USER MOD reduce.3.24.130724 H: found=0, std=0, add=434, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 435 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 271 CYS SG : rot 53:sc= 0.716 USER MOD Set 1.2: A 272 ASN :FLIP amide:sc= 0.649 F(o=-2.3,f=1.4) USER MOD Set 2.1: A 227 TYR OH : rot 62:sc= 0.416 USER MOD Set 2.2: A 259 SER OG : rot 176:sc= 0.444 USER MOD Single : A 222 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 223 HIS : no HE2:sc= 0.0469 K(o=0.047,f=-0.81) USER MOD Single : A 226 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 228 THR OG1 : rot 180:sc= -0.166 USER MOD Single : A 234 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 241 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 HIS : no HE2:sc= -0.0462 K(o=-0.046,f=-0.7) USER MOD Single : A 244 ASN : amide:sc= -0.0787 X(o=-0.079,f=-0.22) USER MOD Single : A 248 THR OG1 : rot 180:sc= 0 USER MOD Single : A 256 SER OG : rot 180:sc= 0 USER MOD Single : A 258 SER OG : rot 180:sc= 0 USER MOD Single : A 261 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0907) USER MOD Single : A 264 CYS SG : rot -20:sc= 0.064 USER MOD Single : A 267 MET CE :methyl 171:sc= -1.11 (180deg=-1.13) USER MOD Single : A 268 LYS NZ :NH3+ 166:sc= -0.0394 (180deg=-0.235) USER MOD Single : A 270 THR OG1 : rot 48:sc= 0.184 USER MOD Single : A 273 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 220 4.461 0.404 -0.387 1.00 0.00 N ATOM 2 CA ASP A 220 4.114 -0.662 -1.364 1.00 0.00 C ATOM 3 C ASP A 220 4.296 -2.059 -0.734 1.00 0.00 C ATOM 4 O ASP A 220 5.364 -2.367 -0.197 1.00 0.00 O ATOM 5 CB ASP A 220 4.970 -0.517 -2.657 1.00 0.00 C ATOM 6 CG ASP A 220 4.709 -1.625 -3.695 1.00 0.00 C ATOM 7 OD1 ASP A 220 3.540 -1.796 -4.109 1.00 0.00 O ATOM 8 OD2 ASP A 220 5.657 -2.351 -4.072 1.00 0.00 O ATOM 0 HA ASP A 220 3.065 -0.551 -1.638 1.00 0.00 H new ATOM 0 HB2 ASP A 220 4.765 0.452 -3.112 1.00 0.00 H new ATOM 0 HB3 ASP A 220 6.026 -0.525 -2.387 1.00 0.00 H new ATOM 13 N ARG A 221 3.234 -2.893 -0.801 1.00 0.00 N ATOM 14 CA ARG A 221 3.241 -4.294 -0.318 1.00 0.00 C ATOM 15 C ARG A 221 2.655 -5.237 -1.392 1.00 0.00 C ATOM 16 O ARG A 221 2.276 -6.377 -1.079 1.00 0.00 O ATOM 17 CB ARG A 221 2.443 -4.429 1.017 1.00 0.00 C ATOM 18 CG ARG A 221 3.144 -3.832 2.261 1.00 0.00 C ATOM 19 CD ARG A 221 2.418 -4.177 3.577 1.00 0.00 C ATOM 20 NE ARG A 221 3.220 -3.794 4.756 1.00 0.00 N ATOM 21 CZ ARG A 221 3.997 -4.628 5.481 1.00 0.00 C ATOM 22 NH1 ARG A 221 4.095 -5.918 5.177 1.00 0.00 N ATOM 23 NH2 ARG A 221 4.676 -4.157 6.507 1.00 0.00 N ATOM 0 H ARG A 221 2.337 -2.610 -1.196 1.00 0.00 H new ATOM 0 HA ARG A 221 4.275 -4.581 -0.126 1.00 0.00 H new ATOM 0 HB2 ARG A 221 1.475 -3.942 0.895 1.00 0.00 H new ATOM 0 HB3 ARG A 221 2.247 -5.485 1.201 1.00 0.00 H new ATOM 0 HG2 ARG A 221 4.168 -4.202 2.308 1.00 0.00 H new ATOM 0 HG3 ARG A 221 3.201 -2.749 2.156 1.00 0.00 H new ATOM 0 HD2 ARG A 221 1.457 -3.664 3.608 1.00 0.00 H new ATOM 0 HD3 ARG A 221 2.210 -5.247 3.609 1.00 0.00 H new ATOM 0 HE ARG A 221 3.184 -2.817 5.048 1.00 0.00 H new ATOM 0 HH11 ARG A 221 3.578 -6.296 4.383 1.00 0.00 H new ATOM 0 HH12 ARG A 221 4.687 -6.530 5.738 1.00 0.00 H new ATOM 0 HH21 ARG A 221 4.613 -3.168 6.750 1.00 0.00 H new ATOM 0 HH22 ARG A 221 5.265 -4.781 7.059 1.00 0.00 H new ATOM 37 N ASN A 222 2.631 -4.769 -2.652 1.00 0.00 N ATOM 38 CA ASN A 222 2.017 -5.502 -3.771 1.00 0.00 C ATOM 39 C ASN A 222 2.882 -6.728 -4.169 1.00 0.00 C ATOM 40 O ASN A 222 3.859 -6.591 -4.912 1.00 0.00 O ATOM 41 CB ASN A 222 1.797 -4.537 -4.967 1.00 0.00 C ATOM 42 CG ASN A 222 1.217 -5.216 -6.215 1.00 0.00 C ATOM 43 OD1 ASN A 222 0.004 -5.366 -6.351 1.00 0.00 O ATOM 44 ND2 ASN A 222 2.081 -5.637 -7.134 1.00 0.00 N ATOM 0 H ASN A 222 3.036 -3.873 -2.922 1.00 0.00 H new ATOM 0 HA ASN A 222 1.046 -5.887 -3.460 1.00 0.00 H new ATOM 0 HB2 ASN A 222 1.126 -3.736 -4.656 1.00 0.00 H new ATOM 0 HB3 ASN A 222 2.749 -4.073 -5.227 1.00 0.00 H new ATOM 0 HD21 ASN A 222 1.743 -6.098 -7.979 1.00 0.00 H new ATOM 0 HD22 ASN A 222 3.082 -5.499 -6.994 1.00 0.00 H new ATOM 51 N HIS A 223 2.535 -7.905 -3.602 1.00 0.00 N ATOM 52 CA HIS A 223 3.195 -9.207 -3.889 1.00 0.00 C ATOM 53 C HIS A 223 2.382 -10.356 -3.240 1.00 0.00 C ATOM 54 O HIS A 223 2.943 -11.267 -2.610 1.00 0.00 O ATOM 55 CB HIS A 223 4.698 -9.214 -3.426 1.00 0.00 C ATOM 56 CG HIS A 223 4.938 -8.891 -1.961 1.00 0.00 C ATOM 57 ND1 HIS A 223 4.771 -9.808 -0.948 1.00 0.00 N ATOM 58 CD2 HIS A 223 5.342 -7.749 -1.359 1.00 0.00 C ATOM 59 CE1 HIS A 223 5.063 -9.251 0.208 1.00 0.00 C ATOM 60 NE2 HIS A 223 5.408 -8.000 -0.015 1.00 0.00 N ATOM 0 H HIS A 223 1.779 -7.983 -2.922 1.00 0.00 H new ATOM 0 HA HIS A 223 3.210 -9.361 -4.968 1.00 0.00 H new ATOM 0 HB2 HIS A 223 5.119 -10.197 -3.636 1.00 0.00 H new ATOM 0 HB3 HIS A 223 5.249 -8.495 -4.032 1.00 0.00 H new ATOM 0 HD1 HIS A 223 4.467 -10.773 -1.074 1.00 0.00 H new ATOM 0 HD2 HIS A 223 5.570 -6.813 -1.848 1.00 0.00 H new ATOM 0 HE1 HIS A 223 5.026 -9.736 1.172 1.00 0.00 H new ATOM 69 N VAL A 224 1.045 -10.304 -3.433 1.00 0.00 N ATOM 70 CA VAL A 224 0.087 -11.252 -2.813 1.00 0.00 C ATOM 71 C VAL A 224 0.338 -12.722 -3.250 1.00 0.00 C ATOM 72 O VAL A 224 0.571 -13.002 -4.434 1.00 0.00 O ATOM 73 CB VAL A 224 -1.409 -10.842 -3.131 1.00 0.00 C ATOM 74 CG1 VAL A 224 -1.693 -10.801 -4.661 1.00 0.00 C ATOM 75 CG2 VAL A 224 -2.422 -11.769 -2.398 1.00 0.00 C ATOM 0 H VAL A 224 0.597 -9.603 -4.024 1.00 0.00 H new ATOM 0 HA VAL A 224 0.251 -11.195 -1.737 1.00 0.00 H new ATOM 0 HB VAL A 224 -1.545 -9.830 -2.751 1.00 0.00 H new ATOM 0 HG11 VAL A 224 -2.731 -10.515 -4.831 1.00 0.00 H new ATOM 0 HG12 VAL A 224 -1.034 -10.073 -5.134 1.00 0.00 H new ATOM 0 HG13 VAL A 224 -1.513 -11.786 -5.091 1.00 0.00 H new ATOM 0 HG21 VAL A 224 -3.439 -11.459 -2.639 1.00 0.00 H new ATOM 0 HG22 VAL A 224 -2.271 -12.799 -2.720 1.00 0.00 H new ATOM 0 HG23 VAL A 224 -2.267 -11.699 -1.321 1.00 0.00 H new ATOM 85 N GLY A 225 0.316 -13.635 -2.265 1.00 0.00 N ATOM 86 CA GLY A 225 0.384 -15.078 -2.501 1.00 0.00 C ATOM 87 C GLY A 225 -0.959 -15.735 -2.200 1.00 0.00 C ATOM 88 O GLY A 225 -1.980 -15.356 -2.777 1.00 0.00 O ATOM 0 H GLY A 225 0.250 -13.386 -1.278 1.00 0.00 H new ATOM 0 HA2 GLY A 225 0.665 -15.270 -3.537 1.00 0.00 H new ATOM 0 HA3 GLY A 225 1.159 -15.518 -1.874 1.00 0.00 H new ATOM 92 N LYS A 226 -0.965 -16.706 -1.281 1.00 0.00 N ATOM 93 CA LYS A 226 -2.202 -17.356 -0.808 1.00 0.00 C ATOM 94 C LYS A 226 -2.893 -16.454 0.220 1.00 0.00 C ATOM 95 O LYS A 226 -4.120 -16.434 0.316 1.00 0.00 O ATOM 96 CB LYS A 226 -1.880 -18.745 -0.195 1.00 0.00 C ATOM 97 CG LYS A 226 -1.110 -19.732 -1.123 1.00 0.00 C ATOM 98 CD LYS A 226 -1.892 -20.200 -2.396 1.00 0.00 C ATOM 99 CE LYS A 226 -1.780 -19.239 -3.610 1.00 0.00 C ATOM 100 NZ LYS A 226 -2.602 -19.691 -4.758 1.00 0.00 N ATOM 0 H LYS A 226 -0.118 -17.066 -0.842 1.00 0.00 H new ATOM 0 HA LYS A 226 -2.875 -17.508 -1.651 1.00 0.00 H new ATOM 0 HB2 LYS A 226 -1.293 -18.594 0.711 1.00 0.00 H new ATOM 0 HB3 LYS A 226 -2.816 -19.214 0.106 1.00 0.00 H new ATOM 0 HG2 LYS A 226 -0.182 -19.257 -1.441 1.00 0.00 H new ATOM 0 HG3 LYS A 226 -0.835 -20.612 -0.542 1.00 0.00 H new ATOM 0 HD2 LYS A 226 -1.525 -21.183 -2.692 1.00 0.00 H new ATOM 0 HD3 LYS A 226 -2.944 -20.317 -2.138 1.00 0.00 H new ATOM 0 HE2 LYS A 226 -2.095 -18.239 -3.311 1.00 0.00 H new ATOM 0 HE3 LYS A 226 -0.737 -19.165 -3.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 -2.497 -19.020 -5.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 -2.285 -20.634 -5.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 -3.601 -19.737 -4.473 1.00 0.00 H new ATOM 114 N TYR A 227 -2.073 -15.711 0.980 1.00 0.00 N ATOM 115 CA TYR A 227 -2.533 -14.772 2.004 1.00 0.00 C ATOM 116 C TYR A 227 -2.615 -13.356 1.407 1.00 0.00 C ATOM 117 O TYR A 227 -1.602 -12.799 0.965 1.00 0.00 O ATOM 118 CB TYR A 227 -1.566 -14.802 3.220 1.00 0.00 C ATOM 119 CG TYR A 227 -1.560 -16.142 3.976 1.00 0.00 C ATOM 120 CD1 TYR A 227 -0.908 -17.268 3.461 1.00 0.00 C ATOM 121 CD2 TYR A 227 -2.220 -16.284 5.200 1.00 0.00 C ATOM 122 CE1 TYR A 227 -0.915 -18.474 4.133 1.00 0.00 C ATOM 123 CE2 TYR A 227 -2.229 -17.486 5.865 1.00 0.00 C ATOM 124 CZ TYR A 227 -1.576 -18.577 5.334 1.00 0.00 C ATOM 125 OH TYR A 227 -1.607 -19.776 6.007 1.00 0.00 O ATOM 0 H TYR A 227 -1.057 -15.750 0.896 1.00 0.00 H new ATOM 0 HA TYR A 227 -3.526 -15.063 2.347 1.00 0.00 H new ATOM 0 HB2 TYR A 227 -0.555 -14.586 2.874 1.00 0.00 H new ATOM 0 HB3 TYR A 227 -1.843 -14.006 3.912 1.00 0.00 H new ATOM 0 HD1 TYR A 227 -0.388 -17.192 2.517 1.00 0.00 H new ATOM 0 HD2 TYR A 227 -2.731 -15.435 5.630 1.00 0.00 H new ATOM 0 HE1 TYR A 227 -0.405 -19.331 3.718 1.00 0.00 H new ATOM 0 HE2 TYR A 227 -2.750 -17.576 6.807 1.00 0.00 H new ATOM 0 HH TYR A 227 -0.695 -20.039 6.250 1.00 0.00 H new ATOM 135 N THR A 228 -3.840 -12.808 1.354 1.00 0.00 N ATOM 136 CA THR A 228 -4.090 -11.421 0.938 1.00 0.00 C ATOM 137 C THR A 228 -3.804 -10.466 2.121 1.00 0.00 C ATOM 138 O THR A 228 -3.894 -10.899 3.273 1.00 0.00 O ATOM 139 CB THR A 228 -5.566 -11.250 0.433 1.00 0.00 C ATOM 140 OG1 THR A 228 -6.501 -11.599 1.465 1.00 0.00 O ATOM 141 CG2 THR A 228 -5.845 -12.105 -0.821 1.00 0.00 C ATOM 0 H THR A 228 -4.688 -13.319 1.600 1.00 0.00 H new ATOM 0 HA THR A 228 -3.424 -11.173 0.112 1.00 0.00 H new ATOM 0 HB THR A 228 -5.692 -10.200 0.169 1.00 0.00 H new ATOM 0 HG1 THR A 228 -7.415 -11.484 1.131 1.00 0.00 H new ATOM 0 HG21 THR A 228 -6.877 -11.958 -1.139 1.00 0.00 H new ATOM 0 HG22 THR A 228 -5.172 -11.804 -1.624 1.00 0.00 H new ATOM 0 HG23 THR A 228 -5.683 -13.157 -0.587 1.00 0.00 H new ATOM 149 N PRO A 229 -3.445 -9.152 1.872 1.00 0.00 N ATOM 150 CA PRO A 229 -3.227 -8.155 2.959 1.00 0.00 C ATOM 151 C PRO A 229 -4.452 -8.013 3.900 1.00 0.00 C ATOM 152 O PRO A 229 -4.295 -7.639 5.063 1.00 0.00 O ATOM 153 CB PRO A 229 -2.915 -6.830 2.196 1.00 0.00 C ATOM 154 CG PRO A 229 -3.393 -7.071 0.790 1.00 0.00 C ATOM 155 CD PRO A 229 -3.184 -8.547 0.535 1.00 0.00 C ATOM 0 HA PRO A 229 -2.420 -8.453 3.629 1.00 0.00 H new ATOM 0 HB2 PRO A 229 -3.430 -5.983 2.649 1.00 0.00 H new ATOM 0 HB3 PRO A 229 -1.849 -6.603 2.217 1.00 0.00 H new ATOM 0 HG2 PRO A 229 -4.443 -6.800 0.681 1.00 0.00 H new ATOM 0 HG3 PRO A 229 -2.832 -6.467 0.077 1.00 0.00 H new ATOM 0 HD2 PRO A 229 -3.869 -8.928 -0.222 1.00 0.00 H new ATOM 0 HD3 PRO A 229 -2.173 -8.758 0.186 1.00 0.00 H new ATOM 163 N GLU A 230 -5.663 -8.328 3.376 1.00 0.00 N ATOM 164 CA GLU A 230 -6.901 -8.383 4.180 1.00 0.00 C ATOM 165 C GLU A 230 -6.868 -9.577 5.154 1.00 0.00 C ATOM 166 O GLU A 230 -7.204 -9.420 6.321 1.00 0.00 O ATOM 167 CB GLU A 230 -8.149 -8.478 3.265 1.00 0.00 C ATOM 168 CG GLU A 230 -8.420 -7.230 2.401 1.00 0.00 C ATOM 169 CD GLU A 230 -9.658 -7.387 1.496 1.00 0.00 C ATOM 170 OE1 GLU A 230 -9.543 -7.995 0.408 1.00 0.00 O ATOM 171 OE2 GLU A 230 -10.759 -6.917 1.876 1.00 0.00 O ATOM 0 H GLU A 230 -5.804 -8.549 2.390 1.00 0.00 H new ATOM 0 HA GLU A 230 -6.964 -7.462 4.759 1.00 0.00 H new ATOM 0 HB2 GLU A 230 -8.034 -9.339 2.607 1.00 0.00 H new ATOM 0 HB3 GLU A 230 -9.024 -8.668 3.887 1.00 0.00 H new ATOM 0 HG2 GLU A 230 -8.558 -6.366 3.052 1.00 0.00 H new ATOM 0 HG3 GLU A 230 -7.547 -7.026 1.782 1.00 0.00 H new ATOM 178 N GLU A 231 -6.472 -10.768 4.649 1.00 0.00 N ATOM 179 CA GLU A 231 -6.355 -12.008 5.463 1.00 0.00 C ATOM 180 C GLU A 231 -5.313 -11.876 6.579 1.00 0.00 C ATOM 181 O GLU A 231 -5.502 -12.398 7.680 1.00 0.00 O ATOM 182 CB GLU A 231 -5.993 -13.223 4.563 1.00 0.00 C ATOM 183 CG GLU A 231 -7.176 -13.798 3.770 1.00 0.00 C ATOM 184 CD GLU A 231 -6.790 -15.028 2.937 1.00 0.00 C ATOM 185 OE1 GLU A 231 -6.175 -14.851 1.869 1.00 0.00 O ATOM 186 OE2 GLU A 231 -7.094 -16.172 3.344 1.00 0.00 O ATOM 0 H GLU A 231 -6.224 -10.900 3.668 1.00 0.00 H new ATOM 0 HA GLU A 231 -7.328 -12.169 5.927 1.00 0.00 H new ATOM 0 HB2 GLU A 231 -5.214 -12.922 3.863 1.00 0.00 H new ATOM 0 HB3 GLU A 231 -5.573 -14.011 5.188 1.00 0.00 H new ATOM 0 HG2 GLU A 231 -7.974 -14.069 4.461 1.00 0.00 H new ATOM 0 HG3 GLU A 231 -7.574 -13.028 3.110 1.00 0.00 H new ATOM 193 N ILE A 232 -4.201 -11.207 6.263 1.00 0.00 N ATOM 194 CA ILE A 232 -3.096 -11.009 7.207 1.00 0.00 C ATOM 195 C ILE A 232 -3.499 -9.998 8.293 1.00 0.00 C ATOM 196 O ILE A 232 -3.280 -10.234 9.486 1.00 0.00 O ATOM 197 CB ILE A 232 -1.800 -10.566 6.443 1.00 0.00 C ATOM 198 CG1 ILE A 232 -1.448 -11.639 5.352 1.00 0.00 C ATOM 199 CG2 ILE A 232 -0.605 -10.355 7.416 1.00 0.00 C ATOM 200 CD1 ILE A 232 -0.371 -11.225 4.362 1.00 0.00 C ATOM 0 H ILE A 232 -4.041 -10.788 5.347 1.00 0.00 H new ATOM 0 HA ILE A 232 -2.874 -11.953 7.705 1.00 0.00 H new ATOM 0 HB ILE A 232 -1.992 -9.608 5.961 1.00 0.00 H new ATOM 0 HG12 ILE A 232 -1.127 -12.552 5.853 1.00 0.00 H new ATOM 0 HG13 ILE A 232 -2.355 -11.882 4.798 