USER MOD reduce.3.24.130724 H: found=0, std=0, add=615, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 615 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 213 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 223 THR OG1 : rot 180:sc= 0.00374 USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 THR OG1 : rot -17:sc= -3.2! USER MOD Single : A 238 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 CYS SG : rot 180:sc= -5.57! USER MOD Single : A 252 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 253 ASN : amide:sc= -0.853 K(o=-0.85,f=-6.4!) USER MOD Single : A 260 THR OG1 : rot 180:sc= 0 USER MOD Single : A 262 TYR OH : rot -30:sc= -1.01 USER MOD Single : A 264 GLN : amide:sc= -0.446 X(o=-0.45,f=-0.0021) USER MOD Single : A 265 CYS SG : rot -123:sc= -1.17 USER MOD Single : A 266 GLN :FLIP amide:sc= -0.416 F(o=-1.3,f=-0.42) USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 269 TYR OH : rot 180:sc= -1.13 USER MOD Single : A 276 HIS :FLIP no HD1:sc= -4.8! C(o=-5.6!,f=-4.8!) USER MOD Single : A 277 LYS NZ :NH3+ 151:sc= 0.293 (180deg=-0.528) USER MOD Single : A 279 THR OG1 : rot 180:sc=-0.00783 USER MOD Single : A 280 LYS NZ :NH3+ -162:sc= -0.0125 (180deg=-0.151) USER MOD Single : B 451 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 210 14.038 10.006 1.063 1.00 0.00 N ATOM 2 CA ARG A 210 13.875 8.599 0.713 1.00 0.00 C ATOM 3 C ARG A 210 12.493 8.095 1.111 1.00 0.00 C ATOM 4 O ARG A 210 12.345 7.369 2.096 1.00 0.00 O ATOM 5 CB ARG A 210 14.959 7.756 1.391 1.00 0.00 C ATOM 6 CG ARG A 210 16.107 7.383 0.468 1.00 0.00 C ATOM 7 CD ARG A 210 16.899 6.205 1.011 1.00 0.00 C ATOM 8 NE ARG A 210 17.246 5.248 -0.037 1.00 0.00 N ATOM 9 CZ ARG A 210 18.247 5.420 -0.897 1.00 0.00 C ATOM 10 NH1 ARG A 210 19.001 6.511 -0.838 1.00 0.00 N ATOM 11 NH2 ARG A 210 18.494 4.500 -1.820 1.00 0.00 N ATOM 0 HA ARG A 210 13.975 8.504 -0.368 1.00 0.00 H new ATOM 0 HB2 ARG A 210 15.355 8.307 2.245 1.00 0.00 H new ATOM 0 HB3 ARG A 210 14.507 6.844 1.781 1.00 0.00 H new ATOM 0 HG2 ARG A 210 15.716 7.136 -0.519 1.00 0.00 H new ATOM 0 HG3 ARG A 210 16.768 8.241 0.343 1.00 0.00 H new ATOM 0 HD2 ARG A 210 17.810 6.569 1.486 1.00 0.00 H new ATOM 0 HD3 ARG A 210 16.317 5.702 1.783 1.00 0.00 H new ATOM 0 HE ARG A 210 16.688 4.398 -0.114 1.00 0.00 H new ATOM 0 HH11 ARG A 210 18.814 7.222 -0.131 1.00 0.00 H new ATOM 0 HH12 ARG A 210 19.767 6.638 -1.499 1.00 0.00 H new ATOM 0 HH21 ARG A 210 17.917 3.661 -1.871 1.00 0.00 H new ATOM 0 HH22 ARG A 210 19.261 4.632 -2.479 1.00 0.00 H new ATOM 24 N GLU A 211 11.481 8.483 0.342 1.00 0.00 N ATOM 25 CA GLU A 211 10.110 8.070 0.614 1.00 0.00 C ATOM 26 C GLU A 211 9.916 6.589 0.304 1.00 0.00 C ATOM 27 O GLU A 211 10.883 5.861 0.074 1.00 0.00 O ATOM 28 CB GLU A 211 9.131 8.909 -0.207 1.00 0.00 C ATOM 29 CG GLU A 211 9.388 10.404 -0.119 1.00 0.00 C ATOM 30 CD GLU A 211 8.389 11.118 0.770 1.00 0.00 C ATOM 31 OE1 GLU A 211 7.183 11.091 0.447 1.00 0.00 O ATOM 32 OE2 GLU A 211 8.812 11.702 1.790 1.00 0.00 O ATOM 0 H GLU A 211 11.585 9.084 -0.476 1.00 0.00 H new ATOM 0 HA GLU A 211 9.912 8.228 1.674 1.00 0.00 H new ATOM 0 HB2 GLU A 211 9.187 8.600 -1.251 1.00 0.00 H new ATOM 0 HB3 GLU A 211 8.116 8.703 0.132 1.00 0.00 H new ATOM 0 HG2 GLU A 211 10.395 10.574 0.263 1.00 0.00 H new ATOM 0 HG3 GLU A 211 9.350 10.835 -1.120 1.00 0.00 H new ATOM 39 N LEU A 212 8.663 6.149 0.297 1.00 0.00 N ATOM 40 CA LEU A 212 8.344 4.754 0.013 1.00 0.00 C ATOM 41 C LEU A 212 7.785 4.600 -1.397 1.00 0.00 C ATOM 42 O LEU A 212 7.163 5.518 -1.934 1.00 0.00 O ATOM 43 CB LEU A 212 7.337 4.221 1.034 1.00 0.00 C ATOM 44 CG LEU A 212 7.894 4.005 2.442 1.00 0.00 C ATOM 45 CD1 LEU A 212 6.783 3.605 3.401 1.00 0.00 C ATOM 46 CD2 LEU A 212 8.992 2.952 2.425 1.00 0.00 C ATOM 0 H LEU A 212 7.851 6.738 0.485 1.00 0.00 H new ATOM 0 HA LEU A 212 9.265 4.175 0.085 1.00 0.00 H new ATOM 0 HB2 LEU A 212 6.500 4.917 1.094 1.00 0.00 H new ATOM 0 HB3 LEU A 212 6.939 3.275 0.668 1.00 0.00 H new ATOM 0 HG LEU A 212 8.324 4.944 2.790 1.00 0.00 H new ATOM 0 HD11 LEU A 212 7.199 3.456 4.397 1.00 0.00 H new ATOM 0 HD12 LEU A 212 6.031 4.393 3.436 1.00 0.00 H new ATOM 0 HD13 LEU A 212 6.322 2.679 3.058 1.00 0.00 H new ATOM 0 HD21 LEU A 212 9.377 2.811 3.435 1.00 0.00 H new ATOM 0 HD22 LEU A 212 8.587 2.010 2.056 1.00 0.00 H new ATOM 0 HD23 LEU A 212 9.800 3.280 1.771 1.00 0.00 H new ATOM 58 N LYS A 213 8.011 3.434 -1.994 1.00 0.00 N ATOM 59 CA LYS A 213 7.530 3.162 -3.344 1.00 0.00 C ATOM 60 C LYS A 213 6.728 1.865 -3.385 1.00 0.00 C ATOM 61 O LYS A 213 7.039 0.908 -2.673 1.00 0.00 O ATOM 62 CB LYS A 213 8.707 3.078 -4.320 1.00 0.00 C ATOM 63 CG LYS A 213 9.731 4.187 -4.137 1.00 0.00 C ATOM 64 CD LYS A 213 10.968 3.690 -3.405 1.00 0.00 C ATOM 65 CE LYS A 213 12.019 3.174 -4.375 1.00 0.00 C ATOM 66 NZ LYS A 213 13.086 4.182 -4.623 1.00 0.00 N ATOM 0 H LYS A 213 8.523 2.663 -1.565 1.00 0.00 H new ATOM 0 HA LYS A 213 6.877 3.982 -3.642 1.00 0.00 H new ATOM 0 HB2 LYS A 213 9.202 2.115 -4.197 1.00 0.00 H new ATOM 0 HB3 LYS A 213 8.325 3.113 -5.340 1.00 0.00 H new ATOM 0 HG2 LYS A 213 10.018 4.583 -5.111 1.00 0.00 H new ATOM 0 HG3 LYS A 213 9.283 5.009 -3.579 1.00 0.00 H new ATOM 0 HD2 LYS A 213 11.388 4.499 -2.808 1.00 0.00 H new ATOM 0 HD3 LYS A 213 10.688 2.895 -2.713 1.00 0.00 H new ATOM 0 HE2 LYS A 213 12.465 2.263 -3.976 1.00 0.00 H new ATOM 0 HE3 LYS A 213 11.543 2.909 -5.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 213 13.783 3.793 -5.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 213 12.664 5.042 -5.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 213 13.557 4.416 -3.726 1.00 0.00 H new ATOM 80 N ILE A 214 5.697 1.840 -4.222 1.00 0.00 N ATOM 81 CA ILE A 214 4.849 0.661 -4.357 1.00 0.00 C ATOM 82 C ILE A 214 5.668 -0.553 -4.786 1.00 0.00 C ATOM 83 O ILE A 214 6.562 -0.448 -5.626 1.00 0.00 O ATOM 84 CB ILE A 214 3.716 0.901 -5.375 1.00 0.00 C ATOM 85 CG1 ILE A 214 2.876 2.109 -4.954 1.00 0.00 C ATOM 86 CG2 ILE A 214 2.839 -0.337 -5.508 1.00 0.00 C ATOM 87 CD1 ILE A 214 2.429 2.969 -6.115 1.00 0.00 C ATOM 0 H ILE A 214 5.428 2.623 -4.818 1.00 0.00 H new ATOM 0 HA ILE A 214 4.408 0.467 -3.379 1.00 0.00 H new ATOM 0 HB ILE A 214 4.163 1.107 -6.348 1.00 0.00 H new ATOM 0 HG12 ILE A 214 1.997 1.759 -4.412 1.00 0.00 H new ATOM 0 HG13 ILE A 214 3.455 2.720 -4.262 1.00 0.00 H new ATOM 0 HG21 ILE A 214 2.046 -0.145 -6.231 1.00 0.00 H new ATOM 0 HG22 ILE A 214 3.445 -1.177 -5.848 1.00 0.00 H new ATOM 0 HG23 ILE A 214 2.397 -0.576 -4.540 1.00 0.00 H new ATOM 0 HD11 ILE A 214 1.839 3.806 -5.742 1.00 0.00 H new ATOM 0 HD12 ILE A 214 3.303 3.349 -6.644 1.00 0.00 H new ATOM 0 HD13 ILE A 214 1.823 2.373 -6.797 1.00 0.00 H new ATOM 99 N GLY A 215 5.357 -1.707 -4.202 1.00 0.00 N ATOM 100 CA GLY A 215 6.074 -2.924 -4.532 1.00 0.00 C ATOM 101 C GLY A 215 7.303 -3.133 -3.664 1.00 0.00 C ATOM 102 O GLY A 215 8.002 -4.135 -3.804 1.00 0.00 O ATOM 0 H GLY A 215 4.620 -1.820 -3.506 1.00 0.00 H new ATOM 0 HA2 GLY A 215 5.405 -3.777 -4.419 1.00 0.00 H new ATOM 0 HA3 GLY A 215 6.375 -2.891 -5.579 1.00 0.00 H new ATOM 106 N ASP A 216 7.568 -2.185 -2.767 1.00 0.00 N ATOM 107 CA ASP A 216 8.722 -2.274 -1.880 1.00 0.00 C ATOM 108 C ASP A 216 8.341 -2.903 -0.545 1.00 0.00 C ATOM 109 O ASP A 216 7.240 -2.690 -0.037 1.00 0.00 O ATOM 110 CB ASP A 216 9.321 -0.886 -1.650 1.00 0.00 C ATOM 111 CG ASP A 216 10.035 -0.354 -2.876 1.00 0.00 C ATOM 112 OD1 ASP A 216 9.391 -0.251 -3.942 1.00 0.00 O ATOM 113 OD2 ASP A 216 11.241 -0.041 -2.773 1.00 0.00 O ATOM 0 H ASP A 216 6.999 -1.348 -2.637 1.00 0.00 H new ATOM 0 HA ASP A 216 9.466 -2.911 -2.359 1.00 0.00 H new ATOM 0 HB2 ASP A 216 8.528 -0.194 -1.366 1.00 0.00 H new ATOM 0 HB3 ASP A 216 10.021 -0.929 -0.816 1.00 0.00 H new ATOM 118 N ARG A 217 9.264 -3.674 0.024 1.00 0.00 N ATOM 119 CA ARG A 217 9.029 -4.329 1.304 1.00 0.00 C ATOM 120 C ARG A 217 9.158 -3.327 2.444 1.00 0.00 C ATOM 121 O ARG A 217 10.128 -2.572 2.511 1.00 0.00 O ATOM 122 CB ARG A 217 10.016 -5.479 1.507 1.00 0.00 C ATOM 123 CG ARG A 217 9.434 -6.647 2.285 1.00 0.00 C ATOM 124 CD ARG A 217 8.587 -7.542 1.394 1.00 0.00 C ATOM 125 NE ARG A 217 9.396 -8.240 0.396 1.00 0.00 N ATOM 126 CZ ARG A 217 9.610 -7.793 -0.841 1.00 0.00 C ATOM 127 NH1 ARG A 217 9.098 -6.633 -1.237 1.00 0.00 N ATOM 128 NH2 ARG A 217 10.348 -8.503 -1.681 1.00 0.00 N ATOM 0 H ARG A 217 10.181 -3.859 -0.382 1.00 0.00 H new ATOM 0 HA ARG A 217 8.016 -4.733 1.301 1.00 0.00 H new ATOM 0 HB2 ARG A 217 10.354 -5.834 0.533 1.00 0.00 H new ATOM 0 HB3 ARG A 217 10.895 -5.105 2.032 1.00 0.00 H new ATOM 0 HG2 ARG A 217 10.242 -7.231 2.726 1.00 0.00 H new ATOM 0 HG3 ARG A 217 8.826 -6.271 3.108 1.00 0.00 H new ATOM 0 HD2 ARG A 217 8.060 -8.272 2.009 1.00 0.00 H new ATOM 0 HD3 ARG A 217 7.829 -6.941 0.891 1.00 0.00 H new ATOM 0 HE ARG A 217 9.824 -9.126 0.664 1.00 0.00 H new ATOM 0 HH11 ARG A 217 8.536 -6.077 -0.592 1.00 0.00 H new ATOM 0 HH12 ARG A 217 9.267 -6.298 -2.186 1.00 0.00 H new ATOM 0 HH21 ARG A 217 10.751 -9.390 -1.381 1.00 0.00 H new ATOM 0 HH22 ARG A 217 10.513 -8.162 -2.628 1.00 0.00 H new ATOM 142 N VAL A 218 8.172 -3.318 3.332 1.00 0.00 N ATOM 143 CA VAL A 218 8.179 -2.396 4.458 1.00 0.00 C ATOM 144 C VAL A 218 7.437 -2.971 5.657 1.00 0.00 C ATOM 145 O VAL A 218 6.966 -4.108 5.627 1.00 0.00 O ATOM 146 CB VAL A 218 7.531 -1.050 4.076 1.00 0.00 C ATOM 147 CG1 VAL A 218 8.165 -0.491 2.810 1.00 0.00 C ATOM 148 CG2 VAL A 218 6.026 -1.209 3.901 1.00 0.00 C ATOM 0 H VAL A 218 7.361 -3.936 3.294 1.00 0.00 H new ATOM 0 HA VAL A 218 9.224 -2.238 4.726 1.00 0.00 H new ATOM 0 HB VAL A 218 7.706 -0.342 4.886 1.00 0.00 H new ATOM 0 HG11 VAL A 218 7.695 0.459 2.556 1.00 0.00 H new ATOM 0 HG12 VAL A 218 9.231 -0.335 2.975 1.00 0.00 H new ATOM 0 HG13 VAL A 218 8.024 -1.196 1.991 1.00 0.00 H new ATOM 0 HG21 VAL A 218 5.587 -0.248 3.632 1.00 0.00 H new ATOM 0 HG22 VAL A 218 5.826 -1.933 3.111 1.00 0.00 H new ATOM 0 HG23 VAL A 218 5.586 -1.560 4.835 1.00 0.00 H new ATOM 158 N LEU A 219 7.323 -2.162 6.705 1.00 0.00 N ATOM 159 CA LEU A 219 6.621 -2.568 7.912 1.00 0.00 C ATOM 160 C LEU A 219 5.513 -1.579 8.234 1.00 0.00 C ATOM 161 O LEU A 219 5.769 -0.393 8.427 1.00 0.00 O ATOM 162 CB LEU A 219 7.580 -2.656 9.099 1.00 0.00 C ATOM 163 CG LEU A 219 8.690 -3.700 8.977 1.00 0.00 C ATOM 164 CD1 LEU A 219 9.402 -3.870 10.311 1.00 0.00 C ATOM 165 CD2 LEU A 219 8.127 -5.030 8.498 1.00 0.00 C ATOM 0 H LEU A 219 7.710 -1.219 6.740 1.00 0.00 H new ATOM 0 HA LEU A 219 6.191 -3.553 7.733 1.00 0.00 H new ATOM 0 HB2 LEU A 219 8.040 -1.679 9.244 1.00 0.00 H new ATOM 0 HB3 LEU A 219 7.000 -2.872 9.996 1.00 0.00 H new ATOM 0 HG LEU A 219 9.413 -3.352 8.239 1.00 0.00 H new ATOM 0 HD11 LEU A 219 10.190 -4.616 10.210 1.00 0.00 H new ATOM 0 HD12 LEU A 219 9.840 -2.919 10.614 1.00 0.00 H new ATOM 0 HD13 LEU A 219 8.687 -4.197 11.066 1.00 0.00 H new ATOM 0 HD21 LEU A 219 8.934 -5.759 8.418 1.00 0.00 H new ATOM 0 HD22 LEU A 219 7.384 -5.388 9.210 1.00 0.00 H new ATOM 0 HD23 LEU A 219 7.660 -4.897 7.522 1.00 0.00 H new ATOM 177 N VAL A 220 4.286 -2.070 8.302 1.00 0.00 N ATOM 178 CA VAL A 220 3.148 -1.215 8.614 1.00 0.00 C ATOM 179 C VAL A 220 2.939 -1.150 10.122 1.00 0.00 C ATOM 180 O VAL A 220 2.592 -2.148 10.757 1.00 0.00 O ATOM 181 CB VAL A 220 1.843 -1.689 7.925 1.00 0.00 C ATOM 182 CG1 VAL A 220 1.232 -0.563 7.106 1.00 0.00 C ATOM 183 CG2 VAL A 220 2.091 -2.912 7.053 1.00 0.00 C ATOM 0 H VAL A 220 4.051 -3.050 8.147 1.00 0.00 H new ATOM 0 HA VAL A 220 3.379 -0.222 8.227 1.00 0.00 H new ATOM 0 HB VAL A 220 1.137 -1.973 8.705 1.00 0.00 H new ATOM 0 HG11 VAL A 220 0.317 -0.915 6.630 1.00 0.00 H new ATOM 0 HG12 VAL A 220 1.001 0.278 7.759 1.00 0.00 H new ATOM 0 HG13 VAL A 220 1.940 -0.244 6.341 1.00 0.00 H new ATOM 0 HG21 VAL A 220 1.157 -3.220 6.584 1.00 0.00 H new ATOM 0 HG22 VAL A 220 2.821 -2.667 6.282 1.00 0.00 H new ATOM 0 HG23 VAL A 220 2.473 -3.726 7.669 1.00 0.00 H new ATOM 193 N GLY A 221 3.176 0.027 10.691 1.00 0.00 N ATOM 194 CA GLY A 221 3.028 0.203 12.125 1.00 0.00 C ATOM 195 C GLY A 221 4.293 -0.163 12.885 1.00 0.00 C ATOM 196 O GLY A 221 4.375 0.042 14.096 1.00 0.00 O ATOM 0 H GLY A 221 3.468 0.863 10.185 1.00 0.00 H new ATOM 0 HA2 GLY A 221 2.767 1.240 12.336 1.00 0.00 H new ATOM 0 HA3 GLY A 221 2.202 -0.413 12.481 1.00 0.00 H new ATOM 200 N GLY A 222 5.282 -0.705 12.174 1.00 0.00 N ATOM 201 CA GLY A 222 6.533 -1.089 12.805 1.00 0.00 C ATOM 202 C GLY A 222 6.523 -2.520 13.305 1.00 0.00 C ATOM 203 O GLY A 222 7.574 -3.153 13.413 1.00 0.00 O ATOM 0 H GLY A 222 5.237 -0.885 11.171 1.00 0.00 H new ATOM 0 HA2 GLY A 222 7.348 -0.964 12.092 1.00 0.00 H new ATOM 0 HA3 GLY A 222 6.734 -0.418 13.640 1.00 0.00 H new ATOM 207 N THR A 223 5.337 -3.032 13.611 1.00 0.00 N ATOM 208 CA THR A 223 5.199 -4.396 14.103 1.00 0.00 C ATOM 209 C THR A 223 4.758 -5.335 12.989 1.00 0.00 C ATOM 210 O THR A 223 5.053 -6.530 13.018 1.00 0.00 O ATOM 211 CB THR A 223 4.192 -4.437 15.252 1.00 0.00 C ATOM 212 OG1 THR A 223 2.987 -3.789 14.887 1.00 0.00 O ATOM 213 CG2 THR A 223 4.703 -3.780 16.515 1.00 0.00 C ATOM 0 H THR A 223 4.457 -2.523 13.527 1.00 0.00 H new ATOM 0 HA THR A 223 6.172 -4.729 14.465 1.00 0.00 H new ATOM 0 HB THR A 223 4.024 -5.495 15.453 1.00 0.00 H new ATOM 0 HG1 THR A 223 2.355 -3.828 15.635 1.00 0.00 H new ATOM 0 HG21 THR A 223 3.941 -3.843 17.292 1.00 0.00 H new ATOM 0 HG22 THR A 223 5.606 -4.290 16.851 1.00 0.00 H new ATOM 0 HG23 THR A 223 4.931 -2.733 16.314 1.00 0.00 H new ATOM 221 N LYS A 224 4.046 -4.789 12.009 1.00 0.00 N ATOM 222 CA LYS A 224 3.560 -5.582 10.887 1.00 0.00 C ATOM 223 C LYS A 224 4.460 -5.402 9.670 1.00 0.00 C ATOM 224 O LYS A 224 5.051 -4.341 9.476 1.00 0.00 O ATOM 225 CB LYS A 224 2.124 -5.186 10.536 1.00 0.00 C ATOM 226 CG LYS A 224 1.256 -4.870 11.745 1.00 0.00 C ATOM 227 CD LYS A 224 0.685 -6.135 12.367 1.00 0.00 C ATOM 228 CE LYS A 224 1.764 -6.949 13.061 1.00 0.00 C ATOM 229 NZ LYS A 224 1.220 -7.738 14.200 1.00 0.00 N ATOM 0 H LYS A 224 3.793 -3.802 11.969 1.00 0.00 H new ATOM 0 HA LYS A 224 3.576 -6.632 11.181 1.00 0.00 H new ATOM 0 HB2 LYS A 224 2.148 -4.315 9.881 1.00 0.00 H new ATOM 0 HB3 LYS A 224 1.662 -5.996 9.972 1.00 0.00 H new ATOM 0 HG2 LYS A 224 1.846 -4.333 12.487 1.00 0.00 H new ATOM 0 HG3 LYS A 224 0.441 -4.210 11.447 1.00 0.00 H new ATOM 0 HD2 LYS A 224 -0.091 -5.870 13.085 1.00 0.00 H new ATOM 0 HD3 LYS A 224 0.211 -6.740 11.594 1.00 0.00 H new ATOM 0 HE2 LYS A 224 2.229 -7.623 12.342 1.00 0.00 H new ATOM 0 HE3 LYS A 224 2.546 -6.281 13.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 224 1.988 -8.279 14.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 224 0.799 -7.093 14.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 224 0.492 -8.394 13.852 1.00 0.00 H new ATOM 243 N ALA A 225 4.561 -6.445 8.852 1.00 0.00 N ATOM 244 CA ALA A 225 5.390 -6.396 7.652 1.00 0.00 C ATOM 245 C ALA A 225 4.554 -6.620 6.401 1.00 0.00 C ATOM 246 O ALA A 225 3.609 -7.409 6.407 1.00 0.00 O ATOM 247 CB ALA A 225 6.501 -7.430 7.729 1.00 0.00 C ATOM 0 H ALA A 225 4.080 -7.333 8.997 1.00 0.00 H new ATOM 0 HA ALA A 225 5.836 -5.403 7.594 1.00 0.00 H new ATOM 0 HB1 ALA A 225 7.109 -7.379 6.826 1.00 0.00 H new ATOM 0 HB2 ALA A 225 7.126 -7.228 8.599 1.00 0.00 H new ATOM 0 HB3 ALA A 225 6.066 -8.426 7.818 1.00 0.00 H new ATOM 253 N GLY A 226 4.905 -5.920 5.328 1.00 0.00 N ATOM 254 CA GLY A 226 4.174 -6.060 4.085 1.00 0.00 C ATOM 255 C GLY A 226 4.820 -5.312 2.937 1.00 0.00 C ATOM 256 O GLY A 226 5.952 -4.838 3.051 1.00 0.00 O ATOM 0 H GLY A 226 5.682 -5.259 5.298 1.00 0.00 H new ATOM 0 HA2 GLY A 226 4.101 -7.117 3.829 1.00 0.00 H new ATOM 0 HA3 GLY A 226 3.156 -5.695 4.224 1.00 0.00 H new ATOM 260 N VAL A 227 4.098 -5.208 1.826 1.00 0.00 N ATOM 261 CA VAL A 227 4.597 -4.516 0.645 1.00 0.00 C ATOM 262 C VAL A 227 3.709 -3.326 0.295 1.00 0.00 C ATOM 263 O VAL A 227 2.486 -3.445 0.251 1.00 0.00 O ATOM 264 CB VAL A 227 4.674 -5.467 -0.569 1.00 0.00 C ATOM 265 CG1 VAL A 227 5.009 -4.700 -1.843 1.00 0.00 C ATOM 266 CG2 VAL A 227 5.693 -6.568 -0.321 1.00 0.00 C ATOM 0 H VAL A 227 3.161 -5.597 1.720 1.00 0.00 H new ATOM 0 HA VAL A 227 5.600 -4.160 0.880 1.00 0.00 H new ATOM 0 HB VAL A 227 3.695 -5.927 -0.701 1.00 0.00 H new ATOM 0 HG11 VAL A 227 5.057 -5.393 -2.683 1.00 0.00 H new ATOM 0 HG12 VAL A 227 4.237 -3.954 -2.032 1.00 0.00 H new ATOM 0 HG13 VAL A 227 5.972 -4.204 -1.726 1.00 0.00 H new ATOM 0 HG21 VAL A 227 5.733 -7.228 -1.187 1.00 0.00 H new ATOM 0 HG22 VAL A 227 6.675 -6.125 -0.157 1.00 0.00 H new ATOM 0 HG23 VAL A 227 5.402 -7.141 0.559 1.00 0.00 H new ATOM 276 N VAL A 228 4.331 -2.183 0.034 1.00 0.00 N ATOM 277 CA VAL A 228 3.590 -0.981 -0.321 1.00 0.00 C ATOM 278 C VAL A 228 2.800 -1.199 -1.607 1.00 0.00 C ATOM 279 O VAL A 228 3.323 -1.735 -2.582 1.00 0.00 O ATOM 280 CB VAL A 228 4.529 0.225 -0.500 1.00 0.00 C ATOM 281 CG1 VAL A 228 3.731 1.506 -0.688 1.00 0.00 C ATOM 282 CG2 VAL A 228 5.473 0.339 0.688 1.00 0.00 C ATOM 0 H VAL A 228 5.344 -2.064 0.062 1.00 0.00 H new ATOM 0 HA VAL A 228 2.902 -0.770 0.498 1.00 0.00 H new ATOM 0 HB VAL A 228 5.127 0.070 -1.398 1.00 0.00 H new ATOM 0 HG11 VAL A 228 4.415 2.346 -0.813 1.00 0.00 H new ATOM 0 HG12 VAL A 228 3.102 1.416 -1.573 1.00 0.00 H new ATOM 0 HG13 VAL A 228 3.104 1.676 0.187 1.00 0.00 H new ATOM 0 HG21 VAL A 228 6.132 1.196 0.548 1.00 0.00 H new ATOM 0 HG22 VAL A 228 4.894 0.472 1.602 1.00 0.00 H new ATOM 0 HG23 VAL A 228 6.071 -0.569 0.766 1.00 0.00 H new ATOM 292 N ARG A 229 1.536 -0.796 -1.598 1.00 0.00 N ATOM 293 CA ARG A 229 0.675 -0.961 -2.763 1.00 0.00 C ATOM 294 C ARG A 229 0.139 0.380 -3.251 1.00 0.00 C ATOM 295 O ARG A 229 0.060 0.625 -4.455 1.00 0.00 O ATOM 296 CB ARG A 229 -0.485 -1.902 -2.426 1.00 0.00 C ATOM 297 CG ARG A 229 -0.069 -3.114 -1.610 1.00 0.00 C ATOM 298 CD ARG A 229 0.982 -3.939 -2.332 1.00 0.00 C ATOM 299 NE ARG A 229 0.386 -5.019 -3.115 1.00 0.00 N ATOM 300 CZ ARG