USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1066 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 104 CYS SG : rot -97:sc= 0.769 USER MOD Set 1.2: A 105 CYS SG : rot 62:sc= -0.0542 USER MOD Set 1.3: A 108 CYS SG : rot -10:sc= 1.13 USER MOD Set 1.4: A 120 CYS SG : rot -124:sc= -0.0974 USER MOD Set 1.5: A 122 CYS SG : rot 84:sc= 1.1 USER MOD Set 1.6: A 145 CYS SG : rot -134:sc= 0.432 USER MOD Set 1.7: A 147 HIS : no HD1:sc= -0.711 K(o=2.5,f=4.6) USER MOD Set 1.8: A 148 CYS SG : rot -105:sc= -1.34 USER MOD Set 1.9: A 150 CYS SG : rot -147:sc= -0.174 USER MOD Set 1.10: A 153 CYS SG : rot 24:sc= 1.44 USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 62 TYR OH : rot 111:sc= -2.01! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.237 USER MOD Single : A 29 GLN : amide:sc= -0.116 X(o=-0.12,f=-0.36) USER MOD Single : A 34 GLN : amide:sc= -0.643 K(o=-0.64,f=-2.8!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0204 X(o=-0.02,f=-0.02) USER MOD Single : A 48 GLN : amide:sc= -1.41 X(o=-1.4,f=-1.4) USER MOD Single : A 53 MET CE :methyl -138:sc= -3.24 (180deg=-6.7!) USER MOD Single : A 54 GLN : amide:sc= -1.51 K(o=-1.5,f=-3.3) USER MOD Single : A 56 HIS : no HE2:sc= -3.18! C(o=-3.2!,f=-7!) USER MOD Single : A 57 HIS : no HD1:sc= -5.89! C(o=-5.9!,f=-5.8!) USER MOD Single : A 58 GLN : amide:sc= 0.016 X(o=0.016,f=0) USER MOD Single : A 60 SER OG : rot 6:sc= 0.521 USER MOD Single : A 64 TYR OH : rot 30:sc= -0.582 USER MOD Single : A 65 THR OG1 : rot 92:sc= 0.991 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -131:sc= -0.0162 (180deg=-0.545) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0.025 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.333) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 154:sc= 0.216 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -127:sc= -0.0604 (180deg=-0.227) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= -0.158 K(o=-0.16,f=-1.1!) USER MOD Single : A 119 THR OG1 : rot -63:sc= 0.877 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.205) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.143 USER MOD Single : A 139 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.0652 X(o=-0.065,f=-0.065) USER MOD Single : A 144 GLN : amide:sc= -2.58 K(o=-2.6,f=-5!) USER MOD Single : A 155 SER OG : rot 180:sc= 0.545 USER MOD ----------------------------------------------------------------- ATOM 216 N ALA A 12 -15.846 -7.342 16.627 1.00 0.00 N ATOM 217 CA ALA A 12 -14.412 -7.274 17.106 1.00 0.00 C ATOM 218 C ALA A 12 -14.351 -7.519 18.626 1.00 0.00 C ATOM 219 O ALA A 12 -15.244 -7.116 19.344 1.00 0.00 O ATOM 220 CB ALA A 12 -13.881 -5.862 16.777 1.00 0.00 C ATOM 0 HA ALA A 12 -13.807 -8.036 16.616 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.846 -5.776 17.109 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.932 -5.696 15.701 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.489 -5.116 17.288 1.00 0.00 H new ATOM 226 N PRO A 13 -13.300 -8.174 19.076 1.00 0.00 N ATOM 227 CA PRO A 13 -13.158 -8.458 20.527 1.00 0.00 C ATOM 228 C PRO A 13 -12.829 -7.176 21.301 1.00 0.00 C ATOM 229 O PRO A 13 -12.427 -6.184 20.724 1.00 0.00 O ATOM 230 CB PRO A 13 -11.994 -9.444 20.591 1.00 0.00 C ATOM 231 CG PRO A 13 -11.197 -9.184 19.354 1.00 0.00 C ATOM 232 CD PRO A 13 -12.164 -8.705 18.302 1.00 0.00 C ATOM 0 HA PRO A 13 -14.071 -8.853 20.973 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -11.394 -9.288 21.487 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -12.350 -10.474 20.622 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.428 -8.435 19.541 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.687 -10.090 19.026 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.718 -7.937 17.670 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.474 -9.518 17.645 1.00 0.00 H new ATOM 240 N ASP A 14 -13.003 -7.189 22.609 1.00 0.00 N ATOM 241 CA ASP A 14 -12.701 -5.953 23.432 1.00 0.00 C ATOM 242 C ASP A 14 -11.320 -5.363 23.076 1.00 0.00 C ATOM 243 O ASP A 14 -11.126 -4.164 23.137 1.00 0.00 O ATOM 244 CB ASP A 14 -12.715 -6.394 24.904 1.00 0.00 C ATOM 245 CG ASP A 14 -13.001 -5.186 25.797 1.00 0.00 C ATOM 246 OD1 ASP A 14 -13.912 -4.441 25.479 1.00 0.00 O ATOM 247 OD2 ASP A 14 -12.303 -5.026 26.785 1.00 0.00 O ATOM 0 H ASP A 14 -13.338 -7.992 23.142 1.00 0.00 H new ATOM 0 HA ASP A 14 -13.440 -5.177 23.234 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -13.474 -7.161 25.058 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -11.756 -6.838 25.171 1.00 0.00 H new ATOM 252 N GLY A 15 -10.360 -6.189 22.702 1.00 0.00 N ATOM 253 CA GLY A 15 -9.005 -5.662 22.341 1.00 0.00 C ATOM 254 C GLY A 15 -9.121 -4.549 21.279 1.00 0.00 C ATOM 255 O GLY A 15 -8.340 -3.615 21.277 1.00 0.00 O ATOM 0 H GLY A 15 -10.461 -7.202 22.633 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -8.511 -5.273 23.231 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -8.383 -6.472 21.960 1.00 0.00 H new ATOM 259 N PHE A 16 -10.086 -4.629 20.378 1.00 0.00 N ATOM 260 CA PHE A 16 -10.226 -3.550 19.329 1.00 0.00 C ATOM 261 C PHE A 16 -10.320 -2.160 19.986 1.00 0.00 C ATOM 262 O PHE A 16 -9.858 -1.181 19.429 1.00 0.00 O ATOM 263 CB PHE A 16 -11.519 -3.852 18.551 1.00 0.00 C ATOM 264 CG PHE A 16 -11.672 -2.872 17.407 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.617 -2.667 16.507 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.874 -2.173 17.245 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.765 -1.763 15.449 1.00 0.00 C ATOM 268 CE2 PHE A 16 -13.021 -1.269 16.186 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.966 -1.063 15.289 1.00 0.00 C ATOM 0 H PHE A 16 -10.772 -5.382 20.323 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.358 -3.542 18.669 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.493 -4.872 18.167 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.379 -3.784 19.217 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.690 -3.207 16.630 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.688 -2.331 17.937 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.952 -1.606 14.756 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.949 -0.730 16.061 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.079 -0.364 14.474 1.00 0.00 H new ATOM 279 N GLU A 17 -10.904 -2.060 21.167 1.00 0.00 N ATOM 280 CA GLU A 17 -11.006 -0.711 21.842 1.00 0.00 C ATOM 281 C GLU A 17 -9.616 -0.060 21.948 1.00 0.00 C ATOM 282 O GLU A 17 -9.480 1.142 21.809 1.00 0.00 O ATOM 283 CB GLU A 17 -11.577 -0.961 23.247 1.00 0.00 C ATOM 284 CG GLU A 17 -12.015 0.369 23.865 1.00 0.00 C ATOM 285 CD GLU A 17 -10.842 0.985 24.632 1.00 0.00 C ATOM 286 OE1 GLU A 17 -10.402 0.375 25.592 1.00 0.00 O ATOM 287 OE2 GLU A 17 -10.406 2.057 24.245 1.00 0.00 O ATOM 0 H GLU A 17 -11.308 -2.839 21.686 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.645 -0.038 21.270 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.424 -1.644 23.190 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.825 -1.437 23.877 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.352 1.052 23.085 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.859 0.210 24.536 1.00 0.00 H new ATOM 294 N LYS A 18 -8.579 -0.840 22.183 1.00 0.00 N ATOM 295 CA LYS A 18 -7.196 -0.241 22.283 1.00 0.00 C ATOM 296 C LYS A 18 -6.852 0.528 20.995 1.00 0.00 C ATOM 297 O LYS A 18 -6.187 1.547 21.041 1.00 0.00 O ATOM 298 CB LYS A 18 -6.218 -1.411 22.475 1.00 0.00 C ATOM 299 CG LYS A 18 -6.220 -1.844 23.943 1.00 0.00 C ATOM 300 CD LYS A 18 -4.840 -2.387 24.319 1.00 0.00 C ATOM 301 CE LYS A 18 -4.772 -3.881 23.994 1.00 0.00 C ATOM 302 NZ LYS A 18 -3.936 -4.471 25.075 1.00 0.00 N ATOM 0 H LYS A 18 -8.626 -1.851 22.309 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.136 0.462 23.114 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.506 -2.247 21.838 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.214 -1.112 22.175 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.476 -0.999 24.582 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.980 -2.608 24.106 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -4.065 -1.850 23.772 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.651 -2.226 25.380 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.766 -4.327 23.976 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -4.328 -4.052 23.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.843 -5.495 24.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.993 -4.032 25.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -4.387 -4.298 25.996 1.00 0.00 H new ATOM 316 N ILE A 19 -7.300 0.059 19.847 1.00 0.00 N ATOM 317 CA ILE A 19 -6.994 0.784 18.571 1.00 0.00 C ATOM 318 C ILE A 19 -8.294 1.261 17.894 1.00 0.00 C ATOM 319 O ILE A 19 -8.409 1.234 16.683 1.00 0.00 O ATOM 320 CB ILE A 19 -6.247 -0.227 17.683 1.00 0.00 C ATOM 321 CG1 ILE A 19 -7.131 -1.453 17.399 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.969 -0.682 18.393 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.902 -1.937 15.964 1.00 0.00 C ATOM 0 H ILE A 19 -7.859 -0.788 19.742 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.391 1.675 18.748 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.998 0.256 16.738 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.898 -2.252 18.103 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.181 -1.197 17.543 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.439 -1.398 17.765 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.329 0.181 18.579 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.228 -1.153 19.341 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.531 -2.806 15.768 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.157 -1.140 15.266 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.855 -2.211 15.835 1.00 0.00 H new ATOM 335 N LYS A 20 -9.278 1.689 18.662 1.00 0.00 N ATOM 336 CA LYS A 20 -10.571 2.155 18.041 1.00 0.00 C ATOM 337 C LYS A 20 -10.511 3.621 17.548 1.00 0.00 C ATOM 338 O LYS A 20 -11.010 3.906 16.476 1.00 0.00 O ATOM 339 CB LYS A 20 -11.651 2.013 19.126 1.00 0.00 C ATOM 340 CG LYS A 20 -13.046 2.034 18.479 1.00 0.00 C ATOM 341 CD LYS A 20 -13.879 3.180 19.065 1.00 0.00 C ATOM 342 CE LYS A 20 -13.823 4.389 18.127 1.00 0.00 C ATOM 343 NZ LYS A 20 -13.993 5.572 19.017 1.00 0.00 N ATOM 0 H LYS A 20 -9.244 1.736 19.680 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.785 1.552 17.158 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.508 1.082 19.674 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.563 2.825 19.848 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.953 2.156 17.400 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.550 1.083 18.650 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.912 2.860 19.200 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.499 3.453 20.049 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.874 4.430 17.592 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.611 4.343 17.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -13.966 6.442 18.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.907 5.508 19.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -13.225 5.593 19.717 1.00 0.00 H new ATOM 357 N PRO A 21 -9.941 4.523 18.331 1.00 0.00 N ATOM 358 CA PRO A 21 -9.899 5.947 17.909 1.00 0.00 C ATOM 359 C PRO A 21 -8.842 6.181 16.817 1.00 0.00 C ATOM 360 O PRO A 21 -9.070 6.947 15.898 1.00 0.00 O ATOM 361 CB PRO A 21 -9.543 6.698 19.188 1.00 0.00 C ATOM 362 CG PRO A 21 -8.831 5.703 20.047 1.00 0.00 C ATOM 363 CD PRO A 21 -9.294 4.327 19.638 1.00 0.00 C ATOM 0 HA PRO A 21 -10.842 6.278 17.473 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.909 7.558 18.975 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.437 7.076 19.683 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.752 5.795 19.924 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.049 5.882 21.100 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.457 3.633 19.565 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.990 3.911 20.366 1.00 0.00 H new ATOM 371 N THR A 22 -7.693 5.538 16.897 1.00 0.00 N ATOM 372 CA THR A 22 -6.648 5.758 15.829 1.00 0.00 C ATOM 373 C THR A 22 -7.221 5.380 14.454 1.00 0.00 C ATOM 374 O THR A 22 -7.014 6.079 13.481 1.00 0.00 O ATOM 375 CB THR A 22 -5.449 4.859 16.179 1.00 0.00 C ATOM 376 OG1 THR A 22 -4.960 5.213 17.466 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.337 5.046 15.141 1.00 0.00 C ATOM 0 H THR A 22 -7.435 4.885 17.637 1.00 0.00 H new ATOM 0 HA THR A 22 -6.342 6.803 15.786 1.00 0.00 H new ATOM 0 HB THR A 22 -5.766 3.816 16.178 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.197 4.642 17.695 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.491 4.407 15.395 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.712 4.777 14.154 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.016 6.088 15.136 1.00 0.00 H new ATOM 385 N LEU A 23 -7.954 4.291 14.371 1.00 0.00 N ATOM 386 CA LEU A 23 -8.548 3.897 13.044 1.00 0.00 C ATOM 387 C LEU A 23 -9.574 4.954 12.607 1.00 0.00 C ATOM 388 O LEU A 23 -9.654 5.293 11.443 1.00 0.00 O ATOM 389 CB LEU A 23 -9.231 2.535 13.243 1.00 0.00 C ATOM 390 CG LEU A 23 -8.223 1.417 12.962 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.496 0.232 13.893 1.00 0.00 C ATOM 392 CD2 LEU A 23 -8.358 0.967 11.505 1.00 0.00 C ATOM 0 H LEU A 23 -8.165 3.666 15.149 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.783 3.830 12.270 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.610 2.451 14.261 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.088 2.444 12.575 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.212 1.786 13.137 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.777 -0.562 13.691 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.399 0.554 14.930 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.506 -0.140 13.722 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.641 0.171 11.302 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.369 0.599 11.330 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.160 1.811 10.844 1.00 0.00 H new ATOM 404 N THR A 24 -10.354 5.492 13.529 1.00 0.00 N ATOM 405 CA THR A 24 -11.360 6.544 13.130 1.00 0.00 C ATOM 406 C THR A 24 -10.645 7.734 12.466 1.00 0.00 C ATOM 407 O THR A 24 -11.165 8.331 11.543 1.00 0.00 O ATOM 408 CB THR A 24 -12.065 7.000 14.418 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.260 5.880 15.270 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.420 7.621 14.070 1.00 0.00 C ATOM 0 H THR A 24 -10.339 5.254 14.521 1.00 0.00 H new ATOM 0 HA THR A 24 -12.079 6.146 12.414 1.00 0.00 H new ATOM 0 HB THR A 24 -11.449 7.742 14.926 1.00 0.00 H new ATOM 0 HG1 THR A 24 -12.708 6.169 16.093 1.00 0.00 H new ATOM 0 HG21 THR A 24 -13.918 7.944 14.984 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.269 8.480 13.416 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.039 6.882 13.561 1.00 0.00 H new ATOM 418 N ASP A 25 -9.453 8.082 12.919 1.00 0.00 N ATOM 419 CA ASP A 25 -8.720 9.239 12.283 1.00 0.00 C ATOM 420 C ASP A 25 -8.547 9.000 10.771 1.00 0.00 C ATOM 421 O ASP A 25 -8.590 9.931 9.990 1.00 0.00 O ATOM 422 CB ASP A 25 -7.343 9.319 12.963 1.00 0.00 C ATOM 423 CG ASP A 25 -6.584 10.538 12.434 1.00 0.00 C ATOM 424 OD1 ASP A 25 -7.176 11.604 12.383 1.00 0.00 O ATOM 425 OD2 ASP A 25 -5.424 10.384 12.087 1.00 0.00 O ATOM 0 H ASP A 25 -8.963 7.624 13.688 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.278 10.167 12.409 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.463 9.393 14.044 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -6.775 8.410 12.766 1.00 0.00 H new ATOM 430 N PHE A 26 -8.357 7.763 10.348 1.00 0.00 N ATOM 431 CA PHE A 26 -8.188 7.496 8.872 1.00 0.00 C ATOM 432 C PHE A 26 -9.410 8.006 8.091 1.00 0.00 C ATOM 433 O PHE A 26 -9.277 8.493 6.984 1.00 0.00 O ATOM 434 CB PHE A 26 -8.070 5.975 8.702 1.00 0.00 C ATOM 435 CG PHE A 26 -6.621 5.570 8.787 1.00 0.00 C ATOM 436 CD1 PHE A 26 -5.942 5.639 10.011 1.00 0.00 C ATOM 437 CD2 PHE A 26 -5.956 5.129 7.640 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.595 5.267 10.082 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.612 4.756 7.716 1.00 0.00 C ATOM 440 CZ PHE A 26 -3.933 4.825 8.933 1.00 0.00 C ATOM 0 H PHE A 26 -8.312 6.940 10.949 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.305 