00 0.00 C ATOM 1126 CE LYS A 241 16.267 7.761 -8.783 1.00 0.00 C ATOM 1127 NZ LYS A 241 17.619 8.371 -8.709 1.00 0.00 N ATOM 0 H LYS A 241 14.596 6.270 -4.520 1.00 0.00 H new ATOM 0 HA LYS A 241 14.628 7.966 -5.942 1.00 0.00 H new ATOM 0 HB2 LYS A 241 12.670 6.418 -7.672 1.00 0.00 H new ATOM 0 HB3 LYS A 241 13.654 7.780 -8.172 1.00 0.00 H new ATOM 0 HG2 LYS A 241 14.714 5.070 -7.282 1.00 0.00 H new ATOM 0 HG3 LYS A 241 14.582 5.616 -8.942 1.00 0.00 H new ATOM 0 HD2 LYS A 241 16.281 6.952 -6.797 1.00 0.00 H new ATOM 0 HD3 LYS A 241 16.889 5.855 -8.021 1.00 0.00 H new ATOM 0 HE2 LYS A 241 16.080 7.414 -9.799 1.00 0.00 H new ATOM 0 HE3 LYS A 241 15.514 8.517 -8.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 241 17.681 9.160 -9.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 241 17.788 8.725 -7.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 241 18.336 7.656 -8.946 1.00 0.00 H new ATOM 1141 N GLY A 242 12.313 8.488 -4.424 1.00 0.00 N ATOM 1142 CA GLY A 242 11.227 9.327 -3.961 1.00 0.00 C ATOM 1143 C GLY A 242 9.874 8.654 -4.102 1.00 0.00 C ATOM 1144 O GLY A 242 9.805 7.445 -4.319 1.00 0.00 O ATOM 0 H GLY A 242 12.884 8.085 -3.681 1.00 0.00 H new ATOM 0 HA2 GLY A 242 11.393 9.587 -2.916 1.00 0.00 H new ATOM 0 HA3 GLY A 242 11.226 10.260 -4.525 1.00 0.00 H new ATOM 1148 N PRO A 243 8.773 9.418 -3.993 1.00 0.00 N ATOM 1149 CA PRO A 243 7.409 8.886 -4.108 1.00 0.00 C ATOM 1150 C PRO A 243 7.046 8.539 -5.553 1.00 0.00 C ATOM 1151 O PRO A 243 6.020 8.978 -6.077 1.00 0.00 O ATOM 1152 CB PRO A 243 6.521 10.031 -3.592 1.00 0.00 C ATOM 1153 CG PRO A 243 7.457 11.051 -3.029 1.00 0.00 C ATOM 1154 CD PRO A 243 8.761 10.859 -3.741 1.00 0.00 C ATOM 0 HA PRO A 243 7.289 7.958 -3.548 1.00 0.00 H new ATOM 0 HB2 PRO A 243 5.921 10.454 -4.398 1.00 0.00 H new ATOM 0 HB3 PRO A 243 5.827 9.675 -2.831 1.00 0.00 H new ATOM 0 HG2 PRO A 243 7.073 12.059 -3.184 1.00 0.00 H new ATOM 0 HG3 PRO A 243 7.577 10.918 -1.954 1.00 0.00 H new ATOM 0 HD2 PRO A 243 8.807 11.433 -4.666 1.00 0.00 H new ATOM 0 HD3 PRO A 243 9.607 11.171 -3.129 1.00 0.00 H new ATOM 1162 N SER A 244 7.913 7.782 -6.200 1.00 0.00 N ATOM 1163 CA SER A 244 7.727 7.406 -7.589 1.00 0.00 C ATOM 1164 C SER A 244 8.532 6.144 -7.883 1.00 0.00 C ATOM 1165 O SER A 244 9.246 6.056 -8.885 1.00 0.00 O ATOM 1166 CB SER A 244 8.163 8.558 -8.509 1.00 0.00 C ATOM 1167 OG SER A 244 7.736 8.354 -9.848 1.00 0.00 O ATOM 