USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 836 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 106 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 109 MET CE :methyl -173:sc= 0 (180deg=-0.017) USER MOD Set 1.3: A 110 SER OG : rot 95:sc= 0.23 USER MOD Set 2.1: A 65 LYS NZ :NH3+ -127:sc= 0.0951 (180deg=-0.056) USER MOD Set 2.2: A 68 SER OG : rot -51:sc= 1.02 USER MOD Set 3.1: A 34 GLN : amide:sc= -0.887 K(o=-0.024,f=-15!) USER MOD Set 3.2: A 37 LYS NZ :NH3+ -109:sc= 0.863 (180deg=-2.37!) USER MOD Set 4.1: A 20 THR OG1 : rot -109:sc= -0.2 USER MOD Set 4.2: A 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 166:sc= -2.01! USER MOD Single : A 24 SER OG : rot 150:sc= -1.16 USER MOD Single : A 27 SER OG : rot -97:sc= 1.05 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 ASN : amide:sc= -0.254 K(o=-0.25,f=-1.1) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0.0681 K(o=0.068,f=-1.8) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl -151:sc= -1.79 (180deg=-2.61) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -1.56 K(o=-1.6,f=-3!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -153:sc= -8.3! (180deg=-8.77!) USER MOD Single : A 73 THR OG1 : rot 51:sc= -5.48! USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 71:sc= -0.0826 USER MOD Single : A 83 SER OG : rot -47:sc= 1.12 USER MOD Single : A 84 ASN : amide:sc=-0.00485 X(o=-0.0049,f=-0.11) USER MOD Single : A 87 ASN : amide:sc= -2 K(o=-2,f=-6.8!) USER MOD Single : A 92 ASN : amide:sc= -0.133 K(o=-0.13,f=-1.5!) USER MOD Single : A 96 THR OG1 : rot 95:sc= -0.253 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot -132:sc= -0.852 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 HIS : no HD1:sc= -8.57! C(o=-8.6!,f=-12!) USER MOD ----------------------------------------------------------------- ATOM 193 N TYR A 12 -3.264 3.726 14.343 1.00 0.00 N ATOM 194 CA TYR A 12 -3.346 5.067 14.918 1.00 0.00 C ATOM 195 C TYR A 12 -2.736 6.081 13.957 1.00 0.00 C ATOM 196 O TYR A 12 -1.521 6.272 13.931 1.00 0.00 O ATOM 197 CB TYR A 12 -2.631 5.132 16.280 1.00 0.00 C ATOM 198 CG TYR A 12 -2.030 3.816 16.728 1.00 0.00 C ATOM 199 CD1 TYR A 12 -1.075 3.173 15.953 1.00 0.00 C ATOM 200 CD2 TYR A 12 -2.425 3.214 17.915 1.00 0.00 C ATOM 201 CE1 TYR A 12 -0.528 1.968 16.345 1.00 0.00 C ATOM 202 CE2 TYR A 12 -1.882 2.008 18.317 1.00 0.00 C ATOM 203 CZ TYR A 12 -0.934 1.389 17.530 1.00 0.00 C ATOM 204 OH TYR A 12 -0.392 0.188 17.926 1.00 0.00 O ATOM 0 HA TYR A 12 -4.397 5.307 15.077 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -1.841 5.881 16.228 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.341 5.470 17.035 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -0.754 3.624 15.026 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -3.168 3.695 18.534 1.00 0.00 H new ATOM 0 HE1 TYR A 12 0.213 1.481 15.728 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -2.199 1.553 19.244 1.00 0.00 H new ATOM 0 HH TYR A 12 -0.784 -0.081 18.783 1.00 0.00 H new ATOM 214 N GLY A 13 -3.586 6.715 13.157 1.00 0.00 N ATOM 215 CA GLY A 13 -3.114 7.682 12.194 1.00 0.00 C ATOM 216 C GLY A 13 -3.761 7.478 10.843 1.00 0.00 C ATOM 217 O GLY A 13 -3.627 6.416 10.243 1.00 0.00 O ATOM 0 H GLY A 13 -4.596 6.573 13.161 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -3.328 8.689 12.553 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -2.031 7.601 12.096 1.00 0.00 H new ATOM 221 N ILE A 14 -4.477 8.497 10.382 1.00 0.00 N ATOM 222 CA ILE A 14 -5.179 8.456 9.094 1.00 0.00 C ATOM 223 C ILE A 14 -4.454 7.582 8.064 1.00 0.00 C ATOM 224 O ILE A 14 -5.091 6.884 7.275 1.00 0.00 O ATOM 225 CB ILE A 14 -5.363 9.876 8.518 1.00 0.00 C ATOM 226 CG1 ILE A 14 -6.340 9.859 7.335 1.00 0.00 C ATOM 227 CG2 ILE A 14 -4.021 10.473 8.109 1.00 0.00 C ATOM 228 CD1 ILE A 14 -5.760 9.293 6.055 1.00 0.00 C ATOM 0 H ILE A 14 -4.590 9.376 10.886 1.00 0.00 H new ATOM 0 HA ILE A 14 -6.155 8.013 9.290 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.788 10.508 9.298 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -7.217 9.275 7.612 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -6.682 10.877 7.146 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.176 11.474 7.706 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.367 10.529 8.979 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -3.559 9.843 7.349 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -6.516 9.318 5.271 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -4.901 9.890 5.750 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -5.445 8.263 6.223 1.00 0.00 H new ATOM 240 N GLU A 15 -3.124 7.623 8.078 1.00 0.00 N ATOM 241 CA GLU A 15 -2.326 6.832 7.145 1.00 0.00 C ATOM 242 C GLU A 15 -2.684 5.351 7.237 1.00 0.00 C ATOM 243 O GLU A 15 -2.812 4.670 6.222 1.00 0.00 O ATOM 244 CB GLU A 15 -0.835 7.027 7.420 1.00 0.00 C ATOM 245 CG GLU A 15 0.025 6.990 6.168 1.00 0.00 C ATOM 246 CD GLU A 15 1.314 7.773 6.322 1.00 0.00 C ATOM 247 OE1 GLU A 15 1.763 7.957 7.473 1.00 0.00 O ATOM 248 OE2 GLU A 15 1.875 8.202 5.291 1.00 0.00 O ATOM 0 H GLU A 15 -2.577 8.194 8.723 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.549 7.178 6.136 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -0.689 7.983 7.923 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.496 6.251 8.106 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.261 5.954 5.924 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.543 7.394 5.330 1.00 0.00 H new ATOM 255 N GLY A 16 -2.850 4.858 8.459 1.00 0.00 N ATOM 256 CA GLY A 16 -3.201 3.464 8.652 1.00 0.00 C ATOM 257 C GLY A 16 -4.598 3.154 8.153 1.00 0.00 C ATOM 258 O GLY A 16 -4.892 2.021 7.774 1.00 0.00 O ATOM 0 H GLY A 16 -2.748 5.398 9.318 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.482 2.834 8.129 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -3.131 3.216 9.711 1.00 0.00 H new ATOM 262 N ARG A 17 -5.459 4.167 8.150 1.00 0.00 N ATOM 263 CA ARG A 17 -6.832 4.003 7.689 1.00 0.00 C ATOM 264 C ARG A 17 -6.871 3.785 6.182 1.00 0.00 C ATOM 265 O ARG A 17 -7.769 3.119 5.670 1.00 0.00 O ATOM 266 CB ARG A 17 -7.672 5.224 8.064 1.00 0.00 C ATOM 267 CG ARG A 17 -8.344 5.106 9.422 1.00 0.00 C ATOM 268 CD ARG A 17 -9.638 5.901 9.475 1.00 0.00 C ATOM 269 NE ARG A 17 -10.598 5.452 8.470 1.00 0.00 N ATOM 270 CZ ARG A 17 -11.686 6.137 8.124 1.00 0.00 C ATOM 271 NH1 ARG A 17 -11.955 7.302 8.699 1.00 0.00 N ATOM 272 NH2 ARG A 17 -12.506 5.656 7.201 1.00 0.00 N ATOM 0 H ARG A 17 -5.229 5.111 8.462 1.00 0.00 H new ATOM 0 HA ARG A 17 -7.252 3.124 8.178 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -7.035 6.108 8.059 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -8.436 5.377 7.302 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -8.551 4.058 9.637 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -7.665 5.462 10.197 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -10.081 5.807 10.467 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -9.421 6.958 9.322 1.00 0.00 H new ATOM 0 HE ARG A 17 -10.425 4.561 8.006 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -11.327 7.677 9.410 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.790 7.823 8.430 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -12.304 4.761 6.756 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -13.340 6.181 6.936 1.00 0.00 H new ATOM 286 N TYR A 18 -5.885 4.336 5.473 1.00 0.00 N ATOM 287 CA TYR A 18 -5.813 4.180 4.022 1.00 0.00 C ATOM 288 C TYR A 18 -6.015 2.719 3.644 1.00 0.00 C ATOM 289 O TYR A 18 -6.595 2.403 2.605 1.00 0.00 O ATOM 290 CB TYR A 18 -4.459 4.663 3.497 1.00 0.00 C ATOM 291 CG TYR A 18 -4.497 6.032 2.863 1.00 0.00 C ATOM 292 CD1 TYR A 18 -5.242 7.062 3.422 1.00 0.00 C ATOM 293 CD2 TYR A 18 -3.780 6.295 1.703 1.00 0.00 C ATOM 294 CE1 TYR A 18 -5.273 8.316 2.844 1.00 0.00 C ATOM 295 CE2 TYR A 18 -3.804 7.545 1.119 1.00 0.00 C ATOM 296 CZ TYR A 18 -4.551 8.553 1.691 1.00 0.00 C ATOM 297 OH TYR A 18 -4.578 9.800 1.112 1.00 0.00 O ATOM 0 H TYR A 18 -5.130 4.890 5.878 1.00 0.00 H new ATOM 0 HA TYR A 18 -6.601 4.783 3.571 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -3.745 4.676 4.321 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -4.088 3.945 2.765 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -5.807 6.879 4.324 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.194 5.508 1.251 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -5.858 9.106 3.291 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -3.240 7.733 0.217 1.00 0.00 H new ATOM 0 HH TYR A 18 -4.017 9.800 0.309 1.00 0.00 H new ATOM 307 N ALA A 19 -5.536 1.837 4.510 1.00 0.00 N ATOM 308 CA ALA A 19 -5.661 0.406 4.294 1.00 0.00 C ATOM 309 C ALA A 19 -7.082 -0.055 4.591 1.00 0.00 C ATOM 310 O ALA A 19 -7.666 -0.825 3.832 1.00 0.00 O ATOM 311 CB ALA A 19 -4.660 -0.341 5.164 1.00 0.00 C ATOM 0 H ALA A 19 -5.055 2.091 5.373 1.00 0.00 H new ATOM 0 HA ALA A 19 -5.445 0.187 3.248 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.761 -1.413 4.996 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.649 -0.027 4.907 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -4.853 -0.119 6.213 1.00 0.00 H new ATOM 317 N THR A 20 -7.635 0.429 5.697 1.00 0.00 N ATOM 318 CA THR A 20 -8.991 0.068 6.086 1.00 0.00 C ATOM 319 C THR A 20 -10.013 0.701 5.149 1.00 0.00 C ATOM 320 O THR A 20 -11.121 0.189 4.993 1.00 0.00 O ATOM 321 CB THR A 20 -9.269 0.482 7.534 1.00 0.00 C ATOM 322 OG1 THR A 20 -8.138 1.115 8.103 1.00 0.00 O ATOM 323 CG2 THR A 20 -9.633 -0.689 8.420 1.00 0.00 C ATOM 0 H THR A 20 -7.167 1.070 6.337 1.00 0.00 H new ATOM 0 HA THR A 20 -9.083 -1.016 6.012 1.00 0.00 H new ATOM 0 HB THR A 20 -10.116 1.166 7.486 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.734 0.523 8.772 1.00 0.00 H new ATOM 0 HG21 THR A 20 -9.819 -0.334 9.434 1.00 0.00 H new ATOM 0 HG22 THR A 20 -10.531 -1.172 8.034 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.812 -1.406 8.431 1.00 0.00 H new ATOM 331 N ALA A 21 -9.634 1.809 4.519 1.00 0.00 N ATOM 332 CA ALA A 21 -10.527 2.489 3.592 1.00 0.00 C ATOM 333 C ALA A 21 -10.313 2.001 2.164 1.00 0.00 C ATOM 334 O ALA A 21 -10.989 2.450 1.238 1.00 0.00 O ATOM 335 CB ALA A 21 -10.341 3.996 3.680 1.00 0.00 C ATOM 0 H ALA A 21 -8.722 2.251 4.633 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.552 2.251 3.875 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.017 4.487 2.980 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.562 4.331 4.693 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.311 4.251 3.430 1.00 0.00 H new ATOM 341 N LEU A 22 -9.389 1.061 1.995 1.00 0.00 N ATOM 342 CA LEU A 22 -9.114 0.492 0.682 1.00 0.00 C ATOM 343 C LEU A 22 -9.473 -0.971 0.706 1.00 0.00 C ATOM 344 O LEU A 22 -10.081 -1.496 -0.226 1.00 0.00 O ATOM 345 CB LEU A 22 -7.647 0.686 0.294 1.00 0.00 C ATOM 346 CG LEU A 22 -7.237 0.067 -1.047 1.00 0.00 C ATOM 347 CD1 LEU A 22 -6.950 -1.419 -0.887 1.00 0.00 C ATOM 348 CD2 LEU A 22 -8.314 0.297 -2.100 1.00 0.00 C ATOM 0 H LEU A 22 -8.819 0.678 2.750 1.00 0.00 H new ATOM 0 HA LEU A 22 -9.716 1.005 -0.068 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.435 1.755 0.262 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -7.021 0.260 1.078 1.00 0.00 H new ATOM 0 HG LEU A 22 -6.323 0.557 -1.383 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.661 -1.839 -1.850 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.139 -1.558 -0.172 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.844 -1.925 -0.524 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -8.002 -0.151 -3.044 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -9.247 -0.161 -1.772 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -8.465 1.368 -2.239 1.00 0.00 H new ATOM 360 N TYR A 23 -9.136 -1.614 1.809 1.00 0.00 N ATOM 361 CA TYR A 23 -9.468 -3.000 1.988 1.00 0.00 C ATOM 362 C TYR A 23 -10.936 -3.104 2.398 1.00 0.00 C ATOM 363 O TYR A 23 -11.551 -4.155 2.249 1.00 0.00 O ATOM 364 CB TYR A 23 -8.542 -3.637 3.022 1.00 0.00 C ATOM 365 CG TYR A 23 -9.238 -4.132 4.259 1.00 0.00 C ATOM 366 CD1 TYR A 23 -10.085 -5.229 4.204 1.00 0.00 C ATOM 367 CD2 TYR A 23 -9.064 -3.492 5.474 1.00 0.00 C ATOM 368 CE1 TYR A 23 -10.735 -5.681 5.327 1.00 0.00 C ATOM 369 CE2 TYR A 23 -9.712 -3.930 6.599 1.00 0.00 C ATOM 370 CZ TYR A 23 -10.548 -5.026 6.527 