8.009 8.490 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.647 5.466 9.475 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.487 5.672 7.742 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.457 5.979 10.897 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.480 5.077 6.697 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.068 5.321 11.023 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.097 4.413 6.831 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.894 4.536 8.987 1.00 0.00 H new ATOM 450 N GLU A 27 -10.600 7.896 8.650 1.00 0.00 N ATOM 451 CA GLU A 27 -11.819 8.379 7.907 1.00 0.00 C ATOM 452 C GLU A 27 -11.670 9.858 7.526 1.00 0.00 C ATOM 453 O GLU A 27 -12.111 10.268 6.470 1.00 0.00 O ATOM 454 CB GLU A 27 -13.021 8.190 8.848 1.00 0.00 C ATOM 455 CG GLU A 27 -13.427 6.714 8.871 1.00 0.00 C ATOM 456 CD GLU A 27 -14.947 6.603 9.004 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.638 7.251 8.234 1.00 0.00 O ATOM 458 OE2 GLU A 27 -15.394 5.873 9.873 1.00 0.00 O ATOM 0 H GLU A 27 -10.779 7.500 9.573 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.953 7.817 6.983 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -12.764 8.523 9.854 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.858 8.803 8.513 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -13.095 6.220 7.958 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.941 6.205 9.703 1.00 0.00 H new ATOM 465 N ILE A 28 -11.046 10.666 8.360 1.00 0.00 N ATOM 466 CA ILE A 28 -10.881 12.118 7.990 1.00 0.00 C ATOM 467 C ILE A 28 -9.998 12.210 6.733 1.00 0.00 C ATOM 468 O ILE A 28 -10.294 12.965 5.825 1.00 0.00 O ATOM 469 CB ILE A 28 -10.235 12.828 9.204 1.00 0.00 C ATOM 470 CG1 ILE A 28 -11.267 12.929 10.339 1.00 0.00 C ATOM 471 CG2 ILE A 28 -9.784 14.245 8.815 1.00 0.00 C ATOM 472 CD1 ILE A 28 -11.042 11.808 11.355 1.00 0.00 C ATOM 0 H ILE A 28 -10.652 10.393 9.260 1.00 0.00 H new ATOM 0 HA ILE A 28 -11.832 12.598 7.760 1.00 0.00 H new ATOM 0 HB ILE A 28 -9.369 12.252 9.530 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -11.184 13.898 10.831 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -12.276 12.864 9.931 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -9.331 14.733 9.678 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -9.054 14.186 8.008 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -10.646 14.823 8.483 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -11.778 11.889 12.155 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -11.148 10.842 10.861 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -10.040 11.893 11.775 1.00 0.00 H new ATOM 484 N GLN A 29 -8.935 11.431 6.657 1.00 0.00 N ATOM 485 CA GLN A 29 -8.077 11.481 5.422 1.00 0.00 C ATOM 486 C GLN A 29 -8.885 10.913 4.252 1.00 0.00 C ATOM 487 O GLN A 29 -9.104 11.588 3.263 1.00 0.00 O ATOM 488 CB GLN A 29 -6.836 10.616 5.696 1.00 0.00 C ATOM 489 CG GLN A 29 -5.668 11.118 4.845 1.00 0.00 C ATOM 490 CD GLN A 29 -4.351 10.881 5.594 1.00 0.00 C ATOM 491 OE1 GLN A 29 -4.220 11.256 6.743 1.00 0.00 O ATOM 492 NE2 GLN A 29 -3.357 10.272 4.995 1.00 0.00 N ATOM 0 H GLN A 29 -8.631 10.778 7.379 1.00 0.00 H new ATOM 0 HA GLN A 29 -7.771 12.498 5.175 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -6.575 10.660 6.753 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.048 9.573 5.463 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.652 10.598 3.887 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.791 12.180 4.630 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -3.460 9.955 4.031 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -2.481 10.115 5.493 1.00 0.00 H new ATOM 501 N LEU A 30 -9.363 9.685 4.363 1.00 0.00 N ATOM 502 CA LEU A 30 -10.197 9.110 3.241 1.00 0.00 C ATOM 503 C LEU A 30 -11.379 10.054 2.933 1.00 0.00 C ATOM 504 O LEU A 30 -11.801 10.167 1.801 1.00 0.00 O ATOM 505 CB LEU A 30 -10.733 7.739 3.716 1.00 0.00 C ATOM 506 CG LEU A 30 -10.411 6.683 2.665 1.00 0.00 C ATOM 507 CD1 LEU A 30 -8.902 6.453 2.636 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.124 5.376 3.011 1.00 0.00 C ATOM 0 H LEU A 30 -9.217 9.068 5.162 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.600 8.998 2.336 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.281 7.469 4.670 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -11.810 7.792 3.877 1.00 0.00 H new ATOM 0 HG LEU A 30 -10.750 7.024 1.687 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -8.663 5.699 1.886 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.397 7.386 2.386 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.567 6.110 3.615 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.891 4.624 2.257 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -10.789 5.027 3.988 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.201 5.544 3.035 1.00 0.00 H new ATOM 520 N ARG A 31 -11.913 10.739 3.934 1.00 0.00 N ATOM 521 CA ARG A 31 -13.063 11.676 3.670 1.00 0.00 C ATOM 522 C ARG A 31 -12.670 12.723 2.615 1.00 0.00 C ATOM 523 O ARG A 31 -13.486 13.114 1.802 1.00 0.00 O ATOM 524 CB ARG A 31 -13.381 12.378 5.003 1.00 0.00 C ATOM 525 CG ARG A 31 -14.417 11.565 5.783 1.00 0.00 C ATOM 526 CD ARG A 31 -14.313 11.902 7.275 1.00 0.00 C ATOM 527 NE ARG A 31 -15.727 12.037 7.741 1.00 0.00 N ATOM 528 CZ ARG A 31 -16.459 13.093 7.419 1.00 0.00 C ATOM 529 NH1 ARG A 31 -15.973 14.063 6.678 1.00 0.00 N ATOM 530 NH2 ARG A 31 -17.692 13.179 7.847 1.00 0.00 N ATOM 0 H ARG A 31 -11.606 10.689 4.905 1.00 0.00 H new ATOM 0 HA ARG A 31 -13.927 11.128 3.293 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -12.471 12.487 5.593 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -13.760 13.382 4.814 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -15.420 11.788 5.418 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.251 10.499 5.628 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -13.791 11.117 7.821 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -13.756 12.825 7.433 1.00 0.00 H new ATOM 0 HE ARG A 31 -16.136 11.302 8.318 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -15.013 14.013 6.338 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -16.556 14.866 6.443 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -18.084 12.436 8.425 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -18.261 13.989 7.603 1.00 0.00 H new ATOM 544 N ASP A 32 -11.430 13.184 2.613 1.00 0.00 N ATOM 545 CA ASP A 32 -11.032 14.210 1.584 1.00 0.00 C ATOM 546 C ASP A 32 -11.163 13.604 0.183 1.00 0.00 C ATOM 547 O ASP A 32 -11.828 14.160 -0.671 1.00 0.00 O ATOM 548 CB ASP A 32 -9.573 14.599 1.870 1.00 0.00 C ATOM 549 CG ASP A 32 -9.541 15.782 2.840 1.00 0.00 C ATOM 550 OD1 ASP A 32 -9.787 15.567 4.015 1.00 0.00 O ATOM 551 OD2 ASP A 32 -9.269 16.883 2.391 1.00 0.00 O ATOM 0 H ASP A 32 -10.695 12.902 3.262 1.00 0.00 H new ATOM 0 HA ASP A 32 -11.673 15.090 1.633 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.036 13.751 2.296 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.067 14.863 0.941 1.00 0.00 H new ATOM 556 N ALA A 33 -10.559 12.459 -0.058 1.00 0.00 N ATOM 557 CA ALA A 33 -10.700 11.831 -1.417 1.00 0.00 C ATOM 558 C ALA A 33 -12.145 11.345 -1.584 1.00 0.00 C ATOM 559 O ALA A 33 -12.746 11.524 -2.625 1.00 0.00 O ATOM 560 CB ALA A 33 -9.727 10.645 -1.478 1.00 0.00 C ATOM 0 H ALA A 33 -9.987 11.942 0.610 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.474 12.540 -2.214 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.802 10.163 -2.453 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -8.708 11.002 -1.327 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -9.979 9.927 -0.698 1.00 0.00 H new ATOM 566 N GLN A 34 -12.715 10.744 -0.557 1.00 0.00 N ATOM 567 CA GLN A 34 -14.136 10.267 -0.673 1.00 0.00 C ATOM 568 C GLN A 34 -15.075 11.461 -0.937 1.00 0.00 C ATOM 569 O GLN A 34 -16.061 11.324 -1.637 1.00 0.00 O ATOM 570 CB GLN A 34 -14.496 9.603 0.667 1.00 0.00 C ATOM 571 CG GLN A 34 -13.995 8.156 0.670 1.00 0.00 C ATOM 572 CD GLN A 34 -14.472 7.452 1.947 1.00 0.00 C ATOM 573 OE1 GLN A 34 -13.941 7.687 3.013 1.00 0.00 O ATOM 574 NE2 GLN A 34 -15.459 6.591 1.887 1.00 0.00 N ATOM 0 H GLN A 34 -12.265 10.566 0.341 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.245 9.565 -1.500 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.047 10.156 1.492 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.575 9.626 0.818 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -14.367 7.629 -0.209 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.906 8.137 0.616 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.908 6.391 0.993 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.778 6.121 2.734 1.00 0.00 H new ATOM 583 N LYS A 35 -14.781 12.632 -0.392 1.00 0.00 N ATOM 584 CA LYS A 35 -15.682 13.812 -0.642 1.00 0.00 C ATOM 585 C LYS A 35 -15.264 14.550 -1.924 1.00 0.00 C ATOM 586 O LYS A 35 -16.101 15.064 -2.641 1.00 0.00 O ATOM 587 CB LYS A 35 -15.542 14.734 0.581 1.00 0.00 C ATOM 588 CG LYS A 35 -16.250 14.105 1.791 1.00 0.00 C ATOM 589 CD LYS A 35 -17.160 15.141 2.459 1.00 0.00 C ATOM 590 CE LYS A 35 -16.305 16.221 3.125 1.00 0.00 C ATOM 591 NZ LYS A 35 -17.149 17.447 3.101 1.00 0.00 N ATOM 0 H LYS A 35 -13.973 12.816 0.202 1.00 0.00 H new ATOM 0 HA LYS A 35 -16.716 13.494 -0.779 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -14.488 14.895 0.808 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -15.974 15.711 0.363 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -16.837 13.244 1.473 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -15.512 13.741 2.506 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.821 15.591 1.718 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -17.796 14.657 3.201 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -16.041 15.943 4.145 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -15.371 16.374 2.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -16.631 18.234 3.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -17.378 17.691 2.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -18.028 17.273 3.629 1.00 0.00 H new ATOM 605 N ASP A 36 -13.980 14.607 -2.230 1.00 0.00 N ATOM 606 CA ASP A 36 -13.541 15.320 -3.488 1.00 0.00 C ATOM 607 C ASP A 36 -14.273 14.740 -4.713 1.00 0.00 C ATOM 608 O ASP A 36 -14.611 15.463 -5.632 1.00 0.00 O ATOM 609 CB ASP A 36 -12.027 15.087 -3.625 1.00 0.00 C ATOM 610 CG ASP A 36 -11.271 16.216 -2.920 1.00 0.00 C ATOM 611 OD1 ASP A 36 -11.554 17.366 -3.214 1.00 0.00 O ATOM 612 OD2 ASP A 36 -10.422 15.912 -2.099 1.00 0.00 O ATOM 0 H ASP A 36 -13.228 14.199 -1.675 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.774 16.383 -3.433 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -11.755 14.126 -3.189 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.748 15.050 -4.678 1.00 0.00 H new ATOM 744 N SER A 45 -8.765 13.455 -10.632 1.00 0.00 N ATOM 745 CA SER A 45 -9.585 12.282 -10.198 1.00 0.00 C ATOM 746 C SER A 45 -8.681 11.136 -9.726 1.00 0.00 C ATOM 747 O SER A 45 -8.814 10.657 -8.615 1.00 0.00 O ATOM 748 CB SER A 45 -10.377 11.867 -11.438 1.00 0.00 C ATOM 749 OG SER A 45 -11.646 12.508 -11.420 1.00 0.00 O ATOM 0 HA SER A 45 -10.238 12.529 -9.361 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.831 12.141 -12.341 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.504 10.785 -11.458 1.00 0.00 H new ATOM 0 HG SER A 45 -12.156 12.246 -12.215 1.00 0.00 H new ATOM 755 N ASN A 46 -7.758 10.690 -10.554 1.00 0.00 N ATOM 756 CA ASN A 46 -6.846 9.565 -10.125 1.00 0.00 C ATOM 757 C ASN A 46 -6.115 9.946 -8.827 1.00 0.00 C ATOM 758 O ASN A 46 -5.944 9.122 -7.947 1.00 0.00 O ATOM 759 CB ASN A 46 -5.832 9.357 -11.261 1.00 0.00 C ATOM 760 CG ASN A 46 -6.567 8.892 -12.525 1.00 0.00 C ATOM 761 OD1 ASN A 46 -7.169 7.837 -12.532 1.00 0.00 O ATOM 762 ND2 ASN A 46 -6.548 9.636 -13.604 1.00 0.00 N ATOM 0 H ASN A 46 -7.596 11.048 -11.495 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.411 8.653 -9.934 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.297 10.286 -11.460 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.088 8.617 -10.967 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.037 9.328 -14.444 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.044 10.523 -13.603 1.00 0.00 H new ATOM 769 N GLU A 47 -5.692 11.188 -8.692 1.00 0.00 N ATOM 770 CA GLU A 47 -4.982 11.598 -7.427 1.00 0.00 C ATOM 771 C GLU A 47 -5.917 11.405 -6.219 1.00 0.00 C ATOM 772 O GLU A 47 -5.484 10.987 -5.160 1.00 0.00 O ATOM 773 CB GLU A 47 -4.616 13.083 -7.581 1.00 0.00 C ATOM 774 CG GLU A 47 -3.662 13.254 -8.765 1.00 0.00 C ATOM 775 CD GLU A 47 -2.682 14.392 -8.472 1.00 0.00 C ATOM 776 OE1 GLU A 47 -1.823 14.206 -7.625 1.00 0.00 O ATOM 777 OE2 GLU A 47 -2.808 15.431 -9.100 1.00 0.00 O ATOM 0 H GLU A 47 -5.805 11.924 -9.389 1.00 0.00 H new ATOM 0 HA GLU A 47 -4.090 10.994 -7.263 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.517 13.676 -7.738 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -4.148 13.450 -6.667 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.117 12.327 -8.943 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.226 13.471 -9.672 1.00 0.00 H new ATOM 784 N GLN A 48 -7.198 11.700 -6.364 1.00 0.00 N ATOM 785 CA GLN A 48 -8.148 11.520 -5.202 1.00 0.00 C ATOM 786 C GLN A 48 -8.119 10.059 -4.724 1.00 0.00 C ATOM 787 O GLN A 48 -8.130 9.794 -3.536 1.00 0.00 O ATOM 788 CB GLN A 48 -9.549 11.873 -5.729 1.00 0.00 C ATOM 789 CG GLN A 48 -10.587 11.745 -4.614 1.00 0.00 C ATOM 790 CD GLN A 48 -11.908 11.235 -5.205 1.00 0.00 C ATOM 791 OE1 GLN A 48 -12.642 11.990 -5.809 1.00 0.00 O ATOM 792 NE2 GLN A 48 -12.245 9.977 -5.059 1.00 0.00 N ATOM 0 H GLN A 48 -7.622 12.052 -7.222 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.870 12.153 -4.359 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -9.551 12.890 -6.121 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.811 11.212 -6.555 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.230 11.058 -3.846 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -10.740 12.710 -4.132 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -11.631 9.340 -4.552 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -13.122 9.635 -5.452 1.00 0.00 H new ATOM 801 N LEU A 49 -8.077 9.109 -5.636 1.00 0.00 N ATOM 802 CA LEU A 49 -8.044 7.666 -5.205 1.00 0.00 C ATOM 803 C LEU A 49 -6.650 7.295 -4.671 1.00 0.00 C ATOM 804 O LEU A 49 -6.533 6.487 -3.768 1.00 0.00 O ATOM 805 CB LEU A 49 -8.384 6.824 -6.444 1.00 0.00 C ATOM 806 CG LEU A 49 -9.884 6.928 -6.737 1.00 0.00 C ATOM 807 CD1 LEU A 49 -10.207 6.162 -8.020 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.677 6.328 -5.572 1.00 0.00 C ATOM 0 H LEU A 49 -8.064 9.265 -6.644 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.758 7.484 -4.402 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.810 7.173 -7.302 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -8.107 5.783 -6.277 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.157 7.976 -6.860 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.274 6.236 -8.229 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.644 6.589 -8.850 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.933 5.114 -7.897 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.744 6.403 -5.782 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.404 5.280 -5.447 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.448 6.874 -4.657 1.00 0.00 H new ATOM 820 N TRP A 50 -5.588 7.877 -5.204 1.00 0.00 N ATOM 821 CA TRP A 50 -4.212 7.530 -4.683 1.00 0.00 C ATOM 822 C TRP A 50 -4.131 7.845 -3.186 1.00 0.00 C ATOM 823 O TRP A 50 -3.557 7.087 -2.427 1.00 0.00 O ATOM 824 CB TRP A 50 -3.195 8.372 -5.484 1.00 0.00 C ATOM 825 CG TRP A 50 -3.312 8.092 -6.964 1.00 0.00 C ATOM 826 CD1 TRP A 50 -4.028 7.084 -7.534 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.699 8.820 -8.069 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.896 7.161 -8.908 1.00 0.00 N ATOM 829 CE2 TRP A 50 -3.090 8.210 -9.284 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.852 9.942 -8.136 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.660 8.693 -10.515 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -1.413 10.427 -9.381 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.821 9.801 -10.568 1.00 0.00 C ATOM 0 H TRP A 50 -5.611 8.562 -5.960 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.997 6.469 -4.806 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.366 9.432 -5.296 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -2.184 8.147 -5.146 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.605 6.344 -6.999 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.342 6.518 -9.563 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.538 10.433 -7.227 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.977 8.209 -11.427 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.759 11.285 -9.423 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.484 10.179 -11.522 1.00 0.00 H new ATOM 844 N GLU A 51 -4.726 8.933 -2.745 1.00 0.00 N ATOM 845 CA GLU A 51 -4.691 9.238 -1.275 1.00 0.00 C ATOM 846 C GLU A 51 -5.490 8.168 -0.513 1.00 0.00 C ATOM 847 O GLU A 51 -5.152 7.833 0.606 1.00 0.00 O ATOM 848 CB GLU A 51 -5.330 10.624 -1.086 1.00 0.00 C ATOM 849 CG GLU A 51 -4.295 11.709 -1.384 1.00 0.00 C ATOM 850 CD GLU A 51 -4.664 12.988 -0.629 1.00 0.00 C ATOM 851 OE1 GLU A 51 -4.239 13.127 0.506 1.00 0.00 O ATOM 852 OE2 GLU A 51 -5.367 13.806 -1.199 1.00 0.00 O ATOM 0 H GLU A 51 -5.224 9.609 -3.325 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.671 9.236 -0.891 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.188 10.734 -1.749 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.699 10.730 -0.066 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.302 11.371 -1.086 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.256 11.905 -2.456 1.00 0.00 H new ATOM 859 N ILE A 52 -6.542 7.615 -1.103 1.00 0.00 N ATOM 860 CA ILE A 52 -7.325 6.561 -0.371 1.00 0.00 C ATOM 861 C ILE A 52 -6.514 5.262 -0.313 1.00 0.00 C ATOM 862 O ILE A 52 -6.261 4.753 0.764 1.00 0.00 O ATOM 863 CB ILE A 52 -8.652 6.364 -1.127 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.383 7.724 -1.167 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.499 5.309 -0.396 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.893 7.564 -1.418 1.00 0.00 C ATOM 0 H ILE A 52 -6.881 7.845 -2.037 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.531 6.861 0.656 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.476 6.015 -2.145 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.226 8.247 -0.223 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.950 8.345 -1.951 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.440 5.166 -0.927 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.954 4.365 -0.362 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.704 5.647 0.620 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.365 8.546 -1.438 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -11.052 7.066 -2.374 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.333 6.966 -0.620 1.00 0.00 H new ATOM 878 N MET A 53 -6.077 4.721 -1.440 1.00 0.00 N ATOM 879 CA MET A 53 -5.259 3.456 -1.355 1.00 0.00 C ATOM 880 C MET A 53 -3.981 3.708 -0.525 1.00 0.00 C ATOM 881 O MET A 53 -3.441 2.786 0.058 1.00 0.00 O ATOM 882 CB MET A 53 -4.918 2.979 -2.786 1.00 0.00 C ATOM 883 CG MET A 53 -4.222 4.074 -3.606 1.00 0.00 C ATOM 884 SD MET A 53 -4.919 4.094 -5.285 1.00 0.00 S ATOM 885 CE MET A 53 -4.285 2.486 -5.814 1.00 0.00 C ATOM 0 H MET A 53 -6.243 5.084 -2.378 1.00 0.00 H new ATOM 0 HA MET A 53 -5.830 2.674 -0.854 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.274 2.102 -2.732 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.832 2.672 -3.293 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.360 5.045 -3.130 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.149 3.888 -3.647 1.00 0.00 H new ATOM 0 HE1 MET A 53 -3.915 2.559 -6.837 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.472 2.181 -5.155 1.00 0.00 H new ATOM 0 HE3 MET A 53 -5.085 1.747 -5.770 1.00 0.00 H new ATOM 895 N GLN A 54 -3.503 4.943 -0.432 1.00 0.00 N ATOM 896 CA GLN A 54 -2.279 5.199 0.406 1.00 0.00 C ATOM 897 C GLN A 54 -2.591 4.908 1.886 1.00 0.00 C ATOM 898 O GLN A 54 -1.742 4.416 2.606 1.00 0.00 O ATOM 899 CB GLN A 54 -1.912 6.681 0.222 1.00 0.00 C ATOM 900 CG GLN A 54 -1.090 6.849 -1.056 1.00 0.00 C ATOM 901 CD GLN A 54 -1.141 8.315 -1.507 1.00 0.00 C ATOM 902 OE1 GLN A 54 -1.428 8.594 -2.655 1.00 0.00 O ATOM 903 NE2 GLN A 54 -0.874 9.272 -0.653 1.00 0.00 N ATOM 0 H GLN A 54 -3.901 5.763 -0.891 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.453 4.556 0.103 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.817 7.286 0.167 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.343 7.035 1.082 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.058 6.547 -0.880 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.482 6.202 -1.841 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -0.633 9.043 0.311 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -0.907 10.247 -0.952 1.00 0.00 H new ATOM 912 N LEU A 55 -3.801 5.191 2.355 1.00 0.00 N ATOM 913 CA LEU A 55 -4.125 4.897 3.804 1.00 0.00 C ATOM 914 C LEU A 55 -3.830 3.416 4.116 1.00 0.00 C ATOM 915 O LEU A 55 -3.392 3.086 5.200 1.00 0.00 O ATOM 916 CB LEU A 55 -5.643 5.155 4.012 1.00 0.00 C ATOM 917 CG LEU A 55 -5.983 6.610 4.436 1.00 0.00 C ATOM 918 CD1 LEU A 55 -4.964 7.188 5.433 1.00 0.00 C ATOM 919 CD2 LEU A 55 -6.054 7.507 3.199 1.00 0.00 C ATOM 0 H LEU A 55 -4.559 5.603 1.811 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.523 5.529 4.458 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.171 4.924 3.087 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.017 4.469 4.772 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.950 6.581 4.938 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.250 8.207 5.696 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -4.946 6.573 6.333 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -3.973 7.195 4.978 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.293 8.526 3.502 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.092 7.497 2.686 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.828 7.138 2.526 1.00 0.00 H new ATOM 931 N HIS A 56 -4.067 2.516 3.175 1.00 0.00 N ATOM 932 CA HIS A 56 -3.796 1.054 3.445 1.00 0.00 C ATOM 933 C HIS A 56 -2.363 0.860 3.968 1.00 0.00 C ATOM 934 O HIS A 56 -2.126 0.035 4.832 1.00 0.00 O ATOM 935 CB HIS A 56 -3.971 0.316 2.108 1.00 0.00 C ATOM 936 CG HIS A 56 -4.030 -1.165 2.361 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.226 -1.829 2.580 1.00 0.00 N ATOM 938 CD2 HIS A 56 -3.049 -2.121 2.434 1.00 0.00 C ATOM 939 CE1 HIS A 56 -4.936 -3.129 2.774 1.00 0.00 C ATOM 940 NE2 HIS A 56 -3.623 -3.361 2.695 1.00 0.00 N ATOM 0 H HIS A 56 -4.431 2.726 2.246 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.479 0.668 4.202 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.883 0.648 1.613 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.142 0.549 1.440 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.156 -1.410 2.592 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -1.992 -1.939 2.308 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -5.675 -3.892 2.970 1.00 0.00 H new ATOM 948 N HIS A 57 -1.407 1.615 3.463 1.00 0.00 N ATOM 949 CA HIS A 57 0.003 1.450 3.969 1.00 0.00 C ATOM 950 C HIS A 57 0.083 1.928 5.423 1.00 0.00 C ATOM 951 O HIS A 57 0.604 1.233 6.275 1.00 0.00 O ATOM 952 CB HIS A 57 0.909 2.308 3.070 1.00 0.00 C ATOM 953 CG HIS A 57 1.385 1.480 1.910 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.486 1.838 1.149 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.925 0.303 1.372 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.651 0.894 0.206 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.727 -0.066 0.298 1.00 0.00 N ATOM 0 H HIS A 57 -1.536 2.322 2.740 1.00 0.00 H new ATOM 0 HA HIS A 57 0.317 0.407 3.939 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.363 3.180 2.710 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.760 2.679 3.640 1.00 0.00 H new ATOM 0 HD2 HIS A 57 0.070 -0.252 1.729 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.436 0.910 -0.536 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.631 -0.892 -0.293 1.00 0.00 H new ATOM 965 N GLN A 58 -0.442 3.100 5.720 1.00 0.00 N ATOM 966 CA GLN A 58 -0.396 3.588 7.143 1.00 0.00 C ATOM 967 C GLN A 58 -1.181 2.619 8.047 1.00 0.00 C ATOM 968 O GLN A 58 -0.784 2.363 9.169 1.00 0.00 O ATOM 969 CB GLN A 58 -1.045 4.982 7.158 1.00 0.00 C ATOM 970 CG GLN A 58 -0.571 5.756 8.390 1.00 0.00 C ATOM 971 CD GLN A 58 -0.771 7.259 8.160 1.00 0.00 C ATOM 972 OE1 GLN A 58 0.165 7.958 7.827 1.00 0.00 O ATOM 973 NE2 GLN A 58 -1.956 7.794 8.322 1.00 0.00 N ATOM 0 H GLN A 58 -0.891 3.728 5.054 1.00 0.00 H new ATOM 0 HA GLN A 58 0.628 3.638 7.514 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.782 5.526 6.251 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.131 4.889 7.170 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.128 5.435 9.270 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.481 5.544 8.583 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -2.745 7.211 8.602 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.090 8.793 8.169 1.00 0.00 H new ATOM 982 N ARG A 59 -2.284 2.068 7.569 1.00 0.00 N ATOM 983 CA ARG A 59 -3.061 1.105 8.431 1.00 0.00 C ATOM 984 C ARG A 59 -2.227 -0.161 8.671 1.00 0.00 C ATOM 985 O ARG A 59 -2.118 -0.626 9.790 1.00 0.00 O ATOM 986 CB ARG A 59 -4.355 0.751 7.674 1.00 0.00 C ATOM 987 CG ARG A 59 -5.503 1.632 8.178 1.00 0.00 C ATOM 988 CD ARG A 59 -6.375 2.076 6.992 1.00 0.00 C ATOM 989 NE ARG A 59 -7.676 2.564 7.580 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.794 2.557 6.868 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.811 2.165 5.614 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.909 2.967 7.417 1.00 0.00 N ATOM 0 H ARG A 59 -2.672 2.239 6.641 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.294 1.549 9.399 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.214 0.898 6.603 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.599 -0.301 7.822 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.107 1.082 8.900 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.104 2.505 8.695 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.885 2.867 6.424 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.546 1.248 6.304 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.696 2.905 8.541 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.949 1.856 5.165 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.686 2.170 5.090 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.913 3.288 8.385 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.774 2.965 6.877 1.00 0.00 H new ATOM 1006 N SER A 60 -1.625 -0.722 7.636 1.00 0.00 N ATOM 1007 CA SER A 60 -0.793 -1.958 7.849 1.00 0.00 C ATOM 1008 C SER A 60 0.378 -1.632 8.783 1.00 0.00 C ATOM 1009 O SER A 60 0.720 -2.423 9.639 1.00 0.00 O ATOM 1010 CB SER A 60 -0.271 -2.391 6.470 1.00 0.00 C ATOM 1011 OG SER A 60 0.148 -1.243 5.743 1.00 0.00 O ATOM 0 H SER A 60 -1.673 -0.385 6.675 1.00 0.00 H new ATOM 0 HA SER A 60 -1.378 -2.757 8.305 1.00 0.00 H new ATOM 0 HB2 SER A 60 0.561 -3.086 6.585 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.052 -2.917 5.922 1.00 0.00 H new ATOM 0 HG SER A 60 0.103 -0.454 6.323 1.00 0.00 H new ATOM 1017 N ARG A 61 0.992 -0.472 8.642 1.00 0.00 N ATOM 1018 CA ARG A 61 2.134 -0.127 9.560 1.00 0.00 C ATOM 1019 C ARG A 61 1.607 -0.018 10.999 1.00 0.00 C ATOM 1020 O ARG A 61 2.227 -0.508 11.924 1.00 0.00 O ATOM 1021 CB ARG A 61 2.693 1.227 9.092 1.00 0.00 C ATOM 1022 CG ARG A 61 4.065 1.459 9.727 1.00 0.00 C ATOM 1023 CD ARG A 61 5.151 0.862 8.830 1.00 0.00 C ATOM 1024 NE ARG A 61 5.103 1.675 7.575 1.00 0.00 N ATOM 1025 CZ ARG A 61 5.574 2.912 7.538 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.107 3.474 8.600 1.00 0.00 N ATOM 1027 NH2 ARG A 61 5.511 3.595 6.424 1.00 0.00 N ATOM 0 H ARG A 61 0.758 0.236 7.946 1.00 0.00 H new ATOM 0 HA ARG A 61 2.913 -0.889 9.536 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.776 1.242 8.005 1.00 0.00 H new ATOM 0 HB3 ARG A 61 2.011 2.030 9.371 1.00 0.00 H new ATOM 0 HG2 ARG A 61 4.238 2.526 9.864 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.102 1.001 10.715 1.00 0.00 H new ATOM 0 HD2 ARG A 61 6.131 0.922 9.303 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.960 -0.192 8.626 1.00 0.00 H new ATOM 0 HE ARG A 61 4.699 1.268 6.731 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.164 2.956 9.477 1.00 0.00 H new ATOM 0 HH12 ARG A 61 6.463 4.428 8.547 1.00 0.00 H new ATOM 0 HH21 ARG A 61 5.101 3.174 5.590 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.872 4.548 6.389 1.00 0.00 H new ATOM 1041 N TYR A 62 0.462 0.606 11.195 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.091 0.720 12.592 1.00 0.00 C ATOM 1043 C TYR A 62 -0.398 -0.685 13.138 1.00 0.00 C ATOM 1044 O TYR A 62 0.002 -1.024 14.238 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.384 1.553 12.491 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.030 1.665 13.853 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.939 0.686 14.275 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -1.717 2.738 14.694 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.532 0.781 15.538 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.312 2.834 15.957 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.220 1.855 16.379 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.805 1.949 17.624 1.00 0.00 O ATOM 0 H TYR A 62 -0.105 1.034 10.463 1.00 0.00 H new ATOM 0 HA TYR A 62 0.620 1.195 13.268 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.158 2.546 12.103 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.074 1.086 11.789 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.182 -0.142 13.625 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.016 3.492 14.369 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.231 0.025 15.864 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.071 3.663 16.606 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.128 1.796 18.316 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.093 -1.510 12.379 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.399 -2.895 12.884 1.00 0.00 C ATOM 1064 C ILE A 63 -0.100 -3.715 12.932 1.00 0.00 C ATOM 1065 O ILE A 63 0.116 -4.477 13.856 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.412 -3.519 11.905 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.710 -2.702 11.927 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.716 -4.959 12.327 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.686 -3.249 10.881 1.00 0.00 C ATOM 0 H ILE A 63 -1.455 -1.291 11.451 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.818 -2.875 13.890 1.00 0.00 H new ATOM 0 HB ILE A 63 -1.991 -3.516 10.900 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.162 -2.747 12.918 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.494 -1.653 11.723 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.433 -5.398 11.633 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.796 -5.543 12.316 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.136 -4.962 13.333 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.606 -2.665 10.901 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.235 -3.181 9.891 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -4.913 -4.291 11.105 1.00 0.00 H new ATOM 1081 N TYR A 64 0.775 -3.558 11.958 1.00 0.00 N ATOM 1082 CA TYR A 64 2.063 -4.331 11.994 1.00 0.00 C ATOM 1083 C TYR A 64 2.904 -3.842 13.179 1.00 0.00 C ATOM 1084 O TYR A 64 3.507 -4.629 13.881 1.00 0.00 O ATOM 1085 CB TYR A 64 2.796 -4.043 10.672 1.00 0.00 C ATOM 1086 CG TYR A 64 3.936 -5.018 10.501 1.00 0.00 C ATOM 1087 CD1 TYR A 64 5.062 -4.939 11.330 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.862 -6.004 9.514 1.00 0.00 C ATOM 1089 CE1 TYR A 64 6.115 -5.849 11.167 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.912 -6.912 9.351 1.00 0.00 C ATOM 1091 CZ TYR A 64 6.038 -6.836 10.177 1.00 0.00 C ATOM 1092 OH TYR A 64 7.074 -7.734 10.016 1.00 0.00 O ATOM 0 H TYR A 64 0.656 -2.940 11.155 1.00 0.00 H new ATOM 0 HA TYR A 64 1.887 -5.401 12.109 1.00 0.00 H new ATOM 0 HB2 TYR A 64 2.103 -4.128 9.835 1.00 0.00 H new ATOM 0 HB3 TYR A 64 3.175 -3.021 10.670 1.00 0.00 H new ATOM 0 HD1 TYR A 64 5.119 -4.178 12.094 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.993 -6.065 