A 229 -0.022 -4.891 -4.376 1.00 0.00 C ATOM 301 NH1 ARG A 229 0.095 -3.729 -5.008 1.00 0.00 N ATOM 302 NH2 ARG A 229 -0.551 -5.929 -5.010 1.00 0.00 N ATOM 0 H ARG A 229 1.084 -0.353 -0.798 1.00 0.00 H new ATOM 0 HA ARG A 229 1.271 -1.396 -3.566 1.00 0.00 H new ATOM 0 HB2 ARG A 229 -1.244 -1.347 -1.875 1.00 0.00 H new ATOM 0 HB3 ARG A 229 -0.948 -2.240 -3.353 1.00 0.00 H new ATOM 0 HG2 ARG A 229 0.322 -2.788 -0.646 1.00 0.00 H new ATOM 0 HG3 ARG A 229 -0.942 -3.734 -1.406 1.00 0.00 H new ATOM 0 HD2 ARG A 229 1.562 -3.292 -2.990 1.00 0.00 H new ATOM 0 HD3 ARG A 229 1.676 -4.359 -1.604 1.00 0.00 H new ATOM 0 HE ARG A 229 0.275 -5.929 -2.667 1.00 0.00 H new ATOM 0 HH11 ARG A 229 0.500 -2.926 -4.527 1.00 0.00 H new ATOM 0 HH12 ARG A 229 -0.220 -3.640 -5.974 1.00 0.00 H new ATOM 0 HH21 ARG A 229 -0.645 -6.825 -4.532 1.00 0.00 H new ATOM 0 HH22 ARG A 229 -0.864 -5.831 -5.976 1.00 0.00 H new ATOM 316 N PHE A 230 -0.229 1.247 -2.315 1.00 0.00 N ATOM 317 CA PHE A 230 -0.755 2.563 -2.658 1.00 0.00 C ATOM 318 C PHE A 230 -0.400 3.589 -1.589 1.00 0.00 C ATOM 319 O PHE A 230 -0.265 3.250 -0.419 1.00 0.00 O ATOM 320 CB PHE A 230 -2.273 2.497 -2.838 1.00 0.00 C ATOM 321 CG PHE A 230 -2.860 3.738 -3.448 1.00 0.00 C ATOM 322 CD1 PHE A 230 -2.654 4.031 -4.787 1.00 0.00 C ATOM 323 CD2 PHE A 230 -3.616 4.611 -2.682 1.00 0.00 C ATOM 324 CE1 PHE A 230 -3.193 5.171 -5.350 1.00 0.00 C ATOM 325 CE2 PHE A 230 -4.156 5.752 -3.240 1.00 0.00 C ATOM 326 CZ PHE A 230 -3.945 6.034 -4.576 1.00 0.00 C ATOM 0 H PHE A 230 -0.173 1.063 -1.313 1.00 0.00 H new ATOM 0 HA PHE A 230 -0.298 2.875 -3.597 1.00 0.00 H new ATOM 0 HB2 PHE A 230 -2.519 1.641 -3.467 1.00 0.00 H new ATOM 0 HB3 PHE A 230 -2.739 2.324 -1.868 1.00 0.00 H new ATOM 0 HD1 PHE A 230 -2.066 3.361 -5.396 1.00 0.00 H new ATOM 0 HD2 PHE A 230 -3.784 4.396 -1.637 1.00 0.00 H new ATOM 0 HE1 PHE A 230 -3.027 5.388 -6.395 1.00 0.00 H new ATOM 0 HE2 PHE A 230 -4.743 6.424 -2.632 1.00 0.00 H new ATOM 0 HZ PHE A 230 -4.367 6.927 -5.014 1.00 0.00 H new ATOM 336 N LEU A 231 -0.252 4.843 -1.996 1.00 0.00 N ATOM 337 CA LEU A 231 0.086 5.908 -1.058 1.00 0.00 C ATOM 338 C LEU A 231 -0.793 7.133 -1.283 1.00 0.00 C ATOM 339 O LEU A 231 -0.873 7.659 -2.394 1.00 0.00 O ATOM 340 CB LEU A 231 1.563 6.286 -1.189 1.00 0.00 C ATOM 341 CG LEU A 231 2.535 5.103 -1.162 1.00 0.00 C ATOM 342 CD1 LEU A 231 3.299 5.007 -2.473 1.00 0.00 C ATOM 343 CD2 LEU A 231 3.499 5.226 0.008 1.00 0.00 C ATOM 0 H LEU A 231 -0.360 5.148 -2.963 1.00 0.00 H new ATOM 0 HA LEU A 231 -0.095 5.539 -0.049 1.00 0.00 H new ATOM 0 HB2 LEU A 231 1.702 6.831 -2.123 1.00 0.00 H new ATOM 0 HB3 LEU A 231 1.822 6.969 -0.380 1.00 0.00 H new ATOM 0 HG LEU A 231 1.955 4.189 -1.034 1.00 0.00 H new ATOM 0 HD11 LEU A 231 3.984 4.160 -2.434 1.00 0.00 H new ATOM 0 HD12 LEU A 231 2.596 4.867 -3.294 1.00 0.00 H new ATOM 0 HD13 LEU A 231 3.865 5.925 -2.632 1.00 0.00 H new ATOM 0 HD21 LEU A 231 4.181 4.376 0.009 1.00 0.00 H new ATOM 0 HD22 LEU A 231 4.071 6.149 -0.087 1.00 0.00 H new ATOM 0 HD23 LEU A 231 2.937 5.242 0.942 1.00 0.00 H new ATOM 355 N GLY A 232 -1.453 7.584 -0.221 1.00 0.00 N ATOM 356 CA GLY A 232 -2.320 8.743 -0.323 1.00 0.00 C ATOM 357 C GLY A 232 -3.210 8.907 0.893 1.00 0.00 C ATOM 358 O GLY A 232 -3.071 8.179 1.876 1.00 0.00 O ATOM 0 H GLY A 232 -1.403 7.167 0.709 1.00 0.00 H new ATOM 0 HA2 GLY A 232 -1.712 9.639 -0.448 1.00 0.00 H new ATOM 0 HA3 GLY A 232 -2.940 8.652 -1.215 1.00 0.00 H new ATOM 362 N GLU A 233 -4.127 9.866 0.827 1.00 0.00 N ATOM 363 CA GLU A 233 -5.042 10.125 1.931 1.00 0.00 C ATOM 364 C GLU A 233 -6.194 9.123 1.929 1.00 0.00 C ATOM 365 O GLU A 233 -6.480 8.495 0.910 1.00 0.00 O ATOM 366 CB GLU A 233 -5.592 11.550 1.843 1.00 0.00 C ATOM 367 CG GLU A 233 -4.518 12.604 1.629 1.00 0.00 C ATOM 368 CD GLU A 233 -5.038 13.826 0.897 1.00 0.00 C ATOM 369 OE1 GLU A 233 -6.241 14.134 1.036 1.00 0.00 O ATOM 370 OE2 GLU A 233 -4.242 14.473 0.185 1.00 0.00 O ATOM 0 H GLU A 233 -4.256 10.477 0.020 1.00 0.00 H new ATOM 0 HA GLU A 233 -4.487 10.014 2.863 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -6.310 11.604 1.025 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -6.136 11.778 2.760 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -4.115 12.908 2.595 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -3.695 12.169 1.063 1.00 0.00 H new ATOM 377 N THR A 234 -6.848 8.977 3.076 1.00 0.00 N ATOM 378 CA THR A 234 -7.967 8.053 3.206 1.00 0.00 C ATOM 379 C THR A 234 -9.291 8.805 3.278 1.00 0.00 C ATOM 380 O THR A 234 -9.323 9.994 3.596 1.00 0.00 O ATOM 381 CB THR A 234 -7.795 7.180 4.450 1.00 0.00 C ATOM 382 OG1 THR A 234 -7.908 7.959 5.627 1.00 0.00 O ATOM 383 CG2 THR A 234 -6.462 6.463 4.499 1.00 0.00 C ATOM 0 H THR A 234 -6.622 9.488 3.930 1.00 0.00 H new ATOM 0 HA THR A 234 -7.981 7.415 2.322 1.00 0.00 H new ATOM 0 HB THR A 234 -8.588 6.434 4.392 1.00 0.00 H new ATOM 0 HG1 THR A 234 -7.806 8.907 5.403 1.00 0.00 H new ATOM 0 HG21 THR A 234 -6.405 5.862 5.406 1.00 0.00 H new ATOM 0 HG22 THR A 234 -6.365 5.815 3.628 1.00 0.00 H new ATOM 0 HG23 THR A 234 -5.655 7.195 4.498 1.00 0.00 H new ATOM 391 N ASP A 235 -10.381 8.106 2.982 1.00 0.00 N ATOM 392 CA ASP A 235 -11.707 8.709 3.013 1.00 0.00 C ATOM 393 C ASP A 235 -12.298 8.686 4.424 1.00 0.00 C ATOM 394 O ASP A 235 -13.393 9.199 4.652 1.00 0.00 O ATOM 395 CB ASP A 235 -12.642 7.982 2.045 1.00 0.00 C ATOM 396 CG ASP A 235 -13.501 8.939 1.242 1.00 0.00 C ATOM 397 OD1 ASP A 235 -12.937 9.721 0.448 1.00 0.00 O ATOM 398 OD2 ASP A 235 -14.740 8.906 1.407 1.00 0.00 O ATOM 0 H ASP A 235 -10.372 7.121 2.718 1.00 0.00 H new ATOM 0 HA ASP A 235 -11.606 9.750 2.704 1.00 0.00 H new ATOM 0 HB2 ASP A 235 -12.051 7.370 1.364 1.00 0.00 H new ATOM 0 HB3 ASP A 235 -13.285 7.304 2.606 1.00 0.00 H new ATOM 403 N PHE A 236 -11.572 8.088 5.368 1.00 0.00 N ATOM 404 CA PHE A 236 -12.041 8.009 6.748 1.00 0.00 C ATOM 405 C PHE A 236 -11.032 8.628 7.719 1.00 0.00 C ATOM 406 O PHE A 236 -11.370 8.931 8.863 1.00 0.00 O ATOM 407 CB PHE A 236 -12.315 6.549 7.134 1.00 0.00 C ATOM 408 CG PHE A 236 -11.085 5.773 7.521 1.00 0.00 C ATOM 409 CD1 PHE A 236 -10.051 5.583 6.618 1.00 0.00 C ATOM 410 CD2 PHE A 236 -10.964 5.237 8.794 1.00 0.00 C ATOM 411 CE1 PHE A 236 -8.921 4.874 6.976 1.00 0.00 C ATOM 412 CE2 PHE A 236 -9.836 4.526 9.158 1.00 0.00 C ATOM 413 CZ PHE A 236 -8.814 4.344 8.248 1.00 0.00 C ATOM 0 H PHE A 236 -10.664 7.655 5.203 1.00 0.00 H new ATOM 0 HA PHE A 236 -12.968 8.579 6.817 1.00 0.00 H new ATOM 0 HB2 PHE A 236 -13.019 6.531 7.966 1.00 0.00 H new ATOM 0 HB3 PHE A 236 -12.799 6.048 6.296 1.00 0.00 H new ATOM 0 HD1 PHE A 236 -10.130 5.994 5.622 1.00 0.00 H new ATOM 0 HD2 PHE A 236 -11.761 5.377 9.510 1.00 0.00 H new ATOM 0 HE1 PHE A 236 -8.122 4.734 6.263 1.00 0.00 H new ATOM 0 HE2 PHE A 236 -9.754 4.113 10.153 1.00 0.00 H new ATOM 0 HZ PHE A 236 -7.932 3.788 8.530 1.00 0.00 H new ATOM 423 N ALA A 237 -9.793 8.806 7.263 1.00 0.00 N ATOM 424 CA ALA A 237 -8.750 9.383 8.102 1.00 0.00 C ATOM 425 C ALA A 237 -8.190 10.662 7.486 1.00 0.00 C ATOM 426 O ALA A 237 -8.079 10.779 6.267 1.00 0.00 O ATOM 427 CB ALA A 237 -7.636 8.371 8.324 1.00 0.00 C ATOM 0 H ALA A 237 -9.490 8.559 6.321 1.00 0.00 H new ATOM 0 HA ALA A 237 -9.193 9.640 9.064 1.00 0.00 H new ATOM 0 HB1 ALA A 237 -6.863 8.813 8.952 1.00 0.00 H new ATOM 0 HB2 ALA A 237 -8.041 7.486 8.816 1.00 0.00 H new ATOM 0 HB3 ALA A 237 -7.205 8.087 7.364 1.00 0.00 H new ATOM 433 N LYS A 238 -7.837 11.616 8.341 1.00 0.00 N ATOM 434 CA LYS A 238 -7.285 12.887 7.883 1.00 0.00 C ATOM 435 C LYS A 238 -5.764 12.821 7.802 1.00 0.00 C ATOM 436 O LYS A 238 -5.109 12.289 8.698 1.00 0.00 O ATOM 437 CB LYS A 238 -7.711 14.018 8.820 1.00 0.00 C ATOM 438 CG LYS A 238 -7.333 15.401 8.316 1.00 0.00 C ATOM 439 CD LYS A 238 -8.364 16.443 8.720 1.00 0.00 C ATOM 440 CE LYS A 238 -9.418 16.631 7.642 1.00 0.00 C ATOM 441 NZ LYS A 238 -10.196 17.885 7.837 1.00 0.00 N ATOM 0 H LYS A 238 -7.923 11.534 9.354 1.00 0.00 H new ATOM 0 HA LYS A 238 -7.675 13.087 6.885 1.00 0.00 H new ATOM 0 HB2 LYS A 238 -8.791 13.974 8.961 1.00 0.00 H new ATOM 0 HB3 LYS A 238 -7.255 13.860 9.798 1.00 0.00 H new ATOM 0 HG2 LYS A 238 -6.357 15.680 8.714 1.00 0.00 H new ATOM 0 HG3 LYS A 238 -7.241 15.381 7.230 1.00 0.00 H new ATOM 0 HD2 LYS A 238 -8.844 16.140 9.651 1.00 0.00 H new ATOM 0 HD3 LYS A 238 -7.866 17.393 8.913 1.00 0.00 H new ATOM 0 HE2 LYS A 238 -8.937 16.651 6.664 1.00 0.00 H new ATOM 0 HE3 LYS A 238 -10.097 15.778 7.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 238 -10.904 17.975 7.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 238 -10.676 17.856 8.