1.00 0.00 C ATOM 371 OH TYR A 23 -11.203 -5.459 7.651 1.00 0.00 O ATOM 0 H TYR A 23 -8.633 -1.192 2.589 1.00 0.00 H new ATOM 0 HA TYR A 23 -9.328 -3.545 1.055 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -8.018 -4.472 2.557 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -7.786 -2.908 3.313 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -10.236 -5.736 3.263 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -8.409 -2.636 5.536 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.386 -6.541 5.271 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -9.569 -3.419 7.540 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.799 -5.048 8.444 1.00 0.00 H new ATOM 381 N SER A 24 -11.508 -1.991 2.884 1.00 0.00 N ATOM 382 CA SER A 24 -12.914 -1.978 3.266 1.00 0.00 C ATOM 383 C SER A 24 -13.735 -2.549 2.119 1.00 0.00 C ATOM 384 O SER A 24 -14.729 -3.246 2.326 1.00 0.00 O ATOM 385 CB SER A 24 -13.374 -0.558 3.597 1.00 0.00 C ATOM 386 OG SER A 24 -12.616 0.404 2.883 1.00 0.00 O ATOM 0 H SER A 24 -11.021 -1.105 3.017 1.00 0.00 H new ATOM 0 HA SER A 24 -13.053 -2.587 4.159 1.00 0.00 H new ATOM 0 HB2 SER A 24 -14.430 -0.448 3.352 1.00 0.00 H new ATOM 0 HB3 SER A 24 -13.276 -0.381 4.668 1.00 0.00 H new ATOM 0 HG SER A 24 -13.169 1.195 2.711 1.00 0.00 H new ATOM 392 N ALA A 25 -13.268 -2.277 0.902 1.00 0.00 N ATOM 393 CA ALA A 25 -13.904 -2.791 -0.296 1.00 0.00 C ATOM 394 C ALA A 25 -13.450 -4.225 -0.518 1.00 0.00 C ATOM 395 O ALA A 25 -14.214 -5.069 -0.985 1.00 0.00 O ATOM 396 CB ALA A 25 -13.563 -1.924 -1.500 1.00 0.00 C ATOM 0 H ALA A 25 -12.446 -1.699 0.726 1.00 0.00 H new ATOM 0 HA ALA A 25 -14.987 -2.769 -0.171 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.050 -2.327 -2.388 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.911 -0.906 -1.326 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.483 -1.918 -1.650 1.00 0.00 H new ATOM 402 N ALA A 26 -12.197 -4.496 -0.147 1.00 0.00 N ATOM 403 CA ALA A 26 -11.639 -5.833 -0.272 1.00 0.00 C ATOM 404 C ALA A 26 -12.268 -6.776 0.751 1.00 0.00 C ATOM 405 O ALA A 26 -12.172 -7.995 0.622 1.00 0.00 O ATOM 406 CB ALA A 26 -10.130 -5.792 -0.094 1.00 0.00 C ATOM 0 H ALA A 26 -11.555 -3.805 0.241 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.864 -6.209 -1.270 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -9.725 -6.799 -0.190 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.691 -5.150 -0.858 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -9.891 -5.397 0.893 1.00 0.00 H new ATOM 412 N SER A 27 -12.912 -6.202 1.765 1.00 0.00 N ATOM 413 CA SER A 27 -13.561 -6.989 2.806 1.00 0.00 C ATOM 414 C SER A 27 -14.858 -7.589 2.282 1.00 0.00 C ATOM 415 O SER A 27 -15.109 -8.784 2.438 1.00 0.00 O ATOM 416 CB SER A 27 -13.843 -6.121 4.034 1.00 0.00 C ATOM 417 OG SER A 27 -14.978 -5.298 3.828 1.00 0.00 O ATOM 0 H SER A 27 -12.997 -5.193 1.886 1.00 0.00 H new ATOM 0 HA SER A 27 -12.890 -7.798 3.096 1.00 0.00 H new ATOM 0 HB2 SER A 27 -14.005 -6.758 4.904 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.974 -5.500 4.251 1.00 0.00 H new ATOM 0 HG SER A 27 -14.688 -4.408 3.537 1.00 0.00 H new ATOM 423 N LYS A 28 -15.674 -6.754 1.642 1.00 0.00 N ATOM 424 CA LYS A 28 -16.938 -7.208 1.078 1.00 0.00 C ATOM 425 C LYS A 28 -16.699 -8.385 0.140 1.00 0.00 C ATOM 426 O LYS A 28 -17.546 -9.267 -0.002 1.00 0.00 O ATOM 427 CB LYS A 28 -17.628 -6.068 0.325 1.00 0.00 C ATOM 428 CG LYS A 28 -18.551 -5.234 1.199 1.00 0.00 C ATOM 429 CD LYS A 28 -19.680 -4.619 0.389 1.00 0.00 C ATOM 430 CE LYS A 28 -20.045 -3.235 0.901 1.00 0.00 C ATOM 431 NZ LYS A 28 -21.130 -3.288 1.918 1.00 0.00 N ATOM 0 H LYS A 28 -15.481 -5.762 1.503 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.587 -7.529 1.893 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -16.868 -5.419 -0.110 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -18.203 -6.485 -0.502 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -18.967 -5.858 1.990 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -17.978 -4.444 1.685 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -19.384 -4.554 -0.658 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -20.555 -5.267 0.433 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -19.163 -2.764 1.335 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -20.361 -2.610 0.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -21.350 -2.324 2.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -21.980 -3.714 1.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -20.820 -3.863 2.727 1.00 0.00 H new ATOM 445 N GLN A 29 -15.525 -8.394 -0.486 1.00 0.00 N ATOM 446 CA GLN A 29 -15.151 -9.463 -1.398 1.00 0.00 C ATOM 447 C GLN A 29 -14.409 -10.561 -0.646 1.00 0.00 C ATOM 448 O GLN A 29 -14.724 -11.741 -0.793 1.00 0.00 O ATOM 449 CB GLN A 29 -14.276 -8.918 -2.529 1.00 0.00 C ATOM 450 CG GLN A 29 -15.069 -8.273 -3.654 1.00 0.00 C ATOM 451 CD GLN A 29 -14.344 -8.329 -4.984 1.00 0.00 C ATOM 452 OE1 GLN A 29 -14.544 -9.253 -5.775 1.00 0.00 O ATOM 453 NE2 GLN A 29 -13.496 -7.340 -5.240 1.00 0.00 N ATOM 0 H GLN A 29 -14.816 -7.669 -0.375 1.00 0.00 H new ATOM 0 HA GLN A 29 -16.059 -9.883 -1.830 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.581 -8.185 -2.119 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -13.677 -9.731 -2.938 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -16.032 -8.774 -3.748 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -15.274 -7.233 -3.399 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -13.361 -6.595 -4.557 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -12.980 -7.326 -6.120 1.00 0.00 H new ATOM 462 N ASN A 30 -13.417 -10.151 0.157 1.00 0.00 N ATOM 463 CA ASN A 30 -12.597 -11.072 0.953 1.00 0.00 C ATOM 464 C ASN A 30 -11.220 -11.206 0.329 1.00 0.00 C ATOM 465 O ASN A 30 -10.589 -12.261 0.400 1.00 0.00 O ATOM 466 CB ASN A 30 -13.247 -12.455 1.091 1.00 0.00 C ATOM 467 CG ASN A 30 -12.616 -13.280 2.195 1.00 0.00 C ATOM 468 OD1 ASN A 30 -12.235 -12.754 3.241 1.00 0.00 O ATOM 469 ND2 ASN A 30 -12.502 -14.584 1.968 1.00 0.00 N ATOM 0 H ASN A 30 -13.161 -9.170 0.272 1.00 0.00 H new ATOM 0 HA ASN A 30 -12.510 -10.652 1.955 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -14.311 -12.335 1.293 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -13.160 -12.991 0.146 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -12.086 -15.190 2.675 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -12.831 -14.979 1.087 1.00 0.00 H new ATOM 476 N LYS A 31 -10.764 -10.123 -0.288 1.00 0.00 N ATOM 477 CA LYS A 31 -9.466 -10.106 -0.933 1.00 0.00 C ATOM 478 C LYS A 31 -8.368 -9.690 0.041 1.00 0.00 C ATOM 479 O LYS A 31 -7.227 -9.484 -0.366 1.00 0.00 O ATOM 480 CB LYS A 31 -9.488 -9.165 -2.138 1.00 0.00 C ATOM 481 CG LYS A 31 -10.151 -9.769 -3.366 1.00 0.00 C ATOM 482 CD LYS A 31 -9.125 -10.168 -4.417 1.00 0.00 C ATOM 483 CE LYS A 31 -9.476 -11.499 -5.061 1.00 0.00 C ATOM 484 NZ LYS A 31 -9.083 -11.543 -6.497 1.00 0.00 N ATOM 0 H LYS A 31 -11.279 -9.245 -0.353 1.00 0.00 H new ATOM 0 HA LYS A 31 -9.247 -11.118 -1.274 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -10.013 -8.249 -1.865 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.465 -8.884 -2.388 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.732 -10.644 -3.073 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -10.850 -9.050 -3.793 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -9.069 -9.395 -5.184 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -8.139 -10.234 -3.958 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -8.977 -12.305 -4.523 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -10.548 -11.673 -4.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -9.340 -12.467 -6.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -9.579 -10.790 -7.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -8.056 -11.402 -6.580 1.00 0.00 H new ATOM 498 N LEU A 32 -8.707 -9.578 1.333 1.00 0.00 N ATOM 499 CA LEU A 32 -7.730 -9.203 2.350 1.00 0.00 C ATOM 500 C LEU A 32 -6.415 -9.937 2.125 1.00 0.00 C ATOM 501 O LEU A 32 -5.343 -9.408 2.403 1.00 0.00 O ATOM 502 CB LEU A 32 -8.278 -9.519 3.739 1.00 0.00 C ATOM 503 CG LEU A 32 -9.094 -8.395 4.366 1.00 0.00 C ATOM 504 CD1 LEU A 32 -9.878 -8.906 5.562 1.00 0.00 C ATOM 505 CD2 LEU A 32 -8.180 -7.249 4.764 1.00 0.00 C ATOM 0 H LEU A 32 -9.648 -9.742 1.692 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.543 -8.132 2.276 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.900 -10.412 3.676 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.444 -9.758 4.399 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.809 -8.027 3.631 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -10.454 -8.089 5.996 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.556 -9.697 5.242 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -9.188 -9.299 6.308 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.772 -6.450 5.211 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.445 -7.604 5.486 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.667 -6.869 3.881 1.00 0.00 H new ATOM 517 N GLU A 33 -6.509 -11.153 1.599 1.00 0.00 N ATOM 518 CA GLU A 33 -5.325 -11.954 1.312 1.00 0.00 C ATOM 519 C GLU A 33 -4.541 -11.333 0.161 1.00 0.00 C ATOM 520 O GLU A 33 -3.317 -11.221 0.213 1.00 0.00 O ATOM 521 CB GLU A 33 -5.722 -13.390 0.964 1.00 0.00 C ATOM 522 CG GLU A 33 -4.617 -14.404 1.213 1.00 0.00 C ATOM 523 CD GLU A 33 -4.772 -15.119 2.541 1.00 0.00 C ATOM 524 OE1 GLU A 33 -5.854 -15.695 2.783 1.00 0.00 O ATOM 525 OE2 GLU A 33 -3.812 -15.104 3.340 1.00 0.00 O ATOM 0 H GLU A 33 -7.392 -11.605 1.363 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.694 -11.974 2.201 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.598 -13.668 1.550 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.014 -13.433 -0.085 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.614 -15.138 0.407 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.652 -13.898 1.187 1.00 0.00 H new ATOM 532 N GLN A 34 -5.267 -10.916 -0.874 1.00 0.00 N ATOM 533 CA GLN A 34 -4.662 -10.286 -2.041 1.00 0.00 C ATOM 534 C GLN A 34 -4.222 -8.862 -1.719 1.00 0.00 C ATOM 535 O GLN A 34 -3.352 -8.303 -2.389 1.00 0.00 O ATOM 536 CB GLN A 34 -5.651 -10.277 -3.208 1.00 0.00 C ATOM 537 CG GLN A 34 -5.091 -9.657 -4.476 1.00 0.00 C ATOM 538 CD GLN A 34 -3.783 -10.292 -4.908 1.00 0.00 C ATOM 539 OE1 GLN A 34 -3.439 -11.391 -4.473 1.00 0.00 O ATOM 540 NE2 GLN A 34 -3.046 -9.600 -5.769 1.00 0.00 N ATOM 0 H GLN A 34 -6.282 -11.005 -0.926 1.00 0.00 H new ATOM 0 HA GLN A 34 -3.782 -10.864 -2.324 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -5.959 -11.301 -3.420 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -6.546 -9.730 -2.911 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -5.822 -9.758 -5.278 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -4.937 -8.590 -4.317 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -3.370 -8.693 -6.104 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -2.156 -9.976 -6.096 1.00 0.00 H new ATOM 549 N VAL A 35 -4.827 -8.279 -0.689 1.00 0.00 N ATOM 550 CA VAL A 35 -4.498 -6.921 -0.276 1.00 0.00 C ATOM 551 C VAL A 35 -3.555 -6.922 0.929 1.00 0.00 C ATOM 552 O VAL A 35 -3.022 -5.882 1.307 1.00 0.00 O ATOM 553 CB VAL A 35 -5.761 -6.105 0.095 1.00 0.00 C ATOM 554 CG1 VAL A 35 -5.647 -4.684 -0.436 1.00 0.00 C ATOM 555 CG2 VAL A 35 -7.042 -6.775 -0.409 1.00 0.00 C ATOM 0 H VAL A 35 -5.549 -8.727 -0.125 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.009 -6.454 -1.131 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.825 -6.069 1.183 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.542 -4.122 -0.168 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.772 -4.202 -0.000 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.546 -4.708 -1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -7.904 -6.170 -0.128 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.002 -6.867 -1.494 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.133 -7.766 0.036 1.00 0.00 H new ATOM 565 N GLU A 36 -3.349 -8.091 1.528 1.00 0.00 N ATOM 566 CA GLU A 36 -2.464 -8.212 2.683 1.00 0.00 C ATOM 567 C GLU A 36 -1.069 -8.632 2.241 1.00 0.00 C ATOM 568 O GLU A 36 -0.084 -8.373 2.933 1.00 0.00 O ATOM 569 CB GLU A 36 -3.021 -9.222 3.689 1.00 0.00 C ATOM 570 CG GLU A 36 -2.115 -9.451 4.890 1.00 0.00 C ATOM 571 CD GLU A 36 -1.331 -10.745 4.790 1.00 0.00 C ATOM 572 OE1 GLU A 36 -1.955 -11.801 4.556 1.00 0.00 O ATOM 573 OE2 GLU A 36 -0.093 -10.702 4.947 1.00 0.00 O ATOM 0 H GLU A 36 -3.782 -8.967 1.234 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.403 -7.238 3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.993 -8.875 4.039 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.186 -10.173 3.183 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.421 -8.616 4.981 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.718 -9.465 5.798 1.00 0.00 H new ATOM 580 N LYS A 37 -0.990 -9.262 1.074 1.00 0.00 N ATOM 581 CA LYS A 37 0.288 -9.692 0.534 1.00 0.00 C ATOM 582 C LYS A 37 0.953 -8.521 -0.158 1.00 0.00 C ATOM 583 O LYS A 37 2.168 -8.339 -0.076 1.00 0.00 O ATOM 584 CB LYS A 37 0.099 -10.854 -0.445 1.00 0.00 C ATOM 585 CG LYS A 37 -0.817 -10.524 -1.612 1.00 0.00 C ATOM 586 CD LYS A 37 -0.809 -11.629 -2.655 1.00 0.00 C ATOM 587 CE LYS A 37 -1.414 -12.915 -2.113 1.00 0.00 C ATOM 588 NZ LYS A 37 -2.758 -13.184 -2.695 1.00 0.00 N ATOM 0 H LYS A 37 -1.795 -9.484 0.488 1.00 0.00 H new ATOM 0 HA LYS A 37 0.922 -10.041 1.349 1.00 0.00 H new ATOM 0 HB2 LYS A 37 1.073 -11.154 -0.832 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -0.307 -11.710 0.094 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -1.833 -10.374 -1.247 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -0.501 -9.587 -2.070 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -1.368 -11.305 -3.533 1.00 0.00 H new ATOM 0 HD3 LYS A 37 0.215 -11.816 -2.980 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -0.749 -13.750 -2.333 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -1.495 -12.849 -1.