8.876 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.985 -5.789 11.804 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.854 -7.673 8.587 1.00 0.00 H new ATOM 0 HH TYR A 64 7.516 -7.882 10.878 1.00 0.00 H new ATOM 1102 N THR A 65 2.952 -2.546 13.412 1.00 0.00 N ATOM 1103 CA THR A 65 3.772 -2.033 14.562 1.00 0.00 C ATOM 1104 C THR A 65 3.256 -2.614 15.888 1.00 0.00 C ATOM 1105 O THR A 65 4.038 -2.967 16.748 1.00 0.00 O ATOM 1106 CB THR A 65 3.636 -0.499 14.563 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.080 0.013 13.315 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.486 0.096 15.687 1.00 0.00 C ATOM 0 H THR A 65 2.468 -1.833 12.866 1.00 0.00 H new ATOM 0 HA THR A 65 4.815 -2.331 14.456 1.00 0.00 H new ATOM 0 HB THR A 65 2.592 -0.230 14.721 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.320 0.079 12.699 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.386 1.181 15.683 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.147 -0.296 16.646 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.531 -0.173 15.534 1.00 0.00 H new ATOM 1116 N LEU A 66 1.954 -2.700 16.079 1.00 0.00 N ATOM 1117 CA LEU A 66 1.447 -3.247 17.386 1.00 0.00 C ATOM 1118 C LEU A 66 1.413 -4.793 17.408 1.00 0.00 C ATOM 1119 O LEU A 66 1.639 -5.391 18.444 1.00 0.00 O ATOM 1120 CB LEU A 66 0.047 -2.633 17.621 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.995 -3.218 16.658 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.562 -4.524 17.235 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -2.133 -2.205 16.470 1.00 0.00 C ATOM 0 H LEU A 66 1.238 -2.423 15.407 1.00 0.00 H new ATOM 0 HA LEU A 66 2.126 -2.972 18.193 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.264 -2.817 18.650 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.097 -1.552 17.491 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.524 -3.426 15.697 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.301 -4.935 16.547 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.754 -5.243 17.371 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.034 -4.322 18.197 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.876 -2.615 15.787 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.600 -1.999 17.433 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.732 -1.280 16.057 1.00 0.00 H new ATOM 1135 N TYR A 67 1.121 -5.452 16.300 1.00 0.00 N ATOM 1136 CA TYR A 67 1.070 -6.964 16.328 1.00 0.00 C ATOM 1137 C TYR A 67 2.457 -7.595 16.090 1.00 0.00 C ATOM 1138 O TYR A 67 2.738 -8.660 16.609 1.00 0.00 O ATOM 1139 CB TYR A 67 0.087 -7.397 15.220 1.00 0.00 C ATOM 1140 CG TYR A 67 -0.055 -8.909 15.223 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.926 -9.702 14.615 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -1.158 -9.519 15.841 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.806 -11.097 14.621 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.277 -10.916 15.848 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.295 -11.704 15.238 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.410 -13.079 15.244 1.00 0.00 O ATOM 0 H TYR A 67 0.920 -5.022 15.397 1.00 0.00 H new ATOM 0 HA TYR A 67 0.744 -7.305 17.310 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.885 -6.931 15.380 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.447 -7.058 14.249 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.777 -9.237 14.140 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.916 -8.911 16.312 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.563 -11.706 14.149 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.126 -11.384 16.324 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.231 -13.337 15.714 1.00 0.00 H new ATOM 1156 N TYR A 68 3.317 -6.981 15.300 1.00 0.00 N ATOM 1157 CA TYR A 68 4.661 -7.614 15.040 1.00 0.00 C ATOM 1158 C TYR A 68 5.790 -7.030 15.922 1.00 0.00 C ATOM 1159 O TYR A 68 6.883 -7.567 15.929 1.00 0.00 O ATOM 1160 CB TYR A 68 4.958 -7.375 13.551 1.00 0.00 C ATOM 1161 CG TYR A 68 4.414 -8.526 12.734 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.854 -9.830 12.990 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.469 -8.293 11.720 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.355 -10.899 12.239 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.971 -9.365 10.970 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.414 -10.667 11.229 1.00 0.00 C ATOM 1167 OH TYR A 68 2.922 -11.723 10.489 1.00 0.00 O ATOM 0 H TYR A 68 3.153 -6.089 14.833 1.00 0.00 H new ATOM 0 HA TYR A 68 4.626 -8.674 15.292 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.505 -6.439 13.225 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.033 -7.281 13.395 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.580 -10.011 13.769 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.127 -7.288 11.520 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.696 -11.904 12.438 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.244 -9.187 10.191 1.00 0.00 H new ATOM 0 HH TYR A 68 2.278 -11.389 9.831 1.00 0.00 H new ATOM 1177 N LYS A 69 5.566 -5.959 16.666 1.00 0.00 N ATOM 1178 CA LYS A 69 6.673 -5.411 17.521 1.00 0.00 C ATOM 1179 C LYS A 69 6.203 -5.241 18.975 1.00 0.00 C ATOM 1180 O LYS A 69 6.782 -5.810 19.882 1.00 0.00 O ATOM 1181 CB LYS A 69 7.033 -4.047 16.926 1.00 0.00 C ATOM 1182 CG LYS A 69 7.425 -4.193 15.453 1.00 0.00 C ATOM 1183 CD LYS A 69 7.212 -2.854 14.736 1.00 0.00 C ATOM 1184 CE LYS A 69 8.559 -2.147 14.552 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.851 -1.528 15.875 1.00 0.00 N ATOM 0 H LYS A 69 4.682 -5.453 16.715 1.00 0.00 H new ATOM 0 HA LYS A 69 7.529 -6.086 17.534 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.185 -3.368 17.018 1.00 0.00 H new ATOM 0 HB3 LYS A 69 7.857 -3.605 17.486 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.468 -4.501 15.371 1.00 0.00 H new ATOM 0 HG3 LYS A 69 6.825 -4.971 14.981 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.742 -3.020 13.767 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.536 -2.224 15.314 1.00 0.00 H new ATOM 0 HE2 LYS A 69 9.339 -2.852 14.265 1.00 0.00 H new ATOM 0 HE3 LYS A 69 8.506 -1.393 13.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 9.118 -0.532 15.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.005 -1.581 16.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 9.634 -2.038 16.332 1.00 0.00 H new ATOM 1199 N ARG A 70 5.165 -4.464 19.211 1.00 0.00 N ATOM 1200 CA ARG A 70 4.683 -4.274 20.629 1.00 0.00 C ATOM 1201 C ARG A 70 4.043 -5.567 21.165 1.00 0.00 C ATOM 1202 O ARG A 70 4.060 -5.814 22.356 1.00 0.00 O ATOM 1203 CB ARG A 70 3.638 -3.150 20.598 1.00 0.00 C ATOM 1204 CG ARG A 70 4.289 -1.851 20.114 1.00 0.00 C ATOM 1205 CD ARG A 70 3.305 -0.683 20.295 1.00 0.00 C ATOM 1206 NE ARG A 70 2.953 -0.646 21.762 1.00 0.00 N ATOM 1207 CZ ARG A 70 1.800 -0.143 22.177 1.00 0.00 C ATOM 1208 NH1 ARG A 70 0.939 0.393 21.341 1.00 0.00 N ATOM 1209 NH2 ARG A 70 1.513 -0.157 23.453 1.00 0.00 N ATOM 0 H ARG A 70 4.637 -3.960 18.498 1.00 0.00 H new ATOM 0 HA ARG A 70 5.517 -4.023 21.285 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.815 -3.424 19.937 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.214 -3.007 21.592 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.204 -1.660 20.675 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.572 -1.943 19.065 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.757 0.258 19.980 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.413 -0.828 19.685 1.00 0.00 H new ATOM 0 HE ARG A 70 3.614 -1.015 22.446 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.151 0.429 20.344 1.00 0.00 H new ATOM 0 HH12 ARG A 70 0.059 0.773 21.689 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.175 -0.553 24.120 1.00 0.00 H new ATOM 0 HH22 ARG A 70 0.627 0.228 23.781 1.00 0.00 H new ATOM 1223 N LYS A 71 3.466 -6.397 20.309 1.00 0.00 N ATOM 1224 CA LYS A 71 2.821 -7.660 20.792 1.00 0.00 C ATOM 1225 C LYS A 71 1.713 -7.329 21.800 1.00 0.00 C ATOM 1226 O LYS A 71 1.580 -7.978 22.820 1.00 0.00 O ATOM 1227 CB LYS A 71 3.933 -8.485 21.453 1.00 0.00 C ATOM 1228 CG LYS A 71 3.738 -9.967 21.126 1.00 0.00 C ATOM 1229 CD LYS A 71 4.901 -10.775 21.705 1.00 0.00 C ATOM 1230 CE LYS A 71 6.034 -10.848 20.678 1.00 0.00 C ATOM 1231 NZ LYS A 71 7.251 -11.175 21.471 1.00 0.00 N ATOM 0 H LYS A 71 3.418 -6.247 19.301 1.00 0.00 H new ATOM 0 HA LYS A 71 2.359 -8.216 19.976 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.908 -8.150 21.099 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.917 -8.336 22.533 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.794 -10.321 21.540 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.685 -10.108 20.046 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.258 -10.310 22.624 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.566 -11.779 21.965 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.836 -11.611 19.925 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.150 -9.902 20.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 8.072 -11.242 20.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.418 -10.428 22.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.115 -12.084 21.957 1.00 0.00 H new ATOM 1245 N ALA A 72 0.904 -6.328 21.513 1.00 0.00 N ATOM 1246 CA ALA A 72 -0.205 -5.968 22.449 1.00 0.00 C ATOM 1247 C ALA A 72 -1.563 -6.318 21.812 1.00 0.00 C ATOM 1248 O ALA A 72 -2.543 -5.627 22.020 1.00 0.00 O ATOM 1249 CB ALA A 72 -0.084 -4.456 22.658 1.00 0.00 C ATOM 0 H ALA A 72 0.968 -5.751 20.674 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.141 -6.511 23.392 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.868 -4.119 23.336 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.891 -4.225 23.087 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.189 -3.947 21.700 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.632 -7.385 21.039 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.927 -7.769 20.395 1.00 0.00 C ATOM 1257 C ILE A 73 -2.953 -9.287 20.137 1.00 0.00 C ATOM 1258 O ILE A 73 -1.919 -9.931 20.142 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.966 -6.983 19.074 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -4.255 -7.315 18.313 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.756 -7.350 18.207 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.364 -6.427 17.070 1.00 0.00 C ATOM 0 H ILE A 73 -0.847 -8.001 20.830 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.790 -7.540 21.020 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.937 -5.917 19.298 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.257 -8.366 18.022 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.120 -7.161 18.959 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.793 -6.788 17.274 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.838 -7.106 18.741 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.775 -8.418 17.988 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.281 -6.666 16.532 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.382 -5.380 17.372 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.506 -6.603 16.421 1.00 0.00 H new ATOM 1274 N SER A 74 -4.112 -9.865 19.911 1.00 0.00 N ATOM 1275 CA SER A 74 -4.166 -11.337 19.654 1.00 0.00 C ATOM 1276 C SER A 74 -4.495 -11.604 18.178 1.00 0.00 C ATOM 1277 O SER A 74 -5.207 -10.842 17.554 1.00 0.00 O ATOM 1278 CB SER A 74 -5.281 -11.870 20.556 1.00 0.00 C ATOM 1279 OG SER A 74 -6.305 -10.890 20.668 1.00 0.00 O ATOM 0 H SER A 74 -5.012 -9.385 19.894 1.00 0.00 H new ATOM 0 HA SER A 74 -3.213 -11.823 19.864 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.689 -12.793 20.143 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.883 -12.111 21.542 1.00 0.00 H new ATOM 0 HG SER A 74 -7.021 -11.230 21.244 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.975 -12.682 17.610 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.262 -12.999 16.158 1.00 0.00 C ATOM 1287 C LYS A 75 -5.764 -12.857 15.830 1.00 0.00 C ATOM 1288 O LYS A 75 -6.117 -12.502 14.723 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.820 -14.454 15.935 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.744 -14.741 14.434 1.00 0.00 C ATOM 1291 CD LYS A 75 -3.422 -16.220 14.212 1.00 0.00 C ATOM 1292 CE LYS A 75 -1.906 -16.427 14.261 1.00 0.00 C ATOM 1293 NZ LYS A 75 -1.725 -17.887 14.490 1.00 0.00 N ATOM 0 H LYS A 75 -3.369 -13.351 18.085 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.728 -12.304 15.510 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.848 -14.625 16.398 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.524 -15.136 16.411 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.691 -14.489 13.956 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.978 -14.118 13.972 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.907 -16.827 14.976 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.813 -16.547 13.249 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.434 -16.112 13.330 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.453 -15.843 15.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.710 -18.108 14.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.179 -18.157 15.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -2.160 -18.418 13.708 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.651 -13.125 16.773 1.00 0.00 N ATOM 1308 CA ASP A 76 -8.119 -12.980 16.466 1.00 0.00 C ATOM 1309 C ASP A 76 -8.425 -11.518 16.118 1.00 0.00 C ATOM 1310 O ASP A 76 -9.014 -11.237 15.090 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.888 -13.402 17.730 1.00 0.00 C ATOM 1312 CG ASP A 76 -9.108 -14.915 17.713 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -9.627 -15.408 16.725 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -8.753 -15.556 18.688 1.00 0.00 O ATOM 0 H ASP A 76 -6.428 -13.431 17.720 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.411 -13.599 15.618 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.329 -13.115 18.621 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.847 -12.885 17.775 1.00 0.00 H new ATOM 1319 N LEU A 77 -8.016 -10.577 16.950 1.00 0.00 N ATOM 1320 CA LEU A 77 -8.284 -9.135 16.615 1.00 0.00 C ATOM 1321 C LEU A 77 -7.480 -8.768 15.361 1.00 0.00 C ATOM 1322 O LEU A 77 -7.993 -8.140 14.455 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.819 -8.289 17.814 1.00 0.00 C ATOM 1324 CG LEU A 77 -8.076 -6.806 17.522 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.579 -6.526 17.582 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.346 -5.938 18.557 1.00 0.00 C ATOM 0 H LEU A 77 -7.520 -10.741 17.826 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.342 -8.956 16.421 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.353 -8.591 18.715 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.758 -8.456 18.001 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.702 -6.565 16.527 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.761 -5.472 17.374 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -10.093 -7.136 16.839 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.955 -6.770 18.575 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.532 -4.885 18.345 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.712 -6.177 19.555 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.275 -6.135 18.506 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.226 -9.171 15.293 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.406 -8.849 14.072 1.00 0.00 C ATOM 1340 C TYR A 78 -6.063 -9.489 12.832 1.00 0.00 C ATOM 1341 O TYR A 78 -6.113 -8.882 11.777 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.997 -9.432 14.320 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.119 -9.238 13.099 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.092 -8.002 12.438 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.334 -10.296 12.631 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.278 -7.828 11.312 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.519 -10.122 11.506 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.492 -8.887 10.846 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.690 -8.716 9.737 1.00 0.00 O ATOM 0 H TYR A 78 -5.742 -9.700 16.018 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.344 -7.776 13.893 