0 H SER A 244 8.764 7.411 -5.778 1.00 0.00 H new ATOM 0 HA SER A 244 6.673 7.203 -7.775 1.00 0.00 H new ATOM 0 HB2 SER A 244 7.753 9.496 -8.136 1.00 0.00 H new ATOM 0 HB3 SER A 244 9.249 8.652 -8.484 1.00 0.00 H new ATOM 0 HG SER A 244 8.073 7.492 -10.171 1.00 0.00 H new ATOM 1173 N GLY A 245 8.422 5.172 -6.987 1.00 0.00 N ATOM 1174 CA GLY A 245 9.154 3.936 -7.138 1.00 0.00 C ATOM 1175 C GLY A 245 8.358 2.748 -6.644 1.00 0.00 C ATOM 1176 O GLY A 245 7.234 2.907 -6.158 1.00 0.00 O ATOM 0 H GLY A 245 7.835 5.221 -6.155 1.00 0.00 H new ATOM 0 HA2 GLY A 245 9.410 3.791 -8.188 1.00 0.00 H new ATOM 0 HA3 GLY A 245 10.092 3.999 -6.587 1.00 0.00 H new ATOM 1180 N ILE A 246 8.919 1.555 -6.789 1.00 0.00 N ATOM 1181 CA ILE A 246 8.247 0.339 -6.353 1.00 0.00 C ATOM 1182 C ILE A 246 8.265 0.224 -4.832 1.00 0.00 C ATOM 1183 O ILE A 246 9.302 0.416 -4.198 1.00 0.00 O ATOM 1184 CB ILE A 246 8.880 -0.925 -6.987 1.00 0.00 C ATOM 1185 CG1 ILE A 246 8.116 -2.178 -6.548 1.00 0.00 C ATOM 1186 CG2 ILE A 246 10.358 -1.034 -6.630 1.00 0.00 C ATOM 1187 CD1 ILE A 246 8.758 -3.476 -6.980 1.00 0.00 C ATOM 0 H ILE A 246 9.838 1.404 -7.205 1.00 0.00 H new ATOM 0 HA ILE A 246 7.213 0.405 -6.691 1.00 0.00 H new ATOM 0 HB ILE A 246 8.807 -0.839 -8.071 1.00 0.00 H new ATOM 0 HG12 ILE A 246 8.026 -2.174 -5.462 1.00 0.00 H new ATOM 0 HG13 ILE A 246 7.104 -2.134 -6.952 1.00 0.00 H new ATOM 0 HG21 ILE A 246 10.778 -1.930 -7.088 1.00 0.00 H new ATOM 0 HG22 ILE A 246 10.887 -0.156 -6.999 1.00 0.00 H new ATOM 0 HG23 ILE A 246 10.467 -1.095 -5.547 1.00 0.00 H new ATOM 0 HD11 ILE A 246 8.156 -4.314 -6.630 1.00 0.00 H new ATOM 0 HD12 ILE A 246 8.823 -3.505 -8.068 1.00 0.00 H new ATOM 0 HD13 ILE A 246 9.759 -3.546 -6.555 1.00 0.00 H new ATOM 1199 N ILE A 247 7.123 -0.121 -4.255 1.00 0.00 N ATOM 1200 CA ILE A 247 7.043 -0.328 -2.824 1.00 0.00 C ATOM 1201 C ILE A 247 7.717 -1.639 -2.462 1.00 0.00 C ATOM 1202 O ILE A 247 7.495 -2.666 -3.103 1.00 0.00 O ATOM 1203 CB ILE A 247 5.583 -0.336 -2.312 1.00 0.00 C ATOM 1204 CG1 ILE A 247 4.948 1.044 -2.495 1.00 0.00 C ATOM 1205 CG2 ILE A 247 5.527 -0.755 -0.847 1.00 0.00 C ATOM 1206 CD1 ILE A 247 3.547 1.144 -1.933 1.00 0.00 C ATOM 0 H ILE A 247 6.246 -0.262 -4.756 1.00 0.00 H new ATOM 0 HA ILE A 247 7.554 0.506 -2.343 1.00 0.00 H new ATOM 0 HB ILE A 247 5.018 -1.062 -2.898 1.00 0.00 H new ATOM 0 HG12 ILE A 247 5.578 1.792 -2.013 1.00 0.00 H new ATOM 0 HG13 