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -3.487 -13.038 -1.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -2.928 -12.536 -3.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.799 -14.166 -3.034 1.00 0.00 H new ATOM 602 N GLU A 38 0.138 -7.714 -0.828 1.00 0.00 N ATOM 603 CA GLU A 38 0.633 -6.542 -1.522 1.00 0.00 C ATOM 604 C GLU A 38 1.380 -5.616 -0.570 1.00 0.00 C ATOM 605 O GLU A 38 2.494 -5.179 -0.854 1.00 0.00 O ATOM 606 CB GLU A 38 -0.529 -5.783 -2.144 1.00 0.00 C ATOM 607 CG GLU A 38 -1.689 -5.543 -1.195 1.00 0.00 C ATOM 608 CD GLU A 38 -1.617 -4.190 -0.512 1.00 0.00 C ATOM 609 OE1 GLU A 38 -0.575 -3.513 -0.640 1.00 0.00 O ATOM 610 OE2 GLU A 38 -2.607 -3.801 0.142 1.00 0.00 O ATOM 0 H GLU A 38 -0.870 -7.855 -0.902 1.00 0.00 H new ATOM 0 HA GLU A 38 1.321 -6.875 -2.299 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.167 -4.822 -2.510 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.890 -6.338 -3.010 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.626 -5.617 -1.747 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.702 -6.327 -0.438 1.00 0.00 H new ATOM 617 N LEU A 39 0.752 -5.311 0.558 1.00 0.00 N ATOM 618 CA LEU A 39 1.348 -4.424 1.546 1.00 0.00 C ATOM 619 C LEU A 39 2.767 -4.862 1.888 1.00 0.00 C ATOM 620 O LEU A 39 3.617 -4.037 2.220 1.00 0.00 O ATOM 621 CB LEU A 39 0.485 -4.379 2.805 1.00 0.00 C ATOM 622 CG LEU A 39 -0.948 -3.886 2.596 1.00 0.00 C ATOM 623 CD1 LEU A 39 -1.725 -3.937 3.902 1.00 0.00 C ATOM 624 CD2 LEU A 39 -0.956 -2.475 2.025 1.00 0.00 C ATOM 0 H LEU A 39 -0.170 -5.665 0.811 1.00 0.00 H new ATOM 0 HA LEU A 39 1.398 -3.422 1.119 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.449 -5.379 3.237 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.971 -3.733 3.536 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.434 -4.547 1.878 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.742 -3.583 3.734 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.754 -4.963 4.268 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.237 -3.302 4.641 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -1.985 -2.145 1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -0.450 -1.800 2.715 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -0.439 -2.468 1.066 1.00 0.00 H new ATOM 636 N LEU A 40 3.023 -6.163 1.789 1.00 0.00 N ATOM 637 CA LEU A 40 4.349 -6.694 2.075 1.00 0.00 C ATOM 638 C LEU A 40 5.330 -6.286 0.982 1.00 0.00 C ATOM 639 O LEU A 40 6.531 -6.161 1.226 1.00 0.00 O ATOM 640 CB LEU A 40 4.301 -8.218 2.200 1.00 0.00 C ATOM 641 CG LEU A 40 5.298 -8.817 3.193 1.00 0.00 C ATOM 642 CD1 LEU A 40 4.894 -8.485 4.621 1.00 0.00 C ATOM 643 CD2 LEU A 40 5.398 -10.323 3.002 1.00 0.00 C ATOM 0 H LEU A 40 2.334 -6.864 1.515 1.00 0.00 H new ATOM 0 HA LEU A 40 4.689 -6.279 3.024 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.294 -8.512 2.497 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.483 -8.654 1.218 1.00 0.00 H new ATOM 0 HG LEU A 40 6.278 -8.380 3.004 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.615 -8.919 5.313 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.873 -7.403 4.751 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.904 -8.894 4.824 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.112 -10.734 3.716 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.420 -10.776 3.165 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.734 -10.540 1.988 1.00 0.00 H new ATOM 655 N ARG A 41 4.810 -6.070 -0.222 1.00 0.00 N ATOM 656 CA ARG A 41 5.638 -5.665 -1.350 1.00 0.00 C ATOM 657 C ARG A 41 6.055 -4.206 -1.208 1.00 0.00 C ATOM 658 O ARG A 41 7.244 -3.887 -1.221 1.00 0.00 O ATOM 659 CB ARG A 41 4.888 -5.873 -2.667 1.00 0.00 C ATOM 660 CG ARG A 41 5.131 -7.234 -3.296 1.00 0.00 C ATOM 661 CD ARG A 41 4.764 -8.361 -2.344 1.00 0.00 C ATOM 662 NE ARG A 41 5.922 -8.840 -1.592 1.00 0.00 N ATOM 663 CZ ARG A 41 5.892 -9.894 -0.779 1.00 0.00 C ATOM 664 NH1 ARG A 41 4.768 -10.580 -0.610 1.00 0.00 N ATOM 665 NH2 ARG A 41 6.990 -10.263 -0.133 1.00 0.00 N ATOM 0 H ARG A 41 3.819 -6.169 -0.441 1.00 0.00 H new ATOM 0 HA ARG A 41 6.534 -6.285 -1.358 1.00 0.00 H new ATOM 0 HB2 ARG A 41 3.820 -5.749 -2.491 1.00 0.00 H new ATOM 0 HB3 ARG A 41 5.187 -5.097 -3.372 1.00 0.00 H new ATOM 0 HG2 ARG A 41 4.545 -7.323 -4.210 1.00 0.00 H new ATOM 0 HG3 ARG A 41 6.180 -7.323 -3.580 1.00 0.00 H new ATOM 0 HD2 ARG A 41 3.999 -8.014 -1.650 1.00 0.00 H new ATOM 0 HD3 ARG A 41 4.332 -9.187 -2.909 1.00 0.00 H new ATOM 0 HE ARG A 41 6.804 -8.338 -1.696 1.00 0.00 H new ATOM 0 HH11 ARG A 41 3.921 -10.301 -1.104 1.00 0.00 H new ATOM 0 HH12 ARG A 41 4.752 -11.387 0.014 1.00 0.00 H new ATOM 0 HH21 ARG A 41 7.856 -9.739 -0.259 1.00 0.00 H new ATOM 0 HH22 ARG A 41 6.968 -11.070 0.490 1.00 0.00 H new ATOM 679 N VAL A 42 5.072 -3.321 -1.061 1.00 0.00 N ATOM 680 CA VAL A 42 5.349 -1.899 -0.905 1.00 0.00 C ATOM 681 C VAL A 42 6.143 -1.641 0.373 1.00 0.00 C ATOM 682 O VAL A 42 6.792 -0.603 0.512 1.00 0.00 O ATOM 683 CB VAL A 42 4.053 -1.064 -0.872 1.00 0.00 C ATOM 684 CG1 VAL A 42 4.372 0.425 -0.858 1.00 0.00 C ATOM 685 CG2 VAL A 42 3.159 -1.412 -2.055 1.00 0.00 C ATOM 0 H VAL A 42 4.081 -3.564 -1.047 1.00 0.00 H new ATOM 0 HA VAL A 42 5.937 -1.593 -1.771 1.00 0.00 H new ATOM 0 HB VAL A 42 3.515 -1.305 0.045 1.00 0.00 H new ATOM 0 HG11 VAL A 42 3.444 0.996 -0.835 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.966 0.662 0.025 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.935 0.685 -1.754 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.250 -0.812 -2.013 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.688 -1.204 -2.985 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.898 -2.469 -2.015 1.00 0.00 H new ATOM 695 N GLY A 43 6.093 -2.592 1.305 1.00 0.00 N ATOM 696 CA GLY A 43 6.818 -2.444 2.553 1.00 0.00 C ATOM 697 C GLY A 43 8.294 -2.744 2.398 1.00 0.00 C ATOM 698 O GLY A 43 9.139 -2.045 2.957 1.00 0.00 O ATOM 0 H GLY A 43 5.564 -3.460 1.216 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.693 -1.427 2.925 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.390 -3.112 3.301 1.00 0.00 H new ATOM 702 N GLN A 44 8.607 -3.784 1.630 1.00 0.00 N ATOM 703 CA GLN A 44 9.993 -4.171 1.398 1.00 0.00 C ATOM 704 C GLN A 44 10.667 -3.198 0.437 1.00 0.00 C ATOM 705 O GLN A 44 11.865 -2.934 0.543 1.00 0.00 O ATOM 706 CB GLN A 44 10.062 -5.593 0.837 1.00 0.00 C ATOM 707 CG GLN A 44 9.976 -6.673 1.902 1.00 0.00 C ATOM 708 CD GLN A 44 9.938 -8.070 1.314 1.00 0.00 C ATOM 709 OE1 GLN A 44 9.508 -8.267 0.178 1.00 0.00 O ATOM 710 NE2 GLN A 44 10.390 -9.049 2.089 1.00 0.00 N ATOM 0 H GLN A 44 7.920 -4.372 1.159 1.00 0.00 H new ATOM 0 HA GLN A 44 10.521 -4.142 2.351 1.00 0.00 H new ATOM 0 HB2 GLN A 44 9.250 -5.733 0.124 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.995 -5.712 0.286 1.00 0.00 H new ATOM 0 HG2 GLN A 44 10.832 -6.588 2.571 1.00 0.00 H new ATOM 0 HG3 GLN A 44 9.083 -6.512 2.506 1.00 0.00 H new ATOM 0 HE21 GLN A 44 10.738 -8.839 3.025 1.00 0.00 H new ATOM 0 HE22 GLN A 44 10.390 -10.010 1.748 1.00 0.00 H new ATOM 719 N ILE A 45 9.886 -2.664 -0.495 1.00 0.00 N ATOM 720 CA ILE A 45 10.401 -1.715 -1.474 1.00 0.00 C ATOM 721 C ILE A 45 10.746 -0.387 -0.809 1.00 0.00 C ATOM 722 O ILE A 45 11.705 0.280 -1.194 1.00 0.00 O ATOM 723 CB ILE A 45 9.378 -1.471 -2.605 1.00 0.00 C ATOM 724 CG1 ILE A 45 8.997 -2.793 -3.270 1.00 0.00 C ATOM 725 CG2 ILE A 45 9.933 -0.497 -3.638 1.00 0.00 C ATOM 726 CD1 ILE A 45 7.625 -2.777 -3.907 1.00 0.00 C ATOM 0 H ILE A 45 8.892 -2.873 -0.593 1.00 0.00 H new ATOM 0 HA ILE A 45 11.305 -2.147 -1.904 1.00 0.00 H new ATOM 0 HB ILE A 45 8.483 -1.029 -2.167 1.00 0.00 H new ATOM 0 HG12 ILE A 45 9.739 -3.034 -4.031 1.00 0.00 H new ATOM 0 HG13 ILE A 45 9.034 -3.588 -2.526 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.195 -0.341 -4.424 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.157 0.455 -3.157 1.00 0.00 H new ATOM 0 HG23 ILE A 45 10.844 -0.908 -4.072 1.00 0.00 H new ATOM 0 HD11 ILE A 45 7.422 -3.748 -4.359 1.00 0.00 H new ATOM 0 HD12 ILE A 45 6.873 -2.567 -3.146 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.589 -2.004 -4.675 1.00 0.00 H new ATOM 738 N LEU A 46 9.960 -0.011 0.192 1.00 0.00 N ATOM 739 CA LEU A 46 10.185 1.238 0.910 1.00 0.00 C ATOM 740 C LEU A 46 11.406 1.129 1.817 1.00 0.00 C ATOM 741 O LEU A 46 12.250 2.024 1.851 1.00 0.00 O ATOM 742 CB LEU A 46 8.950 1.602 1.737 1.00 0.00 C ATOM 743 CG LEU A 46 8.301 2.938 1.375 1.00 0.00 C ATOM 744 CD1 LEU A 46 9.335 4.054 1.373 1.00 0.00 C ATOM 745 CD2 LEU A 46 7.612 2.844 0.022 1.00 0.00 C ATOM 0 H LEU A 46 9.162 -0.552 0.525 1.00 0.00 H new ATOM 0 HA LEU A 46 10.368 2.024 0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.208 0.812 1.622 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.230 1.625 2.790 1.00 0.00 H new ATOM 0 HG LEU A 46 7.550 3.171 2.129 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.853 4.996 1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 46 9.783 4.137 2.363 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.111 3.830 0.641 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.155 3.803 -0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.345 2.587 -0.743 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.841 2.074 0.059 1.00 0.00 H new ATOM 757 N LYS A 47 11.491 0.025 2.549 1.00 0.00 N ATOM 758 CA LYS A 47 12.607 -0.207 3.457 1.00 0.00 C ATOM 759 C LYS A 47 13.880 -0.534 2.683 1.00 0.00 C ATOM 760 O LYS A 47 14.986 -0.388 3.203 1.00 0.00 O ATOM 761 CB LYS A 47 12.277 -1.346 4.424 1.00 0.00 C ATOM 762 CG LYS A 47 11.160 -1.012 5.398 1.00 0.00 C ATOM 763 CD LYS A 47 10.525 -2.270 5.970 1.00 0.00 C ATOM 764 CE LYS A 47 11.354 -2.845 7.107 1.00 0.00 C ATOM 765 NZ LYS A 47 10.505 -3.527 8.123 1.00 0.00 N ATOM 0 H LYS A 47 10.799 -0.725 2.531 1.00 0.00 H new ATOM 0 HA LYS A 47 12.775 0.707 4.027 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.995 -2.229 3.850 1.00 0.00 H new ATOM 0 HB3 LYS A 47 13.174 -1.605 4.987 1.00 0.00 H new ATOM 0 HG2 LYS A 47 11.554 -0.401 6.210 1.00 0.00 H new ATOM 0 HG3 LYS A 47 10.400 -0.417 4.891 1.00 0.00 H new ATOM 0 HD2 LYS A 47 9.522 -2.041 6.329 1.00 0.00 H new ATOM 0 HD3 LYS A 47 10.419 -3.016 5.182 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.079 -3.553 6.706 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.920 -2.045 7.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 11.108 -3.905 8.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 9.830 -2.846 8.