1.00 0.00 H new ATOM 0 HG21 ILE A 232 0.275 -10.049 6.850 1.00 0.00 H new ATOM 0 HG22 ILE A 232 -0.858 -9.581 8.141 1.00 0.00 H new ATOM 0 HG23 ILE A 232 -0.393 -11.287 7.940 1.00 0.00 H new ATOM 0 HD11 ILE A 232 -0.201 -12.033 3.651 1.00 0.00 H new ATOM 0 HD12 ILE A 232 -0.693 -10.332 3.826 1.00 0.00 H new ATOM 0 HD13 ILE A 232 0.554 -11.013 4.898 1.00 0.00 H new ATOM 212 N GLU A 233 -4.135 -8.892 7.864 1.00 0.00 N ATOM 213 CA GLU A 233 -4.700 -7.890 8.790 1.00 0.00 C ATOM 214 C GLU A 233 -5.793 -8.528 9.674 1.00 0.00 C ATOM 215 O GLU A 233 -5.932 -8.182 10.845 1.00 0.00 O ATOM 216 CB GLU A 233 -5.309 -6.692 8.014 1.00 0.00 C ATOM 217 CG GLU A 233 -5.829 -5.555 8.927 1.00 0.00 C ATOM 218 CD GLU A 233 -6.624 -4.469 8.181 1.00 0.00 C ATOM 219 OE1 GLU A 233 -6.004 -3.532 7.636 1.00 0.00 O ATOM 220 OE2 GLU A 233 -7.874 -4.544 8.152 1.00 0.00 O ATOM 0 H GLU A 233 -4.271 -8.668 6.878 1.00 0.00 H new ATOM 0 HA GLU A 233 -3.886 -7.528 9.418 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -4.555 -6.287 7.339 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -6.130 -7.052 7.395 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -6.462 -5.986 9.703 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -4.981 -5.090 9.430 1.00 0.00 H new ATOM 227 N LYS A 234 -6.548 -9.471 9.074 1.00 0.00 N ATOM 228 CA LYS A 234 -7.665 -10.165 9.731 1.00 0.00 C ATOM 229 C LYS A 234 -7.150 -11.160 10.780 1.00 0.00 C ATOM 230 O LYS A 234 -7.770 -11.326 11.822 1.00 0.00 O ATOM 231 CB LYS A 234 -8.547 -10.921 8.701 1.00 0.00 C ATOM 232 CG LYS A 234 -9.915 -11.419 9.244 1.00 0.00 C ATOM 233 CD LYS A 234 -10.877 -10.257 9.587 1.00 0.00 C ATOM 234 CE LYS A 234 -11.227 -9.395 8.354 1.00 0.00 C ATOM 235 NZ LYS A 234 -12.135 -8.271 8.692 1.00 0.00 N ATOM 0 H LYS A 234 -6.395 -9.772 8.111 1.00 0.00 H new ATOM 0 HA LYS A 234 -8.271 -9.403 10.221 1.00 0.00 H new ATOM 0 HB2 LYS A 234 -8.729 -10.264 7.850 1.00 0.00 H new ATOM 0 HB3 LYS A 234 -7.988 -11.779 8.328 1.00 0.00 H new ATOM 0 HG2 LYS A 234 -10.383 -12.066 8.502 1.00 0.00 H new ATOM 0 HG3 LYS A 234 -9.750 -12.024 10.135 1.00 0.00 H new ATOM 0 HD2 LYS A 234 -11.794 -10.663 10.015 1.00 0.00 H new ATOM 0 HD3 LYS A 234 -10.422 -9.626 10.350 1.00 0.00 H new ATOM 0 HE2 LYS A 234 -10.310 -9.000 7.918 1.00 0.00 H new ATOM 0 HE3 LYS A 234 -11.696 -10.023 7.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 234 -12.341 -7.721 7.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 234 -13.022 -8.647 9.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 234 -11.679 -7.656 9.396 1.00 0.00 H new ATOM 249 N LEU A 235 -6.012 -11.827 10.486 1.00 0.00 N ATOM 250 CA LEU A 235 -5.410 -12.800 11.417 1.00 0.00 C ATOM 251 C LEU A 235 -4.855 -12.050 12.633 1.00 0.00 C ATOM 252 O LEU A 235 -4.944 -12.536 13.754 1.00 0.00 O ATOM 253 CB LEU A 235 -4.342 -13.723 10.702 1.00 0.00 C ATOM 254 CG LEU A 235 -2.843 -13.252 10.571 1.00 0.00 C ATOM 255 CD1 LEU A 235 -2.042 -13.526 11.862 1.00 0.00 C ATOM 256 CD2 LEU A 235 -2.149 -13.919 9.356 1.00 0.00 C ATOM 0 H LEU A 235 -5.496 -11.708 9.614 1.00 0.00 H new ATOM 0 HA LEU A 235 -6.177 -13.490 11.770 1.00 0.00 H new ATOM 0 HB2 LEU A 235 -4.335 -14.677 11.229 1.00 0.00 H new ATOM 0 HB3 LEU A 235 -4.708 -13.919 9.694 1.00 0.00 H new ATOM 0 HG LEU A 235 -2.862 -12.174 10.410 1.00 0.00 H new ATOM 0 HD11 LEU A 235 -1.014 -13.187 11.731 1.00 0.00 H new ATOM 0 HD12 LEU A 235 -2.498 -12.989 12.694 1.00 0.00 H new ATOM 0 HD13 LEU A 235 -2.047 -14.595 12.074 1.00 0.00 H new ATOM 0 HD21 LEU A 235 -1.117 -13.574 9.292 1.00 0.00 H new ATOM 0 HD22 LEU A 235 -2.163 -15.002 9.478 1.00 0.00 H new ATOM 0 HD23 LEU A 235 -2.678 -13.650 8.442 1.00 0.00 H new ATOM 268 N LYS A 236 -4.295 -10.857 12.373 1.00 0.00 N ATOM 269 CA LYS A 236 -3.759 -9.940 13.400 1.00 0.00 C ATOM 270 C LYS A 236 -4.885 -9.271 14.226 1.00 0.00 C ATOM 271 O LYS A 236 -4.706 -8.974 15.416 1.00 0.00 O ATOM 272 CB LYS A 236 -2.885 -8.873 12.693 1.00 0.00 C ATOM 273 CG LYS A 236 -1.536 -9.423 12.147 1.00 0.00 C ATOM 274 CD LYS A 236 -0.915 -8.537 11.032 1.00 0.00 C ATOM 275 CE LYS A 236 -0.718 -7.065 11.447 1.00 0.00 C ATOM 276 NZ LYS A 236 0.244 -6.913 12.570 1.00 0.00 N ATOM 0 H LYS A 236 -4.199 -10.493 11.425 1.00 0.00 H new ATOM 0 HA LYS A 236 -3.157 -10.512 14.107 1.00 0.00 H new ATOM 0 HB2 LYS A 236 -3.452 -8.443 11.867 1.00 0.00 H new ATOM 0 HB3 LYS A 236 -2.679 -8.064 13.394 1.00 0.00 H new ATOM 0 HG2 LYS A 236 -0.827 -9.508 12.970 1.00 0.00 H new ATOM 0 HG3 LYS A 236 -1.693 -10.428 11.757 1.00 0.00 H new ATOM 0 HD2 LYS A 236 0.049 -8.956 10.742 1.00 0.00 H new ATOM 0 HD3 LYS A 236 -1.556 -8.574 10.151 1.00 0.00 H new ATOM 0 HE2 LYS A 236 -0.363 -6.494 10.589 1.00 0.00 H new ATOM 0 HE3 LYS A 236 -1.679 -6.641 11.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 236 0.341 -5.906 12.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 236 -0.105 -7.435 13.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 236 1.170 -7.292 12.287 1.00 0.00 H new ATOM 290 N GLU A 237 -6.035 -9.041 13.566 1.00 0.00 N ATOM 291 CA GLU A 237 -7.266 -8.503 14.191 1.00 0.00 C ATOM 292 C GLU A 237 -7.821 -9.528 15.198 1.00 0.00 C ATOM 293 O GLU A 237 -8.015 -9.229 16.376 1.00 0.00 O ATOM 294 CB GLU A 237 -8.325 -8.197 13.076 1.00 0.00 C ATOM 295 CG GLU A 237 -9.735 -7.779 13.564 1.00 0.00 C ATOM 296 CD GLU A 237 -9.763 -6.435 14.308 1.00 0.00 C ATOM 297 OE1 GLU A 237 -9.877 -5.385 13.642 1.00 0.00 O ATOM 298 OE2 GLU A 237 -9.682 -6.417 15.553 1.00 0.00 O ATOM 0 H GLU A 237 -6.141 -9.225 12.568 1.00 0.00 H new ATOM 0 HA GLU A 237 -7.039 -7.579 14.722 1.00 0.00 H new ATOM 0 HB2 GLU A 237 -7.933 -7.402 12.441 1.00 0.00 H new ATOM 0 HB3 GLU A 237 -8.428 -9.083 12.450 1.00 0.00 H new ATOM 0 HG2 GLU A 237 -10.404 -7.722 12.705 1.00 0.00 H new ATOM 0 HG3 GLU A 237 -10.126 -8.555 14.222 1.00 0.00 H new ATOM 305 N LEU A 238 -8.028 -10.748 14.688 1.00 0.00 N ATOM 306 CA LEU A 238 -8.521 -11.901 15.456 1.00 0.00 C ATOM 307 C LEU A 238 -7.505 -12.350 16.515 1.00 0.00 C ATOM 308 O LEU A 238 -7.884 -12.964 17.508 1.00 0.00 O ATOM 309 CB LEU A 238 -8.863 -13.081 14.503 1.00 0.00 C ATOM 310 CG LEU A 238 -10.049 -12.843 13.512 1.00 0.00 C ATOM 311 CD1 LEU A 238 -10.215 -14.033 12.528 1.00 0.00 C ATOM 312 CD2 LEU A 238 -11.371 -12.543 14.272 1.00 0.00 C ATOM 0 H LEU A 238 -7.854 -10.967 13.707 1.00 0.00 H new ATOM 0 HA LEU A 238 -9.427 -11.589 15.975 