ILE A 247 4.923 1.285 -3.558 1.00 0.00 H new ATOM 0 HG21 ILE A 247 4.491 -0.754 -0.508 1.00 0.00 H new ATOM 0 HG22 ILE A 247 5.943 -1.757 -0.739 1.00 0.00 H new ATOM 0 HG23 ILE A 247 6.107 -0.055 -0.246 1.00 0.00 H new ATOM 0 HD11 ILE A 247 3.160 2.149 -2.098 1.00 0.00 H new ATOM 0 HD12 ILE A 247 2.902 0.420 -2.432 1.00 0.00 H new ATOM 0 HD13 ILE A 247 3.568 0.935 -0.864 1.00 0.00 H new ATOM 1218 N LYS A 248 8.585 -1.593 -1.477 1.00 0.00 N ATOM 1219 CA LYS A 248 9.307 -2.770 -1.057 1.00 0.00 C ATOM 1220 C LYS A 248 9.468 -2.772 0.450 1.00 0.00 C ATOM 1221 O LYS A 248 9.611 -1.714 1.064 1.00 0.00 O ATOM 1222 CB LYS A 248 10.656 -2.862 -1.769 1.00 0.00 C ATOM 1223 CG LYS A 248 11.134 -1.537 -2.314 1.00 0.00 C ATOM 1224 CD LYS A 248 12.555 -1.622 -2.848 1.00 0.00 C ATOM 1225 CE LYS A 248 12.651 -2.573 -4.029 1.00 0.00 C ATOM 1226 NZ LYS A 248 14.046 -2.716 -4.521 1.00 0.00 N ATOM 0 H LYS A 248 8.808 -0.748 -0.950 1.00 0.00 H new ATOM 0 HA LYS A 248 8.734 -3.654 -1.335 1.00 0.00 H new ATOM 0 HB2 LYS A 248 11.400 -3.251 -1.074 1.00 0.00 H new ATOM 0 HB3 LYS A 248 10.579 -3.578 -2.588 1.00 0.00 H new ATOM 0 HG2 LYS A 248 10.466 -1.210 -3.111 1.00 0.00 H new ATOM 0 HG3 LYS A 248 11.086 -0.783 -1.528 1.00 0.00 H new ATOM 0 HD2 LYS A 248 12.891 -0.630 -3.150 1.00 0.00 H new ATOM 0 HD3 LYS A 248 13.223 -1.957 -2.055 1.00 0.00 H new ATOM 0 HE2 LYS A 248 12.268 -3.551 -3.738 1.00 0.00 H new ATOM 0 HE3 LYS A 248 12.017 -2.210 -4.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 248 14.064 -3.374 -5.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 248 14.404 -1.788 -4.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 248 14.647 -3.087 -3.758 1.00 0.00 H new ATOM 1240 N LEU A 249 9.256 -3.931 1.046 1.00 0.00 N ATOM 1241 CA LEU A 249 9.251 -4.049 2.490 1.00 0.00 C ATOM 1242 C LEU A 249 10.665 -3.878 3.024 1.00 0.00 C ATOM 1243 O LEU A 249 11.521 -4.751 2.851 1.00 0.00 O ATOM 1244 CB LEU A 249 8.676 -5.409 2.912 1.00 0.00 C ATOM 1245 CG LEU A 249 7.933 -5.437 4.259 1.00 0.00 C ATOM 1246 CD1 LEU A 249 8.864 -5.110 5.418 1.00 0.00 C ATOM 1247 CD2 LEU A 249 6.757 -4.474 4.232 1.00 0.00 C ATOM 0 H LEU A 249 9.085 -4.805 0.550 1.00 0.00 H new ATOM 0 HA LEU A 249 8.619 -3.266 2.910 1.00 0.00 H new ATOM 0 HB2 LEU A 249 7.992 -5.749 2.135 1.00 0.00 H new ATOM 0 HB3 LEU A 249 9.493 -6.129 2.955 1.00 0.00 H new ATOM 0 HG LEU A 249 7.558 -6.449 4.413 1.00 0.00 H new