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 9.984 -4.307 7.673 1.00 0.00 H new ATOM 779 N GLU A 48 13.720 -0.978 1.439 1.00 0.00 N ATOM 780 CA GLU A 48 14.862 -1.324 0.602 1.00 0.00 C ATOM 781 C GLU A 48 15.799 -0.127 0.439 1.00 0.00 C ATOM 782 O GLU A 48 15.347 1.007 0.284 1.00 0.00 O ATOM 783 CB GLU A 48 14.387 -1.810 -0.769 1.00 0.00 C ATOM 784 CG GLU A 48 14.420 -3.322 -0.924 1.00 0.00 C ATOM 785 CD GLU A 48 13.856 -3.785 -2.253 1.00 0.00 C ATOM 786 OE1 GLU A 48 13.118 -3.003 -2.889 1.00 0.00 O ATOM 787 OE2 GLU A 48 14.153 -4.928 -2.657 1.00 0.00 O ATOM 0 H GLU A 48 12.813 -1.106 0.991 1.00 0.00 H new ATOM 0 HA GLU A 48 15.412 -2.128 1.092 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.369 -1.458 -0.937 1.00 0.00 H new ATOM 0 HB3 GLU A 48 15.011 -1.360 -1.541 1.00 0.00 H new ATOM 0 HG2 GLU A 48 15.448 -3.671 -0.829 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.852 -3.779 -0.114 1.00 0.00 H new ATOM 794 N PRO A 49 17.123 -0.365 0.473 1.00 0.00 N ATOM 795 CA PRO A 49 18.118 0.703 0.330 1.00 0.00 C ATOM 796 C PRO A 49 18.189 1.240 -1.096 1.00 0.00 C ATOM 797 O PRO A 49 18.198 2.452 -1.313 1.00 0.00 O ATOM 798 CB PRO A 49 19.431 0.018 0.710 1.00 0.00 C ATOM 799 CG PRO A 49 19.212 -1.422 0.397 1.00 0.00 C ATOM 800 CD PRO A 49 17.754 -1.686 0.656 1.00 0.00 C ATOM 0 HA PRO A 49 17.880 1.568 0.948 1.00 0.00 H new ATOM 0 HB2 PRO A 49 20.268 0.424 0.142 1.00 0.00 H new ATOM 0 HB3 PRO A 49 19.662 0.163 1.765 1.00 0.00 H new ATOM 0 HG2 PRO A 49 19.470 -1.639 -0.640 1.00 0.00 H new ATOM 0 HG3 PRO A 49 19.840 -2.057 1.022 1.00 0.00 H new ATOM 0 HD2 PRO A 49 17.351 -2.422 -0.039 1.00 0.00 H new ATOM 0 HD3 PRO A 49 17.589 -2.073 1.662 1.00 0.00 H new ATOM 808 N LYS A 50 18.237 0.331 -2.065 1.00 0.00 N ATOM 809 CA LYS A 50 18.305 0.716 -3.470 1.00 0.00 C ATOM 810 C LYS A 50 17.061 1.497 -3.877 1.00 0.00 C ATOM 811 O LYS A 50 17.120 2.374 -4.740 1.00 0.00 O ATOM 812 CB LYS A 50 18.456 -0.524 -4.354 1.00 0.00 C ATOM 813 CG LYS A 50 19.903 -0.928 -4.592 1.00 0.00 C ATOM 814 CD LYS A 50 20.350 -1.997 -3.609 1.00 0.00 C ATOM 815 CE LYS A 50 21.305 -2.985 -4.258 1.00 0.00 C ATOM 816 NZ LYS A 50 21.097 -4.371 -3.756 1.00 0.00 N ATOM 0 H LYS A 50 18.230 -0.676 -1.903 1.00 0.00 H new ATOM 0 HA LYS A 50 19.176 1.357 -3.605 1.00 0.00 H new ATOM 0 HB2 LYS A 50 17.926 -1.357 -3.891 1.00 0.00 H new ATOM 0 HB3 LYS A 50 17.977 -0.336 -5.315 1.00 0.00 H new ATOM 0 HG2 LYS A 50 20.016 -1.299 -5.611 1.00 0.00 H new ATOM 0 HG3 LYS A 50 20.547 -0.053 -4.498 1.00 0.00 H new ATOM 0 HD2 LYS A 50 20.836 -1.527 -2.754 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.479 -2.529 -3.227 1.00 0.00 H new ATOM 0 HE2 LYS A 50 21.167 -2.966 -5.339 1.00 0.00 H new ATOM 0 HE3 LYS A 50 22.333 -2.679 -4.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.768 -5.014 -4.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 21.253 -4.395 -2.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.124 -4.674 -3.965 1.00 0.00 H new ATOM 830 N MET A 51 15.936 1.173 -3.250 1.00 0.00 N ATOM 831 CA MET A 51 14.675 1.844 -3.543 1.00 0.00 C ATOM 832 C MET A 51 14.584 3.176 -2.807 1.00 0.00 C ATOM 833 O MET A 51 13.960 4.121 -3.290 1.00 0.00 O ATOM 834 CB MET A 51 13.497 0.952 -3.148 1.00 0.00 C ATOM 835 CG MET A 51 13.257 -0.202 -4.106 1.00 0.00 C ATOM 836 SD MET A 51 12.933 0.347 -5.794 1.00 0.00 S ATOM 837 CE MET A 51 11.808 1.710 -5.499 1.00 0.00 C ATOM 0 H MET A 51 15.871 0.449 -2.535 1.00 0.00 H new ATOM 0 HA MET A 51 14.635 2.037 -4.615 1.00 0.00 H new ATOM 0 HB2 MET A 51 13.674 0.553 -2.149 1.00 0.00 H new ATOM 0 HB3 MET A 51 12.594 1.561 -3.093 1.00 0.00 H new ATOM 0 HG2 MET A 51 14.128 -0.858 -4.103 1.00 0.00 H new ATOM 0 HG3 MET A 51 12.412 -0.792 -3.752 1.00 0.00 H new ATOM 0 HE1 MET A 51 11.138 1.820 -6.352 1.00 0.00 H new ATOM 0 HE2 MET A 51 11.223 1.511 -4.601 1.00 0.00 H new ATOM 0 HE3 MET A 51 12.378 2.629 -5.365 1.00 0.00 H new ATOM 847 N ALA A 52 15.210 3.243 -1.637 1.00 0.00 N ATOM 848 CA ALA A 52 15.200 4.459 -0.831 1.00 0.00 C ATOM 849 C ALA A 52 15.704 5.655 -1.633 1.00 0.00 C ATOM 850 O ALA A 52 15.132 6.743 -1.569 1.00 0.00 O ATOM 851 CB ALA A 52 16.042 4.267 0.421 1.00 0.00 C ATOM 0 H ALA A 52 15.731 2.469 -1.225 1.00 0.00 H new ATOM 0 HA ALA A 52 14.170 4.662 -0.536 1.00 0.00 H new ATOM 0 HB1 ALA A 52 16.026 5.182 1.014 1.00 0.00 H new ATOM 0 HB2 ALA A 52 15.635 3.445 1.011 1.00 0.00 H new ATOM 0 HB3 ALA A 52 17.069 4.036 0.137 1.00 0.00 H new ATOM 857 N ALA A 53 16.774 5.444 -2.390 1.00 0.00 N ATOM 858 CA ALA A 53 17.352 6.504 -3.207 1.00 0.00 C ATOM 859 C ALA A 53 16.339 7.029 -4.220 1.00 0.00 C ATOM 860 O ALA A 53 16.435 8.170 -4.673 1.00 0.00 O ATOM 861 CB ALA A 53 18.600 6.002 -3.918 1.00 0.00 C ATOM 0 H ALA A 53 17.259 4.549 -2.455 1.00 0.00 H new ATOM 0 HA ALA A 53 17.629 7.327 -2.548 1.00 0.00 H new ATOM 0 HB1 ALA A 53 19.021 6.804 -4.524 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.335 5.681 -3.180 1.00 0.00 H new ATOM 0 HB3 ALA A 53 18.339 5.161 -4.560 1.00 0.00 H new ATOM 867 N SER A 54 15.369 6.190 -4.572 1.00 0.00 N ATOM 868 CA SER A 54 14.340 6.572 -5.533 1.00 0.00 C ATOM 869 C SER A 54 13.089 7.077 -4.821 1.00 0.00 C ATOM 870 O SER A 54 12.610 8.178 -5.092 1.00 0.00 O ATOM 871 CB SER A 54 13.985 5.383 -6.428 1.00 0.00 C ATOM 872 OG SER A 54 15.101 4.977 -7.202 1.00 0.00 O ATOM 0 H SER A 54 15.274 5.242 -4.207 1.00 0.00 H new ATOM 0 HA SER A 54 14.735 7.379 -6.149 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.642 4.551 -5.813 1.00 0.00 H new ATOM 0 HB3 SER A 54 13.160 5.653 -7.087 1.00 0.00 H new ATOM 0 HG SER A 54 14.849 4.215 -7.764 1.00 0.00 H new ATOM 878 N LEU A 55 12.562 6.264 -3.911 1.00 0.00 N ATOM 879 CA LEU A 55 11.363 6.628 -3.163 1.00 0.00 C ATOM 880 C LEU A 55 11.590 7.902 -2.355 1.00 0.00 C ATOM 881 O LEU A 55 10.655 8.662 -2.103 1.00 0.00 O ATOM 882 CB LEU A 55 10.952 5.486 -2.232 1.00 0.00 C ATOM 883 CG LEU A 55 10.342 4.270 -2.932 1.00 0.00 C ATOM 884 CD1 LEU A 55 10.555 3.014 -2.102 1.00 0.00 C ATOM 885 CD2 LEU A 55 8.859 4.494 -3.192 1.00 0.00 C ATOM 0 H LEU A 55 12.946 5.349 -3.674 1.00 0.00 H new ATOM 0 HA LEU A 55 10.561 6.812 -3.878 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.828 5.162 -1.670 1.00 0.00 H new ATOM 0 HB3 LEU A 55 10.233 5.868 -1.508 1.00 0.00 H new ATOM 0 HG LEU A 55 10.843 4.137 -3.891 1.00 0.00 H new ATOM 0 HD11 LEU A 55 10.115 2.159 -2.616 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.623 2.845 -1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.080 3.136 -1.128 1.00 0.00 H new ATOM 0 HD21 LEU A 55 8.441 3.619 -3.690 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.343 4.653 -2.245 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.729 5.370 -3.827 1.00 0.00 H new ATOM 897 N LEU A 56 12.835 8.129 -1.951 1.00 0.00 N ATOM 898 CA LEU A 56 13.180 9.312 -1.170 1.00 0.00 C ATOM 899 C LEU A 56 13.547 10.481 -2.080 1.00 0.00 C ATOM 900 O LEU A 56 13.383 11.643 -1.707 1.00 0.00 O ATOM 901 CB LEU A 56 14.343 9.003 -0.225 1.00 0.00 C ATOM 902 CG LEU A 56 14.417 9.887 1.021 1.00 0.00 C ATOM 903 CD1 LEU A 56 14.759 11.318 0.639 1.00 0.00 C ATOM 904 CD2 LEU A 56 13.102 9.837 1.786 1.00 0.00 C ATOM 0 H LEU A 56 13.621 7.511 -2.151 1.00 0.00 H new ATOM 0 HA LEU A 56 12.306 9.594 -0.582 1.00 0.00 H new ATOM 0 HB2 LEU A 56 14.268 7.962 0.090 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.277 9.102 -0.778 1.00 0.00 H new ATOM 0 HG LEU A 56 15.207 9.507 1.669 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.807 11.933 1.538 1.00 0.00 H new ATOM 0 HD12 LEU A 56 15.724 11.339 0.133 1.00 0.00 H new ATOM 0 HD13 LEU A 56 13.991 11.710 -0.028 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.171 10.471 2.670 1.00 0.00 H new ATOM 0 HD22 LEU A 56 12.295 10.193 1.146 1.00 0.00 H new ATOM 0 HD23 LEU A 56 12.897 8.811 2.091 1.00 0.00 H new ATOM 916 N ASN A 57 14.044 10.168 -3.273 1.00 0.00 N ATOM 917 CA ASN A 57 14.433 11.195 -4.231 1.00 0.00 C ATOM 918 C ASN A 57 13.242 12.082 -4.595 1.00 0.00 C ATOM 919 O ASN A 57 12.242 11.598 -5.126 1.00 0.00 O ATOM 920 CB ASN A 57 15.007 10.547 -5.494 1.00 0.00 C ATOM 921 CG ASN A 57 16.505 10.745 -5.614 1.00 0.00 C ATOM 922 OD1 ASN A 57 17.186 11.036 -4.630 1.00 0.00 O ATOM 923 ND2 ASN A 57 17.027 10.587 -6.825 1.00 0.00 N ATOM 0 H ASN A 57 14.186 9.212 -3.598 1.00 0.00 H new ATOM 0 HA ASN A 57 15.198 11.819 -3.769 1.00 0.00 H new ATOM 0 HB2 ASN A 57 14.784 9.480 -5.486 1.00 0.00 H new ATOM 0 HB3 ASN A 57 14.516 10.969 -6.371 1.00 0.00 H new ATOM 0 HD21 ASN A 57 18.030 10.707 -6.968 1.00 0.00 H new ATOM 0 HD22 ASN A 57 16.425 10.346 -7.612 1.00 0.00 H new ATOM 930 N PRO A 58 13.329 13.399 -4.320 1.00 0.00 N ATOM 931 CA PRO A 58 12.249 14.345 -4.630 1.00 0.00 C ATOM 932 C PRO A 58 12.021 14.507 -6.133 1.00 0.00 C ATOM 933 O PRO A 58 11.103 15.209 -6.556 1.00 0.00 O ATOM 934 CB PRO A 58 12.731 15.671 -4.023 1.00 0.00 C ATOM 935 CG PRO A 58 13.856 15.309 -3.112 1.00 0.00 C ATOM 936 CD PRO A 58 14.475 14.072 -3.691 1.00 0.00 C ATOM 0 HA PRO A 58 11.295 14.000 -4.231 1.00 0.00 H new ATOM 0 HB2 PRO A 58 13.062 16.360 -4.800 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.928 16.167 -3.477 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.584 16.118 -3.051 1.00 0.00 H new ATOM 0 HG3 PRO A 58 13.495 15.128 -2.100 1.00 0.00 H new ATOM 0 HD2 PRO A 58 15.253 14.310 -4.417 1.00 0.00 H new ATOM 0 HD3 PRO A 58 14.936 13.452 -2.922 1.00 0.00 H new ATOM 944 N TYR A 59 12.866 13.865 -6.935 1.00 0.00 N ATOM 945 CA TYR A 59 12.760 13.947 -8.386 1.00 0.00 C ATOM 946 C TYR A 59 11.732 12.954 -8.923 1.00 0.00 C ATOM 947 O TYR A 59 11.111 13.190 -9.960 1.00 0.00 O ATOM 948 CB TYR A 59 14.125 13.687 -9.022 1.00 0.00 C ATOM 949 CG TYR A 59 15.145 14.761 -8.714 1.00 0.00 C ATOM 950 CD1 TYR A 59 15.519 15.035 -7.403 1.00 0.00 C ATOM 951 CD2 TYR A 59 15.731 15.503 -9.732 1.00 0.00 C ATOM 952 CE1 TYR A 59 16.447 16.017 -7.117 1.00 0.00 C ATOM 953 CE2 TYR A 59 16.660 16.487 -9.453 1.00 0.00 C ATOM 954 CZ TYR A 59 17.014 16.741 -8.144 1.00 0.00 C ATOM 955 OH TYR A 59 17.938 17.721 -7.862 1.00 0.00 O ATOM 0 H TYR A 59 13.633 13.281 -6.602 1.00 0.00 H new ATOM 0 HA TYR A 59 12.425 14.951 -8.647 1.00 0.00 H new ATOM 0 HB2 TYR A 59 14.503 12.726 -8.673 1.00 0.00 H new ATOM 0 HB3 TYR A 59 14.005 13.609 -10.103 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.077 14.471 -6.595 1.00 0.00 H new ATOM 0 HD2 TYR A 59 15.456 15.308 -10.758 1.00 0.00 H new ATOM 0 HE1 TYR A 59 16.727 16.217 -6.093 1.00 0.00 H new ATOM 0 HE2 TYR A 59 17.107 17.055 -10.256 1.00 0.00 H new ATOM 0 HH TYR A 59 18.241 18.135 -8.697 1.00 0.00 H new ATOM 965 N VAL A 60 11.557 11.844 -8.213 1.00 0.00 N ATOM 966 CA VAL A 60 10.603 10.820 -8.622 1.00 0.00 C ATOM 967 C VAL A 60 9.191 11.388 -8.735 1.00 0.00 C ATOM 968 O VAL A 60 8.340 10.826 -9.425 1.00 0.00 O ATOM 969 CB VAL A 60 10.590 9.637 -7.636 1.00 0.00 C ATOM 970 CG1 VAL A 60 11.936 8.928 -7.635 1.00 0.00 C ATOM 971 CG2 VAL A 60 10.224 10.111 -6.236 1.00 0.00 C ATOM 0 H VAL A 60 12.063 11.631 -7.353 1.00 0.00 H new ATOM 0 HA VAL A 60 10.926 10.466 -9.601 1.00 0.00 H new ATOM 0 HB VAL A 60 9.832 8.925 -7.961 1.00 0.00 H new ATOM 0 HG11 VAL A 60 11.908 8.095 -6.932 1.00 0.00 H new ATOM 0 HG12 VAL A 60 12.150 8.552 -8.635 1.00 0.00 H new ATOM 0 HG13 VAL A 60 12.716 9.628 -7.336 1.00 0.00 H new ATOM 0 HG21 VAL A 60 10.220 9.261 -5.554 1.00 0.00 H new ATOM 0 HG22 VAL A 60 10.955 10.845 -5.897 1.00 0.00 H new ATOM 0 HG23 VAL A 60 9.234 10.567 -6.253 1.00 0.00 H new ATOM 981 N LYS A 61 8.947 12.505 -8.055 1.00 0.00 N ATOM 982 CA LYS A 61 7.637 13.146 -8.082 1.00 0.00 C ATOM 983 C LYS A 61 6.573 12.235 -7.477 1.00 0.00 C ATOM 984 O LYS A 61 6.825 11.058 -7.216 1.00 0.00 O ATOM 985 CB LYS A 61 7.253 13.517 -9.517 1.00 0.00 C ATOM 986 CG LYS A 61 7.631 14.939 -9.898 1.00 0.00 C ATOM 987 CD LYS A 61 9.114 15.057 -10.211 1.00 0.00 C ATOM 988 CE LYS A 61 9.482 16.466 -10.644 1.00 0.00 C ATOM 989 NZ LYS A 61 10.593 16.472 -11.636 1.00 0.00 N ATOM 0 H LYS A 61 9.639 12.984 -7.479 1.00 0.00 H new ATOM 0 HA LYS A 61 7.694 14.056 -7.484 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.738 12.824 -10.205 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.178 13.390 -9.641 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.049 15.251 -10.765 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.375 15.615 -9.082 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.696 14.782 -9.331 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.377 14.352 -11.000 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.608 16.953 -11.076 1.00 0.00 H new ATOM 0 HE3 LYS A 61 9.773 17.050 -9.