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 238 -9.552 18.701 7.808 1.00 0.00 H new ATOM 455 N GLY A 239 -5.209 13.365 6.725 1.00 0.00 N ATOM 456 CA GLY A 239 -3.768 13.359 6.549 1.00 0.00 C ATOM 457 C GLY A 239 -3.322 12.411 5.452 1.00 0.00 C ATOM 458 O GLY A 239 -4.130 11.975 4.632 1.00 0.00 O ATOM 0 H GLY A 239 -5.731 13.810 5.970 1.00 0.00 H new ATOM 0 HA2 GLY A 239 -3.430 14.368 6.313 1.00 0.00 H new ATOM 0 HA3 GLY A 239 -3.292 13.074 7.487 1.00 0.00 H new ATOM 462 N GLU A 240 -2.031 12.093 5.436 1.00 0.00 N ATOM 463 CA GLU A 240 -1.478 11.192 4.432 1.00 0.00 C ATOM 464 C GLU A 240 -1.360 9.773 4.978 1.00 0.00 C ATOM 465 O GLU A 240 -0.907 9.566 6.104 1.00 0.00 O ATOM 466 CB GLU A 240 -0.105 11.689 3.973 1.00 0.00 C ATOM 467 CG GLU A 240 0.941 11.693 5.075 1.00 0.00 C ATOM 468 CD GLU A 240 2.234 12.358 4.647 1.00 0.00 C ATOM 469 OE1 GLU A 240 2.182 13.258 3.782 1.00 0.00 O ATOM 470 OE2 GLU A 240 3.300 11.981 5.179 1.00 0.00 O ATOM 0 H GLU A 240 -1.349 12.446 6.107 1.00 0.00 H new ATOM 0 HA GLU A 240 -2.157 11.178 3.580 1.00 0.00 H new ATOM 0 HB2 GLU A 240 0.245 11.060 3.154 1.00 0.00 H new ATOM 0 HB3 GLU A 240 -0.207 12.699 3.577 1.00 0.00 H new ATOM 0 HG2 GLU A 240 0.542 12.210 5.948 1.00 0.00 H new ATOM 0 HG3 GLU A 240 1.147 10.667 5.379 1.00 0.00 H new ATOM 477 N TRP A 241 -1.771 8.798 4.173 1.00 0.00 N ATOM 478 CA TRP A 241 -1.713 7.399 4.577 1.00 0.00 C ATOM 479 C TRP A 241 -1.096 6.540 3.477 1.00 0.00 C ATOM 480 O TRP A 241 -0.921 6.996 2.347 1.00 0.00 O ATOM 481 CB TRP A 241 -3.113 6.887 4.920 1.00 0.00 C ATOM 482 CG TRP A 241 -3.690 7.528 6.146 1.00 0.00 C ATOM 483 CD1 TRP A 241 -4.168 8.803 6.257 1.00 0.00 C ATOM 484 CD2 TRP A 241 -3.847 6.927 7.437 1.00 0.00 C ATOM 485 NE1 TRP A 241 -4.610 9.031 7.538 1.00 0.00 N ATOM 486 CE2 TRP A 241 -4.425 7.895 8.280 1.00 0.00 C ATOM 487 CE3 TRP A 241 -3.555 5.665 7.959 1.00 0.00 C ATOM 488 CZ2 TRP A 241 -4.716 7.637 9.618 1.00 0.00 C ATOM 489 CZ3 TRP A 241 -3.845 5.410 9.287 1.00 0.00 C ATOM 490 CH2 TRP A 241 -4.420 6.392 10.103 1.00 0.00 C ATOM 0 H TRP A 241 -2.148 8.952 3.238 1.00 0.00 H new ATOM 0 HA TRP A 241 -1.082 7.328 5.463 1.00 0.00 H new ATOM 0 HB2 TRP A 241 -3.777 7.070 4.075 1.00 0.00 H new ATOM 0 HB3 TRP A 241 -3.073 5.808 5.066 1.00 0.00 H new ATOM 0 HD1 TRP A 241 -4.195 9.526 5.455 1.00 0.00 H new ATOM 0 HE1 TRP A 241 -5.011 9.904 7.880 1.00 0.00 H new ATOM 0 HE3 TRP A 241 -3.111 4.902 7.337 1.00 0.00 H new ATOM 0 HZ2 TRP A 241 -5.159 8.393 10.250 1.00 0.00 H new ATOM 0 HZ3 TRP A 241 -3.624 4.437 9.702 1.00 0.00 H new ATOM 0 HH2 TRP A 241 -4.634 6.162 11.136 1.00 0.00 H new ATOM 501 N CYS A 242 -0.766 5.297 3.815 1.00 0.00 N ATOM 502 CA CYS A 242 -0.166 4.379 2.853 1.00 0.00 C ATOM 503 C CYS A 242 -0.769 2.982 2.978 1.00 0.00 C ATOM 504 O CYS A 242 -1.289 2.606 4.031 1.00 0.00 O ATOM 505 CB CYS A 242 1.351 4.318 3.054 1.00 0.00 C ATOM 506 SG CYS A 242 2.197 3.119 1.997 1.00 0.00 S ATOM 0 H CYS A 242 -0.904 4.903 4.746 1.00 0.00 H new ATOM 0 HA CYS A 242 -0.378 4.753 1.851 1.00 0.00 H new ATOM 0 HB2 CYS A 242 1.770 5.307 2.868 1.00 0.00 H new ATOM 0 HB3 CYS A 242 1.558 4.075 4.096 1.00 0.00 H new ATOM 0 HG CYS A 242 3.473 3.148 2.243 1.00 0.00 H new ATOM 512 N GLY A 243 -0.689 2.219 1.894 1.00 0.00 N ATOM 513 CA GLY A 243 -1.222 0.872 1.880 1.00 0.00 C ATOM 514 C GLY A 243 -0.130 -0.171 1.749 1.00 0.00 C ATOM 515 O GLY A 243 0.688 -0.105 0.832 1.00 0.00 O ATOM 0 H GLY A 243 -0.260 2.514 1.017 1.00 0.00 H new ATOM 0 HA2 GLY A 243 -1.784 0.695 2.797 1.00 0.00 H new ATOM 0 HA3 GLY A 243 -1.923 0.768 1.052 1.00 0.00 H new ATOM 519 N VAL A 244 -0.112 -1.131 2.664 1.00 0.00 N ATOM 520 CA VAL A 244 0.894 -2.185 2.640 1.00 0.00 C ATOM 521 C VAL A 244 0.249 -3.564 2.736 1.00 0.00 C ATOM 522 O VAL A 244 -0.592 -3.808 3.601 1.00 0.00 O ATOM 523 CB VAL A 244 1.906 -2.029 3.794 1.00 0.00 C ATOM 524 CG1 VAL A 244 3.138 -2.887 3.549 1.00 0.00 C ATOM 525 CG2 VAL A 244 2.299 -0.570 3.984 1.00 0.00 C ATOM 0 H VAL A 244 -0.781 -1.202 3.431 1.00 0.00 H new ATOM 0 HA VAL A 244 1.419 -2.094 1.689 1.00 0.00 H new ATOM 0 HB VAL A 244 1.425 -2.371 4.710 1.00 0.00 H new ATOM 0 HG11 VAL A 244 3.839 -2.762 4.375 1.00 0.00 H new ATOM 0 HG12 VAL A 244 2.844 -3.934 3.478 1.00 0.00 H new ATOM 0 HG13 VAL A 244 3.616 -2.581 2.618 1.00 0.00 H new ATOM 0 HG21 VAL A 244 3.013 -0.489 4.804 1.00 0.00 H new ATOM 0 HG22 VAL A 244 2.754 -0.194 3.068 1.00 0.00 H new ATOM 0 HG23 VAL A 244 1.412 0.019 4.217 1.00 0.00 H new ATOM 535 N GLU A 245 0.658 -4.464 1.849 1.00 0.00 N ATOM 536 CA GLU A 245 0.131 -5.822 1.840 1.00 0.00 C ATOM 537 C GLU A 245 0.899 -6.686 2.830 1.00 0.00 C ATOM 538 O GLU A 245 2.083 -6.965 2.638 1.00 0.00 O ATOM 539 CB GLU A 245 0.225 -6.420 0.435 1.00 0.00 C ATOM 540 CG GLU A 245 -0.426 -7.790 0.314 1.00 0.00 C ATOM 541 CD GLU A 245 -0.648 -8.202 -1.129 1.00 0.00 C ATOM 542 OE1 GLU A 245 -0.855 -7.309 -1.977 1.00 0.00 O ATOM 543 OE2 GLU A 245 -0.615 -9.419 -1.410 1.00 0.00 O ATOM 0 H GLU A 245 1.353 -4.277 1.127 1.00 0.00 H new ATOM 0 HA GLU A 245 -0.918 -5.792 2.136 1.00 0.00 H new ATOM 0 HB2 GLU A 245 -0.246 -5.739 -0.274 1.00 0.00 H new ATOM 0 HB3 GLU A 245 1.275 -6.499 0.152 1.00 0.00 H new ATOM 0 HG2 GLU A 245 0.202 -8.532 0.808 1.00 0.00 H new ATOM 0 HG3 GLU A 245 -1.382 -7.782 0.837 1.00 0.00 H new ATOM 550 N LEU A 246 0.225 -7.096 3.897 1.00 0.00 N ATOM 551 CA LEU A 246 0.850 -7.911 4.928 1.00 0.00 C ATOM 552 C LEU A 246 1.194 -9.303 4.408 1.00 0.00 C ATOM 553 O LEU A 246 0.462 -9.878 3.604 1.00 0.00 O ATOM 554 CB LEU A 246 -0.070 -8.021 6.145 1.00 0.00 C ATOM 555 CG LEU A 246 -0.575 -6.687 6.694 1.00 0.00 C ATOM 556 CD1 LEU A 246 -1.689 -6.913 7.704 1.00 0.00 C ATOM 557 CD2 LEU A 246 0.567 -5.904 7.324 1.00 0.00 C ATOM 0 H LEU A 246 -0.756 -6.877 4.070 1.00 0.00 H new ATOM 0 HA LEU A 246 1.779 -7.421 5.221 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -0.929 -8.636 5.878 1.00 0.00 H new ATOM 0 HB3 LEU A 246 0.463 -8.545 6.938 1.00 0.00 H new ATOM 0 HG LEU A 246 -0.976 -6.103 5.866 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -2.036 -5.952 8.084 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -2.517 -7.433 7.222 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -1.314 -7.516 8.531 1.00 0.00 H new ATOM 0 HD21 LEU A 246 0.190 -4.957 7.710 1.00 0.00 H new ATOM 0 HD22 LEU A 246 0.998 -6.483 8.141 1.00 0.00 H new ATOM 0 HD23 LEU A 246 1.333 -5.710 6.573 1.00 0.00 H new ATOM 569 N ASP A 247 2.317 -9.833 4.880 1.00 0.00 N ATOM 570 CA ASP A 247 2.775 -11.155 4.475 1.00 0.00 C ATOM 571 C ASP A 247 1.858 -12.247 5.026 1.00 0.00 C ATOM 572 O ASP A 247 1.788 -13.345 4.476 1.00 0.00 O ATOM 573 CB ASP A 247 4.209 -11.384 4.956 1.00 0.00 C ATOM 574 CG ASP A 247 5.234 -10.723 4.055 1.00 0.00 C ATOM 575 OD1 ASP A 247 5.248 -11.032 2.845 1.00 0.00 O ATOM 576 OD2 ASP A 247 6.022 -9.896 4.559 1.00 0.00 O ATOM 0 H ASP A 247 2.929 -9.363 5.547 1.00 0.00 H new ATOM 0 HA ASP A 247 2.749 -11.205 3.386 1.00 0.00 H new ATOM 0 HB2 ASP A 247 4.316 -10.996 5.969 1.00 0.00 H new ATOM 0 HB3 ASP A 247 4.407 -12.455 5.002 1.00 0.00 H new ATOM 581 N GLU A 248 1.160 -11.936 6.114 1.00 0.00 N ATOM 582 CA GLU A 248 0.250 -12.891 6.737 1.00 0.00 C ATOM 583 C GLU A 248 -1.048 -12.205 7.162 1.00 0.00 C ATOM 584 O GLU A 248 -1.138 -10.978 7.158 1.00 0.00 O ATOM 585 CB GLU A 248 0.922 -13.546 7.946 1.00 0.00 C ATOM 586 CG GLU A 248 1.433 -14.949 7.670 1.00 0.00 C ATOM 587 CD GLU A 248 2.604 -15.328 8.556 1.00 0.00 C ATOM 588 OE1 GLU A 248 2.505 -15.134 9.787 1.00 0.00 O ATOM 589 OE2 GLU A 248 3.621 -15.816 8.020 1.00 0.00 O ATOM 0 H GLU A 248 1.207 -11.031 6.582 1.00 0.00 H new ATOM 0 HA GLU A 248 0.006 -13.662 6.006 1.00 0.00 H new ATOM 0 HB2 GLU A 248 1.755 -12.922 8.271 1.00 0.00 H new ATOM 0 HB3 GLU A 248 0.211 -13.583 8.771 1.00 0.00 H new ATOM 0 HG2 GLU A 248 0.623 -15.663 7.820 1.00 0.00 H new ATOM 0 HG3 GLU A 248 1.734 -15.023 6.625 1.00 0.00 H new ATOM 596 N PRO A 249 -2.075 -12.991 7.534 1.00 0.00 N ATOM 597 CA PRO A 249 -3.370 -12.447 7.960 1.00 0.00 C ATOM 598 C PRO A 249 -3.266 -11.661 9.264 1.00 0.00 C ATOM 599 O PRO A 249 -3.757 -12.096 10.306 1.00 0.00 O ATOM 600 CB PRO A 249 -4.241 -13.693 8.151 1.00 0.00 C ATOM 601 CG PRO A 249 -3.276 -14.804 8.377 1.00 0.00 C ATOM 602 CD PRO A 249 -2.059 -14.466 7.566 1.00 0.00 C ATOM 0 HA PRO A 249 -3.773 -11.742 7.233 1.00 0.00 H new ATOM 0 HB2 PRO A 249 -4.916 -13.577 8.999 1.00 0.00 H new ATOM 0 HB3 PRO A 249 -4.861 -13.880 7.274 1.00 0.00 H new ATOM 0 HG2 PRO A 249 -3.027 -14.896 9.434 1.00 0.00 H new ATOM 0 HG3 PRO A 249 -3.700 -15.759 8.065 1.00 0.00 H new ATOM 0 HD2 PRO A 249 -1.149 -14.849 8.027 1.00 0.00 H new ATOM 0 HD3 PRO A 249 -2.112 -14.891 6.564 1.00 0.00 H new ATOM 610 N LEU A 250 -2.622 -10.502 9.195 1.00 0.00 N ATOM 611 CA LEU A 250 -2.450 -9.648 10.365 1.00 0.00 C ATOM 612 C LEU A 250 -2.944 -8.231 10.089 1.00 0.00 C ATOM 613 O LEU A 250 -2.461 -7.270 10.686 1.00 0.00 O ATOM 614 CB LEU A 250 -0.979 -9.617 10.788 1.00 0.00 C ATOM 615 CG LEU A 250 0.028 -9.571 9.634 1.00 0.00 C ATOM 616 CD1 LEU A 250 0.944 -8.365 9.768 1.00 0.00 C ATOM 617 CD2 LEU A 250 0.843 -10.854 9.584 1.00 0.00 C ATOM 0 H LEU A 250 -2.209 -10.131 8.339 1.00 0.00 H new ATOM 0 HA LEU A 250 -3.046 -10.065 11.176 1.00 