1.00 0.00 H new ATOM 0 HB2 LEU A 238 -7.973 -13.321 13.922 1.00 0.00 H new ATOM 0 HB3 LEU A 238 -9.093 -13.957 15.110 1.00 0.00 H new ATOM 0 HG LEU A 238 -9.807 -11.962 12.918 1.00 0.00 H new ATOM 0 HD11 LEU A 238 -11.048 -13.834 11.854 1.00 0.00 H new ATOM 0 HD12 LEU A 238 -9.300 -14.156 11.948 1.00 0.00 H new ATOM 0 HD13 LEU A 238 -10.413 -14.945 13.091 1.00 0.00 H new ATOM 0 HD21 LEU A 238 -12.175 -12.382 13.554 1.00 0.00 H new ATOM 0 HD22 LEU A 238 -11.621 -13.387 14.914 1.00 0.00 H new ATOM 0 HD23 LEU A 238 -11.245 -11.648 14.882 1.00 0.00 H new ATOM 324 N ARG A 239 -6.216 -12.075 16.265 1.00 0.00 N ATOM 325 CA ARG A 239 -5.111 -12.417 17.183 1.00 0.00 C ATOM 326 C ARG A 239 -5.286 -11.726 18.542 1.00 0.00 C ATOM 327 O ARG A 239 -5.152 -12.352 19.587 1.00 0.00 O ATOM 328 CB ARG A 239 -3.759 -11.996 16.566 1.00 0.00 C ATOM 329 CG ARG A 239 -2.521 -12.527 17.308 1.00 0.00 C ATOM 330 CD ARG A 239 -1.219 -11.880 16.807 1.00 0.00 C ATOM 331 NE ARG A 239 -1.153 -10.458 17.176 1.00 0.00 N ATOM 332 CZ ARG A 239 -0.240 -9.582 16.750 1.00 0.00 C ATOM 333 NH1 ARG A 239 0.647 -9.912 15.826 1.00 0.00 N ATOM 334 NH2 ARG A 239 -0.238 -8.363 17.249 1.00 0.00 N ATOM 0 H ARG A 239 -5.905 -11.605 15.414 1.00 0.00 H new ATOM 0 HA ARG A 239 -5.126 -13.496 17.336 1.00 0.00 H new ATOM 0 HB2 ARG A 239 -3.723 -12.342 15.533 1.00 0.00 H new ATOM 0 HB3 ARG A 239 -3.711 -10.907 16.539 1.00 0.00 H new ATOM 0 HG2 ARG A 239 -2.631 -12.337 18.376 1.00 0.00 H new ATOM 0 HG3 ARG A 239 -2.460 -13.608 17.181 1.00 0.00 H new ATOM 0 HD2 ARG A 239 -0.363 -12.407 17.228 1.00 0.00 H new ATOM 0 HD3 ARG A 239 -1.154 -11.980 15.724 1.00 0.00 H new ATOM 0 HE ARG A 239 -1.868 -10.110 17.814 1.00 0.00 H new ATOM 0 HH11 ARG A 239 0.641 -10.850 15.426 1.00 0.00 H new ATOM 0 HH12 ARG A 239 1.337 -9.228 15.514 1.00 0.00 H new ATOM 0 HH21 ARG A 239 -0.928 -8.098 17.952 1.00 0.00 H new ATOM 0 HH22 ARG A 239 0.454 -7.684 16.933 1.00 0.00 H new ATOM 348 N ILE A 240 -5.572 -10.421 18.493 1.00 0.00 N ATOM 349 CA ILE A 240 -5.768 -9.601 19.701 1.00 0.00 C ATOM 350 C ILE A 240 -7.169 -9.870 20.301 1.00 0.00 C ATOM 351 O ILE A 240 -7.333 -9.977 21.523 1.00 0.00 O ATOM 352 CB ILE A 240 -5.598 -8.064 19.381 1.00 0.00 C ATOM 353 CG1 ILE A 240 -4.263 -7.799 18.593 1.00 0.00 C ATOM 354 CG2 ILE A 240 -5.657 -7.204 20.681 1.00 0.00 C ATOM 355 CD1 ILE A 240 -4.078 -6.367 18.102 1.00 0.00 C ATOM 0 H ILE A 240 -5.675 -9.902 17.621 1.00 0.00 H new ATOM 0 HA ILE A 240 -5.006 -9.879 20.429 1.00 0.00 H new ATOM 0 HB ILE A 240 -6.432 -7.763 18.747 1.00 0.00 H new ATOM 0 HG12 ILE A 240 -3.422 -8.058 19.236 1.00 0.00 H new ATOM 0 HG13 ILE A 240 -4.226 -8.469 17.734 1.00 0.00 H new ATOM 0 HG21 ILE A 240 -5.537 -6.151 20.426 1.00 0.00 H new ATOM 0 HG22 ILE A 240 -6.619 -7.351 21.171 1.00 0.00 H new ATOM 0 HG23 ILE A 240 -4.856 -7.508 21.355 1.00 0.00 H new ATOM 0 HD11 ILE A 240 -3.130 -6.284 17.571 1.00 0.00 H new ATOM 0 HD12 ILE A 240 -4.895 -6.105 17.429 1.00 0.00 H new ATOM 0 HD13 ILE A 240 -4.077 -5.687 18.954 1.00 0.00 H new ATOM 367 N LYS A 241 -8.163 -10.008 19.400 1.00 0.00 N ATOM 368 CA LYS A 241 -9.590 -10.161 19.755 1.00 0.00 C ATOM 369 C LYS A 241 -9.874 -11.506 20.473 1.00 0.00 C ATOM 370 O LYS A 241 -10.727 -11.577 21.367 1.00 0.00 O ATOM 371 CB LYS A 241 -10.450 -10.020 18.464 1.00 0.00 C ATOM 372 CG LYS A 241 -11.977 -9.955 18.705 1.00 0.00 C ATOM 373 CD LYS A 241 -12.789 -9.614 17.428 1.00 0.00 C ATOM 374 CE LYS A 241 -12.455 -8.220 16.855 1.00 0.00 C ATOM 375 NZ LYS A 241 -13.330 -7.860 15.715 1.00 0.00 N ATOM 0 H LYS A 241 -7.996 -10.017 18.394 1.00 0.00 H new ATOM 0 HA LYS A 241 -9.858 -9.376 20.462 1.00 0.00 H new ATOM 0 HB2 LYS A 241 -10.141 -9.118 17.935 1.00 0.00 H new ATOM 0 HB3 LYS A 241 -10.236 -10.863 17.808 1.00 0.00 H new ATOM 0 HG2 LYS A 241 -12.316 -10.914 19.097 1.00 0.00 H new ATOM 0 HG3 LYS A 241 -12.185 -9.206 19.469 1.00 0.00 H new ATOM 0 HD2 LYS A 241 -12.594 -10.370 16.667 1.00 0.00 H new ATOM 0 HD3 LYS A 241 -13.853 -9.661 17.658 1.00 0.00 H new ATOM 0 HE2 LYS A 241 -12.558 -7.472 17.641 1.00 0.00 H new ATOM 0 HE3 LYS A 241 -11.414 -8.201 16.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 241 -13.070 -6.917 15.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 241 -13.213 -8.559 14.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 241 -14.322 -7.851 16.028 1.00 0.00 H new ATOM 389 N HIS A 242 -9.150 -12.562 20.072 1.00 0.00 N ATOM 390 CA HIS A 242 -9.265 -13.913 20.671 1.00 0.00 C ATOM 391 C HIS A 242 -8.168 -14.124 21.723 1.00 0.00 C ATOM 392 O HIS A 242 -8.441 -14.569 22.837 1.00 0.00 O ATOM 393 CB HIS A 242 -9.180 -15.020 19.583 1.00 0.00 C ATOM 394 CG HIS A 242 -10.377 -15.096 18.668 1.00 0.00 C ATOM 395 ND1 HIS A 242 -11.413 -15.986 18.862 1.00 0.00 N ATOM 396 CD2 HIS A 242 -10.693 -14.403 17.555 1.00 0.00 C ATOM 397 CE1 HIS A 242 -12.305 -15.836 17.908 1.00 0.00 C ATOM 398 NE2 HIS A 242 -11.891 -14.880 17.105 1.00 0.00 N ATOM 0 H HIS A 242 -8.463 -12.509 19.320 1.00 0.00 H new ATOM 0 HA HIS A 242 -10.240 -13.984 21.153 1.00 0.00 H new ATOM 0 HB2 HIS A 242 -8.288 -14.850 18.980 1.00 0.00 H new ATOM 0 HB3 HIS A 242 -9.053 -15.985 20.074 1.00 0.00 H new ATOM 0 HD1 HIS A 242 -11.477 -16.657 19.628 1.00 0.00 H new ATOM 0 HD2 HIS A 242 -10.107 -13.616 17.103 1.00 0.00 H new ATOM 0 HE1 HIS A 242 -13.220 -16.400 17.802 1.00 0.00 H new ATOM 407 N GLY A 243 -6.916 -13.806 21.346 1.00 0.00 N ATOM 408 CA GLY A 243 -5.756 -13.941 22.237 1.00 0.00 C ATOM 409 C GLY A 243 -4.789 -15.016 21.761 1.00 0.00 C ATOM 410 O GLY A 243 -3.681 -14.707 21.308 1.00 0.00 O ATOM 0 H GLY A 243 -6.684 -13.450 20.419 1.00 0.00 H new ATOM 0 HA2 GLY A 243 -5.234 -12.986 22.299 1.00 0.00 H new ATOM 0 HA3 GLY A 243 -6.099 -14.182 23.243 1.00 0.00 H new ATOM 414 N ASN A 244 -5.226 -16.288 21.838 1.00 0.00 N ATOM 415 CA ASN A 244 -4.367 -17.470 21.568 1.00 0.00 C ATOM 416 C ASN A 244 -5.100 -18.509 20.680 1.00 0.00 C ATOM 417 O ASN A 244 -4.555 -19.579 20.375 1.00 0.00 O ATOM 418 CB ASN A 244 -3.947 -18.081 22.947 1.00 0.00 C ATOM 419 CG ASN A 244 -2.988 -19.282 22.888 1.00 0.00 C ATOM 420 OD1 ASN A 244 -2.156 -19.393 22.003 1.00 0.00 O ATOM 421 ND2 ASN A 244 -3.103 -20.180 23.850 1.00 0.00 N ATOM 0 H ASN A 244 -6.184 -16.531 22.089 1.00 0.00 H new ATOM 0 HA ASN A 244 -3.479 -17.170 21.012 1.00 0.00 H new ATOM 0 HB2 ASN A 244 -3.479 -17.297 23.542 1.00 0.00 H new