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.813 17.452 -11.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.436 16.031 -11.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 10.307 15.937 -12.481 1.00 0.00 H new ATOM 1003 N ARG A 62 5.386 12.788 -7.255 1.00 0.00 N ATOM 1004 CA ARG A 62 4.283 12.026 -6.679 1.00 0.00 C ATOM 1005 C ARG A 62 3.428 11.391 -7.771 1.00 0.00 C ATOM 1006 O ARG A 62 2.834 10.333 -7.569 1.00 0.00 O ATOM 1007 CB ARG A 62 3.417 12.930 -5.799 1.00 0.00 C ATOM 1008 CG ARG A 62 2.999 14.223 -6.480 1.00 0.00 C ATOM 1009 CD ARG A 62 1.606 14.653 -6.050 1.00 0.00 C ATOM 1010 NE ARG A 62 1.635 15.467 -4.835 1.00 0.00 N ATOM 1011 CZ ARG A 62 0.633 16.250 -4.445 1.00 0.00 C ATOM 1012 NH1 ARG A 62 -0.478 16.330 -5.168 1.00 0.00 N ATOM 1013 NH2 ARG A 62 0.740 16.956 -3.327 1.00 0.00 N ATOM 0 H ARG A 62 5.162 13.761 -7.465 1.00 0.00 H new ATOM 0 HA ARG A 62 4.706 11.230 -6.067 1.00 0.00 H new ATOM 0 HB2 ARG A 62 2.524 12.382 -5.498 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.966 13.170 -4.888 1.00 0.00 H new ATOM 0 HG2 ARG A 62 3.714 15.010 -6.240 1.00 0.00 H new ATOM 0 HG3 ARG A 62 3.022 14.090 -7.562 1.00 0.00 H new ATOM 0 HD2 ARG A 62 1.137 15.219 -6.855 1.00 0.00 H new ATOM 0 HD3 ARG A 62 0.990 13.770 -5.880 1.00 0.00 H new ATOM 0 HE ARG A 62 2.472 15.432 -4.253 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -0.567 15.789 -6.028 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -1.243 16.932 -4.863 1.00 0.00 H new ATOM 0 HH21 ARG A 62 1.590 16.898 -2.767 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -0.028 17.557 -3.028 1.00 0.00 H new ATOM 1027 N SER A 63 3.370 12.044 -8.927 1.00 0.00 N ATOM 1028 CA SER A 63 2.585 11.541 -10.049 1.00 0.00 C ATOM 1029 C SER A 63 3.417 10.606 -10.921 1.00 0.00 C ATOM 1030 O SER A 63 2.981 9.505 -11.259 1.00 0.00 O ATOM 1031 CB SER A 63 2.055 12.703 -10.890 1.00 0.00 C ATOM 1032 OG SER A 63 0.836 12.360 -11.525 1.00 0.00 O ATOM 0 H SER A 63 3.856 12.921 -9.112 1.00 0.00 H new ATOM 0 HA SER A 63 1.743 10.979 -9.646 1.00 0.00 H new ATOM 0 HB2 SER A 63 1.905 13.576 -10.255 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.795 12.979 -11.641 1.00 0.00 H new ATOM 0 HG SER A 63 0.518 13.121 -12.055 1.00 0.00 H new ATOM 1038 N VAL A 64 4.617 11.050 -11.283 1.00 0.00 N ATOM 1039 CA VAL A 64 5.508 10.252 -12.116 1.00 0.00 C ATOM 1040 C VAL A 64 5.816 8.909 -11.463 1.00 0.00 C ATOM 1041 O VAL A 64 5.875 7.880 -12.136 1.00 0.00 O ATOM 1042 CB VAL A 64 6.831 10.991 -12.392 1.00 0.00 C ATOM 1043 CG1 VAL A 64 7.661 10.237 -13.420 1.00 0.00 C ATOM 1044 CG2 VAL A 64 6.561 12.414 -12.855 1.00 0.00 C ATOM 0 H VAL A 64 4.994 11.958 -11.012 1.00 0.00 H new ATOM 0 HA VAL A 64 4.991 10.083 -13.060 1.00 0.00 H new ATOM 0 HB VAL A 64 7.400 11.037 -11.463 1.00 0.00 H new ATOM 0 HG11 VAL A 64 8.592 10.775 -13.602 1.00 0.00 H new ATOM 0 HG12 VAL A 64 7.886 9.239 -13.045 1.00 0.00 H new ATOM 0 HG13 VAL A 64 7.101 10.156 -14.352 1.00 0.00 H new ATOM 0 HG21 VAL A 64 7.507 12.920 -13.045 1.00 0.00 H new ATOM 0 HG22 VAL A 64 5.970 12.393 -13.771 1.00 0.00 H new ATOM 0 HG23 VAL A 64 6.011 12.950 -12.081 1.00 0.00 H new ATOM 1054 N LYS A 65 6.012 8.928 -10.149 1.00 0.00 N ATOM 1055 CA LYS A 65 6.314 7.710 -9.405 1.00 0.00 C ATOM 1056 C LYS A 65 5.176 6.702 -9.525 1.00 0.00 C ATOM 1057 O LYS A 65 5.409 5.497 -9.624 1.00 0.00 O ATOM 1058 CB LYS A 65 6.567 8.038 -7.932 1.00 0.00 C ATOM 1059 CG LYS A 65 7.069 6.853 -7.123 1.00 0.00 C ATOM 1060 CD LYS A 65 8.577 6.702 -7.234 1.00 0.00 C ATOM 1061 CE LYS A 65 9.014 5.268 -6.978 1.00 0.00 C ATOM 1062 NZ LYS A 65 8.715 4.382 -8.135 1.00 0.00 N ATOM 0 H LYS A 65 5.967 9.772 -9.578 1.00 0.00 H new ATOM 0 HA LYS A 65 7.214 7.267 -9.832 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.296 8.846 -7.868 1.00 0.00 H new ATOM 0 HB3 LYS A 65 5.643 8.406 -7.486 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.791 6.981 -6.077 1.00 0.00 H new ATOM 0 HG3 LYS A 65 6.584 5.941 -7.472 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.902 7.011 -8.227 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.064 7.365 -6.519 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.084 5.246 -6.771 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.510 4.888 -6.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.172 3.557 -7.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.158 4.907 -8.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.606 4.062 -8.566 1.00 0.00 H new ATOM 1076 N VAL A 66 3.944 7.202 -9.517 1.00 0.00 N ATOM 1077 CA VAL A 66 2.770 6.344 -9.625 1.00 0.00 C ATOM 1078 C VAL A 66 2.790 5.546 -10.925 1.00 0.00 C ATOM 1079 O VAL A 66 2.412 4.375 -10.952 1.00 0.00 O ATOM 1080 CB VAL A 66 1.467 7.162 -9.557 1.00 0.00 C ATOM 1081 CG1 VAL A 66 0.256 6.242 -9.525 1.00 0.00 C ATOM 1082 CG2 VAL A 66 1.476 8.084 -8.347 1.00 0.00 C ATOM 0 H VAL A 66 3.733 8.197 -9.437 1.00 0.00 H new ATOM 0 HA VAL A 66 2.802 5.657 -8.779 1.00 0.00 H new ATOM 0 HB VAL A 66 1.402 7.778 -10.454 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.654 6.840 -9.477 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.241 5.629 -10.426 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.313 5.596 -8.649 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.547 8.653 -8.317 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.568 7.490 -7.438 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.320 8.770 -8.419 1.00 0.00 H new ATOM 1092 N LYS A 67 3.235 6.187 -12.001 1.00 0.00 N ATOM 1093 CA LYS A 67 3.303 5.536 -13.304 1.00 0.00 C ATOM 1094 C LYS A 67 4.216 4.316 -13.255 1.00 0.00 C ATOM 1095 O LYS A 67 3.862 3.243 -13.742 1.00 0.00 O ATOM 1096 CB LYS A 67 3.801 6.519 -14.365 1.00 0.00 C ATOM 1097 CG LYS A 67 3.300 6.208 -15.766 1.00 0.00 C ATOM 1098 CD LYS A 67 1.785 6.292 -15.847 1.00 0.00 C ATOM 1099 CE LYS A 67 1.330 6.842 -17.190 1.00 0.00 C ATOM 1100 NZ LYS A 67 0.078 7.639 -17.067 1.00 0.00 N ATOM 0 H LYS A 67 3.554 7.156 -11.996 1.00 0.00 H new ATOM 0 HA LYS A 67 2.299 5.206 -13.570 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.487 7.526 -14.091 1.00 0.00 H new ATOM 0 HB3 LYS A 67 4.891 6.515 -14.369 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.743 6.907 -16.475 1.00 0.00 H new ATOM 0 HG3 LYS A 67 3.626 5.209 -16.057 1.00 0.00 H new ATOM 0 HD2 LYS A 67 1.356 5.302 -15.693 1.00 0.00 H new ATOM 0 HD3 LYS A 67 1.411 6.929 -15.046 1.00 0.00 H new ATOM 0 HE2 LYS A 67 2.118 7.466 -17.613 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.169 6.017 -17.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.199 7.996 -18.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.681 7.037 -16.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 0.239 8.441 -16.424 1.00 0.00 H new ATOM 1114 N SER A 68 5.394 4.488 -12.662 1.00 0.00 N ATOM 1115 CA SER A 68 6.357 3.400 -12.549 1.00 0.00 C ATOM 1116 C SER A 68 5.814 2.283 -11.663 1.00 0.00 C ATOM 1117 O SER A 68 6.142 1.111 -11.855 1.00 0.00 O ATOM 1118 CB SER A 68 7.680 3.919 -11.982 1.00 0.00 C ATOM 1119 OG SER A 68 7.617 4.044 -10.573 1.00 0.00 O ATOM 0 H SER A 68 5.703 5.370 -12.253 1.00 0.00 H new ATOM 0 HA SER A 68 6.531 2.996 -13.547 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.487 3.239 -12.254 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.915 4.886 -12.426 1.00 0.00 H new ATOM 0 HG SER A 68 6.823 4.563 -10.326 1.00 0.00 H new ATOM 1125 N LEU A 69 4.985 2.654 -10.693 1.00 0.00 N ATOM 1126 CA LEU A 69 4.396 1.684 -9.777 1.00 0.00 C ATOM 1127 C LEU A 69 3.389 0.793 -10.499 1.00 0.00 C ATOM 1128 O LEU A 69 3.257 -0.389 -10.186 1.00 0.00 O ATOM 1129 CB LEU A 69 3.715 2.400 -8.610 1.00 0.00 C ATOM 1130 CG LEU A 69 4.666 3.105 -7.640 1.00 0.00 C ATOM 1131 CD1 LEU A 69 3.882 3.929 -6.630 1.00 0.00 C ATOM 1132 CD2 LEU A 69 5.551 2.091 -6.932 1.00 0.00 C ATOM 0 H LEU A 69 4.706 3.620 -10.521 1.00 0.00 H new ATOM 0 HA LEU A 69 5.198 1.055 -9.390 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.018 3.136 -9.012 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.124 1.673 -8.052 1.00 0.00 H new ATOM 0 HG LEU A 69 5.305 3.779 -8.211 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.574 4.423 -5.948 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.290 4.680 -7.154 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.219 3.275 -6.063 1.00 0.00 H new ATOM 0 HD21 LEU A 69 6.221 2.609 -6.246 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.929 1.392 -6.373 1.00 0.00 H new ATOM 0 HD23 LEU A 69 6.139 1.544 -7.669 1.00 0.00 H new ATOM 1144 N SER A 70 2.680 1.371 -11.462 1.00 0.00 N ATOM 1145 CA SER A 70 1.682 0.630 -12.226 1.00 0.00 C ATOM 1146 C SER A 70 2.338 -0.449 -13.079 1.00 0.00 C ATOM 1147 O SER A 70 1.843 -1.571 -13.164 1.00 0.00 O ATOM 1148 CB SER A 70 0.873 1.580 -13.111 1.00 0.00 C ATOM 1149 OG SER A 70 -0.275 2.059 -12.431 1.00 0.00 O ATOM 0 H SER A 70 2.777 2.350 -11.732 1.00 0.00 H new ATOM 0 HA SER A 70 1.008 0.146 -11.519 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.498 2.421 -13.413 1.00 0.00 H new ATOM 0 HB3 SER A 70 0.571 1.064 -14.022 1.00 0.00 H new ATOM 0 HG SER A 70 -0.774 2.665 -13.018 1.00 0.00 H new ATOM 1155 N ASP A 71 3.459 -0.109 -13.700 1.00 0.00 N ATOM 1156 CA ASP A 71 4.180 -1.065 -14.529 1.00 0.00 C ATOM 1157 C ASP A 71 5.061 -1.947 -13.659 1.00 0.00 C ATOM 1158 O ASP A 71 5.309 -3.109 -13.981 1.00 0.00 O ATOM 1159 CB ASP A 71 5.025 -0.339 -15.579 1.00 0.00 C ATOM 1160 CG ASP A 71 4.242 -0.032 -16.840 1.00 0.00 C ATOM 1161 OD1 ASP A 71 3.515 0.983 -16.855 1.00 0.00 O ATOM 1162 OD2 ASP A 71 4.356 -0.807 -17.813 1.00 0.00 O ATOM 0 H ASP A 71 3.887 0.815 -13.646 1.00 0.00 H new ATOM 0 HA ASP A 71 3.455 -1.692 -15.048 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.406 0.591 -15.156 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.890 -0.952 -15.832 1.00 0.00 H new ATOM 1167 N MET A 72 5.516 -1.389 -12.543 1.00 0.00 N ATOM 1168 CA MET A 72 6.351 -2.130 -11.612 1.00 0.00 C ATOM 1169 C MET A 72 5.499 -3.073 -10.782 1.00 0.00 C ATOM 1170 O MET A 72 5.980 -4.108 -10.321 1.00 0.00 O ATOM 1171 CB MET A 72 7.124 -1.173 -10.702 1.00 0.00 C ATOM 1172 CG MET A 72 8.003 -1.880 -9.683 1.00 0.00 C ATOM 1173 SD MET A 72 8.634 -0.764 -8.416 1.00 0.00 S ATOM 1174 CE MET A 72 7.130 -0.390 -7.516 1.00 0.00 C ATOM 0 H MET A 72 5.320 -0.428 -12.263 1.00 0.00 H new ATOM 0 HA MET A 72 7.070 -2.716 -12.184 1.00 0.00 H new ATOM 0 HB2 MET A 72 7.746 -0.523 -11.317 1.00 0.00 H new ATOM 0 HB3 MET A 72 6.416 -0.533 -10.176 1.00 0.00 H new ATOM 0 HG2 MET A 72 7.432 -2.677 -9.207 1.00 0.00 H new ATOM 0 HG3 MET A 72 8.841 -2.351 -10.197 1.00 0.00 H new ATOM 0 HE1 MET A 72 7.220 0.590 -7.048 1.00 0.00 H new ATOM 0 HE2 MET A 72 6.285 -0.387 -8.205 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.968 -1.146 -6.747 1.00 0.00 H new ATOM 1184 N THR A 73 4.224 -2.730 -10.602 1.00 0.00 N ATOM 1185 CA THR A 73 3.340 -3.587 -9.837 1.00 0.00 C ATOM 1186 C THR A 73 3.158 -4.913 -10.552 1.00 0.00 C ATOM 1187 O THR A 73 2.974 -5.951 -9.916 1.00 0.00 O ATOM 1188 CB THR A 73 1.982 -2.941 -9.594 1.00 0.00 C ATOM 1189 OG1 THR A 73 1.222 -3.760 -8.739 1.00 0.00 O ATOM 1190 CG2 THR A 73 1.161 -2.736 -10.838 1.00 0.00 C ATOM 0 H THR A 73 3.793 -1.882 -10.970 1.00 0.00 H new ATOM 0 HA THR A 73 3.805 -3.751 -8.865 1.00 0.00 H new ATOM 0 HB THR A 73 2.201 -1.962 -9.168 1.00 0.00 H new ATOM 0 HG1 THR A 73 1.749 -3.980 -7.943 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.211 -2.272 -10.574 1.00 0.00 H new ATOM 0 HG22 THR A 73 1.702 -2.089 -11.528 1.00 0.00 H new ATOM 0 HG23 THR A 73 0.975 -3.699 -11.314 1.00 0.00 H new ATOM 1198 N ALA A 74 3.232 -4.880 -11.880 1.00 0.00 N ATOM 1199 CA ALA A 74 3.097 -6.095 -12.664 1.00 0.00 C ATOM 1200 C ALA A 74 4.049 -7.163 -12.138 1.00 0.00 C ATOM 1201 O ALA A 74 3.797 -8.360 -12.282 1.00 0.00 O ATOM 1202 CB ALA A 74 3.367 -5.814 -14.134 1.00 0.00 C ATOM 0 H ALA A 74 3.383 -4.033 -12.427 1.00 0.00 H new ATOM 0 HA ALA A 74 2.075 -6.461 -12.571 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.261 -6.736 -14.706 1.00 0.00 H new ATOM 0 HB2 ALA A 74 2.654 -5.076 -14.500 1.00 0.00 H new ATOM 0 HB3 ALA A 74 4.380 -5.429 -14.251 1.00 0.00 H new ATOM 1208 N LYS A 75 5.144 -6.719 -11.521 1.00 0.00 N ATOM 1209 CA LYS A 75 6.130 -7.637 -10.968 1.00 0.00 C ATOM 1210 C LYS A 75 6.020 -7.734 -9.447 1.00 0.00 C ATOM 1211 O LYS A 75 6.567 -8.658 -8.843 1.00 0.00 O ATOM 1212 CB LYS A 75 7.542 -7.203 -11.365 1.00 0.00 C ATOM 1213 CG LYS A 75 7.962 -7.686 -12.743 1.00 0.00 C ATOM 1214 CD LYS A 75 9.172 -6.921 -13.255 1.00 0.00 C ATOM 1215 CE LYS A 75 10.010 -7.770 -14.198 1.00 0.00 C ATOM 1216 NZ LYS A 75 11.173 -8.388 -13.503 1.00 0.00 N ATOM 0 H LYS A 75 5.367 -5.732 -11.394 1.00 0.00 H new ATOM 0 HA LYS A 75 5.928 -8.625 -11.382 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.600 -6.115 -11.337 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.250 -7.579 -10.626 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.193 -8.750 -12.702 1.00 0.00 H new ATOM 0 HG3 LYS A 75 7.133 -7.567 -13.440 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.842 -6.020 -13.771 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.784 -6.600 -12.412 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.388 -8.553 -14.631 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.366 -7.153 -15.