0.00 H new ATOM 0 HB2 LEU A 250 -0.818 -8.747 11.425 1.00 0.00 H new ATOM 0 HB3 LEU A 250 -0.773 -10.499 11.395 1.00 0.00 H new ATOM 0 HG LEU A 250 -0.528 -9.478 8.701 1.00 0.00 H new ATOM 0 HD11 LEU A 250 1.651 -8.351 8.939 1.00 0.00 H new ATOM 0 HD12 LEU A 250 0.348 -7.452 9.752 1.00 0.00 H new ATOM 0 HD13 LEU A 250 1.490 -8.426 10.709 1.00 0.00 H new ATOM 0 HD21 LEU A 250 1.552 -10.802 8.758 1.00 0.00 H new ATOM 0 HD22 LEU A 250 1.386 -10.977 10.521 1.00 0.00 H new ATOM 0 HD23 LEU A 250 0.176 -11.703 9.437 1.00 0.00 H new ATOM 629 N GLY A 251 -3.907 -8.109 9.181 1.00 0.00 N ATOM 630 CA GLY A 251 -4.445 -6.803 8.844 1.00 0.00 C ATOM 631 C GLY A 251 -5.866 -6.617 9.339 1.00 0.00 C ATOM 632 O GLY A 251 -6.381 -7.441 10.095 1.00 0.00 O ATOM 0 H GLY A 251 -4.324 -8.889 8.673 1.00 0.00 H new ATOM 0 HA2 GLY A 251 -3.809 -6.029 9.274 1.00 0.00 H new ATOM 0 HA3 GLY A 251 -4.420 -6.671 7.762 1.00 0.00 H new ATOM 636 N LYS A 252 -6.501 -5.528 8.913 1.00 0.00 N ATOM 637 CA LYS A 252 -7.872 -5.236 9.322 1.00 0.00 C ATOM 638 C LYS A 252 -8.816 -5.250 8.124 1.00 0.00 C ATOM 639 O LYS A 252 -9.977 -5.641 8.244 1.00 0.00 O ATOM 640 CB LYS A 252 -7.941 -3.876 10.020 1.00 0.00 C ATOM 641 CG LYS A 252 -6.766 -3.601 10.947 1.00 0.00 C ATOM 642 CD LYS A 252 -6.868 -4.403 12.233 1.00 0.00 C ATOM 643 CE LYS A 252 -5.514 -4.547 12.910 1.00 0.00 C ATOM 644 NZ LYS A 252 -5.623 -5.217 14.234 1.00 0.00 N ATOM 0 H LYS A 252 -6.090 -4.836 8.287 1.00 0.00 H new ATOM 0 HA LYS A 252 -8.186 -6.013 10.019 1.00 0.00 H new ATOM 0 HB2 LYS A 252 -7.987 -3.092 9.264 1.00 0.00 H new ATOM 0 HB3 LYS A 252 -8.866 -3.819 10.594 1.00 0.00 H new ATOM 0 HG2 LYS A 252 -5.834 -3.847 10.437 1.00 0.00 H new ATOM 0 HG3 LYS A 252 -6.729 -2.537 11.183 1.00 0.00 H new ATOM 0 HD2 LYS A 252 -7.566 -3.914 12.913 1.00 0.00 H new ATOM 0 HD3 LYS A 252 -7.274 -5.391 12.015 1.00 0.00 H new ATOM 0 HE2 LYS A 252 -4.846 -5.120 12.267 1.00 0.00 H new ATOM 0 HE3 LYS A 252 -5.066 -3.562 13.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 252 -4.678 -5.296 14.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 252 -6.240 -4.657 14.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 252 -6.027 -6.167 14.110 1.00 0.00 H new ATOM 658 N ASN A 253 -8.316 -4.817 6.971 1.00 0.00 N ATOM 659 CA ASN A 253 -9.122 -4.778 5.754 1.00 0.00 C ATOM 660 C ASN A 253 -8.491 -5.622 4.651 1.00 0.00 C ATOM 661 O ASN A 253 -7.338 -6.039 4.755 1.00 0.00 O ATOM 662 CB ASN A 253 -9.292 -3.333 5.275 1.00 0.00 C ATOM 663 CG ASN A 253 -7.979 -2.705 4.849 1.00 0.00 C ATOM 664 OD1 ASN A 253 -7.721 -2.527 3.657 1.00 0.00 O ATOM 665 ND2 ASN A 253 -7.141 -2.366 5.820 1.00 0.00 N ATOM 0 H ASN A 253 -7.358 -4.488 6.853 1.00 0.00 H new ATOM 0 HA ASN A 253 -10.102 -5.195 5.986 1.00 0.00 H new ATOM 0 HB2 ASN A 253 -9.990 -3.311 4.438 1.00 0.00 H new ATOM 0 HB3 ASN A 253 -9.733 -2.738 6.075 1.00 0.00 H new ATOM 0 HD21 ASN A 253 -6.243 -1.940 5.593 1.00 0.00 H new ATOM 0 HD22 ASN A 253 -7.395 -2.531 6.794 1.00 0.00 H new ATOM 672 N ASP A 254 -9.258 -5.869 3.594 1.00 0.00 N ATOM 673 CA ASP A 254 -8.778 -6.665 2.468 1.00 0.00 C ATOM 674 C ASP A 254 -8.318 -5.771 1.319 1.00 0.00 C ATOM 675 O ASP A 254 -8.323 -6.185 0.160 1.00 0.00 O ATOM 676 CB ASP A 254 -9.877 -7.614 1.986 1.00 0.00 C ATOM 677 CG ASP A 254 -11.082 -6.878 1.434 1.00 0.00 C ATOM 678 OD1 ASP A 254 -11.790 -6.223 2.227 1.00 0.00 O ATOM 679 OD2 ASP A 254 -11.317 -6.956 0.210 1.00 0.00 O ATOM 0 H ASP A 254 -10.215 -5.530 3.493 1.00 0.00 H new ATOM 0 HA ASP A 254 -7.923 -7.250 2.808 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -9.473 -8.271 1.216 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -10.192 -8.250 2.814 1.00 0.00 H new ATOM 684 N GLY A 255 -7.917 -4.546 1.645 1.00 0.00 N ATOM 685 CA GLY A 255 -7.455 -3.621 0.626 1.00 0.00 C ATOM 686 C GLY A 255 -8.468 -2.534 0.310 1.00 0.00 C ATOM 687 O GLY A 255 -8.372 -1.873 -0.724 1.00 0.00 O ATOM 0 H GLY A 255 -7.904 -4.178 2.596 1.00 0.00 H new ATOM 0 HA2 GLY A 255 -6.525 -3.159 0.957 1.00 0.00 H new ATOM 0 HA3 GLY A 255 -7.229 -4.175 -0.285 1.00 0.00 H new ATOM 691 N ALA A 256 -9.438 -2.345 1.200 1.00 0.00 N ATOM 692 CA ALA A 256 -10.463 -1.328 1.001 1.00 0.00 C ATOM 693 C ALA A 256 -10.762 -0.583 2.299 1.00 0.00 C ATOM 694 O ALA A 256 -10.479 -1.079 3.390 1.00 0.00 O ATOM 695 CB ALA A 256 -11.733 -1.958 0.444 1.00 0.00 C ATOM 0 H ALA A 256 -9.535 -2.881 2.062 1.00 0.00 H new ATOM 0 HA ALA A 256 -10.084 -0.604 0.279 1.00 0.00 H new ATOM 0 HB1 ALA A 256 -12.489 -1.186 0.301 1.00 0.00 H new ATOM 0 HB2 ALA A 256 -11.514 -2.434 -0.512 1.00 0.00 H new ATOM 0 HB3 ALA A 256 -12.106 -2.706 1.144 1.00 0.00 H new ATOM 701 N VAL A 257 -11.332 0.610 2.172 1.00 0.00 N ATOM 702 CA VAL A 257 -11.667 1.427 3.331 1.00 0.00 C ATOM 703 C VAL A 257 -12.923 2.255 3.078 1.00 0.00 C ATOM 704 O VAL A 257 -12.976 3.052 2.141 1.00 0.00 O ATOM 705 CB VAL A 257 -10.508 2.372 3.703 1.00 0.00 C ATOM 706 CG1 VAL A 257 -10.832 3.155 4.967 1.00 0.00 C ATOM 707 CG2 VAL A 257 -9.214 1.587 3.868 1.00 0.00 C ATOM 0 H VAL A 257 -11.572 1.033 1.275 1.00 0.00 H new ATOM 0 HA VAL A 257 -11.850 0.742 4.159 1.00 0.00 H new ATOM 0 HB VAL A 257 -10.374 3.087 2.891 1.00 0.00 H new ATOM 0 HG11 VAL A 257 -9.999 3.815 5.210 1.00 0.00 H new ATOM 0 HG12 VAL A 257 -11.731 3.750 4.806 1.00 0.00 H new ATOM 0 HG13 VAL A 257 -10.998 2.462 5.792 1.00 0.00 H new ATOM 0 HG21 VAL A 257 -8.406 2.269 4.131 1.00 0.00 H new ATOM 0 HG22 VAL A 257 -9.336 0.847 4.659 1.00 0.00 H new ATOM 0 HG23 VAL A 257 -8.973 1.082 2.933 1.00 0.00 H new ATOM 717 N ALA A 258 -13.933 2.063 3.922 1.00 0.00 N ATOM 718 CA ALA A 258 -15.188 2.794 3.793 1.00 0.00 C ATOM 719 C ALA A 258 -15.813 2.585 2.418 1.00 0.00 C ATOM 720 O ALA A 258 -16.425 3.494 1.859 1.00 0.00 O ATOM 721 CB ALA A 258 -14.964 4.276 4.051 1.00 0.00 C ATOM 0 H ALA A 258 -13.906 1.407 4.703 1.00 0.00 H new ATOM 0 HA ALA A 258 -15.881 2.405 4.539 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -15.909 4.810 3.951 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -14.573 4.415 5.059 1.00 0.00 H new ATOM 0 HB3 ALA A 258 -14.249 4.667 3.328 1.00 0.00 H new ATOM 727 N GLY A 259 -15.652 1.382 1.875 1.00 0.00 N ATOM 728 CA GLY A 259 -16.204 1.078 0.568 1.00 0.00 C ATOM 729 C GLY A 259 -15.321 1.560 -0.567 1.00 0.00 C ATOM 730 O GLY A 259 -15.737 1.556 -1.727 1.00 0.00 O ATOM 0 H GLY A 259 -15.149 0.613 2.317 1.00 0.00 H new ATOM 0 HA2 GLY A 259 -16.346 0.001 0.480 1.00 0.00 H new ATOM 0 HA3 GLY A 259 -17.188 1.538 0.478 1.00 0.00 H new ATOM 734 N THR A 260 -14.100 1.976 -0.239 1.00 0.00 N ATOM 735 CA THR A 260 -13.161 2.461 -1.244 1.00 0.00 C ATOM 736 C THR A 260 -11.929 1.565 -1.310 1.00 0.00 C ATOM 737 O THR A 260 -11.150 1.496 -0.360 1.00 0.00 O ATOM 738 CB THR A 260 -12.745 3.898 -0.932 1.00 0.00 C ATOM 739 OG1 THR A 260 -13.878 4.696 -0.638 1.00 0.00 O ATOM 740 CG2 THR A 260 -11.995 4.565 -2.064 1.00 0.00 C ATOM 0 H THR A 260 -13.739 1.986 0.715 1.00 0.00 H new ATOM 0 HA THR A 260 -13.659 2.438 -2.213 1.00 0.00 H new ATOM 0 HB THR A 260 -12.080 3.824 -0.072 1.00 0.00 H new ATOM 0 HG1 THR A 260 -13.591 5.612 -0.439 1.00 0.00 H new ATOM 0 HG21 THR A 260 -11.730 5.582 -1.775 1.00 0.00 H new ATOM 0 HG22 THR A 260 -11.088 4.001 -2.281 1.00 0.00 H new ATOM 0 HG23 THR A 260 -12.626 4.593 -2.952 1.00 0.00 H new ATOM 748 N ARG A 261 -11.758 0.882 -2.438 1.00 0.00 N ATOM 749 CA ARG A 261 -10.618 -0.009 -2.623 1.00 0.00 C ATOM 750 C ARG A 261 -9.427 0.748 -3.202 1.00 0.00 C ATOM 751 O ARG A 261 -9.468 1.210 -4.343 1.00 0.00 O ATOM 752 CB ARG A 261 -10.996 -1.172 -3.541 1.00 0.00 C ATOM 753 CG ARG A 261 -9.946 -2.271 -3.595 1.00 0.00 C ATOM 754 CD ARG A 261 -8.920 -2.009 -4.686 1.00 0.00 C ATOM 755 NE ARG A 261 -9.546 -1.803 -5.990 1.00 0.00 N ATOM 756 CZ ARG A 261 -9.988 -2.791 -6.765 1.00 0.00 C ATOM 757 NH1 ARG A 261 -9.876 -4.054 -6.372 1.00 0.00 N ATOM 758 NH2 ARG A 261 -10.544 -2.516 -7.937 1.00 0.00 N ATOM 0 H ARG A 261 -12.392 0.928 -3.235 1.00 0.00 H new ATOM 0 HA ARG A 261 -10.335 -0.405 -1.648 1.00 0.00 H new ATOM 0 HB2 ARG A 261 -11.940 -1.599 -3.202 1.00 0.00 H new ATOM 0 HB3 ARG A 261 -11.162 -0.790 -4.548 1.00 0.00 H new ATOM 0 HG2 ARG A 261 -9.443 -2.343 -2.631 1.00 0.00 H new ATOM 0 HG3 ARG A 261 -10.431 -3.231 -3.773 1.00 0.00 H new ATOM 0 HD2 ARG A 261 -8.330 -1.131 -4.425 1.00 0.00 H new ATOM 0 HD3 ARG A 261 -8.230 -2.851 -4.744 1.00 0.00 H new ATOM 0 HE ARG A 261 -9.651 -0.846 -6.326 1.00 0.00 H new ATOM 0 HH11 ARG A 261 -9.449 -4.272 -5.472 1.00 0.00 H new ATOM 0 HH12 ARG A 261 -10.217 -4.806 -6.970 1.00 0.00 H new ATOM 0 HH21 ARG A 261 -10.633 -1.548 -8.245 1.00 0.00 H new ATOM 0 HH22 ARG A 261 -10.883 -3.273 -8.531 1.00 0.00 H new ATOM 772 N TYR A 262 -8.370 0.871 -2.409 1.00 0.00 N ATOM 773 CA TYR A 262 -7.167 1.571 -2.844 1.00 0.00 C ATOM 774 C TYR A 262 -6.238 0.629 -3.603 1.00 0.00 C ATOM 775 O TYR A 262 -5.553 1.038 -4.542 1.00 0.00 O ATOM 776 CB TYR A 262 -6.439 