ATOM 0 HD11 LEU A 249 8.305 -5.139 6.353 1.00 0.00 H new ATOM 0 HD12 LEU A 249 9.671 -5.842 5.455 1.00 0.00 H new ATOM 0 HD13 LEU A 249 9.284 -4.114 5.277 1.00 0.00 H new ATOM 0 HD21 LEU A 249 6.240 -4.504 5.191 1.00 0.00 H new ATOM 0 HD22 LEU A 249 7.119 -3.463 4.046 1.00 0.00 H new ATOM 0 HD23 LEU A 249 6.067 -4.764 3.439 1.00 0.00 H new ATOM 1259 N ASN A 250 10.885 -2.784 3.726 1.00 0.00 N ATOM 1260 CA ASN A 250 12.156 -2.545 4.378 1.00 0.00 C ATOM 1261 C ASN A 250 12.131 -3.101 5.775 1.00 0.00 C ATOM 1262 O ASN A 250 11.253 -2.756 6.570 1.00 0.00 O ATOM 1263 CB ASN A 250 12.469 -1.054 4.449 1.00 0.00 C ATOM 1264 CG ASN A 250 13.546 -0.723 5.464 1.00 0.00 C ATOM 1265 OD1 ASN A 250 14.706 -1.106 5.315 1.00 0.00 O ATOM 1266 ND2 ASN A 250 13.163 -0.003 6.504 1.00 0.00 N ATOM 0 H ASN A 250 10.196 -2.044 3.859 1.00 0.00 H new ATOM 0 HA ASN A 250 12.928 -3.041 3.789 1.00 0.00 H new ATOM 0 HB2 ASN A 250 12.786 -0.707 3.465 1.00 0.00 H new ATOM 0 HB3 ASN A 250 11.559 -0.509 4.701 1.00 0.00 H new ATOM 0 HD21 ASN A 250 13.840 0.256 7.222 1.00 0.00 H new ATOM 0 HD22 ASN A 250 12.191 0.294 6.589 1.00 0.00 H new ATOM 1273 N LYS A 251 13.158 -3.838 6.120 1.00 0.00 N ATOM 1274 CA LYS A 251 13.311 -4.267 7.477 1.00 0.00 C ATOM 1275 C LYS A 251 14.753 -4.654 7.759 1.00 0.00 C ATOM 1276 O LYS A 251 15.363 -5.426 7.018 1.00 0.00 O ATOM 1277 CB LYS A 251 12.354 -5.420 7.801 1.00 0.00 C ATOM 1278 CG LYS A 251 12.455 -6.606 6.852 1.00 0.00 C ATOM 1279 CD LYS A 251 11.289 -7.560 7.041 1.00 0.00 C ATOM 1280 CE LYS A 251 11.226 -8.093 8.463 1.00 0.00 C ATOM 1281 NZ LYS A 251 9.929 -8.759 8.746 1.00 0.00 N ATOM 0 H LYS A 251 13.891 -4.148 5.482 1.00 0.00 H new ATOM 0 HA LYS A 251 13.054 -3.432 8.128 1.00 0.00 H new ATOM 0 HB2 LYS A 251 12.550 -5.765 8.816 1.00 0.00 H new ATOM 0 HB3 LYS A 251 11.331 -5.043 7.785 1.00 0.00 H new ATOM 0 HG2 LYS A 251 12.474 -6.250 5.822 1.00 0.00 H new ATOM 0 HG3 LYS A 251 13.393 -7.135 7.024 1.00 0.00 H new ATOM 0 HD2 LYS A 251 10.357 -7.048 6.802 1.00 0.00 H new ATOM 0 HD3 LYS A 251 11.383 -8.393 6.344 1.00 0.00 H new ATOM 0 HE2 LYS A 251 12.040 -8.800 8.622 1.00 0.00 H new ATOM 0 HE3 LYS A 251 11.374 -7.273 9.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 251 9.925 -9.109 9.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 251 9.154 -8.078 8.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 251 9.799 -9.558 8.093 1.00 0.00 H new