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.542 -8.945 15.183 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -4.073 -10.493 14.556 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.699 -7.184 12.797 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.356 -11.249 13.138 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.257 -6.876 10.803 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.911 -10.940 11.147 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.210 -9.549 9.549 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.589 -10.694 12.952 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.261 -11.331 11.766 1.00 0.00 C ATOM 1361 C ASP A 79 -8.599 -10.623 11.514 1.00 0.00 C ATOM 1362 O ASP A 79 -8.949 -10.333 10.386 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.495 -12.808 12.122 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.963 -13.564 10.878 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -7.142 -13.793 10.004 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -9.133 -13.902 10.819 1.00 0.00 O ATOM 0 H ASP A 79 -6.582 -11.254 13.805 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.653 -11.251 10.865 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.576 -13.251 12.505 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.241 -12.889 12.912 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.346 -10.320 12.562 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.660 -9.601 12.366 1.00 0.00 C ATOM 1373 C TRP A 80 -10.424 -8.286 11.600 1.00 0.00 C ATOM 1374 O TRP A 80 -11.227 -7.900 10.772 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.212 -9.312 13.777 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.541 -8.632 13.679 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.725 -9.261 13.494 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.843 -7.209 13.766 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.733 -8.313 13.459 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.239 -7.034 13.622 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -12.048 -6.065 13.953 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.825 -5.768 13.662 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.634 -4.790 13.994 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -14.019 -4.641 13.848 1.00 0.00 C ATOM 0 H TRP A 80 -9.108 -10.535 13.530 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.364 -10.199 11.787 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.311 -10.243 14.335 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.513 -8.683 14.328 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.861 -10.327 13.391 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.721 -8.533 13.329 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.979 -6.168 14.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.894 -5.660 13.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -12.013 -3.918 14.139 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.463 -3.657 13.879 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.321 -7.604 11.853 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.052 -6.328 11.103 1.00 0.00 C ATOM 1397 C LEU A 81 -8.728 -6.669 9.642 1.00 0.00 C ATOM 1398 O LEU A 81 -9.263 -6.070 8.728 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.840 -5.661 11.773 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.176 -5.305 13.222 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.889 -4.960 13.970 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -9.113 -4.098 13.245 1.00 0.00 C ATOM 0 H LEU A 81 -8.610 -7.871 12.533 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.913 -5.660 11.121 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.982 -6.333 11.744 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.559 -4.762 11.224 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.663 -6.154 13.702 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -7.126 -4.706 15.003 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.217 -5.818 13.952 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.405 -4.110 13.489 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.353 -3.843 14.277 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.625 -3.249 12.766 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.030 -4.339 12.708 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.865 -7.643 9.411 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.528 -8.025 7.987 1.00 0.00 C ATOM 1416 C ILE A 82 -8.824 -8.377 7.217 1.00 0.00 C ATOM 1417 O ILE A 82 -8.919 -8.135 6.029 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.588 -9.255 8.067 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.240 -8.850 8.696 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.339 -9.833 6.666 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.545 -7.782 7.839 1.00 0.00 C ATOM 0 H ILE A 82 -7.386 -8.182 10.132 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.044 -7.205 7.458 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.067 -10.013 8.687 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.403 -8.467 9.703 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.597 -9.726 8.788 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.677 -10.696 6.741 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.287 -10.140 6.225 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -5.875 -9.074 6.036 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.595 -7.508 8.298 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.364 -8.178 6.840 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.182 -6.900 7.770 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.819 -8.944 7.878 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.092 -9.299 7.151 1.00 0.00 C ATOM 1435 C LYS A 83 -12.114 -8.139 7.159 1.00 0.00 C ATOM 1436 O LYS A 83 -13.064 -8.165 6.399 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.674 -10.521 7.876 1.00 0.00 C ATOM 1438 CG LYS A 83 -11.088 -11.800 7.273 1.00 0.00 C ATOM 1439 CD LYS A 83 -9.883 -12.251 8.101 1.00 0.00 C ATOM 1440 CE LYS A 83 -9.709 -13.765 7.968 1.00 0.00 C ATOM 1441 NZ LYS A 83 -9.413 -13.992 6.526 1.00 0.00 N ATOM 0 H LYS A 83 -9.805 -9.172 8.872 1.00 0.00 H new ATOM 0 HA LYS A 83 -10.878 -9.506 6.103 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.444 -10.469 8.940 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.760 -10.528 7.785 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -11.844 -12.585 7.254 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.787 -11.623 6.240 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -8.983 -11.740 7.760 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -10.026 -11.981 9.147 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -8.897 -14.126 8.599 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -10.611 -14.295 8.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -8.956 -14.919 6.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -10.299 -13.970 5.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -8.776 -13.246 6.181 1.00 0.00 H new ATOM 1455 N GLU A 84 -11.953 -7.128 7.998 1.00 0.00 N ATOM 1456 CA GLU A 84 -12.956 -6.005 8.008 1.00 0.00 C ATOM 1457 C GLU A 84 -12.410 -4.729 7.326 1.00 0.00 C ATOM 1458 O GLU A 84 -12.881 -3.641 7.593 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.229 -5.726 9.478 1.00 0.00 C ATOM 1460 CG GLU A 84 -13.916 -6.927 10.118 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.301 -7.120 9.497 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.114 -6.218 9.616 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.524 -8.167 8.912 1.00 0.00 O ATOM 0 H GLU A 84 -11.185 -7.035 8.663 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.852 -6.285 7.454 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.294 -5.513 9.996 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.858 -4.841 9.578 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.313 -7.823 9.972 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.007 -6.776 11.194 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.428 -4.851 6.445 1.00 0.00 N ATOM 1471 CA LYS A 85 -10.838 -3.667 5.714 1.00 0.00 C ATOM 1472 C LYS A 85 -9.904 -2.844 6.611 1.00 0.00 C ATOM 1473 O LYS A 85 -10.194 -1.713 6.950 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.005 -2.809 5.193 1.00 0.00 C ATOM 1475 CG LYS A 85 -11.643 -2.233 3.822 1.00 0.00 C ATOM 1476 CD LYS A 85 -12.924 -1.862 3.071 1.00 0.00 C ATOM 1477 CE LYS A 85 -12.594 -1.582 1.603 1.00 0.00 C ATOM 1478 NZ LYS A 85 -13.784 -2.054 0.844 1.00 0.00 N ATOM 0 H LYS A 85 -11.002 -5.744 6.198 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.225 -4.020 4.885 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -12.909 -3.413 5.118 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.218 -2.002 5.894 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.010 -1.353 3.941 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.071 -2.962 3.249 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -13.648 -2.673 3.143 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.383 -0.984 3.525 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -12.414 -0.520 1.434 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -11.693 -2.111 1.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -13.633 -1.895 -0.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -13.927 -3.069 1.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -14.625 -1.528 1.155 1.00 0.00 H new ATOM 1492 N TYR A 86 -8.769 -3.403 6.977 1.00 0.00 N ATOM 1493 CA TYR A 86 -7.793 -2.661 7.826 1.00 0.00 C ATOM 1494 C TYR A 86 -6.398 -2.794 7.201 1.00 0.00 C ATOM 1495 O TYR A 86 -5.806 -1.823 6.771 1.00 0.00 O ATOM 1496 CB TYR A 86 -7.838 -3.352 9.190 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.100 -2.967 9.914 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.341 -3.462 9.485 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.029 -2.117 11.022 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.507 -3.098 10.173 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.193 -1.756 11.706 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.432 -2.246 11.283 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.582 -1.890 11.957 1.00 0.00 O ATOM 0 H TYR A 86 -8.482 -4.347 6.719 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.024 -1.599 7.913 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -7.797 -4.434 9.062 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -6.967 -3.068 9.781 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.398 -4.119 8.630 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.072 -1.738 11.350 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.465 -3.475 9.847 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.135 -1.099 12.561 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.361 -1.668 12.886 1.00 0.00 H new ATOM 1513 N ALA A 87 -5.881 -4.001 7.129 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.539 -4.218 6.513 1.00 0.00 C ATOM 1515 C ALA A 87 -4.592 -5.468 5.622 1.00 0.00 C ATOM 1516 O ALA A 87 -5.494 -6.276 5.750 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.587 -4.433 7.690 1.00 0.00 C ATOM 0 H ALA A 87 -6.337 -4.846 7.473 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.218 -3.383 5.891 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.577 -4.600 7.315 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.595 -3.551 8.331 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -3.909 -5.302 8.264 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.650 -5.639 4.720 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.682 -6.845 3.838 1.00 0.00 C ATOM 1525 C ASP A 88 -2.487 -7.761 4.140 1.00 0.00 C ATOM 1526 O ASP A 88 -1.348 -7.377 3.952 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.598 -6.305 2.411 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.933 -7.423 1.423 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.454 -8.526 1.623 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.663 -7.156 0.482 1.00 0.00 O ATOM 0 H ASP A 88 -2.870 -5.001 4.560 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.583 -7.439 3.993 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.291 -5.473 2.284 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.598 -5.919 2.215 1.00 0.00 H new ATOM 1535 N LYS A 89 -2.733 -8.975 4.599 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.584 -9.904 4.901 1.00 0.00 C ATOM 1537 C LYS A 89 -0.740 -10.120 3.634 1.00 0.00 C ATOM 1538 O LYS A 89 0.474 -10.180 3.700 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.196 -11.237 5.362 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.498 -11.168 6.861 1.00 0.00 C ATOM 1541 CD LYS A 89 -3.675 -12.088 7.189 1.00 0.00 C ATOM 1542 CE LYS A 89 -3.153 -13.483 7.538 1.00 0.00 C ATOM 1543 NZ LYS A 89 -4.177 -14.422 7.004 1.00 0.00 N ATOM 0 H LYS A 89 -3.662 -9.357 4.775 1.00 0.00 H new ATOM 0 HA LYS A 89 -0.934 -9.488 5.671 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.110 -11.442 4.805 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.507 -12.056 5.156 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -1.620 -11.466 7.433 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -2.733 -10.143 7.148 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.245 -11.682 8.025 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -4.354 -12.145 6.338 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.178 -13.664 7.086 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -3.032 -13.601 8.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -3.889 -15.401 7.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -5.093 -14.231 7.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -4.265 -14.291 5.976 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.367 -10.231 2.476 1.00 0.00 N ATOM 1558 CA LEU A 90 -0.568 -10.435 1.214 1.00 0.00 C ATOM 1559 C LEU A 90 0.396 -9.253 1.012 1.00 0.00 C ATOM 1560 O LEU A 90 1.533 -9.442 0.625 1.00 0.00 O ATOM 1561 CB LEU A 90 -1.575 -10.506 0.054 1.00 0.00 C ATOM 1562 CG LEU A 90 -0.834 -10.787 -1.253 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -0.233 -12.193 -1.209 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -1.815 -10.689 -2.424 1.00 0.00 C ATOM 0 H LEU A 90 -2.379 -10.190 2.352 1.00 0.00 H new ATOM 0 HA LEU A 90 0.026 -11.347 1.266 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.308 -11.290 0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.124 -9.567 -0.022 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.036 -10.056 -1.382 1.00 0.00 H new ATOM 0 HD11 LEU A 90 0.295 -12.392 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.465 -12.265 -0.374 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -1.030 -12.925 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.289 -10.889 -3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -2.612 -11.421 -2.293 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.244 -9.687 -2.457 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.041 -8.034 1.286 1.00 0.00 N ATOM 1577 CA LEU A 91 0.890 -6.861 1.113 1.00 0.00 C ATOM 1578 C LEU A 91 2.011 -6.968 2.152 1.00 0.00 C ATOM 1579 O LEU A 91 3.179 -6.941 1.810 1.00 0.00 O ATOM 1580 CB LEU A 91 0.058 -5.584 1.341 1.00 0.00 C ATOM 1581 CG LEU A 91 0.952 -4.347 1.201 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.507 -4.262 -0.224 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.130 -3.091 1.497 1.00 0.00 C ATOM 0 H LEU A 91 -0.980 -7.806 1.614 1.00 0.00 H new ATOM 0 HA LEU A 91 1.339 -6.841 0.120 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.758 -5.537 0.620 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.394 -5.606 2.333 1.00 0.00 H new ATOM 0 HG LEU A 91 1.780 -4.423 1.906 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.141 -3.380 -0.315 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.094 -5.155 -0.440 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.682 -4.190 -0.932 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.764 -2.210 1.398 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.698 -3.023 0.791 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.262 -3.144 2.513 1.00 0.00 H new ATOM 1595 N ILE A 92 1.670 -7.121 3.417 1.00 0.00 N ATOM 1596 CA