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.719 -8.959 -14.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.781 -7.640 -13.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 10.833 -8.997 -12.732 1.00 0.00 H new ATOM 1230 N GLU A 76 5.318 -6.790 -8.822 1.00 0.00 N ATOM 1231 CA GLU A 76 5.162 -6.806 -7.374 1.00 0.00 C ATOM 1232 C GLU A 76 4.075 -7.790 -6.958 1.00 0.00 C ATOM 1233 O GLU A 76 4.348 -8.760 -6.251 1.00 0.00 O ATOM 1234 CB GLU A 76 4.836 -5.403 -6.857 1.00 0.00 C ATOM 1235 CG GLU A 76 5.787 -4.921 -5.776 1.00 0.00 C ATOM 1236 CD GLU A 76 7.113 -4.445 -6.337 1.00 0.00 C ATOM 1237 OE1 GLU A 76 7.108 -3.502 -7.155 1.00 0.00 O ATOM 1238 OE2 GLU A 76 8.157 -5.017 -5.959 1.00 0.00 O ATOM 0 H GLU A 76 4.854 -6.013 -9.292 1.00 0.00 H new ATOM 0 HA GLU A 76 6.104 -7.131 -6.933 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.861 -4.702 -7.691 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.819 -5.396 -6.465 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.319 -4.108 -5.221 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.966 -5.730 -5.067 1.00 0.00 H new ATOM 1245 N LYS A 77 2.844 -7.536 -7.409 1.00 0.00 N ATOM 1246 CA LYS A 77 1.698 -8.398 -7.094 1.00 0.00 C ATOM 1247 C LYS A 77 0.379 -7.640 -7.234 1.00 0.00 C ATOM 1248 O LYS A 77 -0.645 -8.221 -7.596 1.00 0.00 O ATOM 1249 CB LYS A 77 1.804 -8.966 -5.672 1.00 0.00 C ATOM 1250 CG LYS A 77 2.276 -10.410 -5.627 1.00 0.00 C ATOM 1251 CD LYS A 77 2.974 -10.727 -4.314 1.00 0.00 C ATOM 1252 CE LYS A 77 2.850 -12.201 -3.960 1.00 0.00 C ATOM 1253 NZ LYS A 77 3.627 -13.063 -4.891 1.00 0.00 N ATOM 0 H LYS A 77 2.613 -6.735 -7.997 1.00 0.00 H new ATOM 0 HA LYS A 77 1.714 -9.220 -7.809 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.492 -8.349 -5.094 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.830 -8.896 -5.188 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.424 -11.077 -5.757 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.957 -10.597 -6.457 1.00 0.00 H new ATOM 0 HD2 LYS A 77 4.027 -10.456 -4.386 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.543 -10.122 -3.516 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.201 -12.360 -2.940 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.800 -12.493 -3.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 3.516 -14.060 -4.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.276 -12.931 -5.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 4.633 -12.802 -4.848 1.00 0.00 H new ATOM 1267 N PHE A 78 0.406 -6.344 -6.926 1.00 0.00 N ATOM 1268 CA PHE A 78 -0.791 -5.509 -6.997 1.00 0.00 C ATOM 1269 C PHE A 78 -1.508 -5.646 -8.316 1.00 0.00 C ATOM 1270 O PHE A 78 -1.119 -6.427 -9.183 1.00 0.00 O ATOM 1271 CB PHE A 78 -0.452 -4.036 -6.791 1.00 0.00 C ATOM 1272 CG PHE A 78 0.686 -3.819 -5.858 1.00 0.00 C ATOM 1273 CD1 PHE A 78 0.703 -4.441 -4.627 1.00 0.00 C ATOM 1274 CD2 PHE A 78 1.750 -3.020 -6.226 1.00 0.00 C ATOM 1275 CE1 PHE A 78 1.773 -4.269 -3.775 1.00 0.00 C ATOM 1276 CE2 PHE A 78 2.818 -2.838 -5.379 1.00 0.00 C ATOM 1277 CZ PHE A 78 2.833 -3.465 -4.150 1.00 0.00 C ATOM 0 H PHE A 78 1.246 -5.849 -6.624 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.445 -5.859 -6.198 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -0.213 -3.587 -7.755 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.331 -3.518 -6.407 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.126 -5.066 -4.329 1.00 0.00 H new ATOM 0 HD2 PHE A 78 1.744 -2.533 -7.190 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.783 -4.762 -2.814 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.642 -2.206 -5.675 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.671 -3.328 -3.483 1.00 0.00 H new ATOM 1287 N SER A 79 -2.556 -4.842 -8.441 1.00 0.00 N ATOM 1288 CA SER A 79 -3.390 -4.787 -9.632 1.00 0.00 C ATOM 1289 C SER A 79 -4.867 -4.777 -9.260 1.00 0.00 C ATOM 1290 O SER A 79 -5.661 -4.072 -9.881 1.00 0.00 O ATOM 1291 CB SER A 79 -3.113 -5.952 -10.591 1.00 0.00 C ATOM 1292 OG SER A 79 -4.098 -6.021 -11.607 1.00 0.00 O ATOM 0 H SER A 79 -2.854 -4.201 -7.706 1.00 0.00 H new ATOM 0 HA SER A 79 -3.137 -3.859 -10.145 1.00 0.00 H new ATOM 0 HB2 SER A 79 -2.128 -5.829 -11.042 1.00 0.00 H new ATOM 0 HB3 SER A 79 -3.094 -6.889 -10.034 1.00 0.00 H new ATOM 0 HG SER A 79 -3.898 -6.770 -12.206 1.00 0.00 H new ATOM 1298 N PRO A 80 -5.279 -5.598 -8.277 1.00 0.00 N ATOM 1299 CA PRO A 80 -6.664 -5.696 -7.882 1.00 0.00 C ATOM 1300 C PRO A 80 -7.039 -4.901 -6.637 1.00 0.00 C ATOM 1301 O PRO A 80 -7.743 -3.897 -6.737 1.00 0.00 O ATOM 1302 CB PRO A 80 -6.810 -7.195 -7.635 1.00 0.00 C ATOM 1303 CG PRO A 80 -5.440 -7.665 -7.220 1.00 0.00 C ATOM 1304 CD PRO A 80 -4.463 -6.545 -7.517 1.00 0.00 C ATOM 0 HA PRO A 80 -7.326 -5.275 -8.638 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.547 -7.395 -6.857 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -7.147 -7.711 -8.534 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.426 -7.915 -6.159 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -5.164 -8.568 -7.764 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -4.070 -6.098 -6.604 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.608 -6.896 -8.094 1.00 0.00 H new ATOM 1312 N LEU A 81 -6.590 -5.339 -5.462 1.00 0.00 N ATOM 1313 CA LEU A 81 -6.927 -4.627 -4.244 1.00 0.00 C ATOM 1314 C LEU A 81 -5.819 -3.666 -3.880 1.00 0.00 C ATOM 1315 O LEU A 81 -5.832 -3.049 -2.815 1.00 0.00 O ATOM 1316 CB LEU A 81 -7.188 -5.601 -3.105 1.00 0.00 C ATOM 1317 CG LEU A 81 -8.587 -6.221 -3.102 1.00 0.00 C ATOM 1318 CD1 LEU A 81 -9.650 -5.135 -3.016 1.00 0.00 C ATOM 1319 CD2 LEU A 81 -8.793 -7.073 -4.344 1.00 0.00 C ATOM 0 H LEU A 81 -6.005 -6.165 -5.334 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.840 -4.057 -4.416 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.450 -6.402 -3.154 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.033 -5.082 -2.159 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.679 -6.863 -2.226 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.639 -5.593 -3.015 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -9.514 -4.564 -2.097 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -9.560 -4.469 -3.874 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.793 -7.507 -4.326 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.682 -6.453 -5.233 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.052 -7.872 -4.364 1.00 0.00 H new ATOM 1331 N THR A 82 -4.863 -3.542 -4.784 1.00 0.00 N ATOM 1332 CA THR A 82 -3.744 -2.660 -4.583 1.00 0.00 C ATOM 1333 C THR A 82 -3.557 -1.732 -5.773 1.00 0.00 C ATOM 1334 O THR A 82 -2.657 -0.893 -5.771 1.00 0.00 O ATOM 1335 CB THR A 82 -2.481 -3.459 -4.333 1.00 0.00 C ATOM 1336 OG1 THR A 82 -2.778 -4.827 -4.112 1.00 0.00 O ATOM 1337 CG2 THR A 82 -1.716 -2.952 -3.140 1.00 0.00 C ATOM 0 H THR A 82 -4.847 -4.049 -5.669 1.00 0.00 H new ATOM 0 HA THR A 82 -3.951 -2.046 -3.706 1.00 0.00 H new ATOM 0 HB THR A 82 -1.870 -3.343 -5.228 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.069 -5.238 -4.952 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.819 -3.555 -3.000 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.432 -1.913 -3.305 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.342 -3.021 -2.250 1.00 0.00 H new ATOM 1345 N SER A 83 -4.417 -1.855 -6.787 1.00 0.00 N ATOM 1346 CA SER A 83 -4.314 -0.985 -7.945 1.00 0.00 C ATOM 1347 C SER A 83 -5.069 0.316 -7.687 1.00 0.00 C ATOM 1348 O SER A 83 -5.559 0.973 -8.606 1.00 0.00 O ATOM 1349 CB SER A 83 -4.855 -1.662 -9.200 1.00 0.00 C ATOM 1350 OG SER A 83 -4.985 -0.738 -10.267 1.00 0.00 O ATOM 0 H SER A 83 -5.175 -2.536 -6.825 1.00 0.00 H new ATOM 0 HA SER A 83 -3.259 -0.767 -8.110 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.187 -2.471 -9.496 1.00 0.00 H new ATOM 0 HB3 SER A 83 -5.825 -2.111 -8.985 1.00 0.00 H new ATOM 0 HG SER A 83 -5.430 0.073 -9.945 1.00 0.00 H new ATOM 1356 N ASN A 84 -5.132 0.673 -6.418 1.00 0.00 N ATOM 1357 CA ASN A 84 -5.786 1.883 -5.955 1.00 0.00 C ATOM 1358 C ASN A 84 -4.972 2.402 -4.794 1.00 0.00 C ATOM 1359 O ASN A 84 -4.618 3.579 -4.730 1.00 0.00 O ATOM 1360 CB ASN A 84 -7.226 1.597 -5.522 1.00 0.00 C ATOM 1361 CG ASN A 84 -8.229 1.878 -6.624 1.00 0.00 C ATOM 1362 OD1 ASN A 84 -8.294 2.989 -7.151 1.00 0.00 O ATOM 1363 ND2 ASN A 84 -9.018 0.871 -6.977 1.00 0.00 N ATOM 0 H ASN A 84 -4.722 0.120 -5.666 1.00 0.00 H new ATOM 0 HA ASN A 84 -5.839 2.622 -6.755 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.310 0.554 -5.216 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.468 2.206 -4.651 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -9.713 1.001 -7.712 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -8.929 -0.033 -6.513 1.00 0.00 H new ATOM 1370 N LEU A 85 -4.618 1.474 -3.909 1.00 0.00 N ATOM 1371 CA LEU A 85 -3.774 1.784 -2.782 1.00 0.00 C ATOM 1372 C LEU A 85 -2.401 2.184 -3.310 1.00 0.00 C ATOM 1373 O LEU A 85 -1.632 2.859 -2.626 1.00 0.00 O ATOM 1374 CB LEU A 85 -3.650 0.572 -1.852 1.00 0.00 C ATOM 1375 CG LEU A 85 -3.367 0.903 -0.383 1.00 0.00 C ATOM 1376 CD1 LEU A 85 -4.664 0.990 0.404 1.00 0.00 C ATOM 1377 CD2 LEU A 85 -2.439 -0.135 0.231 1.00 0.00 C ATOM 0 H LEU A 85 -4.910 0.498 -3.960 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.210 2.602 -2.208 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.574 -0.004 -1.907 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -2.852 -0.071 -2.223 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.873 1.873 -0.340 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -4.443 1.226 1.445 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -5.295 1.772 -0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.186 0.035 0.351 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.250 0.118 1.274 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.905 -1.119 0.175 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.496 -0.149 -0.315 1.00 0.00 H new ATOM 1389 N ILE A 86 -2.102 1.764 -4.550 1.00 0.00 N ATOM 1390 CA ILE A 86 -0.830 2.086 -5.170 1.00 0.00 C ATOM 1391 C ILE A 86 -0.758 3.576 -5.502 1.00 0.00 C ATOM 1392 O ILE A 86 0.167 4.273 -5.087 1.00 0.00 O ATOM 1393 CB ILE A 86 -0.590 1.236 -6.447 1.00 0.00 C ATOM 1394 CG1 ILE A 86 0.436 0.136 -6.163 1.00 0.00 C ATOM 1395 CG2 ILE A 86 -0.127 2.094 -7.622 1.00 0.00 C ATOM 1396 CD1 ILE A 86 -0.024 -0.867 -5.130 1.00 0.00 C ATOM 0 H ILE A 86 -2.727 1.205 -5.131 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.043 1.846 -4.455 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.541 0.782 -6.724 1.00 0.00 H new ATOM 0 HG12 ILE A 86 0.661 -0.388 -7.092 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.364 0.595 -5.823 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.030 1.461 -8.495 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -0.887 2.842 -7.848 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.807 2.592 -7.363 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.753 -1.617 -4.980 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.221 -0.355 -4.188 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.936 -1.354 -5.476 1.00 0.00 H new ATOM 1408 N ASN A 87 -1.748 4.056 -6.249 1.00 0.00 N ATOM 1409 CA ASN A 87 -1.804 5.460 -6.635 1.00 0.00 C ATOM 1410 C ASN A 87 -2.071 6.342 -5.420 1.00 0.00 C ATOM 1411 O ASN A 87 -1.667 7.504 -5.384 1.00 0.00 O ATOM 1412 CB ASN A 87 -2.891 5.678 -7.688 1.00 0.00 C ATOM 1413 CG ASN A 87 -2.798 4.685 -8.831 1.00 0.00 C ATOM 1414 OD1 ASN A 87 -2.137 4.939 -9.837 1.00 0.00 O ATOM 1415 ND2 ASN A 87 -3.464 3.545 -8.680 1.00 0.00 N ATOM 0 H ASN A 87 -2.522 3.492 -6.599 1.00 0.00 H new ATOM 0 HA ASN A 87 -0.839 5.736 -7.060 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -3.871 5.595 -7.217 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -2.812 6.691 -8.083 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -3.439 2.839 -9.416 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -4.000 3.376 -7.829 1.00 0.00 H new ATOM 1422 N LEU A 88 -2.753 5.780 -4.427 1.00 0.00 N ATOM 1423 CA LEU A 88 -3.074 6.513 -3.209 1.00 0.00 C ATOM 1424 C LEU A 88 -1.853 6.612 -2.301 1.00 0.00 C ATOM 1425 O LEU A 88 -1.682 7.595 -1.583 1.00 0.00 O ATOM 1426 CB LEU A 88 -4.228 5.832 -2.468 1.00 0.00 C ATOM 1427 CG LEU A 88 -5.556 6.588 -2.506 1.00 0.00 C ATOM 1428 CD1 LEU A 88 -6.640 5.798 -1.789 1.00 0.00 C ATOM 1429 CD2 LEU A 88 -5.401 7.967 -1.883 1.00 0.00 C ATOM 0 H LEU A 88 -3.094 4.819 -4.443 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.379 7.522 -3.487 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -4.379 4.841 -2.895 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.938 5.690 -1.427 1.00 0.00 H new ATOM 0 HG LEU A 88 -5.853 6.712 -3.548 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -7.578 6.351 -1.826 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.769 4.832 -2.277 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.351 5.644 -0.750 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.356 8.492 -1.918 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.082 7.864 -0.846 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -4.654 8.535 -2.438 1.00 0.00 H new ATOM 1441 N LEU A 89 -1.006 5.588 -2.340 1.00 0.00 N ATOM 1442 CA LEU A 89 0.198 5.570 -1.518 1.00 0.00 C ATOM 1443 C LEU A 89 1.218 6.576 -2.036 1.00 0.00 C ATOM 1444 O LEU A 89 1.981 7.155 -1.263 1.00 0.00 O ATOM 1445 CB LEU A 89 0.804 4.165 -1.493 1.00 0.00 C ATOM 1446 CG LEU A 89 0.484 3.353 -0.239 1.00 0.00 C ATOM 1447 CD1 LEU A 89 0.812 1.885 -0.454 1.00 0.00 C ATOM 1448 CD2 LEU A 89 1.245 3.905 0.956 1.00 0.00 C ATOM 0 H LEU A 89 -1.130 4.764 -2.929 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.077 5.851 -0.501 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.449 3.616 -2.365 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.887 4.249 -1.588 1.00 0.00 H new ATOM 0 HG LEU A 89 -0.584 3.436 -0.036 1.00 0.00 H new ATOM 0 HD11 LEU A 89 0.577 1.323 0.450 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.222 1.498 -1.285 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.873 1.779 -0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.007 3.317 1.842 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.316 3.851 0.762 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.958 4.943 1.122 1.00 0.00 H new ATOM 1460 N ALA A 90 1.220 6.785 -3.348 1.00 0.00 N ATOM 1461 CA ALA A 90 2.139 7.728 -3.970 1.00 0.00 C ATOM 1462 C ALA A 90 1.397 8.960 -4.474 1.00 0.00 C ATOM 1463 O ALA A 90 1.860 9.646 -5.386 1.00 0.00 O ATOM 1464 CB ALA A 90 2.890 7.057 -5.111 1.00 0.00 C ATOM 0 H ALA A 90 0.594 6.313 -4.001 1.00 0.00 H new ATOM 0 HA ALA A 90 2.858 8.051 -3.217 1.00 0.00 H new ATOM 0 HB1 ALA A 90 3.574 7.773 -5.567 1.00 0.00 H new ATOM 0 HB2 ALA A 90 3.457 6.210 -4.725 1.00 0.00 H new ATOM 0 HB3 ALA A 90 2.178 6.707 -5.859 1.00 0.00 H new ATOM 1470 N GLU A 91 0.240 9.237 -3.876 1.00 0.00 N ATOM 1471 CA GLU A 91 -0.565 10.388 -4.267 1.00 0.00 C ATOM 1472 C GLU A 91 -0.134 11.637 -3.507 1.00 0.00 C ATOM 1473 O GLU A 91 0.145 12.675 -4.108 1.00 0.00 O ATOM 1474 CB GLU A 91 -2.049 10.108 -4.015 1.00 0.00 C ATOM 1475 CG GLU A 91 -2.950 10.524 -5.166 1.00 0.00 C ATOM 1476 CD GLU A 91 -4.384 10.751 -4.730 1.00 0.00 C ATOM 1477 OE1 GLU A 91 -4.596 11.116 -3.554 1.00 0.00 O ATOM 1478 OE2 GLU A 91 -5.295 10.563 -5.563 1.00 0.00 O ATOM 0 H GLU A 91 -0.159 8.680 -3.120 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.411 10.563 -5.332 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -2.182 9.043 -3.827 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.361 10.633 -3.112 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.561 11.438 -5.615 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.926 9.755 -5.938 1.00 0.00 H new ATOM 1485 N ASN A 92 -0.086 11.534 -2.182 1.00 0.00 N ATOM 1486 CA ASN A 92 0.309 12.658 -1.343 1.00 0.00 C ATOM 1487 C ASN A 92 1.567 12.335 -0.541 1.00 0.00 C ATOM 1488 O ASN A 92 1.827 12.949 0.494 1.00 0.00 O ATOM 1489 CB ASN A 92 -0.830 13.038 -0.395 1.00 0.00 C ATOM 1490 CG ASN A 92 -1.789 14.035 -1.014 1.00 0.00 C ATOM 1491 OD1 ASN A 92 -1.401 14.852 -1.850 1.00 0.00 O ATOM 1492 ND2 ASN A 92 -3.051 13.974 -0.605 1.00 0.00 N ATOM 0 H ASN A 92 -0.316 10.684 -1.668 1.00 0.00 H new ATOM 0 HA ASN A 92 0.529 13.502 -1.997 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -1.378 12.139 -0.111 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -0.413 13.459 0.520 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -3.742 14.620 -0.986 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -3.329 13.281 0.090 1.00 0.00 H new ATOM 1499 N GLY A 93 2.345 11.371 -1.023 1.00 0.00 N ATOM 1500 CA GLY A 93 3.563 10.990 -0.334 1.00 0.00 C ATOM 1501 C GLY A 93 3.293 10.125 0.880 1.00 0.00 C ATOM 1502 O GLY A 93 4.057 10.142 1.846 1.00 0.00 O ATOM 0 H GLY A 93 2.154 10.848 -1.877 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.214 10.452 -1.023 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.099 11.888 -0.025 1.00 0.00 H new ATOM 1506 N ARG A 94 2.203 9.367 0.833 1.00 0.00 N ATOM 1507 CA ARG A 94 1.832 8.491 1.938 1.00 0.00 C ATOM 1508 C ARG A 94 2.940 7.488 2.236 1.00 0.00 C ATOM 1509 O ARG A 94 3.055 6.994 3.358 1.00 0.00 O ATOM 1510 CB ARG A 94 0.530 7.754 1.618 1.00 0.00 C ATOM 1511 CG ARG A 94 -0.677 8.670 1.514 1.00 0.00 C ATOM 1512 CD ARG A 94 -1.303 8.923 2.877 1.00 0.00 C ATOM 1513 NE ARG A 94 -0.693 10.063 3.557 1.00 0.00 N ATOM 1514 CZ ARG A 94 -1.260 10.712 4.572 1.00 0.00 C ATOM 1515 NH1 ARG A 94 -2.449 10.335 5.027 1.00 0.00 N ATOM 1516 NH2 ARG A 94 -0.638 11.739 5.132 1.00 0.00 N ATOM 0 H ARG A 94 1.561 9.342 0.041 1.00 0.00 H new ATOM 0 HA ARG A 94 1.682 9.109 2.823 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.649 7.215 0.678 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.345 7.009 2.391 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.378 9.619 1.068 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -1.417 8.224 0.849 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -2.372 9.102 2.757 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -1.196 8.032 3.496 1.00 0.00 H new ATOM 0 HE ARG A 94 0.221 10.381 3.235 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -2.932 9.545 4.599 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -2.879 10.835 5.805 1.00 0.00 H new ATOM 0 HH21 ARG A 94 0.275 12.033 4.786 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -1.072 12.236 5.910 1.00 0.00 H new ATOM 1530 N LEU A 95 3.757 7.192 1.230 1.00 0.00 N ATOM 1531 CA LEU A 95 4.858 6.250 1.396 1.00 0.00 C ATOM 1532 C LEU A 95 5.747 6.664 2.564 1.00 0.00 C ATOM 1533 O LEU A 95 5.497 7.679 3.212 1.00 0.00 O ATOM 1534 CB LEU A 95 5.684 6.164 0.110 1.00 0.00 C ATOM 1535 CG LEU A 95 4.923 5.658 -1.117 1.00 0.00 C ATOM 1536 CD1 LEU A 95 5.858 5.528 -2.309 1.00 0.00 C ATOM 1537 CD2 LEU A 95 4.252 4.326 -0.815 1.00 0.00 C ATOM 0 H LEU A 95 3.678 7.590 0.294 1.00 0.00 H new ATOM 0 HA LEU A 95 4.438 5.267 1.611 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.085 7.153 -0.113 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.536 5.507 0.287 1.00 0.00 H new ATOM 0 HG LEU A 95 4.149 6.384 -1.367 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.299 5.167 -3.172 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.292 6.501 -2.539 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.654 4.823 -2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 95 3.715 3.980 -1.698 1.00 0.00 H new ATOM 0 HD22 LEU A 95 5.009 3.591 -0.540 1.00 0.00 H new ATOM 0 HD23 LEU A 95 3.551 4.451 0.010 1.00 0.00 H new ATOM 1549 N THR A 96 6.772 5.858 2.837 1.00 0.00 N ATOM 1550 CA THR A 96 7.699 6.118 3.941 1.00 0.00 C ATOM 1551 C THR A 96 7.139 5.544 5.235 1.00 0.00 C ATOM 1552 O THR A 96 7.799 4.758 5.915 1.00 0.00 O ATOM 1553 CB THR A 96 7.973 7.618 4.101 1.00 0.00 C ATOM 1554 OG1 THR A 96 7.951 8.269 2.843 1.00 0.00 O ATOM 1555 CG2 THR A 96 9.307 7.917 4.749 1.00 0.00 C ATOM 0 H THR A 96 6.983 5.013 2.306 1.00 0.00 H new ATOM 0 HA THR A 96 8.646 5.630 3.710 1.00 0.00 H new ATOM 0 HB THR A 96 7.180 7.988 4.751 1.00 0.00 H new ATOM 0 HG1 THR A 96 7.061 8.649 2.687 1.00 0.00 H new ATOM 0 HG21 THR A 96 9.437 8.996 4.832 1.00 0.00 H new ATOM 0 HG22 THR A 96 9.337 7.470 5.743 1.00 0.00 H new ATOM 0 HG23 THR A 96 10.109 7.500 4.140 1.00 0.00 H new ATOM 1563 N ASN A 97 5.905 5.921 5.555 1.00 0.00 N ATOM 1564 CA ASN A 97 5.242 5.420 6.750 1.00 0.00 C ATOM 1565 C ASN A 97 4.337 4.244 6.391 1.00 0.00 C ATOM 1566 O ASN A 97 3.401 3.916 7.120 1.00 0.00 O ATOM 1567 CB ASN A 97 4.423 6.530 7.412 1.00 0.00 C ATOM 1568 CG ASN A 97 5.296 7.577 8.075 1.00 0.00 C ATOM 1569 OD1 ASN A 97 5.663 7.448 9.243 1.00 0.00 O ATOM 1570 ND2 ASN A 97 5.635 8.622 7.329 1.00 0.00 N ATOM 0 H ASN A 97 5.346 6.571 5.003 1.00 0.00 H new ATOM 0 HA ASN A 97 6.002 5.082 7.454 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.793 7.009 6.663 1.00 0.00 H new ATOM 0 HB3 ASN A 97 3.757 6.092 8.156 1.00 0.00 H new ATOM 0 HD21 ASN A 97 6.222 9.359 7.720 1.00 0.00 H new ATOM 0 HD22 ASN A 97 5.308 8.688 6.365 1.00 0.00 H new ATOM 1577 N THR A 98 4.625 3.618 5.248 1.00 0.00 N ATOM 1578 CA THR A 98 3.849 2.483 4.764 1.00 0.00 C ATOM 1579 C THR A 98 3.618 1.440 5.861 1.00 0.00 C ATOM 1580 O THR A 98 2.488 1.007 6.082 1.00 0.00 O ATOM 1581 CB THR A 98 4.553 1.832 3.571 1.00 0.00 C ATOM 1582 OG1 THR A 98 5.636 2.631 3.128 1.00 0.00 O ATOM 1583 CG2 THR A 98 3.637 1.607 2.387 1.00 0.00 C ATOM 0 H THR A 98 5.398 3.884 4.638 1.00 0.00 H new ATOM 0 HA THR A 98 2.876 2.862 4.453 1.00 0.00 H new ATOM 0 HB THR A 98 4.899 0.864 3.934 1.00 0.00 H new ATOM 0 HG1 THR A 98 5.591 2.732 2.154 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.198 1.143 1.576 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.816 0.953 2.681 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.236 2.563 2.050 1.00 0.00 H new ATOM 1591 N PRO A 99 4.692 1.016 6.557 1.00 0.00 N ATOM 1592 CA PRO A 99 4.607 0.013 7.623 1.00 0.00 C ATOM 1593 C PRO A 99 3.364 0.163 8.496 1.00 0.00 C ATOM 1594 O PRO A 99 2.829 -0.825 8.998 1.00 0.00 O ATOM 1595 CB PRO A 99 5.873 0.281 8.429 1.00 0.00 C ATOM 1596 CG PRO A 99 6.865 0.736 7.413 1.00 0.00 C ATOM 1597 CD PRO A 99 6.082 1.475 6.354 1.00 0.00 C ATOM 0 HA PRO A 99 4.529 -1.000 7.228 1.00 0.00 H new ATOM 0 HB2 PRO A 99 5.706 1.042 9.191 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.214 -0.617 8.944 1.00 0.00 H new ATOM 0 HG2 PRO A 99 7.615 1.385 7.866 1.00 0.00 H new ATOM 0 HG3 PRO A 99 7.396 -0.112 6.982 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.168 2.555 6.474 1.00 0.00 H new ATOM 0 HD3 PRO A 99 6.440 1.236 5.353 1.00 0.00 H new ATOM 1605 N ALA A 100 2.905 1.396 8.670 1.00 0.00 N ATOM 1606 CA ALA A 100 1.720 1.653 9.478 1.00 0.00 C ATOM 1607 C ALA A 100 0.465 1.157 8.770 1.00 0.00 C ATOM 1608 O ALA A 100 -0.390 0.514 9.377 1.00 0.00 O ATOM 1609 CB ALA A 100 1.601 3.136 9.795 1.00 0.00 C ATOM 0 H ALA A 100 3.332 2.229 8.265 1.00 0.00 H new ATOM 0 HA ALA A 100 1.822 1.106 10.415 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.710 3.309 10.399 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.483 3.462 10.347 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.525 3.702 8.866 1.00 0.00 H