ATOM 0 HB3 ASN A 244 -4.849 -18.387 23.476 1.00 0.00 H new ATOM 0 HD21 ASN A 244 -2.487 -20.992 23.866 1.00 0.00 H new ATOM 0 HD22 ASN A 244 -3.808 -20.061 24.577 1.00 0.00 H new ATOM 428 N ASP A 245 -6.322 -18.172 20.223 1.00 0.00 N ATOM 429 CA ASP A 245 -7.190 -19.092 19.447 1.00 0.00 C ATOM 430 C ASP A 245 -6.829 -19.059 17.944 1.00 0.00 C ATOM 431 O ASP A 245 -7.650 -18.670 17.103 1.00 0.00 O ATOM 432 CB ASP A 245 -8.683 -18.712 19.658 1.00 0.00 C ATOM 433 CG ASP A 245 -9.111 -18.716 21.132 1.00 0.00 C ATOM 434 OD1 ASP A 245 -8.835 -17.721 21.842 1.00 0.00 O ATOM 435 OD2 ASP A 245 -9.737 -19.702 21.576 1.00 0.00 O ATOM 0 H ASP A 245 -6.739 -17.254 20.379 1.00 0.00 H new ATOM 0 HA ASP A 245 -7.027 -20.108 19.807 1.00 0.00 H new ATOM 0 HB2 ASP A 245 -8.861 -17.722 19.238 1.00 0.00 H new ATOM 0 HB3 ASP A 245 -9.310 -19.410 19.104 1.00 0.00 H new ATOM 440 N TRP A 246 -5.593 -19.487 17.626 1.00 0.00 N ATOM 441 CA TRP A 246 -5.067 -19.540 16.249 1.00 0.00 C ATOM 442 C TRP A 246 -5.847 -20.537 15.380 1.00 0.00 C ATOM 443 O TRP A 246 -5.910 -20.384 14.159 1.00 0.00 O ATOM 444 CB TRP A 246 -3.576 -19.923 16.261 1.00 0.00 C ATOM 445 CG TRP A 246 -2.683 -18.872 16.868 1.00 0.00 C ATOM 446 CD1 TRP A 246 -2.137 -18.858 18.122 1.00 0.00 C ATOM 447 CD2 TRP A 246 -2.245 -17.664 16.229 1.00 0.00 C ATOM 448 NE1 TRP A 246 -1.352 -17.745 18.273 1.00 0.00 N ATOM 449 CE2 TRP A 246 -1.404 -16.997 17.131 1.00 0.00 C ATOM 450 CE3 TRP A 246 -2.462 -17.100 14.965 1.00 0.00 C ATOM 451 CZ2 TRP A 246 -0.791 -15.792 16.821 1.00 0.00 C ATOM 452 CZ3 TRP A 246 -1.858 -15.903 14.659 1.00 0.00 C ATOM 453 CH2 TRP A 246 -1.023 -15.267 15.580 1.00 0.00 C ATOM 0 H TRP A 246 -4.924 -19.809 18.326 1.00 0.00 H new ATOM 0 HA TRP A 246 -5.187 -18.547 15.817 1.00 0.00 H new ATOM 0 HB2 TRP A 246 -3.454 -20.854 16.815 1.00 0.00 H new ATOM 0 HB3 TRP A 246 -3.252 -20.116 15.238 1.00 0.00 H new ATOM 0 HD1 TRP A 246 -2.300 -19.611 18.879 1.00 0.00 H new ATOM 0 HE1 TRP A 246 -0.813 -17.512 19.107 1.00 0.00 H new ATOM 0 HE3 TRP A 246 -3.093 -17.597 14.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 246 -0.155 -15.288 17.533 1.00 0.00 H new ATOM 0 HZ3 TRP A 246 -2.032 -15.449 13.694 1.00 0.00 H new ATOM 0 HH2 TRP A 246 -0.548 -14.337 15.305 1.00 0.00 H new ATOM 464 N ALA A 247 -6.394 -21.569 16.039 1.00 0.00 N ATOM 465 CA ALA A 247 -7.247 -22.588 15.409 1.00 0.00 C ATOM 466 C ALA A 247 -8.510 -21.957 14.816 1.00 0.00 C ATOM 467 O ALA A 247 -8.879 -22.248 13.679 1.00 0.00 O ATOM 468 CB ALA A 247 -7.595 -23.685 16.425 1.00 0.00 C ATOM 0 H ALA A 247 -6.255 -21.722 17.038 1.00 0.00 H new ATOM 0 HA ALA A 247 -6.696 -23.045 14.587 1.00 0.00 H new ATOM 0 HB1 ALA A 247 -8.227 -24.435 15.949 1.00 0.00 H new ATOM 0 HB2 ALA A 247 -6.678 -24.156 16.780 1.00 0.00 H new ATOM 0 HB3 ALA A 247 -8.127 -23.244 17.268 1.00 0.00 H new ATOM 474 N THR A 248 -9.121 -21.056 15.597 1.00 0.00 N ATOM 475 CA THR A 248 -10.345 -20.335 15.211 1.00 0.00 C ATOM 476 C THR A 248 -10.039 -19.260 14.139 1.00 0.00 C ATOM 477 O THR A 248 -10.850 -19.031 13.224 1.00 0.00 O ATOM 478 CB THR A 248 -10.991 -19.679 16.473 1.00 0.00 C ATOM 479 OG1 THR A 248 -11.128 -20.671 17.506 1.00 0.00 O ATOM 480 CG2 THR A 248 -12.372 -19.055 16.182 1.00 0.00 C ATOM 0 H THR A 248 -8.777 -20.804 16.524 1.00 0.00 H new ATOM 0 HA THR A 248 -11.048 -21.048 14.780 1.00 0.00 H new ATOM 0 HB THR A 248 -10.331 -18.872 16.792 1.00 0.00 H new ATOM 0 HG1 THR A 248 -11.531 -20.263 18.300 1.00 0.00 H new ATOM 0 HG21 THR A 248 -12.772 -18.615 17.095 1.00 0.00 H new ATOM 0 HG22 THR A 248 -12.269 -18.281 15.421 1.00 0.00 H new ATOM 0 HG23 THR A 248 -13.052 -19.828 15.824 1.00 0.00 H new ATOM 488 N ILE A 249 -8.854 -18.616 14.265 1.00 0.00 N ATOM 489 CA ILE A 249 -8.357 -17.612 13.297 1.00 0.00 C ATOM 490 C ILE A 249 -8.217 -18.255 11.893 1.00 0.00 C ATOM 491 O ILE A 249 -8.833 -17.794 10.924 1.00 0.00 O ATOM 492 CB ILE A 249 -6.968 -17.004 13.770 1.00 0.00 C ATOM 493 CG1 ILE A 249 -7.121 -16.261 15.142 1.00 0.00 C ATOM 494 CG2 ILE A 249 -6.353 -16.068 12.706 1.00 0.00 C ATOM 495 CD1 ILE A 249 -5.822 -15.773 15.764 1.00 0.00 C ATOM 0 H ILE A 249 -8.215 -18.779 15.043 1.00 0.00 H new ATOM 0 HA ILE A 249 -9.079 -16.797 13.244 1.00 0.00 H new ATOM 0 HB ILE A 249 -6.280 -17.839 13.903 1.00 0.00 H new ATOM 0 HG12 ILE A 249 -7.782 -15.405 15.002 1.00 0.00 H new ATOM 0 HG13 ILE A 249 -7.613 -16.931 15.847 1.00 0.00 H new ATOM 0 HG21 ILE A 249 -5.404 -15.675 13.072 1.00 0.00 H new ATOM 0 HG22 ILE A 249 -6.184 -16.626 11.785 1.00 0.00 H new ATOM 0 HG23 ILE A 249 -7.036 -15.242 12.510 1.00 0.00 H new ATOM 0 HD11 ILE A 249 -6.036 -15.273 16.709 1.00 0.00 H new ATOM 0 HD12 ILE A 249 -5.163 -16.622 15.944 1.00 0.00 H new ATOM 0 HD13 ILE A 249 -5.334 -15.073 15.086 1.00 0.00 H new ATOM 507 N GLY A 250 -7.437 -19.354 11.827 1.00 0.00 N ATOM 508 CA GLY A 250 -7.212 -20.101 10.587 1.00 0.00 C ATOM 509 C GLY A 250 -8.496 -20.713 10.031 1.00 0.00 C ATOM 510 O GLY A 250 -8.695 -20.731 8.814 1.00 0.00 O ATOM 0 H GLY A 250 -6.949 -19.742 12.634 1.00 0.00 H new ATOM 0 HA2 GLY A 250 -6.777 -19.437 9.840 1.00 0.00 H new ATOM 0 HA3 GLY A 250 -6.486 -20.893 10.770 1.00 0.00 H new ATOM 514 N ALA A 251 -9.379 -21.184 10.937 1.00 0.00 N ATOM 515 CA ALA A 251 -10.687 -21.784 10.575 1.00 0.00 C ATOM 516 C ALA A 251 -11.600 -20.770 9.866 1.00 0.00 C ATOM 517 O ALA A 251 -12.375 -21.140 8.978 1.00 0.00 O ATOM 518 CB ALA A 251 -11.385 -22.349 11.817 1.00 0.00 C ATOM 0 H ALA A 251 -9.208 -21.160 11.942 1.00 0.00 H new ATOM 0 HA ALA A 251 -10.490 -22.600 9.879 1.00 0.00 H new ATOM 0 HB1 ALA A 251 -12.342 -22.784 11.530 1.00 0.00 H new ATOM 0 HB2 ALA A 251 -10.758 -23.117 12.269 1.00 0.00 H new ATOM 0 HB3 ALA A 251 -11.552 -21.548 12.537 1.00 0.00 H new ATOM 524 N ALA A 252 -11.507 -19.497 10.284 1.00 0.00 N ATOM 525 CA ALA A 252 -12.241 -18.384 9.650 1.00 0.00 C ATOM 526 C ALA A 252 -11.635 -18.043 8.270 1.00 0.00 C ATOM 527 O ALA A 252 -12.360 -17.837 7.291 1.00 0.00 O ATOM 528 CB ALA A 252 -12.220 -17.156 10.573 1.00 0.00 C ATOM 0 H ALA A 252 -10.923 -19.208 11.069 1.00 0.00 H new ATOM 0 HA ALA A 252 -13.276 -18.689 9.493 1.00 0.00 H new ATOM 0 HB1 ALA A 252 -12.763 -16.337 10.101 1.00 0.00 H new ATOM 0 HB2 ALA A 252 -12.694 -17.406 11.522 1.00 0.00 H new ATOM 0 HB3 ALA A 252 -11.188 -16.852 10.751 1.00 0.00 H new ATOM 534 N LEU A 253 -10.291 -18.015 8.214 1.00 0.00 