2.169 -1.640 1.00 0.00 C ATOM 777 CG TYR A 262 -7.198 3.295 -0.975 1.00 0.00 C ATOM 778 CD1 TYR A 262 -8.301 3.038 -0.170 1.00 0.00 C ATOM 779 CD2 TYR A 262 -6.812 4.619 -1.155 1.00 0.00 C ATOM 780 CE1 TYR A 262 -8.998 4.064 0.436 1.00 0.00 C ATOM 781 CE2 TYR A 262 -7.505 5.651 -0.551 1.00 0.00 C ATOM 782 CZ TYR A 262 -8.597 5.369 0.243 1.00 0.00 C ATOM 783 OH TYR A 262 -9.289 6.394 0.845 1.00 0.00 O ATOM 0 H TYR A 262 -8.321 0.496 -1.462 1.00 0.00 H new ATOM 0 HA TYR A 262 -7.464 2.377 -3.515 1.00 0.00 H new ATOM 0 HB2 TYR A 262 -6.257 1.382 -0.908 1.00 0.00 H new ATOM 0 HB3 TYR A 262 -5.465 2.538 -1.961 1.00 0.00 H new ATOM 0 HD1 TYR A 262 -8.619 2.017 -0.016 1.00 0.00 H new ATOM 0 HD2 TYR A 262 -5.958 4.844 -1.776 1.00 0.00 H new ATOM 0 HE1 TYR A 262 -9.853 3.846 1.058 1.00 0.00 H new ATOM 0 HE2 TYR A 262 -7.193 6.674 -0.700 1.00 0.00 H new ATOM 0 HH TYR A 262 -10.229 6.138 0.948 1.00 0.00 H new ATOM 793 N PHE A 263 -6.225 -0.635 -3.194 1.00 0.00 N ATOM 794 CA PHE A 263 -5.386 -1.640 -3.836 1.00 0.00 C ATOM 795 C PHE A 263 -5.979 -3.032 -3.653 1.00 0.00 C ATOM 796 O PHE A 263 -6.921 -3.219 -2.884 1.00 0.00 O ATOM 797 CB PHE A 263 -3.965 -1.595 -3.269 1.00 0.00 C ATOM 798 CG PHE A 263 -3.916 -1.493 -1.773 1.00 0.00 C ATOM 799 CD1 PHE A 263 -4.083 -0.271 -1.143 1.00 0.00 C ATOM 800 CD2 PHE A 263 -3.699 -2.621 -0.995 1.00 0.00 C ATOM 801 CE1 PHE A 263 -4.036 -0.173 0.234 1.00 0.00 C ATOM 802 CE2 PHE A 263 -3.651 -2.528 0.383 1.00 0.00 C ATOM 803 CZ PHE A 263 -3.818 -1.304 0.998 1.00 0.00 C ATOM 0 H PHE A 263 -6.787 -0.988 -2.420 1.00 0.00 H new ATOM 0 HA PHE A 263 -5.345 -1.417 -4.902 1.00 0.00 H new ATOM 0 HB2 PHE A 263 -3.430 -2.492 -3.581 1.00 0.00 H new ATOM 0 HB3 PHE A 263 -3.438 -0.744 -3.700 1.00 0.00 H new ATOM 0 HD1 PHE A 263 -4.252 0.616 -1.736 1.00 0.00 H new ATOM 0 HD2 PHE A 263 -3.566 -3.581 -1.471 1.00 0.00 H new ATOM 0 HE1 PHE A 263 -4.169 0.786 0.713 1.00 0.00 H new ATOM 0 HE2 PHE A 263 -3.483 -3.413 0.979 1.00 0.00 H new ATOM 0 HZ PHE A 263 -3.778 -1.230 2.075 1.00 0.00 H new ATOM 813 N GLN A 264 -5.424 -4.007 -4.366 1.00 0.00 N ATOM 814 CA GLN A 264 -5.903 -5.383 -4.280 1.00 0.00 C ATOM 815 C GLN A 264 -4.945 -6.245 -3.466 1.00 0.00 C ATOM 816 O GLN A 264 -3.746 -6.288 -3.741 1.00 0.00 O ATOM 817 CB GLN A 264 -6.075 -5.973 -5.680 1.00 0.00 C ATOM 818 CG GLN A 264 -6.845 -7.285 -5.697 1.00 0.00 C ATOM 819 CD GLN A 264 -8.345 -7.080 -5.623 1.00 0.00 C ATOM 820 OE1 GLN A 264 -9.041 -7.135 -6.638 1.00 0.00 O ATOM 821 NE2 GLN A 264 -8.853 -6.843 -4.420 1.00 0.00 N ATOM 0 H GLN A 264 -4.644 -3.871 -5.009 1.00 0.00 H new ATOM 0 HA GLN A 264 -6.869 -5.373 -3.776 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -6.593 -5.249 -6.309 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -5.091 -6.133 -6.121 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -6.601 -7.834 -6.607 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -6.524 -7.902 -4.857 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -8.240 -6.806 -3.606 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -9.857 -6.698 -4.310 1.00 0.00 H new ATOM 830 N CYS A 265 -5.485 -6.929 -2.463 1.00 0.00 N ATOM 831 CA CYS A 265 -4.680 -7.792 -1.607 1.00 0.00 C ATOM 832 C CYS A 265 -5.532 -8.900 -0.996 1.00 0.00 C ATOM 833 O CYS A 265 -6.758 -8.811 -0.971 1.00 0.00 O ATOM 834 CB CYS A 265 -4.017 -6.973 -0.499 1.00 0.00 C ATOM 835 SG CYS A 265 -5.159 -5.917 0.423 1.00 0.00 S ATOM 0 H CYS A 265 -6.476 -6.902 -2.223 1.00 0.00 H new ATOM 0 HA CYS A 265 -3.906 -8.251 -2.222 1.00 0.00 H new ATOM 0 HB2 CYS A 265 -3.526 -7.653 0.197 1.00 0.00 H new ATOM 0 HB3 CYS A 265 -3.238 -6.350 -0.939 1.00 0.00 H new ATOM 0 HG CYS A 265 -4.763 -4.681 0.349 1.00 0.00 H new ATOM 841 N GLN A 266 -4.871 -9.942 -0.503 1.00 0.00 N ATOM 842 CA GLN A 266 -5.566 -11.069 0.110 1.00 0.00 C ATOM 843 C GLN A 266 -6.372 -10.615 1.325 1.00 0.00 C ATOM 844 O GLN A 266 -6.180 -9.509 1.830 1.00 0.00 O ATOM 845 CB GLN A 266 -4.566 -12.149 0.522 1.00 0.00 C ATOM 846 CG GLN A 266 -4.268 -13.154 -0.579 1.00 0.00 C ATOM 847 CD GLN A 266 -5.130 -14.397 -0.482 1.00 0.00 C ATOM 848 OE1 GLN A 266 -6.309 -14.347 -1.093 1.00 0.00 O flip ATOM 849 NE2 GLN A 266 -4.743 -15.390 0.134 1.00 0.00 N flip ATOM 0 H GLN A 266 -3.855 -10.030 -0.516 1.00 0.00 H new ATOM 0 HA GLN A 266 -6.254 -11.484 -0.627 1.00 0.00 H new ATOM 0 HB2 GLN A 266 -3.635 -11.672 0.829 1.00 0.00 H new ATOM 0 HB3 GLN A 266 -4.954 -12.679 1.391 1.00 0.00 H new ATOM 0 HG2 GLN A 266 -4.425 -12.682 -1.549 1.00 0.00 H new ATOM 0 HG3 GLN A 266 -3.217 -13.440 -0.530 1.00 0.00 H new ATOM 0 HE21 GLN A 266 -3.830 -15.384 0.588 1.00 0.00 H new ATOM 0 HE22 GLN A 266 -5.335 -16.218 0.190 1.00 0.00 H new ATOM 858 N PRO A 267 -7.292 -11.464 1.810 1.00 0.00 N ATOM 859 CA PRO A 267 -8.127 -11.146 2.971 1.00 0.00 C ATOM 860 C PRO A 267 -7.302 -10.973 4.244 1.00 0.00 C ATOM 861 O PRO A 267 -6.394 -11.757 4.517 1.00 0.00 O ATOM 862 CB PRO A 267 -9.059 -12.358 3.101 1.00 0.00 C ATOM 863 CG PRO A 267 -8.973 -13.064 1.789 1.00 0.00 C ATOM 864 CD PRO A 267 -7.592 -12.798 1.269 1.00 0.00 C ATOM 0 HA PRO A 267 -8.658 -10.203 2.838 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -8.747 -13.008 3.919 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -10.082 -12.047 3.314 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -9.146 -14.133 1.909 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -9.729 -12.695 1.096 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -6.878 -13.545 1.616 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -7.561 -12.809 0.180 1.00 0.00 H new ATOM 872 N LYS A 268 -7.627 -9.944 5.020 1.00 0.00 N ATOM 873 CA LYS A 268 -6.920 -9.669 6.266 1.00 0.00 C ATOM 874 C LYS A 268 -5.440 -9.385 6.016 1.00 0.00 C ATOM 875 O LYS A 268 -4.618 -9.487 6.926 1.00 0.00 O ATOM 876 CB LYS A 268 -7.069 -10.846 7.231 1.00 0.00 C ATOM 877 CG LYS A 268 -8.420 -10.899 7.924 1.00 0.00 C ATOM 878 CD LYS A 268 -8.403 -10.137 9.239 1.00 0.00 C ATOM 879 CE LYS A 268 -9.783 -10.084 9.871 1.00 0.00 C ATOM 880 NZ LYS A 268 -9.722 -10.235 11.351 1.00 0.00 N ATOM 0 H LYS A 268 -8.377 -9.286 4.808 1.00 0.00 H new ATOM 0 HA LYS A 268 -7.365 -8.780 6.712 1.00 0.00 H new ATOM 0 HB2 LYS A 268 -6.915 -11.776 6.683 1.00 0.00 H new ATOM 0 HB3 LYS A 268 -6.285 -10.787 7.986 1.00 0.00 H new ATOM 0 HG2 LYS A 268 -9.183 -10.478 7.269 1.00 0.00 H new ATOM 0 HG3 LYS A 268 -8.695 -11.938 8.108 1.00 0.00 H new ATOM 0 HD2 LYS A 268 -7.705 -10.613 9.927 1.00 0.00 H new ATOM 0 HD3 LYS A 268 -8.041 -9.123 9.068 1.00 0.00 H new ATOM 0 HE2 LYS A 268 -10.260 -9.136 9.622 1.00 0.00 H new ATOM 0 HE3 LYS A 268 -10.405 -10.874 9.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 -10.684 -10.193 11.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 -9.290 -11.151 11.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 -9.149 -9.467 11.755 1.00 0.00 H new ATOM 894 N TYR A 269 -5.103 -9.024 4.779 1.00 0.00 N ATOM 895 CA TYR A 269 -3.720 -8.722 4.422 1.00 0.00 C ATOM 896 C TYR A 269 -3.538 -7.233 4.134 1.00 0.00 C ATOM 897 O TYR A 269 -2.412 -6.758 3.981 1.00 0.00 O ATOM 898 CB TYR A 269 -3.293 -9.537 3.198 1.00 0.00 C ATOM 899 CG TYR A 269 -2.753 -10.910 3.528 1.00 0.00 C ATOM 900 CD1 TYR A 269 -3.335 -11.691 4.520 1.00 0.00 C ATOM 901 CD2 TYR A 269 -1.661 -11.429 2.843 1.00 0.00 C ATOM 902 CE1 TYR A 269 -2.844 -12.948 4.820 1.00 0.00 C ATOM 903 CE2 TYR A 269 -1.165 -12.685 3.136 1.00 0.00 C ATOM 904 CZ TYR A 269 -1.759 -13.439 4.125 1.00 0.00 C ATOM 905 OH TYR A 269 -1.267 -14.690 4.420 1.00 0.00 O ATOM 0 H TYR A 269 -5.767 -8.934 4.010 1.00 0.00 H new ATOM 0 HA TYR A 269 -3.092 -8.991 5.271 1.00 0.00 H new ATOM 0 HB2 TYR A 269 -4.148 -9.645 2.531 1.00 0.00 H new ATOM 0 HB3 TYR A 269 -2.531 -8.980 2.652 1.00 0.00 H new ATOM 0 HD1 TYR A 269 -4.185 -11.309 5.066 1.00 0.00 H new ATOM 0 HD2 TYR A 269 -1.192 -10.841 2.068 1.00 0.00 H new ATOM 0 HE1 TYR A 269 -3.307 -13.542 5.594 1.00 0.00 H new ATOM 0 HE2 TYR A 269 -0.316 -13.074 2.593 1.00 0.00 H new ATOM 0 HH TYR A 269 -0.502 -14.886 3.840 1.00 0.00 H new ATOM 915 N GLY A 270 -4.644 -6.499 4.054 1.00 0.00 N ATOM 916 CA GLY A 270 -4.570 -5.075 3.777 1.00 0.00 C ATOM 917 C GLY A 270 -4.462 -4.237 5.036 1.00 0.00 C ATOM 918 O GLY A 270 -5.347 -4.271 5.891 1.00 0.00 O ATOM 0 H GLY A 270 -5.589 -6.864 4.176 1.00 0.00 H new ATOM 0 HA2 GLY A 270 -3.708 -4.878 3.140 1.00 0.00 H new ATOM 0 HA3 GLY A 270 -5.456 -4.771 3.219 1.00 0.00 H new ATOM 922 N LEU A 271 -3.377 -3.476 5.143 1.00 0.00 N ATOM 923 CA LEU A 271 -3.156 -2.614 6.299 1.00 0.00 C ATOM 924 C LEU A 271 -2.831 -1.192 5.852 1.00 0.00 C ATOM 925 O LEU A 271 -1.922 -0.976 5.052 1.00 0.00 O ATOM 926 CB LEU A 271 -2.023 -3.166 7.167 1.00 0.00 C ATOM 927 CG LEU A 271 -2.191 -2.939 8.671 1.00 0.00 C ATOM 928 CD1 LEU A 271 -3.483 -3.574 9.169 1.00 0.00 C ATOM 929 CD2 LEU A 271 -0.992 -3.492 9.432 1.00 0.00 C ATOM 0 H LEU A 271 -2.637 -3.439 4.442 1.00 0.00 H