new ATOM 1615 N VAL A 101 0.370 1.452 7.478 1.00 0.00 N ATOM 1616 CA VAL A 101 -0.773 1.028 6.681 1.00 0.00 C ATOM 1617 C VAL A 101 -0.768 -0.485 6.475 1.00 0.00 C ATOM 1618 O VAL A 101 -1.783 -1.072 6.101 1.00 0.00 O ATOM 1619 CB VAL A 101 -0.790 1.724 5.306 1.00 0.00 C ATOM 1620 CG1 VAL A 101 -2.110 1.473 4.593 1.00 0.00 C ATOM 1621 CG2 VAL A 101 -0.536 3.217 5.457 1.00 0.00 C ATOM 0 H VAL A 101 1.071 1.983 6.961 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.668 1.314 7.234 1.00 0.00 H new ATOM 0 HB VAL A 101 0.011 1.301 4.699 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.101 1.973 3.624 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -2.247 0.402 4.447 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.929 1.864 5.196 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.552 3.690 4.475 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -1.312 3.656 6.084 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.438 3.375 5.920 1.00 0.00 H new ATOM 1631 N ILE A 102 0.382 -1.112 6.719 1.00 0.00 N ATOM 1632 CA ILE A 102 0.514 -2.556 6.557 1.00 0.00 C ATOM 1633 C ILE A 102 0.211 -3.290 7.859 1.00 0.00 C ATOM 1634 O ILE A 102 -0.530 -4.273 7.870 1.00 0.00 O ATOM 1635 CB ILE A 102 1.931 -2.943 6.089 1.00 0.00 C ATOM 1636 CG1 ILE A 102 2.387 -2.030 4.947 1.00 0.00 C ATOM 1637 CG2 ILE A 102 1.967 -4.404 5.662 1.00 0.00 C ATOM 1638 CD1 ILE A 102 3.758 -2.373 4.405 1.00 0.00 C ATOM 0 H ILE A 102 1.233 -0.642 7.029 1.00 0.00 H new ATOM 0 HA ILE A 102 -0.210 -2.852 5.797 1.00 0.00 H new ATOM 0 HB ILE A 102 2.621 -2.813 6.923 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.661 -2.087 4.136 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.393 -0.998 5.298 1.00 0.00 H new ATOM 0 HG21 ILE A 102 2.974 -4.663 5.334 1.00 0.00 H new ATOM 0 HG22 ILE A 102 1.686 -5.036 6.504 1.00 0.00 H new ATOM 0 HG23 ILE A 102 1.267 -4.561 4.841 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.013 -1.685 3.599 1.00 0.00 H new ATOM 0 HD12 ILE A 102 4.496 -2.288 5.203 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.753 -3.394 4.022 1.00 0.00 H new ATOM 1650 N SER A 103 0.793 -2.813 8.956 1.00 0.00 N ATOM 1651 CA SER A 103 0.587 -3.433 10.260 1.00 0.00 C ATOM 1652 C SER A 103 -0.870 -3.330 10.690 1.00 0.00 C ATOM 1653 O SER A 103 -1.464 -4.309 11.142 1.00 0.00 O ATOM 1654 CB SER A 103 1.489 -2.781 11.310 1.00 0.00 C ATOM 1655 OG SER A 103 2.642 -3.569 11.553 1.00 0.00 O ATOM 0 H SER A 103 1.410 -2.001 8.967 1.00 0.00 H new ATOM 0 HA SER A 103 0.847 -4.488 10.174 1.00 0.00 H new ATOM 0 HB2 SER A 103 1.788 -1.789 10.972 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.934 -2.647 12.238 1.00 0.00 H new ATOM 0 HG SER A 103 3.203 -3.130 12.226 1.00 0.00 H new ATOM 1661 N ALA A 104 -1.444 -2.143 10.540 1.00 0.00 N ATOM 1662 CA ALA A 104 -2.835 -1.925 10.910 1.00 0.00 C ATOM 1663 C ALA A 104 -3.759 -2.817 10.088 1.00 0.00 C ATOM 1664 O ALA A 104 -4.903 -3.062 10.472 1.00 0.00 O ATOM 1665 CB ALA A 104 -3.202 -0.460 10.731 1.00 0.00 C ATOM 0 H ALA A 104 -0.970 -1.321 10.167 1.00 0.00 H new ATOM 0 HA ALA A 104 -2.960 -2.189 11.960 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -4.245 -0.309 11.011 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -2.564 0.155 11.365 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.061 -0.174 9.689 1.00 0.00 H new ATOM 1671 N PHE A 105 -3.256 -3.301 8.955 1.00 0.00 N ATOM 1672 CA PHE A 105 -4.035 -4.165 8.078 1.00 0.00 C ATOM 1673 C PHE A 105 -4.296 -5.518 8.722 1.00 0.00 C ATOM 1674 O PHE A 105 -5.402 -6.046 8.644 1.00 0.00 O ATOM 1675 CB PHE A 105 -3.312 -4.371 6.748 1.00 0.00 C ATOM 1676 CG PHE A 105 -4.235 -4.745 5.625 1.00 0.00 C ATOM 1677 CD1 PHE A 105 -4.864 -3.763 4.884 1.00 0.00 C ATOM 1678 CD2 PHE A 105 -4.476 -6.074 5.307 1.00 0.00 C ATOM 1679 CE1 PHE A 105 -5.716 -4.091 3.856 1.00 0.00 C ATOM 1680 CE2 PHE A 105 -5.327 -6.408 4.275 1.00 0.00 C ATOM 1681 CZ PHE A 105 -5.950 -5.415 3.550 1.00 0.00 C ATOM 0 H PHE A 105 -2.311 -3.108 8.624 1.00 0.00 H new ATOM 0 HA PHE A 105 -4.991 -3.672 7.901 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -2.782 -3.456 6.484 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -2.561 -5.152 6.867 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -4.684 -2.724 5.115 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -3.992 -6.855 5.874 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -6.202 -3.312 3.288 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -5.505 -7.446 4.035 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.620 -5.673 2.744 1.00 0.00 H new ATOM 1691 N SER A 106 -3.270 -6.087 9.342 1.00 0.00 N ATOM 1692 CA SER A 106 -3.404 -7.392 9.977 1.00 0.00 C ATOM 1693 C SER A 106 -4.411 -7.357 11.119 1.00 0.00 C ATOM 1694 O SER A 106 -5.093 -8.349 11.384 1.00 0.00 O ATOM 1695 CB SER A 106 -2.046 -7.880 10.488 1.00 0.00 C ATOM 1696 OG SER A 106 -2.197 -8.995 11.350 1.00 0.00 O ATOM 0 H SER A 106 -2.343 -5.669 9.419 1.00 0.00 H new ATOM 0 HA SER A 106 -3.773 -8.089 9.224 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.412 -8.152 9.644 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.541 -7.072 11.018 1.00 0.00 H new ATOM 0 HG SER A 106 -1.316 -9.289 11.662 1.00 0.00 H new ATOM 1702 N THR A 107 -4.509 -6.219 11.793 1.00 0.00 N ATOM 1703 CA THR A 107 -5.445 -6.079 12.900 1.00 0.00 C ATOM 1704 C THR A 107 -6.803 -5.614 12.402 1.00 0.00 C ATOM 1705 O THR A 107 -7.832 -5.926 13.001 1.00 0.00 O ATOM 1706 CB THR A 107 -4.901 -5.103 13.945 1.00 0.00 C ATOM 1707 OG1 THR A 107 -3.626 -5.518 14.402 1.00 0.00 O ATOM 1708 CG2 THR A 107 -5.799 -4.960 15.154 1.00 0.00 C ATOM 0 H THR A 107 -3.956 -5.385 11.595 1.00 0.00 H new ATOM 0 HA THR A 107 -5.565 -7.057 13.367 1.00 0.00 H new ATOM 0 HB THR A 107 -4.844 -4.139 13.439 1.00 0.00 H new ATOM 0 HG1 THR A 107 -3.294 -4.881 15.068 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.355 -4.254 15.856 1.00 0.00 H new ATOM 0 HG22 THR A 107 -6.776 -4.594 14.840 1.00 0.00 H new ATOM 0 HG23 THR A 107 -5.914 -5.930 15.639 1.00 0.00 H new ATOM 1716 N MET A 108 -6.809 -4.885 11.294 1.00 0.00 N ATOM 1717 CA MET A 108 -8.051 -4.409 10.721 1.00 0.00 C ATOM 1718 C MET A 108 -8.647 -5.476 9.814 1.00 0.00 C ATOM 1719 O MET A 108 -9.856 -5.518 9.602 1.00 0.00 O ATOM 1720 CB MET A 108 -7.823 -3.120 9.938 1.00 0.00 C ATOM 1721 CG MET A 108 -7.879 -1.869 10.801 1.00 0.00 C ATOM 1722 SD MET A 108 -6.593 -0.676 10.385 1.00 0.00 S ATOM 1723 CE MET A 108 -6.958 0.635 11.550 1.00 0.00 C ATOM 0 H MET A 108 -5.971 -4.614 10.780 1.00 0.00 H new ATOM 0 HA MET A 108 -8.750 -4.199 11.531 1.00 0.00 H new ATOM 0 HB2 MET A 108 -6.851 -3.170 9.446 1.00 0.00 H new ATOM 0 HB3 MET A 108 -8.574 -3.044 9.152 1.00 0.00 H new ATOM 0 HG2 MET A 108 -8.856 -1.398 10.688 1.00 0.00 H new ATOM 0 HG3 MET A 108 -7.781 -2.151 11.849 1.00 0.00 H new ATOM 0 HE1 MET A 108 -6.245 1.449 11.417 1.00 0.00 H new ATOM 0 HE2 MET A 108 -7.968 1.005 11.376 1.00 0.00 H new ATOM 0 HE3 MET A 108 -6.882 0.250 12.567 1.00 0.00 H new ATOM 1733 N MET A 109 -7.787 -6.348 9.288 1.00 0.00 N ATOM 1734 CA MET A 109 -8.233 -7.420 8.413 1.00 0.00 C ATOM 1735 C MET A 109 -8.827 -8.570 9.221 1.00 0.00 C ATOM 1736 O MET A 109 -9.451 -9.466 8.659 1.00 0.00 O ATOM 1737 CB MET A 109 -7.074 -7.923 7.548 1.00 0.00 C ATOM 1738 CG MET A 109 -6.012 -8.683 8.326 1.00 0.00 C ATOM 1739 SD MET A 109 -6.378 -10.443 8.463 1.00 0.00 S ATOM 1740 CE MET A 109 -4.877 -11.042 9.236 1.00 0.00 C ATOM 0 H MET A 109 -6.781 -6.329 9.455 1.00 0.00 H new ATOM 0 HA MET A 109 -9.010 -7.023 7.760 1.00 0.00 H new ATOM 0 HB2 MET A 109 -7.471 -8.570 6.766 1.00 0.00 H new ATOM 0 HB3 MET A 109 -6.608 -7.072 7.051 1.00 0.00 H new ATOM 0 HG2 MET A 109 -5.047 -8.554 7.837 1.00 0.00 H new ATOM 0 HG3 MET A 109 -5.923 -8.255 9.325 1.00 0.00 H new ATOM 0 HE1 MET A 109 -4.897 -12.131 9.274 1.00 0.00 H new ATOM 0 HE2 MET A 109 -4.014 -10.715 8.656 1.00 0.00 H new ATOM 0 HE3 MET A 109 -4.806 -10.645 10.249 1.00 0.00 H new ATOM 1750 N SER A 110 -8.634 -8.548 10.542 1.00 0.00 N ATOM 1751 CA SER A 110 -9.170 -9.599 11.401 1.00 0.00 C ATOM 1752 C SER A 110 -10.473 -9.149 12.046 1.00 0.00 C ATOM 1753 O SER A 110 -11.360 -9.963 12.306 1.00 0.00 O ATOM 1754 CB SER A 110 -8.153 -9.985 12.477 1.00 0.00 C ATOM 1755 OG SER A 110 -7.059 -10.690 11.915 1.00 0.00 O ATOM 0 H SER A 110 -8.115 -7.820 11.034 1.00 0.00 H new ATOM 0 HA SER A 110 -9.372 -10.474 10.784 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.792 -9.088 12.979 1.00 0.00 H new ATOM 0 HB3 SER A 110 -8.637 -10.602 13.235 1.00 0.00 H new ATOM 0 HG SER A 110 -6.331 -10.063 11.720 1.00 0.00 H new ATOM 1761 N VAL A 111 -10.592 -7.849 12.288 1.00 0.00 N ATOM 1762 CA VAL A 111 -11.801 -7.300 12.885 1.00 0.00 C ATOM 1763 C VAL A 111 -12.973 -7.388 11.908 1.00 0.00 C ATOM 1764 O VAL A 111 -14.128 -7.208 12.295 1.00 0.00 O ATOM 1765 CB VAL A 111 -11.607 -5.833 13.317 1.00 0.00 C ATOM 1766 CG1 VAL A 111 -11.357 -4.941 12.111 1.00 0.00 C ATOM 1767 CG2 VAL A 111 -12.810 -5.346 14.109 1.00 0.00 C ATOM 0 H VAL A 111 -9.870 -7.159 12.081 1.00 0.00 H new ATOM 0 HA VAL A 111 -12.019 -7.896 13.771 1.00 0.00 H new ATOM 0 HB VAL A 111 -10.729 -5.781 13.961 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -11.223 -3.911 12.442 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -10.459 -5.275 11.591 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -12.210 -4.997 11.434 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -12.655 -4.309 14.405 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -13.705 -5.417 13.491 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -12.934 -5.963 14.999 1.00 0.00 H new ATOM 1777 N HIS A 112 -12.669 -7.671 10.641 1.00 0.00 N ATOM 1778 CA HIS A 112 -13.689 -7.787 9.617 1.00 0.00 C ATOM 1779 C HIS A 112 -14.496 -9.070 9.798 1.00 0.00 C ATOM 1780 O HIS A 112 -15.664 -9.140 9.415 1.00 0.00 O ATOM 1781 CB HIS A 112 -13.038 -7.758 8.236 1.00 0.00 C ATOM 1782 CG HIS A 112 -12.518 -9.083 7.776 1.00 0.00 C ATOM 1783 ND1 HIS A 112 -11.844 -9.962 8.593 1.00 0.00 N ATOM 1784 CD2 HIS A 112 -12.585 -9.673 6.568 1.00 0.00 C ATOM 1785 CE1 HIS A 112 -11.522 -11.041 7.903 1.00 0.00 C ATOM 1786 NE2 HIS A 112 -11.961 -10.891 6.669 1.00 0.00 N ATOM 0 H HIS A 112 -11.718 -7.823 10.305 1.00 0.00 H new ATOM 0 HA HIS A 112 -14.373 -6.943 9.708 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -13.766 -7.394 7.511 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -12.216 -7.042 8.249 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -13.046 -9.263 5.681 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -10.990 -11.900 8.285 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -11.854 -11.568 5.914 1.00 0.00 H new ATOM 1795 N ARG A 113 -13.861 -10.087 10.379 1.00 0.00 N ATOM 1796 CA ARG A 113 -14.521 -11.367 10.601 1.00 0.00 C ATOM 1797 C ARG A 113 -15.680 -11.220 11.582 1.00 0.00 C ATOM 1798 O ARG A 113 -16.667 -11.951 11.505 1.00 0.00 O ATOM 1799 CB ARG A 113 -13.519 -12.396 11.128 1.00 0.00 C ATOM 1800 CG ARG A 113 -13.745 -13.798 10.585 1.00 0.00 C ATOM 1801 CD ARG A 113 -12.430 -14.518 10.336 1.00 0.00 C ATOM 1802 NE ARG A 113 -12.078 -15.413 11.436 1.00 0.00 N ATOM 1803 CZ ARG A 113 -12.655 -16.594 11.644 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -13.611 -17.026 10.830 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -12.276 -17.346 12.668 1.00 0.00 N ATOM 0 H ARG A 113 -12.894 -10.047 10.702 1.00 0.00 H new ATOM 0 HA ARG A 113 -14.919 -11.712 9.647 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -12.510 -12.074 10.870 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -13.577 -12.423 12.216 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -14.346 -14.370 11.292 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -14.312 -13.742 9.656 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -12.500 -15.091 9.411 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -11.636 -13.784 10.197 1.00 0.00 H new ATOM 0 HE ARG A 113 -11.347 -15.115 12.082 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.907 -16.452 10.040 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -14.050 -17.932 10.994 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -11.542 -17.019 13.297 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -12.718 -18.251 12.827 1.00 0.00 H new