N ATOM 535 CA LEU A 253 -9.527 -17.614 7.011 1.00 0.00 C ATOM 536 C LEU A 253 -9.490 -18.707 5.922 1.00 0.00 C ATOM 537 O LEU A 253 -9.161 -18.406 4.769 1.00 0.00 O ATOM 538 CB LEU A 253 -8.078 -17.256 7.420 1.00 0.00 C ATOM 539 CG LEU A 253 -7.932 -16.044 8.387 1.00 0.00 C ATOM 540 CD1 LEU A 253 -6.500 -15.955 8.939 1.00 0.00 C ATOM 541 CD2 LEU A 253 -8.360 -14.718 7.705 1.00 0.00 C ATOM 0 H LEU A 253 -9.699 -18.271 9.004 1.00 0.00 H new ATOM 0 HA LEU A 253 -10.039 -16.752 6.583 1.00 0.00 H new ATOM 0 HB2 LEU A 253 -7.626 -18.129 7.890 1.00 0.00 H new ATOM 0 HB3 LEU A 253 -7.505 -17.048 6.516 1.00 0.00 H new ATOM 0 HG LEU A 253 -8.606 -16.205 9.228 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -6.422 -15.101 9.612 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -6.262 -16.869 9.483 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -5.799 -15.832 8.114 1.00 0.00 H new ATOM 0 HD21 LEU A 253 -8.245 -13.893 8.409 1.00 0.00 H new ATOM 0 HD22 LEU A 253 -7.733 -14.539 6.831 1.00 0.00 H new ATOM 0 HD23 LEU A 253 -9.403 -14.788 7.395 1.00 0.00 H new ATOM 553 N GLY A 254 -9.799 -19.966 6.294 1.00 0.00 N ATOM 554 CA GLY A 254 -9.638 -21.111 5.379 1.00 0.00 C ATOM 555 C GLY A 254 -8.170 -21.464 5.155 1.00 0.00 C ATOM 556 O GLY A 254 -7.769 -21.849 4.054 1.00 0.00 O ATOM 0 H GLY A 254 -10.159 -20.213 7.216 1.00 0.00 H new ATOM 0 HA2 GLY A 254 -10.161 -21.976 5.786 1.00 0.00 H new ATOM 0 HA3 GLY A 254 -10.105 -20.878 4.422 1.00 0.00 H new ATOM 560 N ARG A 255 -7.378 -21.300 6.219 1.00 0.00 N ATOM 561 CA ARG A 255 -5.919 -21.528 6.245 1.00 0.00 C ATOM 562 C ARG A 255 -5.574 -22.476 7.399 1.00 0.00 C ATOM 563 O ARG A 255 -6.431 -22.769 8.247 1.00 0.00 O ATOM 564 CB ARG A 255 -5.177 -20.163 6.435 1.00 0.00 C ATOM 565 CG ARG A 255 -5.482 -19.105 5.346 1.00 0.00 C ATOM 566 CD ARG A 255 -5.034 -19.547 3.943 1.00 0.00 C ATOM 567 NE ARG A 255 -5.473 -18.600 2.907 1.00 0.00 N ATOM 568 CZ ARG A 255 -5.994 -18.932 1.717 1.00 0.00 C ATOM 569 NH1 ARG A 255 -6.155 -20.205 1.374 1.00 0.00 N ATOM 570 NH2 ARG A 255 -6.372 -17.980 0.888 1.00 0.00 N ATOM 0 H ARG A 255 -7.742 -20.994 7.121 1.00 0.00 H new ATOM 0 HA ARG A 255 -5.602 -21.976 5.304 1.00 0.00 H new ATOM 0 HB2 ARG A 255 -5.445 -19.751 7.408 1.00 0.00 H new ATOM 0 HB3 ARG A 255 -4.103 -20.348 6.452 1.00 0.00 H new ATOM 0 HG2 ARG A 255 -6.553 -18.902 5.333 1.00 0.00 H new ATOM 0 HG3 ARG A 255 -4.983 -18.171 5.604 1.00 0.00 H new ATOM 0 HD2 ARG A 255 -3.948 -19.635 3.919 1.00 0.00 H new ATOM 0 HD3 ARG A 255 -5.438 -20.536 3.727 1.00 0.00 H new ATOM 0 HE ARG A 255 -5.373 -17.606 3.111 1.00 0.00 H new ATOM 0 HH11 ARG A 255 -5.881 -20.946 2.019 1.00 0.00 H new ATOM 0 HH12 ARG A 255 -6.553 -20.442 0.465 1.00 0.00 H new ATOM 0 HH21 ARG A 255 -6.267 -17.001 1.154 1.00 0.00 H new ATOM 0 HH22 ARG A 255 -6.769 -18.222 -0.020 1.00 0.00 H new ATOM 584 N SER A 256 -4.321 -22.953 7.420 1.00 0.00 N ATOM 585 CA SER A 256 -3.797 -23.756 8.528 1.00 0.00 C ATOM 586 C SER A 256 -3.532 -22.850 9.750 1.00 0.00 C ATOM 587 O SER A 256 -2.919 -21.780 9.610 1.00 0.00 O ATOM 588 CB SER A 256 -2.500 -24.484 8.089 1.00 0.00 C ATOM 589 OG SER A 256 -2.696 -25.224 6.893 1.00 0.00 O ATOM 0 H SER A 256 -3.647 -22.792 6.672 1.00 0.00 H new ATOM 0 HA SER A 256 -4.533 -24.509 8.809 1.00 0.00 H new ATOM 0 HB2 SER A 256 -1.705 -23.754 7.940 1.00 0.00 H new ATOM 0 HB3 SER A 256 -2.172 -25.155 8.883 1.00 0.00 H new ATOM 0 HG SER A 256 -1.859 -25.669 6.643 1.00 0.00 H new ATOM 595 N ALA A 257 -4.024 -23.282 10.924 1.00 0.00 N ATOM 596 CA ALA A 257 -3.817 -22.592 12.210 1.00 0.00 C ATOM 597 C ALA A 257 -2.318 -22.413 12.506 1.00 0.00 C ATOM 598 O ALA A 257 -1.873 -21.344 12.947 1.00 0.00 O ATOM 599 CB ALA A 257 -4.478 -23.396 13.323 1.00 0.00 C ATOM 0 H ALA A 257 -4.584 -24.131 11.008 1.00 0.00 H new ATOM 0 HA ALA A 257 -4.268 -21.601 12.153 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -4.328 -22.890 14.276 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -5.546 -23.484 13.123 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -4.034 -24.391 13.366 1.00 0.00 H new ATOM 605 N SER A 258 -1.563 -23.486 12.227 1.00 0.00 N ATOM 606 CA SER A 258 -0.105 -23.535 12.394 1.00 0.00 C ATOM 607 C SER A 258 0.599 -22.490 11.504 1.00 0.00 C ATOM 608 O SER A 258 1.572 -21.861 11.923 1.00 0.00 O ATOM 609 CB SER A 258 0.380 -24.959 12.032 1.00 0.00 C ATOM 610 OG SER A 258 -0.360 -25.947 12.733 1.00 0.00 O ATOM 0 H SER A 258 -1.956 -24.358 11.873 1.00 0.00 H new ATOM 0 HA SER A 258 0.145 -23.300 13.429 1.00 0.00 H new ATOM 0 HB2 SER A 258 0.279 -25.119 10.959 1.00 0.00 H new ATOM 0 HB3 SER A 258 1.439 -25.057 12.270 1.00 0.00 H new ATOM 0 HG SER A 258 -0.034 -26.837 12.484 1.00 0.00 H new ATOM 616 N SER A 259 0.069 -22.307 10.275 1.00 0.00 N ATOM 617 CA SER A 259 0.685 -21.451 9.249 1.00 0.00 C ATOM 618 C SER A 259 0.414 -19.954 9.517 1.00 0.00 C ATOM 619 O SER A 259 1.299 -19.134 9.297 1.00 0.00 O ATOM 620 CB SER A 259 0.203 -21.856 7.845 1.00 0.00 C ATOM 621 OG SER A 259 0.893 -21.138 6.833 1.00 0.00 O ATOM 0 H SER A 259 -0.798 -22.750 9.971 1.00 0.00 H new ATOM 0 HA SER A 259 1.764 -21.599 9.299 1.00 0.00 H new ATOM 0 HB2 SER A 259 0.354 -22.926 7.701 1.00 0.00 H new ATOM 0 HB3 SER A 259 -0.868 -21.671 7.759 1.00 0.00 H new ATOM 0 HG SER A 259 0.612 -21.463 5.952 1.00 0.00 H new ATOM 627 N VAL A 260 -0.812 -19.597 9.981 1.00 0.00 N ATOM 628 CA VAL A 260 -1.140 -18.190 10.354 1.00 0.00 C ATOM 629 C VAL A 260 -0.355 -17.778 11.615 1.00 0.00 C ATOM 630 O VAL A 260 0.091 -16.622 11.743 1.00 0.00 O ATOM 631 CB VAL A 260 -2.694 -17.932 10.561 1.00 0.00 C ATOM 632 CG1 VAL A 260 -3.482 -18.179 9.254 1.00 0.00 C ATOM 633 CG2 VAL A 260 -3.292 -18.765 11.724 1.00 0.00 C ATOM 0 H VAL A 260 -1.583 -20.253 10.106 1.00 0.00 H new ATOM 0 HA VAL A 260 -0.839 -17.570 9.510 1.00 0.00 H new ATOM 0 HB VAL A 260 -2.795 -16.882 10.837 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -4.542 -17.994 9.428 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -3.119 -17.506 8.477 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -3.341 -19.211 8.934 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -4.356 -18.547 11.818 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -3.156 -19.827 11.519 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -2.785 -18.507 12.654 1.00 0.00 H new ATOM 643 N LYS A 261 -0.164 -18.758 12.522 1.00 