new ATOM 0 HA LEU A 271 -4.071 -2.592 6.890 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -1.934 -4.237 6.984 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -1.086 -2.709 6.848 1.00 0.00 H new ATOM 0 HG LEU A 271 -2.247 -1.866 8.852 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -3.584 -3.401 10.241 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -4.331 -3.129 8.648 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -3.460 -4.646 8.975 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -1.129 -3.322 10.500 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.903 -4.562 9.244 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -0.085 -2.988 9.098 1.00 0.00 H new ATOM 941 N PHE A 272 -3.588 -0.228 6.364 1.00 0.00 N ATOM 942 CA PHE A 272 -3.389 1.173 6.009 1.00 0.00 C ATOM 943 C PHE A 272 -2.685 1.936 7.126 1.00 0.00 C ATOM 944 O PHE A 272 -3.254 2.142 8.197 1.00 0.00 O ATOM 945 CB PHE A 272 -4.736 1.835 5.710 1.00 0.00 C ATOM 946 CG PHE A 272 -5.299 1.485 4.362 1.00 0.00 C ATOM 947 CD1 PHE A 272 -5.443 0.160 3.977 1.00 0.00 C ATOM 948 CD2 PHE A 272 -5.690 2.480 3.482 1.00 0.00 C ATOM 949 CE1 PHE A 272 -5.965 -0.163 2.740 1.00 0.00 C ATOM 950 CE2 PHE A 272 -6.213 2.163 2.243 1.00 0.00 C ATOM 951 CZ PHE A 272 -6.351 0.839 1.871 1.00 0.00 C ATOM 0 H PHE A 272 -4.346 -0.391 7.027 1.00 0.00 H new ATOM 0 HA PHE A 272 -2.758 1.204 5.121 1.00 0.00 H new ATOM 0 HB2 PHE A 272 -5.452 1.544 6.479 1.00 0.00 H new ATOM 0 HB3 PHE A 272 -4.621 2.917 5.775 1.00 0.00 H new ATOM 0 HD1 PHE A 272 -5.143 -0.628 4.652 1.00 0.00 H new ATOM 0 HD2 PHE A 272 -5.585 3.516 3.767 1.00 0.00 H new ATOM 0 HE1 PHE A 272 -6.071 -1.198 2.452 1.00 0.00 H new ATOM 0 HE2 PHE A 272 -6.514 2.949 1.566 1.00 0.00 H new ATOM 0 HZ PHE A 272 -6.760 0.588 0.903 1.00 0.00 H new ATOM 961 N ALA A 273 -1.451 2.368 6.869 1.00 0.00 N ATOM 962 CA ALA A 273 -0.688 3.124 7.857 1.00 0.00 C ATOM 963 C ALA A 273 0.082 4.267 7.199 1.00 0.00 C ATOM 964 O ALA A 273 0.494 4.169 6.042 1.00 0.00 O ATOM 965 CB ALA A 273 0.267 2.216 8.621 1.00 0.00 C ATOM 0 H ALA A 273 -0.961 2.208 5.989 1.00 0.00 H new ATOM 0 HA ALA A 273 -1.398 3.551 8.565 1.00 0.00 H new ATOM 0 HB1 ALA A 273 0.823 2.805 9.351 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -0.301 1.442 9.137 1.00 0.00 H new ATOM 0 HB3 ALA A 273 0.963 1.751 7.923 1.00 0.00 H new ATOM 971 N PRO A 274 0.283 5.370 7.936 1.00 0.00 N ATOM 972 CA PRO A 274 1.001 6.546 7.433 1.00 0.00 C ATOM 973 C PRO A 274 2.346 6.190 6.810 1.00 0.00 C ATOM 974 O PRO A 274 2.880 5.104 7.036 1.00 0.00 O ATOM 975 CB PRO A 274 1.216 7.393 8.686 1.00 0.00 C ATOM 976 CG PRO A 274 0.121 7.000 9.613 1.00 0.00 C ATOM 977 CD PRO A 274 -0.184 5.557 9.320 1.00 0.00 C ATOM 0 HA PRO A 274 0.443 7.049 6.644 1.00 0.00 H new ATOM 0 HB2 PRO A 274 2.194 7.202 9.128 1.00 0.00 H new ATOM 0 HB3 PRO A 274 1.173 8.457 8.454 1.00 0.00 H new ATOM 0 HG2 PRO A 274 0.426 7.130 10.651 1.00 0.00 H new ATOM 0 HG3 PRO A 274 -0.760 7.622 9.459 1.00 0.00 H new ATOM 0 HD2 PRO A 274 0.334 4.891 10.010 1.00 0.00 H new ATOM 0 HD3 PRO A 274 -1.249 5.347 9.414 1.00 0.00 H new ATOM 985 N VAL A 275 2.888 7.118 6.029 1.00 0.00 N ATOM 986 CA VAL A 275 4.173 6.910 5.376 1.00 0.00 C ATOM 987 C VAL A 275 5.316 6.947 6.389 1.00 0.00 C ATOM 988 O VAL A 275 6.322 6.259 6.226 1.00 0.00 O ATOM 989 CB VAL A 275 4.427 7.972 4.287 1.00 0.00 C ATOM 990 CG1 VAL A 275 4.476 9.367 4.894 1.00 0.00 C ATOM 991 CG2 VAL A 275 5.711 7.667 3.529 1.00 0.00 C ATOM 0 H VAL A 275 2.457 8.021 5.833 1.00 0.00 H new ATOM 0 HA VAL A 275 4.138 5.925 4.910 1.00 0.00 H new ATOM 0 HB VAL A 275 3.598 7.940 3.580 1.00 0.00 H new ATOM 0 HG11 VAL A 275 4.656 10.100 4.108 1.00 0.00 H new ATOM 0 HG12 VAL A 275 3.526 9.585 5.382 1.00 0.00 H new ATOM 0 HG13 VAL A 275 5.281 9.417 5.627 1.00 0.00 H new ATOM 0 HG21 VAL A 275 5.872 8.428 2.765 1.00 0.00 H new ATOM 0 HG22 VAL A 275 6.552 7.666 4.223 1.00 0.00 H new ATOM 0 HG23 VAL A 275 5.630 6.689 3.055 1.00 0.00 H new ATOM 1001 N HIS A 276 5.151 7.752 7.436 1.00 0.00 N ATOM 1002 CA HIS A 276 6.172 7.869 8.473 1.00 0.00 C ATOM 1003 C HIS A 276 6.161 6.647 9.386 1.00 0.00 C ATOM 1004 O HIS A 276 7.187 6.283 9.961 1.00 0.00 O ATOM 1005 CB HIS A 276 5.964 9.144 9.295 1.00 0.00 C ATOM 1006 CG HIS A 276 4.548 9.363 9.731 1.00 0.00 C ATOM 1007 ND1 HIS A 276 3.674 8.542 10.360 1.00 0.00 N flip ATOM 1008 CD2 HIS A 276 3.879 10.554 9.537 1.00 0.00 C flip ATOM 1009 CE1 HIS A 276 2.507 9.244 10.532 1.00 0.00 C flip ATOM 1010 NE2 HIS A 276 2.656 10.454 10.027 1.00 0.00 N flip ATOM 0 H HIS A 276 4.324 8.330 7.588 1.00 0.00 H new ATOM 0 HA HIS A 276 7.144 7.925 7.983 1.00 0.00 H new ATOM 0 HB2 HIS A 276 6.603 9.104 10.177 1.00 0.00 H new ATOM 0 HB3 HIS A 276 6.289 10.001 8.705 1.00 0.00 H new ATOM 0 HD2 HIS A 276 4.291 11.431 9.059 1.00 0.00 H new ATOM 0 HE1 HIS A 276 1.612 8.867 11.004 1.00 0.00 H new ATOM 0 HE2 HIS A 276 1.947 11.188 10.017 1.00 0.00 H new ATOM 1019 N LYS A 277 4.999 6.011 9.508 1.00 0.00 N ATOM 1020 CA LYS A 277 4.864 4.823 10.343 1.00 0.00 C ATOM 1021 C LYS A 277 5.423 3.597 9.633 1.00 0.00 C ATOM 1022 O LYS A 277 5.737 2.589 10.268 1.00 0.00 O ATOM 1023 CB LYS A 277 3.395 4.582 10.699 1.00 0.00 C ATOM 1024 CG LYS A 277 2.895 5.435 11.854 1.00 0.00 C ATOM 1025 CD LYS A 277 2.474 4.577 13.037 1.00 0.00 C ATOM 1026 CE LYS A 277 3.584 4.462 14.069 1.00 0.00 C ATOM 1027 NZ LYS A 277 3.985 5.791 14.608 1.00 0.00 N ATOM 0 H LYS A 277 4.139 6.298 9.040 1.00 0.00 H new ATOM 0 HA LYS A 277 5.432 4.991 11.258 1.00 0.00 H new ATOM 0 HB2 LYS A 277 2.781 4.780 9.821 1.00 0.00 H new ATOM 0 HB3 LYS A 277 3.260 3.530 10.951 1.00 0.00 H new ATOM 0 HG2 LYS A 277 3.679 6.125 12.164 1.00 0.00 H new ATOM 0 HG3 LYS A 277 2.051 6.040 11.523 1.00 0.00 H new ATOM 0 HD2 LYS A 277 1.587 5.008 13.502 1.00 0.00 H new ATOM 0 HD3 LYS A 277 2.199 3.583 12.686 1.00 0.00 H new ATOM 0 HE2 LYS A 277 3.253 3.824 14.888 1.00 0.00 H new ATOM 0 HE3 LYS A 277 4.450 3.978 13.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 277 4.336 5.680 15.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 277 4.736 6.195 14.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 277 3.163 6.428 14.607 1.00 0.00 H new ATOM 1041 N VAL A 278 5.546 3.690 8.313 1.00 0.00 N ATOM 1042 CA VAL A 278 6.066 2.585 7.522 1.00 0.00 C ATOM 1043 C VAL A 278 7.552 2.756 7.235 1.00 0.00 C ATOM 1044 O VAL A 278 8.030 3.869 7.016 1.00 0.00 O ATOM 1045 CB VAL A 278 5.309 2.440 6.189 1.00 0.00 C ATOM 1046 CG1 VAL A 278 5.743 1.177 5.466 1.00 0.00 C ATOM 1047 CG2 VAL A 278 3.808 2.429 6.422 1.00 0.00 C ATOM 0 H VAL A 278 5.293 4.517 7.772 1.00 0.00 H new ATOM 0 HA VAL A 278 5.919 1.682 8.115 1.00 0.00 H new ATOM 0 HB VAL A 278 5.552 3.299 5.563 1.00 0.00 H new ATOM 0 HG11 VAL A 278 5.198 1.090 4.526 1.00 0.00 H new ATOM 0 HG12 VAL A 278 6.813 1.224 5.262 1.00 0.00 H new ATOM 0 HG13 VAL A 278 5.530 0.309 6.090 1.00 0.00 H new ATOM 0 HG21 VAL A 278 3.292 2.326 5.467 1.00 0.00 H new ATOM 0 HG22 VAL A 278 3.546 1.591 7.068 1.00 0.00 H new ATOM 0 HG23 VAL A 278 3.507 3.362 6.898 1.00 0.00 H new ATOM 1057 N THR A 279 8.274 1.643 7.239 1.00 0.00 N ATOM 1058 CA THR A 279 9.708 1.657 6.981 1.00 0.00 C ATOM 1059 C THR A 279 10.124 0.428 6.179 1.00 0.00 C ATOM 1060 O THR A 279 9.540 -0.645 6.322 1.00 0.00 O ATOM 1061 CB THR A 279 10.482 1.708 8.301 1.00 0.00 C ATOM 1062 OG1 THR A 279 9.641 2.132 9.360 1.00 0.00 O ATOM 1063 CG2 THR A 279 11.672 2.641 8.260 1.00 0.00 C ATOM 0 H THR A 279 7.888 0.716 7.419 1.00 0.00 H new ATOM 0 HA THR A 279 9.942 2.547 6.397 1.00 0.00 H new ATOM 0 HB THR A 279 10.841 0.692 8.464 1.00 0.00 H new ATOM 0 HG1 THR A 279 10.154 2.157 10.195 1.00 0.00 H new ATOM 0 HG21 THR A 279 12.176 2.630 9.226 1.00 0.00 H new ATOM 0 HG22 THR A 279 12.365 2.313 7.485 1.00 0.00 H new ATOM 0 HG23 THR A 279 11.333 3.653 8.039 1.00 0.00 H new ATOM 1071 N LYS A 280 11.140 0.591 5.339 1.00 0.00 N ATOM 1072 CA LYS A 280 11.631 -0.509 4.518 1.00 0.00 C ATOM 1073 C LYS A 280 12.350 -1.547 5.375 1.00 0.00 C ATOM 1074 O LYS A 280 13.213 -1.209 6.186 1.00 0.00 O ATOM 1075 CB LYS A 280 12.571 0.018 3.430 1.00 0.00 C ATOM 1076 CG LYS A 280 12.098 -0.291 2.018 1.00 0.00 C ATOM 1077 CD LYS A 280 13.151 0.075 0.985 1.00 0.00 C ATOM 1078 CE LYS A 280 13.039 -0.796 -0.256 1.00 0.00 C ATOM 1079 NZ LYS A 280 13.491 -2.191 0.000 1.00 0.00 N ATOM 0 H LYS A 280 11.638 1.471 5.209 1.00 0.00 H new ATOM 0 HA LYS A 280 10.774 -0.988 4.044 1.00 0.00 H new ATOM 0 HB2 LYS A 280 12.675 1.097 3.542 1.00 0.00 H new ATOM 0 HB3 LYS A 280 13.561 -0.414 3.576 1.00 0.00 H new ATOM 0 HG2 LYS A 280 11.860 -1.352 1.937 1.00 0.00 H new ATOM 0 HG3 LYS A 280 11.179 0.258 1.813 1.00 0.00 H new ATOM 0 HD2 LYS A 280 13.041 1.123 0.707 1.00 0.00 H new ATOM 0 HD3 LYS A 280 14.144 -0.036 1.421 1.00 0.00 H new ATOM 0 HE2 LYS A 280 12.004 -0.807 -0.599 1.00 0.00 H new ATOM 0 HE3 LYS A 280 13.636 -0.363 -1.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 13.690 -2.663 -0.