0.00 N ATOM 644 CA LYS A 261 0.605 -18.583 13.758 1.00 0.00 C ATOM 645 C LYS A 261 2.097 -18.354 13.452 1.00 0.00 C ATOM 646 O LYS A 261 2.721 -17.456 14.022 1.00 0.00 O ATOM 647 CB LYS A 261 0.406 -19.822 14.664 1.00 0.00 C ATOM 648 CG LYS A 261 1.115 -19.747 16.035 1.00 0.00 C ATOM 649 CD LYS A 261 0.757 -20.949 16.952 1.00 0.00 C ATOM 650 CE LYS A 261 1.581 -20.975 18.250 1.00 0.00 C ATOM 651 NZ LYS A 261 3.021 -21.229 17.982 1.00 0.00 N ATOM 0 H LYS A 261 -0.545 -19.698 12.411 1.00 0.00 H new ATOM 0 HA LYS A 261 0.243 -17.698 14.282 1.00 0.00 H new ATOM 0 HB2 LYS A 261 -0.662 -19.964 14.831 1.00 0.00 H new ATOM 0 HB3 LYS A 261 0.766 -20.703 14.133 1.00 0.00 H new ATOM 0 HG2 LYS A 261 2.194 -19.718 15.882 1.00 0.00 H new ATOM 0 HG3 LYS A 261 0.839 -18.818 16.534 1.00 0.00 H new ATOM 0 HD2 LYS A 261 -0.303 -20.907 17.201 1.00 0.00 H new ATOM 0 HD3 LYS A 261 0.919 -21.878 16.405 1.00 0.00 H new ATOM 0 HE2 LYS A 261 1.470 -20.024 18.771 1.00 0.00 H new ATOM 0 HE3 LYS A 261 1.192 -21.748 18.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 261 3.515 -21.408 18.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 261 3.118 -22.059 17.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 261 3.439 -20.398 17.516 1.00 0.00 H new ATOM 665 N ASP A 262 2.636 -19.171 12.533 1.00 0.00 N ATOM 666 CA ASP A 262 4.057 -19.124 12.117 1.00 0.00 C ATOM 667 C ASP A 262 4.358 -17.855 11.302 1.00 0.00 C ATOM 668 O ASP A 262 5.433 -17.272 11.427 1.00 0.00 O ATOM 669 CB ASP A 262 4.412 -20.394 11.285 1.00 0.00 C ATOM 670 CG ASP A 262 5.889 -20.448 10.836 1.00 0.00 C ATOM 671 OD1 ASP A 262 6.746 -20.828 11.658 1.00 0.00 O ATOM 672 OD2 ASP A 262 6.192 -20.110 9.673 1.00 0.00 O ATOM 0 H ASP A 262 2.098 -19.891 12.051 1.00 0.00 H new ATOM 0 HA ASP A 262 4.673 -19.100 13.016 1.00 0.00 H new ATOM 0 HB2 ASP A 262 4.189 -21.281 11.879 1.00 0.00 H new ATOM 0 HB3 ASP A 262 3.772 -20.431 10.404 1.00 0.00 H new ATOM 677 N ARG A 263 3.388 -17.449 10.463 1.00 0.00 N ATOM 678 CA ARG A 263 3.491 -16.250 9.596 1.00 0.00 C ATOM 679 C ARG A 263 3.575 -14.976 10.452 1.00 0.00 C ATOM 680 O ARG A 263 4.412 -14.092 10.204 1.00 0.00 O ATOM 681 CB ARG A 263 2.271 -16.179 8.628 1.00 0.00 C ATOM 682 CG ARG A 263 2.298 -15.054 7.551 1.00 0.00 C ATOM 683 CD ARG A 263 3.432 -15.207 6.497 1.00 0.00 C ATOM 684 NE ARG A 263 4.751 -14.739 6.986 1.00 0.00 N ATOM 685 CZ ARG A 263 5.909 -14.818 6.306 1.00 0.00 C ATOM 686 NH1 ARG A 263 5.977 -15.436 5.130 1.00 0.00 N ATOM 687 NH2 ARG A 263 7.002 -14.279 6.814 1.00 0.00 N ATOM 0 H ARG A 263 2.502 -17.944 10.363 1.00 0.00 H new ATOM 0 HA ARG A 263 4.402 -16.325 9.002 1.00 0.00 H new ATOM 0 HB2 ARG A 263 2.186 -17.138 8.117 1.00 0.00 H new ATOM 0 HB3 ARG A 263 1.368 -16.056 9.226 1.00 0.00 H new ATOM 0 HG2 ARG A 263 1.338 -15.037 7.035 1.00 0.00 H new ATOM 0 HG3 ARG A 263 2.409 -14.091 8.050 1.00 0.00 H new ATOM 0 HD2 ARG A 263 3.510 -16.255 6.207 1.00 0.00 H new ATOM 0 HD3 ARG A 263 3.164 -14.647 5.601 1.00 0.00 H new ATOM 0 HE ARG A 263 4.783 -14.322 7.916 1.00 0.00 H new ATOM 0 HH11 ARG A 263 5.141 -15.861 4.728 1.00 0.00 H new ATOM 0 HH12 ARG A 263 6.865 -15.485 4.630 1.00 0.00 H new ATOM 0 HH21 ARG A 263 6.965 -13.806 7.717 1.00 0.00 H new ATOM 0 HH22 ARG A 263 7.883 -14.335 6.303 1.00 0.00 H new ATOM 701 N CYS A 264 2.700 -14.917 11.475 1.00 0.00 N ATOM 702 CA CYS A 264 2.636 -13.793 12.429 1.00 0.00 C ATOM 703 C CYS A 264 3.842 -13.784 13.387 1.00 0.00 C ATOM 704 O CYS A 264 4.329 -12.709 13.776 1.00 0.00 O ATOM 705 CB CYS A 264 1.335 -13.862 13.240 1.00 0.00 C ATOM 706 SG CYS A 264 1.161 -12.530 14.444 1.00 0.00 S ATOM 0 H CYS A 264 2.016 -15.650 11.663 1.00 0.00 H new ATOM 0 HA CYS A 264 2.661 -12.871 11.849 1.00 0.00 H new ATOM 0 HB2 CYS A 264 0.488 -13.834 12.555 1.00 0.00 H new ATOM 0 HB3 CYS A 264 1.292 -14.819 13.761 1.00 0.00 H new ATOM 0 HG CYS A 264 2.327 -12.011 14.688 1.00 0.00 H new ATOM 712 N ARG A 265 4.298 -14.995 13.779 1.00 0.00 N ATOM 713 CA ARG A 265 5.454 -15.165 14.682 1.00 0.00 C ATOM 714 C ARG A 265 6.735 -14.666 13.999 1.00 0.00 C ATOM 715 O ARG A 265 7.537 -13.966 14.620 1.00 0.00 O ATOM 716 CB ARG A 265 5.638 -16.648 15.124 1.00 0.00 C ATOM 717 CG ARG A 265 6.844 -16.866 16.071 1.00 0.00 C ATOM 718 CD ARG A 265 7.087 -18.336 16.435 1.00 0.00 C ATOM 719 NE ARG A 265 8.221 -18.475 17.367 1.00 0.00 N ATOM 720 CZ ARG A 265 8.952 -19.586 17.554 1.00 0.00 C ATOM 721 NH1 ARG A 265 8.680 -20.698 16.896 1.00 0.00 N ATOM 722 NH2 ARG A 265 9.951 -19.565 18.409 1.00 0.00 N ATOM 0 H ARG A 265 3.877 -15.875 13.480 1.00 0.00 H new ATOM 0 HA ARG A 265 5.258 -14.573 15.576 1.00 0.00 H new ATOM 0 HB2 ARG A 265 4.729 -16.986 15.622 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.765 -17.270 14.238 1.00 0.00 H new ATOM 0 HG2 ARG A 265 7.741 -16.465 15.600 1.00 0.00 H new ATOM 0 HG3 ARG A 265 6.683 -16.296 16.986 1.00 0.00 H new ATOM 0 HD2 ARG A 265 6.188 -18.755 16.887 1.00 0.00 H new ATOM 0 HD3 ARG A 265 7.285 -18.910 15.529 1.00 0.00 H new ATOM 0 HE ARG A 265 8.473 -17.655 17.919 1.00 0.00 H new ATOM 0 HH11 ARG A 265 7.905 -20.722 16.234 1.00 0.00 H new ATOM 0 HH12 ARG A 265 9.245 -21.533 17.050 1.00 0.00 H new ATOM 0 HH21 ARG A 265 10.165 -18.710 18.923 1.00 0.00 H new ATOM 0 HH22 ARG A 265 10.512 -20.404 18.558 1.00 0.00 H new ATOM 736 N LEU A 266 6.902 -15.038 12.712 1.00 0.00 N ATOM 737 CA LEU A 266 8.042 -14.611 11.890 1.00 0.00 C ATOM 738 C LEU A 266 7.997 -13.075 11.767 1.00 0.00 C ATOM 739 O LEU A 266 9.019 -12.411 11.976 1.00 0.00 O ATOM 740 CB LEU A 266 8.010 -15.310 10.482 1.00 0.00 C ATOM 741 CG LEU A 266 9.396 -15.696 9.841 1.00 0.00 C ATOM 742 CD1 LEU A 266 9.202 -16.309 8.435 1.00 0.00 C ATOM 743 CD2 LEU A 266 10.394 -14.510 9.794 1.00 0.00 C ATOM 0 H LEU A 266 6.246 -15.644 12.218 1.00 0.00 H new ATOM 0 HA LEU A 266 8.979 -14.907 12.362 1.00 0.00 H new ATOM 0 HB2 LEU A 266 7.413 -16.218 10.568 1.00 0.00 H new ATOM 0 HB3 LEU A 266 7.489 -14.650 9.789 1.00 0.00 H new ATOM 0 HG LEU A 266 9.840 -16.448 10.494 1.00 0.00 H new ATOM 0 HD11 LEU A 266 10.173 -16.567 8.013 1.00 0.00 H new ATOM 0 HD12 LEU A 266 8.589 -17.207 8.511 1.00 0.00 H new ATOM 0 HD13 LEU A 266 8.706 -15.585 7.788 1.00 0.00 H new ATOM 0 HD21 LEU A 266 11.330 -14.839 9.342 1.00 0.00 H new ATOM 0 HD22 LEU A 266 9.969 -13.700 9.200 1.00 0.00 H new ATOM 0 HD23 LEU A 266 10.586 -14.155 10.807 1.00 0.00 H new ATOM 755 N MET A 267 6.764 -12.554 11.463 1.00 0.00 N ATOM 756 CA MET A 267 6.438 -11.104 11.373 1.00 0.00 C ATOM 757 C MET A 267 7.054 -10.468 10.104 1.00 0.00 C ATOM 758 O MET A 267 6.338 -9.936 9.246 1.00 0.00 O ATOM 759 CB MET A 267 6.884 -10.360 12.670 1.00 0.00 C ATOM 760 CG MET A 267 6.691 -8.839 12.657 1.00 0.00 C ATOM 761 SD MET A 267 7.401 -8.050 14.122 1.00 0.00 S ATOM 762 CE MET A 267 9.138 -8.482 13.963 1.00 0.00 C ATOM 0 H MET A 267 5.958 -13.149 11.271 1.00 0.00 H new ATOM 0 HA MET A 267 5.356 -11.001 11.287 1.00 0.00 H new ATOM 0 HB2 MET A 267 6.330 -10.772 13.513 1.00 0.00 H new ATOM 0 HB3 MET A 267 7.938 -10.574 12.846 1.00 0.00 H new ATOM 0 HG2 MET A 267 7.153 -8.423 11.762 1.00 0.00 H new ATOM 0 HG3 MET A 267 5.627 -8.610 12.602 1.00 0.00 H new ATOM 0 HE1 MET A 267 9.719 -7.933 14.704 1.00 0.00 H new ATOM 0 HE2 MET A 267 9.263 -9.553 14.125 1.00 0.00 H new ATOM 0 HE3 MET A 267 9.487 -8.223 12.964 1.00 0.00 H new ATOM 772 N LYS A 268 8.392 -10.497 10.034 1.00 0.00 N ATOM 773 CA LYS A 268 9.166 -10.147 8.834 1.00 0.00 C ATOM 774 C LYS A 268 9.163 -11.326 7.839 1.00 0.00 C ATOM 775 O LYS A 268 8.535 -12.367 8.090 1.00 0.00 O ATOM 776 CB LYS A 268 10.622 -9.800 9.248 1.00 0.00 C ATOM 777 CG LYS A 268 10.743 -8.618 10.230 1.00 0.00 C ATOM 778 CD LYS A 268 10.220 -7.291 9.632 1.00 0.00 C ATOM 779 CE LYS A 268 10.450 -6.097 10.570 1.00 0.00 C ATOM 780 NZ LYS A 268 11.890 -5.887 10.875 1.00 0.00 N ATOM 0 H LYS A 268 8.978 -10.769 10.824 1.00 0.00 H new ATOM 0 HA LYS A 268 8.712 -9.283 8.348 1.00 0.00 H new ATOM 0 HB2 LYS A 268 11.077 -10.681 9.701 1.00 0.00 H new ATOM 0 HB3 LYS A 268 11.197 -9.571 8.351 1.00 0.00 H new ATOM 0 HG2 LYS A 268 10.186 -8.847 11.139 1.00 0.00 H new ATOM 0 HG3 LYS A 268 11.787 -8.496 10.518 1.00 0.00 H new ATOM 0 HD2 LYS A 268 10.717 -7.103 8.680 1.00 0.00 H new ATOM 0 HD3 LYS A 268 9.155 -7.385 9.422 1.00 0.00 H new ATOM 0 HE2 LYS A 268 10.043 -5.195 10.113 1.00 0.00 H new ATOM 0 HE3 LYS A 268 9.904 -6.258 11.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 12.020 -4.950 11.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 12.215 -6.621 11.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 12.443 -5.943 9.996 1.00 0.00 H new ATOM 794 N ASP A 269 9.879 -11.158 6.717 1.00 0.00 N ATOM 795 CA ASP A 269 10.075 -12.228 5.725 1.00 0.00 C ATOM 796 C ASP A 269 11.383 -11.969 4.958 1.00 0.00 C ATOM 797 O ASP A 269 11.494 -10.971 4.232 1.00 0.00 O ATOM 798 CB ASP A 269 8.868 -12.307 4.739 1.00 0.00 C ATOM 799 CG ASP A 269 8.970 -13.496 3.763 1.00 0.00 C ATOM 800 OD1 ASP A 269 8.745 -14.652 4.205 1.00 0.00 O ATOM 801 OD2 ASP A 269 9.262 -13.294 2.562 1.00 0.00 O ATOM 0 H ASP A 269 10.337 -10.280 6.472 1.00 0.00 H new ATOM 0 HA ASP A 269 10.139 -13.185 6.243 1.00 0.00 H new ATOM 0 HB2 ASP A 269 7.943 -12.390 5.310 1.00 0.00 H new ATOM 0 HB3 ASP A 269 8.809 -11.380 4.169 1.00 0.00 H new ATOM 806 N THR A 270 12.381 -12.853 5.149 1.00 0.00 N ATOM 807 CA THR A 270 13.648 -12.800 4.402 1.00 0.00 C ATOM 808 C THR A 270 13.428 -13.383 2.989 1.00 0.00 C ATOM 809 O THR A 270 13.621 -14.581 2.745 1.00 0.00 O ATOM 810 CB THR A 270 14.794 -13.553 5.172 1.00 0.00 C ATOM 811 OG1 THR A 270 14.351 -14.868 5.538 1.00 0.00 O ATOM 812 CG2 THR A 270 15.237 -12.785 6.438 1.00 0.00 C ATOM 0 H THR A 270 12.331 -13.618 5.821 1.00 0.00 H new ATOM 0 HA THR A 270 13.967 -11.762 4.306 1.00 0.00 H new ATOM 0 HB THR A 270 15.652 -13.621 4.504 1.00 0.00 H new ATOM 0 HG1 THR A 270 13.946 -15.305 4.760 1.00 0.00 H new ATOM 0 HG21 THR A 270 16.030 -13.339 6.941 1.00 0.00 H new ATOM 0 HG22 THR A 270 15.606 -11.799 6.155 1.00 0.00 H new ATOM 0 HG23 THR A 270 14.388 -12.675 7.112 1.00 0.00 H new ATOM 820 N CYS A 271 12.933 -12.517 2.089 1.00 0.00 N ATOM 821 CA CYS A 271 12.626 -12.864 0.692 1.00 0.00 C ATOM 822 C CYS A 271 13.920 -13.033 -0.132 1.00 0.00 C ATOM 823 O CYS A 271 13.973 -13.845 -1.059 1.00 0.00 O ATOM 824 CB CYS A 271 11.746 -11.753 0.096 1.00 0.00 C ATOM 825 SG CYS A 271 12.507 -10.120 0.214 1.00 0.00 S ATOM 0 H CYS A 271 12.732 -11.543 2.315 1.00 0.00 H new ATOM 0 HA CYS A 271 12.094 -13.815 0.661 1.00 0.00 H new ATOM 0 HB2 CYS A 271 11.542 -11.979 -0.951 1.00 0.00 H new ATOM 0 HB3 CYS A 271 10.786 -11.740 0.612 1.00 0.00 H new ATOM 0 HG CYS A 271 13.698 -10.158 -0.306 1.00 0.00 H new ATOM 831 N ASN A 272 14.955 -12.244 0.220 1.00 0.00 N ATOM 832 CA ASN A 272 16.277 -12.286 -0.436 1.00 0.00 C ATOM 833 C ASN A 272 17.191 -13.284 0.281 1.00 0.00 C ATOM 834 O ASN A 272 17.116 -13.443 1.508 1.00 0.00 O ATOM 835 CB ASN A 272 16.939 -10.881 -0.446 1.00 0.00 C ATOM 836 CG ASN A 272 16.124 -9.839 -1.213 1.00 0.00 C ATOM 837 OD1 ASN A 272 15.273 -9.094 -0.519 1.00 0.00 O flip ATOM 838 ND2 ASN A 272 16.262 -9.702 -2.427 1.00 0.00 N flip ATOM 0 H ASN A 272 14.897 -11.556 0.971 1.00 0.00 H new ATOM 0 HA ASN A 272 16.132 -12.606 -1.468 1.00 0.00 H new ATOM 0 HB2 ASN A 272 17.075 -10.543 0.581 1.00 0.00 H new ATOM 0 HB3 ASN A 272 17.931 -10.957 -0.891 1.00 0.00 H new ATOM 0 HD21 ASN A 272 16.924 -10.289 -2.934 1.00 0.00 H new ATOM 0 HD22 ASN A 272 15.715 -9.001 -2.927 1.00 0.00 H new ATOM 845 N THR A 273 18.040 -13.952 -0.506 1.00 0.00 N ATOM 846 CA THR A 273 19.079 -14.858 0.006 1.00 0.00 C ATOM 847 C THR A 273 20.227 -14.036 0.648 1.00 0.00 C ATOM 848 O THR A 273 20.729 -14.374 1.727 1.00 0.00 O ATOM 849 CB THR A 273 19.626 -15.752 -1.159 1.00 0.00 C ATOM 850 OG1 THR A 273 18.523 -16.427 -1.799 1.00 0.00 O ATOM 851 CG2 THR A 273 20.656 -16.805 -0.685 1.00 0.00 C ATOM 0 H THR A 273 18.028 -13.880 -1.523 1.00 0.00 H new ATOM 0 HA THR A 273 18.648 -15.506 0.769 1.00 0.00 H new ATOM 0 HB THR A 273 20.140 -15.089 -1.855 1.00 0.00 H new ATOM 0 HG1 THR A 273 18.861 -16.986 -2.530 1.00 0.00 H new ATOM 0 HG21 THR A 273 20.996 -17.391 -1.539 1.00 0.00 H new ATOM 0 HG22 THR A 273 21.508 -16.301 -0.229 1.00 0.00 H new ATOM 0 HG23 THR A 273 20.191 -17.466 0.047 1.00 0.00 H new ATOM 859 N GLY A 274 20.619 -12.949 -0.043 1.00 0.00 N ATOM 860 CA GLY A 274 21.659 -12.030 0.433 1.00 0.00 C ATOM 861 C GLY A 274 22.480 -11.477 -0.732 1.00 0.00 C ATOM 862 O GLY A 274 23.518 -12.076 -1.081 1.00 0.00 O ATOM 863 OXT GLY A 274 22.064 -10.471 -1.346 1.00 0.00 O ATOM 0 H GLY A 274 20.222 -12.687 -0.945 1.00 0.00 H new ATOM 0 HA2 GLY A 274 21.199 -11.207 0.980 1.00 0.00 H new ATOM 0 HA3 GLY A 274 22.316 -12.549 1.131 1.00 0.00 H new TER 867 GLY A 274