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 14.354 -2.175 0.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 12.745 -2.711 0.504 1.00 0.00 H new ATOM 1093 N ILE A 281 11.985 -2.813 5.191 1.00 0.00 N ATOM 1094 CA ILE A 281 12.593 -3.901 5.949 1.00 0.00 C ATOM 1095 C ILE A 281 13.938 -4.302 5.350 1.00 0.00 C ATOM 1096 O ILE A 281 14.836 -4.753 6.061 1.00 0.00 O ATOM 1097 CB ILE A 281 11.670 -5.136 5.999 1.00 0.00 C ATOM 1098 CG1 ILE A 281 12.280 -6.225 6.883 1.00 0.00 C ATOM 1099 CG2 ILE A 281 11.414 -5.667 4.595 1.00 0.00 C ATOM 1100 CD1 ILE A 281 11.264 -7.210 7.415 1.00 0.00 C ATOM 0 H ILE A 281 11.272 -3.110 4.524 1.00 0.00 H new ATOM 0 HA ILE A 281 12.747 -3.535 6.964 1.00 0.00 H new ATOM 0 HB ILE A 281 10.716 -4.837 6.432 1.00 0.00 H new ATOM 0 HG12 ILE A 281 13.034 -6.766 6.311 1.00 0.00 H new ATOM 0 HG13 ILE A 281 12.793 -5.755 7.722 1.00 0.00 H new ATOM 0 HG21 ILE A 281 10.761 -6.538 4.649 1.00 0.00 H new ATOM 0 HG22 ILE A 281 10.937 -4.893 3.994 1.00 0.00 H new ATOM 0 HG23 ILE A 281 12.361 -5.951 4.135 1.00 0.00 H new ATOM 0 HD11 ILE A 281 11.767 -7.953 8.033 1.00 0.00 H new ATOM 0 HD12 ILE A 281 10.523 -6.681 8.014 1.00 0.00 H new ATOM 0 HD13 ILE A 281 10.768 -7.707 6.581 1.00 0.00 H new ATOM 1112 N GLY A 282 14.070 -4.134 4.038 1.00 0.00 N ATOM 1113 CA GLY A 282 15.308 -4.482 3.367 1.00 0.00 C ATOM 1114 C GLY A 282 16.472 -3.621 3.816 1.00 0.00 C ATOM 1115 O GLY A 282 16.843 -2.664 3.136 1.00 0.00 O ATOM 0 H GLY A 282 13.341 -3.763 3.428 1.00 0.00 H new ATOM 0 HA2 GLY A 282 15.540 -5.530 3.559 1.00 0.00 H new ATOM 0 HA3 GLY A 282 15.176 -4.377 2.290 1.00 0.00 H new ATOM 1119 N PHE A 283 17.048 -3.960 4.963 1.00 0.00 N ATOM 1120 CA PHE A 283 18.176 -3.209 5.503 1.00 0.00 C ATOM 1121 C PHE A 283 19.422 -3.405 4.642 1.00 0.00 C ATOM 1122 O PHE A 283 19.619 -4.469 4.054 1.00 0.00 O ATOM 1123 CB PHE A 283 18.463 -3.643 6.942 1.00 0.00 C ATOM 1124 CG PHE A 283 17.246 -3.638 7.823 1.00 0.00 C ATOM 1125 CD1 PHE A 283 16.619 -2.448 8.155 1.00 0.00 C ATOM 1126 CD2 PHE A 283 16.730 -4.824 8.320 1.00 0.00 C ATOM 1127 CE1 PHE A 283 15.499 -2.441 8.966 1.00 0.00 C ATOM 1128 CE2 PHE A 283 15.611 -4.823 9.130 1.00 0.00 C ATOM 1129 CZ PHE A 283 14.994 -3.630 9.454 1.00 0.00 C ATOM 0 H PHE A 283 16.753 -4.750 5.537 1.00 0.00 H new ATOM 0 HA PHE A 283 17.913 -2.151 5.496 1.00 0.00 H new ATOM 0 HB2 PHE A 283 18.891 -4.645 6.932 1.00 0.00 H new ATOM 0 HB3 PHE A 283 19.215 -2.980 7.370 1.00 0.00 H new ATOM 0 HD1 PHE A 283 17.009 -1.515 7.776 1.00 0.00 H new ATOM 0 HD2 PHE A 283 17.208 -5.760 8.071 1.00 0.00 H new ATOM 0 HE1 PHE A 283 15.020 -1.506 9.218 1.00 0.00 H new ATOM 0 HE2 PHE A 283 15.218 -5.755 9.510 1.00 0.00 H new ATOM 0 HZ PHE A 283 14.119 -3.627 10.087 1.00 0.00 H new TER 1139 PHE A 283 ATOM 1140 N GLY B 444 7.835 3.316 23.425 1.00 0.00 N ATOM 1141 CA GLY B 444 7.115 2.850 22.254 1.00 0.00 C ATOM 1142 C GLY B 444 7.161 3.846 21.111 1.00 0.00 C ATOM 1143 O GLY B 444 7.392 5.036 21.325 1.00 0.00 O ATOM 0 HA2 GLY B 444 7.540 1.902 21.923 1.00 0.00 H new ATOM 0 HA3 GLY B 444 6.076 2.657 22.523 1.00 0.00 H new ATOM 1146 N GLU B 445 6.942 3.357 19.895 1.00 0.00 N ATOM 1147 CA GLU B 445 6.958 4.212 18.713 1.00 0.00 C ATOM 1148 C GLU B 445 5.541 4.581 18.289 1.00 0.00 C ATOM 1149 O GLU B 445 5.246 4.689 17.099 1.00 0.00 O ATOM 1150 CB GLU B 445 7.683 3.512 17.563 1.00 0.00 C ATOM 1151 CG GLU B 445 9.129 3.168 17.874 1.00 0.00 C ATOM 1152 CD GLU B 445 10.054 3.412 16.697 1.00 0.00 C ATOM 1153 OE1 GLU B 445 10.077 4.552 16.188 1.00 0.00 O ATOM 1154 OE2 GLU B 445 10.754 2.462 16.285 1.00 0.00 O ATOM 0 H GLU B 445 6.751 2.374 19.702 1.00 0.00 H new ATOM 0 HA GLU B 445 7.491 5.129 18.965 1.00 0.00 H new ATOM 0 HB2 GLU B 445 7.147 2.597 17.310 1.00 0.00 H new ATOM 0 HB3 GLU B 445 7.652 4.153 16.682 1.00 0.00 H new ATOM 0 HG2 GLU B 445 9.465 3.762 18.724 1.00 0.00 H new ATOM 0 HG3 GLU B 445 9.194 2.121 18.171 1.00 0.00 H new ATOM 1161 N GLU B 446 4.665 4.772 19.272 1.00 0.00 N ATOM 1162 CA GLU B 446 3.277 5.128 19.003 1.00 0.00 C ATOM 1163 C GLU B 446 2.567 4.012 18.242 1.00 0.00 C ATOM 1164 O GLU B 446 3.144 3.389 17.349 1.00 0.00 O ATOM 1165 CB GLU B 446 3.206 6.434 18.207 1.00 0.00 C ATOM 1166 CG GLU B 446 2.634 7.598 19.002 1.00 0.00 C ATOM 1167 CD GLU B 446 1.511 8.307 18.272 1.00 0.00 C ATOM 1168 OE1 GLU B 446 0.356 7.840 18.362 1.00 0.00 O ATOM 1169 OE2 GLU B 446 1.785 9.331 17.611 1.00 0.00 O ATOM 0 H GLU B 446 4.893 4.686 20.262 1.00 0.00 H new ATOM 0 HA GLU B 446 2.772 5.268 19.959 1.00 0.00 H new ATOM 0 HB2 GLU B 446 4.207 6.696 17.863 1.00 0.00 H new ATOM 0 HB3 GLU B 446 2.595 6.276 17.318 1.00 0.00 H new ATOM 0 HG2 GLU B 446 2.265 7.232 19.960 1.00 0.00 H new ATOM 0 HG3 GLU B 446 3.429 8.311 19.218 1.00 0.00 H new ATOM 1176 N GLU B 447 1.312 3.764 18.602 1.00 0.00 N ATOM 1177 CA GLU B 447 0.520 2.723 17.955 1.00 0.00 C ATOM 1178 C GLU B 447 -0.923 3.178 17.767 1.00 0.00 C ATOM 1179 O GLU B 447 -1.371 4.133 18.403 1.00 0.00 O ATOM 1180 CB GLU B 447 0.561 1.435 18.779 1.00 0.00 C ATOM 1181 CG GLU B 447 1.948 1.078 19.284 1.00 0.00 C ATOM 1182 CD GLU B 447 2.915 0.758 18.160 1.00 0.00 C ATOM 1183 OE1 GLU B 447 2.472 0.181 17.144 1.00 0.00 O ATOM 1184 OE2 GLU B 447 4.113 1.085 18.296 1.00 0.00 O ATOM 0 H GLU B 447 0.821 4.270 19.339 1.00 0.00 H new ATOM 0 HA GLU B 447 0.951 2.529 16.973 1.00 0.00 H new ATOM 0 HB2 GLU B 447 -0.111 1.538 19.631 1.00 0.00 H new ATOM 0 HB3 GLU B 447 0.182 0.613 18.171 1.00 0.00 H new ATOM 0 HG2 GLU B 447 2.341 1.908 19.871 1.00 0.00 H new ATOM 0 HG3 GLU B 447 1.877 0.220 19.952 1.00 0.00 H new ATOM 1191 N GLY B 448 -1.646 2.490 16.890 1.00 0.00 N ATOM 1192 CA GLY B 448 -3.031 2.840 16.634 1.00 0.00 C ATOM 1193 C GLY B 448 -3.185 3.805 15.476 1.00 0.00 C ATOM 1194 O GLY B 448 -4.223 4.451 15.332 1.00 0.00 O ATOM 0 H GLY B 448 -1.298 1.696 16.352 1.00 0.00 H new ATOM 0 HA2 GLY B 448 -3.598 1.933 16.424 1.00 0.00 H new ATOM 0 HA3 GLY B 448 -3.461 3.284 17.532 1.00 0.00 H new ATOM 1198 N GLU B 449 -2.150 3.906 14.646 1.00 0.00 N ATOM 1199 CA GLU B 449 -2.179 4.802 13.494 1.00 0.00 C ATOM 1200 C GLU B 449 -2.342 4.020 12.201 1.00 0.00 C ATOM 1201 O GLU B 449 -1.934 4.481 11.139 1.00 0.00 O ATOM 1202 CB GLU B 449 -0.894 5.627 13.417 1.00 0.00 C ATOM 1203 CG GLU B 449 -0.314 5.996 14.774 1.00 0.00 C ATOM 1204 CD GLU B 449 -1.142 7.039 15.498 1.00 0.00 C ATOM 1205 OE1 GLU B 449 -1.244 8.173 14.988 1.00 0.00 O ATOM 1206 OE2 GLU B 449 -1.685 6.721 16.577 1.00 0.00 O ATOM 0 H GLU B 449 -1.283 3.379 14.750 1.00 0.00 H new ATOM 0 HA GLU B 449 -3.032 5.469 13.621 1.00 0.00 H new ATOM 0 HB2 GLU B 449 -0.147 5.066 12.854 1.00 0.00 H new ATOM 0 HB3 GLU B 449 -1.094 6.541 12.858 1.00 0.00 H new ATOM 0 HG2 GLU B 449 -0.245 5.100 15.391 1.00 0.00 H new ATOM 0 HG3 GLU B 449 0.701 6.371 14.641 1.00 0.00 H new ATOM 1213 N GLU B 450 -2.931 2.834 12.287 1.00 0.00 N ATOM 1214 CA GLU B 450 -3.124 2.010 11.103 1.00 0.00 C ATOM 1215 C GLU B 450 -4.493 1.336 11.113 1.00 0.00 C ATOM 1216 O GLU B 450 -5.070 1.092 12.172 1.00 0.00 O ATOM 1217 CB GLU B 450 -2.009 0.967 10.995 1.00 0.00 C ATOM 1218 CG GLU B 450 -2.096 -0.143 12.033 1.00 0.00 C ATOM 1219 CD GLU B 450 -1.402 0.219 13.332 1.00 0.00 C ATOM 1220 OE1 GLU B 450 -0.439 1.013 13.290 1.00 0.00 O ATOM 1221 OE2 GLU B 450 -1.823 -0.291 14.392 1.00 0.00 O ATOM 0 H GLU B 450 -3.279 2.425 13.154 1.00 0.00 H new ATOM 0 HA GLU B 450 -3.082 2.660 10.229 1.00 0.00 H new ATOM 0 HB2 GLU B 450 -2.036 0.523 10.000 1.00 0.00 H new ATOM 0 HB3 GLU B 450 -1.046 1.468 11.094 1.00 0.00 H new ATOM 0 HG2 GLU B 450 -3.144 -0.366 12.235 1.00 0.00 H new ATOM 0 HG3 GLU B 450 -1.650 -1.051 11.627 1.00 0.00 H new ATOM 1228 N TYR B 451 -5.005 1.042 9.923 1.00 0.00 N ATOM 1229 CA TYR B 451 -6.306 0.402 9.783 1.00 0.00 C ATOM 1230 C TYR B 451 -6.252 -0.728 8.760 1.00 0.00 C ATOM 1231 O TYR B 451 -5.132 -1.141 8.395 1.00 0.00 O ATOM 1232 CB TYR B 451 -7.357 1.431 9.367 1.00 0.00 C ATOM 1233 CG TYR B 451 -7.869 2.273 10.514 1.00 0.00 C ATOM 1234 CD1 TYR B 451 -7.176 3.402 10.933 1.00 0.00 C ATOM 1235 CD2 TYR B 451 -9.042 1.940 11.177 1.00 0.00 C ATOM 1236 CE1 TYR B 451 -7.639 4.175 11.982 1.00 0.00 C ATOM 1237 CE2 TYR B 451 -9.511 2.706 12.227 1.00 0.00 C ATOM 1238 CZ TYR B 451 -8.806 3.823 12.625 1.00 0.00 C ATOM 1239 OH TYR B 451 -9.270 4.588 13.670 1.00 0.00 O ATOM 1240 OXT TYR B 451 -7.331 -1.188 8.332 1.00 0.00 O ATOM 0 H TYR B 451 -4.536 1.238 9.039 1.00 0.00 H new ATOM 0 HA TYR B 451 -6.581 -0.022 10.749 1.00 0.00 H new ATOM 0 HB2 TYR B 451 -6.930 2.087 8.608 1.00 0.00 H new ATOM 0 HB3 TYR B 451 -8.197 0.913 8.905 1.00 0.00 H new ATOM 0 HD1 TYR B 451 -6.261 3.680 10.431 1.00 0.00 H new ATOM 0 HD2 TYR B 451 -9.598 1.067 10.867 1.00 0.00 H new ATOM 0 HE1 TYR B 451 -7.089 5.050 12.296 1.00 0.00 H new ATOM 0 HE2 TYR B 451 -10.425 2.432 12.733 1.00 0.00 H new ATOM 0 HH TYR B 451 -10.104 4.203 14.012 1.00 0.00 H new TER 1250 TYR B 451