ILE A 92 2.746 -7.266 4.462 1.00 0.00 C ATOM 1597 C ILE A 92 3.624 -8.493 4.118 1.00 0.00 C ATOM 1598 O ILE A 92 4.813 -8.490 4.377 1.00 0.00 O ATOM 1599 CB ILE A 92 2.019 -7.437 5.820 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.367 -6.099 6.201 1.00 0.00 C ATOM 1601 CG2 ILE A 92 3.012 -7.848 6.914 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.613 -6.231 7.532 1.00 0.00 C ATOM 0 H ILE A 92 0.712 -7.151 3.767 1.00 0.00 H new ATOM 0 HA ILE A 92 3.407 -6.400 4.504 1.00 0.00 H new ATOM 0 HB ILE A 92 1.263 -8.216 5.727 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.131 -5.326 6.283 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.679 -5.786 5.416 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.484 -7.963 7.860 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.481 -8.794 6.643 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.778 -7.079 7.018 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.157 -5.275 7.788 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.164 -6.990 7.436 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.310 -6.522 8.318 1.00 0.00 H new ATOM 1614 N ALA A 93 3.058 -9.530 3.521 1.00 0.00 N ATOM 1615 CA ALA A 93 3.898 -10.724 3.153 1.00 0.00 C ATOM 1616 C ALA A 93 4.871 -10.340 2.027 1.00 0.00 C ATOM 1617 O ALA A 93 6.033 -10.702 2.065 1.00 0.00 O ATOM 1618 CB ALA A 93 2.933 -11.820 2.672 1.00 0.00 C ATOM 0 H ALA A 93 2.070 -9.598 3.278 1.00 0.00 H new ATOM 0 HA ALA A 93 4.484 -11.074 4.003 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.501 -12.708 2.394 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.238 -12.070 3.473 1.00 0.00 H new ATOM 0 HB3 ALA A 93 2.375 -11.460 1.807 1.00 0.00 H new ATOM 1624 N LYS A 94 4.417 -9.603 1.027 1.00 0.00 N ATOM 1625 CA LYS A 94 5.356 -9.203 -0.084 1.00 0.00 C ATOM 1626 C LYS A 94 6.528 -8.388 0.482 1.00 0.00 C ATOM 1627 O LYS A 94 7.661 -8.583 0.084 1.00 0.00 O ATOM 1628 CB LYS A 94 4.555 -8.359 -1.093 1.00 0.00 C ATOM 1629 CG LYS A 94 3.954 -9.273 -2.165 1.00 0.00 C ATOM 1630 CD LYS A 94 2.587 -8.741 -2.586 1.00 0.00 C ATOM 1631 CE LYS A 94 2.259 -9.234 -3.998 1.00 0.00 C ATOM 1632 NZ LYS A 94 1.656 -10.582 -3.803 1.00 0.00 N ATOM 0 H LYS A 94 3.458 -9.268 0.933 1.00 0.00 H new ATOM 0 HA LYS A 94 5.768 -10.086 -0.572 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.763 -7.815 -0.579 1.00 0.00 H new ATOM 0 HB3 LYS A 94 5.204 -7.616 -1.557 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.618 -9.322 -3.028 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.857 -10.288 -1.779 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.823 -9.077 -1.885 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.586 -7.651 -2.560 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.565 -8.560 -4.501 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.155 -9.288 -4.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.159 -11.276 -4.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.735 -10.856 -2.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 0.653 -10.557 -4.077 1.00 0.00 H new ATOM 1646 N TRP A 95 6.278 -7.486 1.412 1.00 0.00 N ATOM 1647 CA TRP A 95 7.421 -6.685 1.984 1.00 0.00 C ATOM 1648 C TRP A 95 8.378 -7.614 2.748 1.00 0.00 C ATOM 1649 O TRP A 95 9.583 -7.464 2.667 1.00 0.00 O ATOM 1650 CB TRP A 95 6.813 -5.641 2.944 1.00 0.00 C ATOM 1651 CG TRP A 95 6.464 -4.370 2.212 1.00 0.00 C ATOM 1652 CD1 TRP A 95 7.095 -3.878 1.114 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.412 -3.412 2.532 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.490 -2.693 0.740 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.451 -2.363 1.582 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.434 -3.355 3.542 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.555 -1.296 1.634 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.531 -2.280 3.597 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.592 -1.253 2.644 1.00 0.00 C ATOM 0 H TRP A 95 5.356 -7.273 1.793 1.00 0.00 H new ATOM 0 HA TRP A 95 7.987 -6.194 1.192 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.919 -6.051 3.414 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.521 -5.422 3.743 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.934 -4.339 0.614 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.778 -2.131 -0.061 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.377 -4.142 4.279 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.606 -0.508 0.898 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.786 -2.244 4.378 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.895 -0.430 2.691 1.00 0.00 H new ATOM 1670 N ARG A 96 7.857 -8.580 3.475 1.00 0.00 N ATOM 1671 CA ARG A 96 8.766 -9.521 4.226 1.00 0.00 C ATOM 1672 C ARG A 96 9.405 -10.540 3.263 1.00 0.00 C ATOM 1673 O ARG A 96 10.506 -11.002 3.496 1.00 0.00 O ATOM 1674 CB ARG A 96 7.897 -10.241 5.272 1.00 0.00 C ATOM 1675 CG ARG A 96 7.895 -9.437 6.581 1.00 0.00 C ATOM 1676 CD ARG A 96 6.459 -9.271 7.089 1.00 0.00 C ATOM 1677 NE ARG A 96 5.967 -10.665 7.318 1.00 0.00 N ATOM 1678 CZ ARG A 96 6.365 -11.370 8.366 1.00 0.00 C ATOM 1679 NH1 ARG A 96 7.207 -10.875 9.246 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.914 -12.586 8.536 1.00 0.00 N ATOM 0 H ARG A 96 6.858 -8.758 3.582 1.00 0.00 H new ATOM 0 HA ARG A 96 9.579 -8.975 4.705 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.879 -10.352 4.900 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.282 -11.245 5.451 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.499 -9.947 7.332 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.348 -8.459 6.418 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.431 -8.686 8.008 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.840 -8.749 6.360 1.00 0.00 H new ATOM 0 HE ARG A 96 5.313 -11.080 6.655 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.568 -9.928 9.130 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.499 -11.438 10.045 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.260 -12.986 7.863 1.00 0.00 H new ATOM 0 HH22 ARG A 96 6.217 -13.134 9.341 1.00 0.00 H new ATOM 1694 N LYS A 97 8.733 -10.900 2.182 1.00 0.00 N ATOM 1695 CA LYS A 97 9.334 -11.894 1.214 1.00 0.00 C ATOM 1696 C LYS A 97 10.727 -11.428 0.755 1.00 0.00 C ATOM 1697 O LYS A 97 11.222 -10.411 1.204 1.00 0.00 O ATOM 1698 CB LYS A 97 8.393 -11.943 -0.002 1.00 0.00 C ATOM 1699 CG LYS A 97 7.324 -13.014 0.194 1.00 0.00 C ATOM 1700 CD LYS A 97 7.985 -14.394 0.280 1.00 0.00 C ATOM 1701 CE LYS A 97 6.974 -15.470 -0.120 1.00 0.00 C ATOM 1702 NZ LYS A 97 6.294 -15.848 1.149 1.00 0.00 N ATOM 0 H LYS A 97 7.807 -10.554 1.930 1.00 0.00 H new ATOM 0 HA LYS A 97 9.443 -12.871 1.686 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.921 -10.971 -0.144 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.966 -12.154 -0.905 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.758 -12.814 1.104 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.616 -12.990 -0.634 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.854 -14.434 -0.377 1.00 0.00 H new ATOM 0 HD3 LYS A 97 8.343 -14.575 1.294 1.00 0.00 H new ATOM 0 HE2 LYS A 97 6.261 -15.090 -0.852 1.00 0.00 H new ATOM 0 HE3 LYS A 97 7.469 -16.328 -0.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 5.584 -16.583 0.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 6.996 -16.213 1.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.826 -15.012 1.554 1.00 0.00 H new ATOM 1716 N THR A 98 11.357 -12.152 -0.148 1.00 0.00 N ATOM 1717 CA THR A 98 12.707 -11.729 -0.636 1.00 0.00 C ATOM 1718 C THR A 98 12.587 -11.137 -2.048 1.00 0.00 C ATOM 1719 O THR A 98 11.956 -11.714 -2.913 1.00 0.00 O ATOM 1720 CB THR A 98 13.561 -13.002 -0.653 1.00 0.00 C ATOM 1721 OG1 THR A 98 13.542 -13.598 0.637 1.00 0.00 O ATOM 1722 CG2 THR A 98 15.000 -12.650 -1.032 1.00 0.00 C ATOM 0 H THR A 98 10.994 -13.010 -0.563 1.00 0.00 H new ATOM 0 HA THR A 98 13.152 -10.964 -0.000 1.00 0.00 H new ATOM 0 HB THR A 98 13.157 -13.701 -1.385 1.00 0.00 H new ATOM 0 HG1 THR A 98 14.086 -14.413 0.629 1.00 0.00 H new ATOM 0 HG21 THR A 98 15.605 -13.556 -1.043 1.00 0.00 H new ATOM 0 HG22 THR A 98 15.014 -12.192 -2.021 1.00 0.00 H new ATOM 0 HG23 THR A 98 15.408 -11.951 -0.302 1.00 0.00 H new ATOM 1730 N GLY A 99 13.176 -9.984 -2.286 1.00 0.00 N ATOM 1731 CA GLY A 99 13.081 -9.357 -3.638 1.00 0.00 C ATOM 1732 C GLY A 99 12.011 -8.239 -3.660 1.00 0.00 C ATOM 1733 O GLY A 99 11.698 -7.720 -4.715 1.00 0.00 O ATOM 0 H GLY A 99 13.716 -9.455 -1.601 1.00 0.00 H new ATOM 0 HA2 GLY A 99 14.049 -8.943 -3.919 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.832 -10.117 -4.378 1.00 0.00 H new ATOM 1737 N TYR A 100 11.449 -7.851 -2.524 1.00 0.00 N ATOM 1738 CA TYR A 100 10.420 -6.767 -2.534 1.00 0.00 C ATOM 1739 C TYR A 100 10.947 -5.536 -1.776 1.00 0.00 C ATOM 1740 O TYR A 100 10.448 -5.195 -0.718 1.00 0.00 O ATOM 1741 CB TYR A 100 9.203 -7.357 -1.817 1.00 0.00 C ATOM 1742 CG TYR A 100 8.513 -8.355 -2.715 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.882 -7.927 -3.888 1.00 0.00 C ATOM 1744 CD2 TYR A 100 8.502 -9.712 -2.369 1.00 0.00 C ATOM 1745 CE1 TYR A 100 7.241 -8.855 -4.716 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.861 -10.640 -3.196 1.00 0.00 C ATOM 1747 CZ TYR A 100 7.230 -10.213 -4.370 1.00 0.00 C ATOM 1748 OH TYR A 100 6.598 -11.129 -5.186 1.00 0.00 O ATOM 0 H TYR A 100 11.662 -8.240 -1.605 1.00 0.00 H new ATOM 0 HA TYR A 100 10.174 -6.442 -3.545 1.00 0.00 H new ATOM 0 HB2 TYR A 100 9.514 -7.842 -0.892 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.510 -6.561 -1.543 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.890 -6.880 -4.154 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.989 -10.042 -1.463 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.755 -8.525 -5.622 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.853 -11.686 -2.929 1.00 0.00 H new ATOM 0 HH TYR A 100 6.686 -12.026 -4.800 1.00 0.00 H new ATOM 1758 N GLU A 101 11.946 -4.860 -2.306 1.00 0.00 N ATOM 1759 CA GLU A 101 12.484 -3.647 -1.594 1.00 0.00 C ATOM 1760 C GLU A 101 11.643 -2.412 -1.952 1.00 0.00 C ATOM 1761 O GLU A 101 11.382 -1.575 -1.109 1.00 0.00 O ATOM 1762 CB GLU A 101 13.932 -3.467 -2.073 1.00 0.00 C ATOM 1763 CG GLU A 101 14.775 -2.878 -0.939 1.00 0.00 C ATOM 1764 CD GLU A 101 15.196 -3.996 0.018 1.00 0.00 C ATOM 1765 OE1 GLU A 101 14.446 -4.275 0.938 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.262 -4.553 -0.187 1.00 0.00 O ATOM 0 H GLU A 101 12.406 -5.090 -3.187 1.00 0.00 H new ATOM 0 HA GLU A 101 12.443 -3.770 -0.512 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.344 -4.426 -2.387 1.00 0.00 H new ATOM 0 HB3 GLU A 101 13.960 -2.809 -2.941 1.00 0.00 H new ATOM 0 HG2 GLU A 101 15.656 -2.382 -1.346 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.203 -2.121 -0.402 1.00 0.00 H new ATOM 1773 N LYS A 102 11.212 -2.288 -3.192 1.00 0.00 N ATOM 1774 CA LYS A 102 10.388 -1.105 -3.584 1.00 0.00 C ATOM 1775 C LYS A 102 8.987 -1.563 -4.023 1.00 0.00 C ATOM 1776 O LYS A 102 8.760 -1.850 -5.183 1.00 0.00 O ATOM 1777 CB LYS A 102 11.151 -0.468 -4.750 1.00 0.00 C ATOM 1778 CG LYS A 102 12.476 0.121 -4.239 1.00 0.00 C ATOM 1779 CD LYS A 102 12.435 1.654 -4.315 1.00 0.00 C ATOM 1780 CE LYS A 102 13.259 2.138 -5.514 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.016 3.318 -5.011 1.00 0.00 N ATOM 0 H LYS A 102 11.397 -2.955 -3.941 1.00 0.00 H new ATOM 0 HA LYS A 102 10.243 -0.401 -2.765 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.346 -1.214 -5.521 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.547 0.314 -5.209 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.651 -0.195 -3.211 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.306 -0.259 -4.835 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.404 1.995 -4.410 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.830 2.083 -3.394 1.00 0.00 H new ATOM 0 HE2 LYS A 102 13.933 1.359 -5.870 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.616 2.409 -6.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.604 3.705 -5.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.348 4.046 -4.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.625 3.028 -4.219 1.00 0.00 H new ATOM 1795 N LEU A 103 8.046 -1.639 -3.102 1.00 0.00 N ATOM 1796 CA LEU A 103 6.667 -2.085 -3.465 1.00 0.00 C ATOM 1797 C LEU A 103 5.637 -1.043 -2.973 1.00 0.00 C ATOM 1798 O LEU A 103 5.718 -0.572 -1.854 1.00 0.00 O ATOM 1799 CB LEU A 103 6.518 -3.450 -2.752 1.00 0.00 C ATOM 1800 CG LEU A 103 5.042 -3.828 -2.555 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.348 -3.912 -3.916 1.00 0.00 C ATOM 1802 CD2 LEU A 103 4.957 -5.184 -1.848 1.00 0.00 C ATOM 0 H LEU A 103 8.180 -1.410 -2.117 1.00 0.00 H new ATOM 0 HA LEU A 103 6.499 -2.180 -4.538 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.017 -4.223 -3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.017 -3.411 -1.783 1.00 0.00 H new ATOM 0 HG LEU A 103 4.549 -3.069 -1.947 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.301 -4.180 -3.775 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.411 -2.946 -4.417 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.837 -4.670 -4.528 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.911 -5.456 -1.706 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.450 -5.943 -2.456 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.450 -5.120 -0.878 1.00 0.00 H new ATOM 1814 N CYS A 104 4.673 -0.678 -3.802 1.00 0.00 N ATOM 1815 CA CYS A 104 3.658 0.335 -3.360 1.00 0.00 C ATOM 1816 C CYS A 104 2.267 -0.293 -3.120 1.00 0.00 C ATOM 1817 O CYS A 104 1.588 0.087 -2.187 1.00 0.00 O ATOM 1818 CB CYS A 104 3.630 1.432 -4.442 1.00 0.00 C ATOM 1819 SG CYS A 104 3.138 0.793 -6.069 1.00 0.00 S ATOM 0 H CYS A 104 4.551 -1.034 -4.750 1.00 0.00 H new ATOM 0 HA CYS A 104 3.936 0.759 -2.395 1.00 0.00 H new ATOM 0 HB2 CYS A 104 2.938 2.218 -4.140 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.617 1.888 -4.518 1.00 0.00 H new ATOM 0 HG CYS A 104 4.200 0.547 -6.778 1.00 0.00 H new ATOM 1824 N CYS A 105 1.826 -1.249 -3.917 1.00 0.00 N ATOM 1825 CA CYS A 105 0.477 -1.870 -3.656 1.00 0.00 C ATOM 1826 C CYS A 105 0.545 -3.391 -3.896 1.00 0.00 C ATOM 1827 O CYS A 105 1.616 -3.948 -4.038 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.518 -1.251 -4.648 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.310 0.546 -4.802 1.00 0.00 S ATOM 0 H CYS A 105 2.331 -1.620 -4.722 1.00 0.00 H new ATOM 0 HA CYS A 105 0.170 -1.689 -2.626 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.389 -1.715 -5.626 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.535 -1.470 -4.323 1.00 0.00 H new ATOM 0 HG CYS A 105 0.876 0.807 -5.266 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.590 -4.067 -3.953 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.567 -5.551 -4.197 1.00 0.00 C ATOM 1836 C LEU A 106 -0.831 -5.862 -5.682 1.00 0.00 C ATOM 1837 O LEU A 106 -0.214 -6.747 -6.246 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.670 -6.144 -3.316 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.137 -6.372 -1.899 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.270 -6.896 -1.012 1.00 0.00 C ATOM 1841 CD2 LEU A 106 0.009 -7.395 -1.932 1.00 0.00 C ATOM 0 H LEU A 106 -1.518 -3.659 -3.842 1.00 0.00 H new ATOM 0 HA LEU A 106 0.406 -5.977 -3.954 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.527 -5.471 -3.288 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.019 -7.086 -3.739 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.762 -5.431 -1.496 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.895 -7.060 -0.002 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.078 -6.165 -0.985 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.644 -7.836 -1.417 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.385 -7.553 -0.921 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.358 -8.339 -2.335 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.814 -7.019 -2.563 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.712 -5.124 -6.336 1.00 0.00 N ATOM 1854 CA ARG A 107 -1.961 -5.373 -7.798 1.00 0.00 C ATOM 1855 C ARG A 107 -1.233 -4.295 -8.631 1.00 0.00 C ATOM 1856 O ARG A 107 -1.707 -3.877 -9.669 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.478 -5.272 -7.986 1.00 0.00 C ATOM 1858 CG ARG A 107 -3.897 -6.088 -9.211 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.307 -5.680 -9.639 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.202 -6.198 -8.559 1.00 0.00 N ATOM 1861 CZ ARG A 107 -6.496 -7.487 -8.469 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -6.012 -8.362 -9.322 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -7.284 -7.904 -7.512 1.00 0.00 N ATOM 0 H ARG A 107 -2.261 -4.370 -5.924 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.591 -6.346 -8.123 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -3.990 -5.641 -7.098 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.771 -4.230 -8.113 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.195 -5.922 -10.029 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.870 -7.153 -8.978 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.392 -4.598 -9.738 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.566 -6.110 -10.607 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.594 -5.547 -7.879 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.395 -8.054 -10.074 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -6.253 -9.349 -9.232 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -7.668 -7.238 -6.841 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -7.515 -8.895 -7.437 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.091 -3.832 -8.164 1.00 0.00 N ATOM 1878 CA CYS A 108 0.679 -2.772 -8.887 1.00 0.00 C ATOM 1879 C CYS A 108 2.153 -3.250 -9.060 1.00 0.00 C ATOM 1880 O CYS A 108 3.032 -2.453 -9.319 1.00 0.00 O ATOM 1881 CB CYS A 108 0.581 -1.616 -7.879 1.00 0.00 C ATOM 1882 SG CYS A 108 0.581 0.040 -8.609 1.00 0.00 S ATOM 0 H CYS A 108 0.343 -4.152 -7.298 1.00 0.00 H new ATOM 0 HA CYS A 108 0.323 -2.517 -9.885 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.332 -1.739 -7.296 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.417 -1.689 -7.183 1.00 0.00 H new ATOM 0 HG CYS A 108 0.877 -0.043 -9.872 1.00 0.00 H new ATOM 1887 N ILE A 109 2.431 -4.552 -8.903 1.00 0.00 N ATOM 1888 CA ILE A 109 3.838 -5.078 -9.032 1.00 0.00 C ATOM 1889 C ILE A 109 3.822 -6.596 -9.327 1.00 0.00 C ATOM 1890 O ILE A 109 4.638 -7.332 -8.802 1.00 0.00 O ATOM 1891 CB ILE A 109 4.491 -4.859 -7.652 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.616 -5.501 -6.549 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.656 -3.364 -7.372 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.465 -6.422 -5.660 1.00 0.00 C ATOM 0 H ILE A 109 1.732 -5.263 -8.691 1.00 0.00 H new ATOM 0 HA ILE A 109 4.370 -4.576 -9.840 1.00 0.00 H new ATOM 0 HB ILE A 109 5.475 -5.328 -7.653 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.156 -4.722 -5.941 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.806 -6.070 -7.004 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.118 -3.226 -6.395 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.289 -2.918 -8.139 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.679 -2.882 -7.383 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.835 -6.866 -4.889 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.904 -7.212 -6.269 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.260 -5.843 -5.190 1.00 0.00 H new ATOM 1906 N GLN A 110 2.900 -7.080 -10.136 1.00 0.00 N ATOM 1907 CA GLN A 110 2.855 -8.557 -10.410 1.00 0.00 C ATOM 1908 C GLN A 110 3.424 -8.874 -11.800 1.00 0.00 C ATOM 1909 O GLN A 110 2.788 -8.614 -12.802 1.00 0.00 O ATOM 1910 CB GLN A 110 1.374 -8.945 -10.338 1.00 0.00 C ATOM 1911 CG GLN A 110 1.001 -9.263 -8.888 1.00 0.00 C ATOM 1912 CD GLN A 110 1.218 -10.758 -8.620 1.00 0.00 C ATOM 1913 OE1 GLN A 110 0.911 -11.583 -9.458 1.00 0.00 O ATOM 1914 NE2 GLN A 110 1.738 -11.150 -7.482 1.00 0.00 N ATOM 0 H GLN A 110 2.188 -6.525 -10.611 1.00 0.00 H new ATOM 0 HA GLN A 110 3.456 -9.113 -9.691 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.755 -8.131 -10.714 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.182 -9.810 -10.972 1.00 0.00 H new ATOM 0 HG2 GLN A 110 1.609 -8.668 -8.206 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -0.039 -8.997 -8.702 1.00 0.00 H new ATOM 0 HE21 GLN A 110 1.997 -10.461 -6.776 1.00 0.00 H new ATOM 0 HE22 GLN A 110 1.883 -12.144 -7.303 1.00 0.00 H new ATOM 2034 N THR A 119 1.104 -6.947 -14.822 1.00 0.00 N ATOM 2035 CA THR A 119 1.979 -6.132 -13.927 1.00 0.00 C ATOM 2036 C THR A 119 1.710 -4.636 -14.129 1.00 0.00 C ATOM 2037 O THR A 119 0.988 -4.247 -15.028 1.00 0.00 O ATOM 2038 CB THR A 119 3.412 -6.457 -14.359 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.458 -7.765 -14.913 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.354 -6.373 -13.148 1.00 0.00 C ATOM 0 HA THR A 119 1.798 -6.358 -12.876 1.00 0.00 H new ATOM 0 HB THR A 119 3.732 -5.735 -15.110 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.209 -8.420 -14.227 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.372 -6.605 -13.462 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.323 -5.366 -12.732 1.00 0.00 H new ATOM 0 HG23 THR A 119 4.036 -7.088 -12.389 1.00 0.00 H new ATOM 2048 N CYS A 120 2.306 -3.792 -13.313 1.00 0.00 N ATOM 2049 CA CYS A 120 2.104 -2.324 -13.480 1.00 0.00 C ATOM 2050 C CYS A 120 3.396 -1.703 -14.035 1.00 0.00 C ATOM 2051 O CYS A 120 4.468 -2.254 -13.862 1.00 0.00 O ATOM 2052 CB CYS A 120 1.800 -1.786 -12.084 1.00 0.00 C ATOM 2053 SG CYS A 120 1.407 -0.029 -12.213 1.00 0.00 S ATOM 0 H CYS A 120 2.920 -4.061 -12.544 1.00 0.00 H new ATOM 0 HA CYS A 120 1.296 -2.087 -14.172 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.964 -2.329 -11.644 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.657 -1.934 -11.427 1.00 0.00 H new ATOM 0 HG CYS A 120 2.199 0.651 -11.438 1.00 0.00 H new ATOM 2058 N ILE A 121 3.314 -0.574 -14.707 1.00 0.00 N ATOM 2059 CA ILE A 121 4.568 0.044 -15.271 1.00 0.00 C ATOM 2060 C ILE A 121 5.453 0.606 -14.140 1.00 0.00 C ATOM 2061 O ILE A 121 6.665 0.528 -14.216 1.00 0.00 O ATOM 2062 CB ILE A 121 4.109 1.149 -16.255 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.293 1.591 -17.145 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.519 2.352 -15.504 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.358 2.360 -16.344 1.00 0.00 C ATOM 0 H ILE A 121 2.452 -0.060 -14.888 1.00 0.00 H new ATOM 0 HA ILE A 121 5.179 -0.693 -15.792 1.00 0.00 H new ATOM 0 HB ILE A 121 3.324 0.737 -16.890 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.748 0.714 -17.605 1.00 0.00 H new ATOM 0 HG13 ILE A 121 4.923 2.220 -17.955 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.206 3.111 -16.221 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.658 2.029 -14.919 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.274 2.771 -14.839 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.172 2.652 -17.008 1.00 0.00 H new ATOM 0 HD12 ILE A 121 5.910 3.252 -15.905 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.748 1.722 -15.551 1.00 0.00 H new ATOM 2077 N CYS A 122 4.876 1.177 -13.099 1.00 0.00 N ATOM 2078 CA CYS A 122 5.740 1.743 -11.997 1.00 0.00 C ATOM 2079 C CYS A 122 6.699 0.665 -11.445 1.00 0.00 C ATOM 2080 O CYS A 122 7.821 0.968 -11.083 1.00 0.00 O ATOM 2081 CB CYS A 122 4.787 2.328 -10.917 1.00 0.00 C ATOM 2082 SG CYS A 122 4.125 1.049 -9.799 1.00 0.00 S ATOM 0 H CYS A 122 3.870 1.275 -12.964 1.00 0.00 H new ATOM 0 HA CYS A 122 6.386 2.540 -12.366 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.323 3.075 -10.331 1.00 0.00 H new ATOM 0 HB3 CYS A 122 3.959 2.841 -11.407 1.00 0.00 H new ATOM 0 HG CYS A 122 4.981 0.818 -8.848 1.00 0.00 H new ATOM 2087 N ARG A 123 6.289 -0.591 -11.407 1.00 0.00 N ATOM 2088 CA ARG A 123 7.228 -1.661 -10.906 1.00 0.00 C ATOM 2089 C ARG A 123 8.501 -1.684 -11.775 1.00 0.00 C ATOM 2090 O ARG A 123 9.580 -1.958 -11.284 1.00 0.00 O ATOM 2091 CB ARG A 123 6.488 -3.003 -11.028 1.00 0.00 C ATOM 2092 CG ARG A 123 6.950 -3.943 -9.913 1.00 0.00 C ATOM 2093 CD ARG A 123 8.420 -4.312 -10.130 1.00 0.00 C ATOM 2094 NE ARG A 123 8.588 -5.638 -9.459 1.00 0.00 N ATOM 2095 CZ ARG A 123 8.655 -5.737 -8.140 1.00 0.00 C ATOM 2096 NH1 ARG A 123 8.576 -4.678 -7.368 1.00 0.00 N ATOM 2097 NH2 ARG A 123 8.803 -6.914 -7.588 1.00 0.00 N ATOM 0 H ARG A 123 5.366 -0.916 -11.694 1.00 0.00 H new ATOM 0 HA ARG A 123 7.522 -1.472 -9.874 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.412 -2.844 -10.962 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.685 -3.452 -12.002 1.00 0.00 H new ATOM 0 HG2 ARG A 123 6.824 -3.462 -8.943 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.336 -4.843 -9.905 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.659 -4.374 -11.192 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.083 -3.563 -9.697 1.00 0.00 H new ATOM 0 HE ARG A 123 8.652 -6.482 -10.028 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.460 -3.753 -7.782 1.00 0.00 H new ATOM 0 HH12 ARG A 123 8.630 -4.780 -6.355 1.00 0.00 H new ATOM 0 HH21 ARG A 123 8.866 -7.747 -8.173 1.00 0.00 H new ATOM 0 HH22 ARG A 123 8.855 -6.998 -6.573 1.00 0.00 H new ATOM 2111 N VAL A 124 8.388 -1.393 -13.060 1.00 0.00 N ATOM 2112 CA VAL A 124 9.611 -1.399 -13.936 1.00 0.00 C ATOM 2113 C VAL A 124 10.377 -0.072 -13.769 1.00 0.00 C ATOM 2114 O VAL A 124 9.806 0.984 -13.953 1.00 0.00 O ATOM 2115 CB VAL A 124 9.107 -1.536 -15.385 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.299 -1.587 -16.344 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.285 -2.822 -15.527 1.00 0.00 C ATOM 0 H VAL A 124 7.515 -1.156 -13.531 1.00 0.00 H new ATOM 0 HA VAL A 124 10.286 -2.214 -13.673 1.00 0.00 H new ATOM 0 HB VAL A 124 8.482 -0.677 -15.628 1.00 0.00 H new ATOM 0 HG11 VAL A 124 9.938 -1.684 -17.368 1.00 0.00 H new ATOM 0 HG12 VAL A 124 10.881 -0.670 -16.250 1.00 0.00 H new ATOM 0 HG13 VAL A 124 10.927 -2.443 -16.098 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.930 -2.916 -16.553 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.908 -3.681 -15.279 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.432 -2.785 -14.850 1.00 0.00 H new ATOM 2127 N PRO A 125 11.649 -0.154 -13.434 1.00 0.00 N ATOM 2128 CA PRO A 125 12.462 1.079 -13.262 1.00 0.00 C ATOM 2129 C PRO A 125 12.618 1.818 -14.603 1.00 0.00 C ATOM 2130 O PRO A 125 12.261 1.300 -15.643 1.00 0.00 O ATOM 2131 CB PRO A 125 13.809 0.559 -12.759 1.00 0.00 C ATOM 2132 CG PRO A 125 13.866 -0.856 -13.229 1.00 0.00 C ATOM 2133 CD PRO A 125 12.451 -1.364 -13.188 1.00 0.00 C ATOM 0 HA PRO A 125 12.009 1.796 -12.577 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.635 1.144 -13.162 1.00 0.00 H new ATOM 0 HB3 PRO A 125 13.876 0.619 -11.673 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.273 -0.916 -14.238 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.514 -1.454 -12.588 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.275 -2.125 -13.948 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.213 -1.815 -12.225 1.00 0.00 H new ATOM 2141 N ARG A 126 13.144 3.028 -14.585 1.00 0.00 N ATOM 2142 CA ARG A 126 13.310 3.790 -15.875 1.00 0.00 C ATOM 2143 C ARG A 126 14.491 3.233 -16.688 1.00 0.00 C ATOM 2144 O ARG A 126 14.435 3.187 -17.903 1.00 0.00 O ATOM 2145 CB ARG A 126 13.578 5.254 -15.489 1.00 0.00 C ATOM 2146 CG ARG A 126 13.651 6.111 -16.754 1.00 0.00 C ATOM 2147 CD ARG A 126 12.260 6.210 -17.385 1.00 0.00 C ATOM 2148 NE ARG A 126 12.232 7.551 -18.047 1.00 0.00 N ATOM 2149 CZ ARG A 126 12.097 8.663 -17.341 1.00 0.00 C ATOM 2150 NH1 ARG A 126 11.979 8.634 -16.033 1.00 0.00 N ATOM 2151 NH2 ARG A 126 12.081 9.819 -17.954 1.00 0.00 N ATOM 0 H ARG A 126 13.461 3.515 -13.747 1.00 0.00 H new ATOM 0 HA ARG A 126 12.418 3.699 -16.495 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.786 5.619 -14.835 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.512 5.329 -14.932 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.023 7.106 -16.511 1.00 0.00 H new ATOM 0 HG3 ARG A 126 14.353 5.673 -17.463 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.096 5.410 -18.107 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.477 6.125 -16.631 1.00 0.00 H new ATOM 0 HE ARG A 126 12.319 7.610 -19.062 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.990 7.741 -15.540 1.00 0.00 H new ATOM 0 HH12 ARG A 126 11.876 9.504 -15.511 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.172 9.859 -18.969 1.00 0.00 H new ATOM 0 HH22 ARG A 126 11.977 10.680 -17.417 1.00 0.00 H new ATOM 2165 N ALA A 127 15.564 2.812 -16.040 1.00 0.00 N ATOM 2166 CA ALA A 127 16.736 2.266 -16.818 1.00 0.00 C ATOM 2167 C ALA A 127 16.288 1.079 -17.683 1.00 0.00 C ATOM 2168 O ALA A 127 16.688 0.958 -18.826 1.00 0.00 O ATOM 2169 CB ALA A 127 17.780 1.806 -15.787 1.00 0.00 C ATOM 0 H ALA A 127 15.678 2.822 -15.026 1.00 0.00 H new ATOM 0 HA ALA A 127 17.151 3.024 -17.482 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.650 1.402 -16.305 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.085 2.654 -15.174 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.347 1.035 -15.150 1.00 0.00 H new ATOM 2175 N GLN A 128 15.452 0.207 -17.156 1.00 0.00 N ATOM 2176 CA GLN A 128 14.981 -0.959 -17.984 1.00 0.00 C ATOM 2177 C GLN A 128 14.077 -0.445 -19.113 1.00 0.00 C ATOM 2178 O GLN A 128 14.172 -0.897 -20.239 1.00 0.00 O ATOM 2179 CB GLN A 128 14.192 -1.886 -17.046 1.00 0.00 C ATOM 2180 CG GLN A 128 14.177 -3.303 -17.623 1.00 0.00 C ATOM 2181 CD GLN A 128 15.366 -4.095 -17.065 1.00 0.00 C ATOM 2182 OE1 GLN A 128 15.327 -4.556 -15.942 1.00 0.00 O ATOM 2183 NE2 GLN A 128 16.433 -4.279 -17.805 1.00 0.00 N ATOM 0 H GLN A 128 15.081 0.249 -16.207 1.00 0.00 H new ATOM 0 HA GLN A 128 15.817 -1.495 -18.434 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.646 -1.890 -16.055 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.172 -1.519 -16.928 1.00 0.00 H new ATOM 0 HG2 GLN A 128 13.242 -3.801 -17.367 1.00 0.00 H new ATOM 0 HG3 GLN A 128 14.230 -3.265 -18.711 1.00 0.00 H new ATOM 0 HE21 GLN A 128 16.472 -3.894 -18.749 1.00 0.00 H new ATOM 0 HE22 GLN A 128 17.224 -4.807 -17.437 1.00 0.00 H new ATOM 2192 N LEU A 129 13.207 0.506 -18.828 1.00 0.00 N ATOM 2193 CA LEU A 129 12.315 1.045 -19.915 1.00 0.00 C ATOM 2194 C LEU A 129 13.169 1.727 -20.994 1.00 0.00 C ATOM 2195 O LEU A 129 12.895 1.601 -22.172 1.00 0.00 O ATOM 2196 CB LEU A 129 11.379 2.069 -19.255 1.00 0.00 C ATOM 2197 CG LEU A 129 10.151 1.351 -18.694 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.681 2.062 -17.424 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.029 1.372 -19.735 1.00 0.00 C ATOM 0 H LEU A 129 13.078 0.925 -17.907 1.00 0.00 H new ATOM 0 HA LEU A 129 11.744 0.248 -20.391 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.903 2.594 -18.456 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.073 2.820 -19.983 1.00 0.00 H new ATOM 0 HG LEU A 129 10.409 0.319 -18.458 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.806 1.551 -17.024 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.480 2.048 -16.683 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.422 3.094 -17.660 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.153 0.860 -19.336 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.770 2.404 -19.970 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.364 0.866 -20.641 1.00 0.00 H new ATOM 2211 N GLU A 130 14.210 2.446 -20.607 1.00 0.00 N ATOM 2212 CA GLU A 130 15.072 3.123 -21.645 1.00 0.00 C ATOM 2213 C GLU A 130 15.663 2.074 -22.600 1.00 0.00 C ATOM 2214 O GLU A 130 15.741 2.296 -23.794 1.00 0.00 O ATOM 2215 CB GLU A 130 16.198 3.845 -20.888 1.00 0.00 C ATOM 2216 CG GLU A 130 15.753 5.269 -20.543 1.00 0.00 C ATOM 2217 CD GLU A 130 16.266 6.239 -21.610 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.421 6.622 -21.529 1.00 0.00 O ATOM 2219 OE2 GLU A 130 15.493 6.583 -22.490 1.00 0.00 O ATOM 0 H GLU A 130 14.495 2.591 -19.638 1.00 0.00 H new ATOM 0 HA GLU A 130 14.490 3.827 -22.240 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.446 3.300 -19.977 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.101 3.873 -21.498 1.00 0.00 H new ATOM 0 HG2 GLU A 130 14.666 5.317 -20.486 1.00 0.00 H new ATOM 0 HG3 GLU A 130 16.137 5.554 -19.563 1.00 0.00 H new ATOM 2226 N GLU A 131 16.075 0.927 -22.091 1.00 0.00 N ATOM 2227 CA GLU A 131 16.654 -0.125 -23.004 1.00 0.00 C ATOM 2228 C GLU A 131 15.615 -0.540 -24.059 1.00 0.00 C ATOM 2229 O GLU A 131 15.955 -0.777 -25.203 1.00 0.00 O ATOM 2230 CB GLU A 131 17.021 -1.329 -22.121 1.00 0.00 C ATOM 2231 CG GLU A 131 17.824 -2.340 -22.942 1.00 0.00 C ATOM 2232 CD GLU A 131 18.694 -3.179 -22.005 1.00 0.00 C ATOM 2233 OE1 GLU A 131 19.596 -2.617 -21.403 1.00 0.00 O ATOM 2234 OE2 GLU A 131 18.447 -4.370 -21.906 1.00 0.00 O ATOM 0 H GLU A 131 16.037 0.677 -21.103 1.00 0.00 H new ATOM 0 HA GLU A 131 17.530 0.254 -23.531 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.604 -0.998 -21.261 1.00 0.00 H new ATOM 0 HB3 GLU A 131 16.117 -1.797 -21.732 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.150 -2.985 -23.505 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.449 -1.821 -23.669 1.00 0.00 H new ATOM 2241 N GLU A 132 14.353 -0.629 -23.690 1.00 0.00 N ATOM 2242 CA GLU A 132 13.308 -1.031 -24.699 1.00 0.00 C ATOM 2243 C GLU A 132 13.253 0.003 -25.834 1.00 0.00 C ATOM 2244 O GLU A 132 13.232 -0.356 -26.996 1.00 0.00 O ATOM 2245 CB GLU A 132 11.962 -1.072 -23.957 1.00 0.00 C ATOM 2246 CG GLU A 132 11.837 -2.395 -23.199 1.00 0.00 C ATOM 2247 CD GLU A 132 11.056 -2.171 -21.904 1.00 0.00 C ATOM 2248 OE1 GLU A 132 10.041 -1.495 -21.956 1.00 0.00 O ATOM 2249 OE2 GLU A 132 11.486 -2.677 -20.880 1.00 0.00 O ATOM 0 H GLU A 132 14.004 -0.444 -22.749 1.00 0.00 H new ATOM 0 HA GLU A 132 13.540 -2.001 -25.138 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.892 -0.235 -23.263 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.141 -0.968 -24.666 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.330 -3.134 -23.819 1.00 0.00 H new ATOM 0 HG3 GLU A 132 12.827 -2.792 -22.975 1.00 0.00 H new ATOM 2256 N ALA A 133 13.231 1.283 -25.513 1.00 0.00 N ATOM 2257 CA ALA A 133 13.177 2.320 -26.606 1.00 0.00 C ATOM 2258 C ALA A 133 14.421 2.203 -27.500 1.00 0.00 C ATOM 2259 O ALA A 133 14.329 2.309 -28.708 1.00 0.00 O ATOM 2260 CB ALA A 133 13.148 3.695 -25.920 1.00 0.00 C ATOM 0 H ALA A 133 13.248 1.649 -24.561 1.00 0.00 H new ATOM 0 HA ALA A 133 12.297 2.181 -27.234 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.109 4.478 -26.677 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.268 3.764 -25.280 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.047 3.819 -25.316 1.00 0.00 H new ATOM 2266 N ARG A 134 15.586 1.982 -26.920 1.00 0.00 N ATOM 2267 CA ARG A 134 16.828 1.857 -27.768 1.00 0.00 C ATOM 2268 C ARG A 134 16.746 0.612 -28.674 1.00 0.00 C ATOM 2269 O ARG A 134 17.292 0.608 -29.762 1.00 0.00 O ATOM 2270 CB ARG A 134 18.013 1.724 -26.797 1.00 0.00 C ATOM 2271 CG ARG A 134 19.324 1.766 -27.585 1.00 0.00 C ATOM 2272 CD ARG A 134 20.418 2.399 -26.721 1.00 0.00 C ATOM 2273 NE ARG A 134 21.679 2.221 -27.504 1.00 0.00 N ATOM 2274 CZ ARG A 134 21.949 2.979 -28.556 1.00 0.00 C ATOM 2275 NH1 ARG A 134 21.124 3.920 -28.952 1.00 0.00 N ATOM 2276 NH2 ARG A 134 23.062 2.791 -29.218 1.00 0.00 N ATOM 0 H ARG A 134 15.731 1.884 -25.915 1.00 0.00 H new ATOM 0 HA ARG A 134 16.941 2.726 -28.417 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.990 2.531 -26.065 1.00 0.00 H new ATOM 0 HB3 ARG A 134 17.939 0.789 -26.242 1.00 0.00 H new ATOM 0 HG2 ARG A 134 19.616 0.758 -27.880 1.00 0.00 H new ATOM 0 HG3 ARG A 134 19.192 2.341 -28.502 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.214 3.454 -26.535 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.485 1.911 -25.748 1.00 0.00 H new ATOM 0 HE ARG A 134 22.345 1.501 -27.222 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.253 4.080 -28.446 1.00 0.00 H new ATOM 0 HH12 ARG A 134 21.354 4.491 -29.765 1.00 0.00 H new ATOM 0 HH21 ARG A 134 23.715 2.065 -28.923 1.00 0.00 H new ATOM 0 HH22 ARG A 134 23.277 3.371 -30.029 1.00 0.00 H new ATOM 2290 N LYS A 135 16.077 -0.443 -28.246 1.00 0.00 N ATOM 2291 CA LYS A 135 15.987 -1.672 -29.112 1.00 0.00 C ATOM 2292 C LYS A 135 14.808 -1.577 -30.101 1.00 0.00 C ATOM 2293 O LYS A 135 14.863 -2.151 -31.174 1.00 0.00 O ATOM 2294 CB LYS A 135 15.786 -2.862 -28.161 1.00 0.00 C ATOM 2295 CG LYS A 135 17.148 -3.383 -27.699 1.00 0.00 C ATOM 2296 CD LYS A 135 17.623 -2.572 -26.491 1.00 0.00 C ATOM 2297 CE LYS A 135 19.105 -2.858 -26.236 1.00 0.00 C ATOM 2298 NZ LYS A 135 19.836 -1.849 -27.052 1.00 0.00 N ATOM 0 H LYS A 135 15.597 -0.506 -27.348 1.00 0.00 H new ATOM 0 HA LYS A 135 16.892 -1.784 -29.710 1.00 0.00 H new ATOM 0 HB2 LYS A 135 15.191 -2.557 -27.300 1.00 0.00 H new ATOM 0 HB3 LYS A 135 15.234 -3.655 -28.665 1.00 0.00 H new ATOM 0 HG2 LYS A 135 17.075 -4.438 -27.436 1.00 0.00 H new ATOM 0 HG3 LYS A 135 17.873 -3.306 -28.510 1.00 0.00 H new ATOM 0 HD2 LYS A 135 17.473 -1.508 -26.672 1.00 0.00 H new ATOM 0 HD3 LYS A 135 17.035 -2.832 -25.611 1.00 0.00 H new ATOM 0 HE2 LYS A 135 19.349 -2.763 -25.178 1.00 0.00 H new ATOM 0 HE3 LYS A 135 19.368 -3.873 -26.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 20.817 -2.163 -27.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 19.369 -1.745 -27.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 19.833 -0.934 -26.557 1.00 0.00 H new ATOM 2312 N LYS A 136 13.743 -0.870 -29.766 1.00 0.00 N ATOM 2313 CA LYS A 136 12.587 -0.774 -30.725 1.00 0.00 C ATOM 2314 C LYS A 136 12.624 0.540 -31.535 1.00 0.00 C ATOM 2315 O LYS A 136 11.602 0.986 -32.021 1.00 0.00 O ATOM 2316 CB LYS A 136 11.322 -0.828 -29.859 1.00 0.00 C ATOM 2317 CG LYS A 136 10.993 -2.286 -29.527 1.00 0.00 C ATOM 2318 CD LYS A 136 9.640 -2.354 -28.816 1.00 0.00 C ATOM 2319 CE LYS A 136 9.653 -3.503 -27.804 1.00 0.00 C ATOM 2320 NZ LYS A 136 8.248 -3.995 -27.765 1.00 0.00 N ATOM 0 H LYS A 136 13.627 -0.365 -28.887 1.00 0.00 H new ATOM 0 HA LYS A 136 12.622 -1.584 -31.454 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.472 -0.260 -28.941 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.487 -0.367 -30.387 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.967 -2.881 -30.440 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.771 -2.710 -28.892 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.436 -1.411 -28.309 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.842 -2.505 -29.543 1.00 0.00 H new ATOM 0 HE2 LYS A 136 10.340 -4.292 -28.111 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.979 -3.161 -26.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 8.175 -4.785 -27.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.618 -3.224 -27.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.968 -4.320 -28.712 1.00 0.00 H new ATOM 2334 N GLY A 137 13.781 1.161 -31.703 1.00 0.00 N ATOM 2335 CA GLY A 137 13.858 2.431 -32.498 1.00 0.00 C ATOM 2336 C GLY A 137 12.799 3.444 -32.027 1.00 0.00 C ATOM 2337 O GLY A 137 12.108 4.035 -32.836 1.00 0.00 O ATOM 0 H GLY A 137 14.670 0.838 -31.322 1.00 0.00 H new ATOM 0 HA2 GLY A 137 14.852 2.867 -32.398 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.711 2.211 -33.555 1.00 0.00 H new ATOM 2341 N THR A 138 12.662 3.654 -30.734 1.00 0.00 N ATOM 2342 CA THR A 138 11.644 4.635 -30.243 1.00 0.00 C ATOM 2343 C THR A 138 12.117 5.295 -28.936 1.00 0.00 C ATOM 2344 O THR A 138 13.284 5.226 -28.598 1.00 0.00 O ATOM 2345 CB THR A 138 10.369 3.812 -30.018 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.332 4.668 -29.558 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.623 2.717 -28.978 1.00 0.00 C ATOM 0 H THR A 138 13.207 3.191 -30.007 1.00 0.00 H new ATOM 0 HA THR A 138 11.478 5.446 -30.953 1.00 0.00 H new ATOM 0 HB THR A 138 10.075 3.346 -30.959 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.516 4.145 -29.415 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.711 2.140 -28.827 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.416 2.057 -29.331 1.00 0.00 H new ATOM 0 HG23 THR A 138 10.924 3.174 -28.035 1.00 0.00 H new ATOM 2355 N GLN A 139 11.230 5.936 -28.202 1.00 0.00 N ATOM 2356 CA GLN A 139 11.648 6.593 -26.928 1.00 0.00 C ATOM 2357 C GLN A 139 10.583 6.375 -25.841 1.00 0.00 C ATOM 2358 O GLN A 139 9.408 6.259 -26.138 1.00 0.00 O ATOM 2359 CB GLN A 139 11.769 8.078 -27.271 1.00 0.00 C ATOM 2360 CG GLN A 139 13.105 8.334 -27.970 1.00 0.00 C ATOM 2361 CD GLN A 139 13.107 9.744 -28.573 1.00 0.00 C ATOM 2362 OE1 GLN A 139 12.489 10.642 -28.036 1.00 0.00 O ATOM 2363 NE2 GLN A 139 13.780 9.986 -29.672 1.00 0.00 N ATOM 0 H GLN A 139 10.241 6.029 -28.434 1.00 0.00 H new ATOM 0 HA GLN A 139 12.582 6.186 -26.541 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.945 8.381 -27.917 1.00 0.00 H new ATOM 0 HB3 GLN A 139 11.700 8.678 -26.364 1.00 0.00 H new ATOM 0 HG2 GLN A 139 13.925 8.230 -27.259 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.266 7.592 -28.753 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.301 9.236 -30.127 1.00 0.00 H new ATOM 0 HE22 GLN A 139 13.783 10.924 -30.072 1.00 0.00 H new ATOM 2372 N VAL A 140 10.979 6.317 -24.586 1.00 0.00 N ATOM 2373 CA VAL A 140 9.981 6.106 -23.493 1.00 0.00 C ATOM 2374 C VAL A 140 10.220 7.112 -22.354 1.00 0.00 C ATOM 2375 O VAL A 140 11.287 7.685 -22.245 1.00 0.00 O ATOM 2376 CB VAL A 140 10.213 4.666 -23.010 1.00 0.00 C ATOM 2377 CG1 VAL A 140 11.657 4.499 -22.517 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.241 4.351 -21.867 1.00 0.00 C ATOM 0 H VAL A 140 11.947 6.407 -24.277 1.00 0.00 H new ATOM 0 HA VAL A 140 8.956 6.256 -23.834 1.00 0.00 H new ATOM 0 HB VAL A 140 10.041 3.980 -23.839 1.00 0.00 H new ATOM 0 HG11 VAL A 140 11.809 3.475 -22.177 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.347 4.718 -23.332 1.00 0.00 H new ATOM 0 HG13 VAL A 140 11.841 5.186 -21.691 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.403 3.330 -21.522 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.412 5.044 -21.043 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.216 4.455 -22.222 1.00 0.00 H new ATOM 2388 N SER A 141 9.235 7.334 -21.503 1.00 0.00 N ATOM 2389 CA SER A 141 9.425 8.307 -20.379 1.00 0.00 C ATOM 2390 C SER A 141 8.282 8.198 -19.352 1.00 0.00 C ATOM 2391 O SER A 141 7.311 8.928 -19.424 1.00 0.00 O ATOM 2392 CB SER A 141 9.413 9.676 -21.051 1.00 0.00 C ATOM 2393 OG SER A 141 9.521 10.689 -20.059 1.00 0.00 O ATOM 0 H SER A 141 8.319 6.886 -21.541 1.00 0.00 H new ATOM 0 HA SER A 141 10.347 8.120 -19.828 1.00 0.00 H new ATOM 0 HB2 SER A 141 10.239 9.754 -21.758 1.00 0.00 H new ATOM 0 HB3 SER A 141 8.493 9.806 -21.621 1.00 0.00 H new ATOM 0 HG SER A 141 9.515 11.570 -20.489 1.00 0.00 H new ATOM 2399 N PHE A 142 8.388 7.294 -18.401 1.00 0.00 N ATOM 2400 CA PHE A 142 7.303 7.146 -17.378 1.00 0.00 C ATOM 2401 C PHE A 142 7.689 7.873 -16.072 1.00 0.00 C ATOM 2402 O PHE A 142 8.849 8.138 -15.818 1.00 0.00 O ATOM 2403 CB PHE A 142 7.171 5.625 -17.157 1.00 0.00 C ATOM 2404 CG PHE A 142 6.352 5.327 -15.914 1.00 0.00 C ATOM 2405 CD1 PHE A 142 4.957 5.444 -15.928 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.006 4.944 -14.741 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.222 5.171 -14.764 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.277 4.679 -13.589 1.00 0.00 C ATOM 2409 CZ PHE A 142 4.887 4.787 -13.591 1.00 0.00 C ATOM 0 H PHE A 142 9.176 6.656 -18.291 1.00 0.00 H new ATOM 0 HA PHE A 142 6.361 7.587 -17.703 1.00 0.00 H new ATOM 0 HB2 PHE A 142 6.700 5.167 -18.026 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.161 5.180 -17.060 1.00 0.00 H new ATOM 0 HD1 PHE A 142 4.448 5.744 -16.832 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.082 4.854 -14.730 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.145 5.257 -14.772 1.00 0.00 H new ATOM 0 HE2 PHE A 142 6.791 4.387 -12.685 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.325 4.576 -12.693 1.00 0.00 H new ATOM 2419 N HIS A 143 6.716 8.174 -15.238 1.00 0.00 N ATOM 2420 CA HIS A 143 7.004 8.857 -13.941 1.00 0.00 C ATOM 2421 C HIS A 143 6.168 8.199 -12.832 1.00 0.00 C ATOM 2422 O HIS A 143 6.701 7.636 -11.894 1.00 0.00 O ATOM 2423 CB HIS A 143 6.578 10.311 -14.149 1.00 0.00 C ATOM 2424 CG HIS A 143 7.575 11.006 -15.034 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.785 11.482 -14.553 1.00 0.00 N ATOM 2426 CD2 HIS A 143 7.557 11.314 -16.372 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.438 12.045 -15.584 1.00 0.00 C ATOM 2428 NE2 HIS A 143 8.734 11.970 -16.718 1.00 0.00 N ATOM 0 H HIS A 143 5.730 7.972 -15.406 1.00 0.00 H new ATOM 0 HA HIS A 143 8.052 8.790 -13.649 1.00 0.00 H new ATOM 0 HB2 HIS A 143 5.587 10.349 -14.601 1.00 0.00 H new ATOM 0 HB3 HIS A 143 6.511 10.822 -13.189 1.00 0.00 H new ATOM 0 HD2 HIS A 143 6.751 11.082 -17.053 1.00 0.00 H new ATOM 0 HE1 HIS A 143 10.413 12.503 -15.506 1.00 0.00 H new ATOM 0 HE2 HIS A 143 9.002 12.319 -17.638 1.00 0.00 H new ATOM 2436 N GLN A 144 4.859 8.247 -12.949 1.00 0.00 N ATOM 2437 CA GLN A 144 3.979 7.605 -11.928 1.00 0.00 C ATOM 2438 C GLN A 144 2.877 6.815 -12.646 1.00 0.00 C ATOM 2439 O GLN A 144 2.503 7.153 -13.755 1.00 0.00 O ATOM 2440 CB GLN A 144 3.385 8.763 -11.108 1.00 0.00 C ATOM 2441 CG GLN A 144 2.598 9.713 -12.018 1.00 0.00 C ATOM 2442 CD GLN A 144 1.929 10.798 -11.165 1.00 0.00 C ATOM 2443 OE1 GLN A 144 0.718 10.861 -11.092 1.00 0.00 O ATOM 2444 NE2 GLN A 144 2.666 11.663 -10.510 1.00 0.00 N ATOM 0 H GLN A 144 4.364 8.707 -13.713 1.00 0.00 H new ATOM 0 HA GLN A 144 4.516 6.909 -11.283 1.00 0.00 H new ATOM 0 HB2 GLN A 144 2.731 8.368 -10.331 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.184 9.309 -10.606 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.265 10.170 -12.749 1.00 0.00 H new ATOM 0 HG3 GLN A 144 1.844 9.158 -12.577 1.00 0.00 H new ATOM 0 HE21 GLN A 144 3.683 11.614 -10.568 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.222 12.385 -9.942 1.00 0.00 H new ATOM 2453 N CYS A 145 2.357 5.767 -12.041 1.00 0.00 N ATOM 2454 CA CYS A 145 1.283 4.979 -12.740 1.00 0.00 C ATOM 2455 C CYS A 145 -0.113 5.482 -12.350 1.00 0.00 C ATOM 2456 O CYS A 145 -0.308 6.024 -11.278 1.00 0.00 O ATOM 2457 CB CYS A 145 1.470 3.496 -12.359 1.00 0.00 C ATOM 2458 SG CYS A 145 1.188 3.213 -10.585 1.00 0.00 S ATOM 0 H CYS A 145 2.622 5.429 -11.116 1.00 0.00 H new ATOM 0 HA CYS A 145 1.367 5.102 -13.820 1.00 0.00 H new ATOM 0 HB2 CYS A 145 0.781 2.882 -12.939 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.479 3.178 -12.622 1.00 0.00 H new ATOM 0 HG CYS A 145 2.132 2.456 -10.111 1.00 0.00 H new ATOM 2463 N VAL A 146 -1.088 5.313 -13.223 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.477 5.798 -12.896 1.00 0.00 C ATOM 2465 C VAL A 146 -3.128 4.934 -11.796 1.00 0.00 C ATOM 2466 O VAL A 146 -3.991 5.409 -11.081 1.00 0.00 O ATOM 2467 CB VAL A 146 -3.301 5.730 -14.200 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -2.615 6.572 -15.276 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -3.413 4.279 -14.691 1.00 0.00 C ATOM 0 H VAL A 146 -0.985 4.867 -14.135 1.00 0.00 H new ATOM 0 HA VAL A 146 -2.440 6.818 -12.512 1.00 0.00 H new ATOM 0 HB VAL A 146 -4.302 6.115 -14.003 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.194 6.526 -16.198 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.548 7.607 -14.941 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -1.613 6.184 -15.458 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -3.997 4.250 -15.611 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -2.416 3.881 -14.881 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.905 3.674 -13.930 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.739 3.674 -11.648 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.369 2.812 -10.572 1.00 0.00 C ATOM 2481 C HIS A 147 -3.335 3.544 -9.215 1.00 0.00 C ATOM 2482 O HIS A 147 -4.365 3.783 -8.613 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.538 1.513 -10.494 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.610 0.738 -11.796 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.520 1.032 -12.811 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.879 -0.336 -12.259 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.311 0.156 -13.810 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.325 -0.698 -13.526 1.00 0.00 N ATOM 0 H HIS A 147 -2.027 3.213 -12.214 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.411 2.596 -10.808 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.499 1.755 -10.269 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.905 0.892 -9.677 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -1.080 -0.823 -11.719 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.874 0.145 -14.732 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.974 -1.455 -14.113 1.00 0.00 H new ATOM 2496 N CYS A 148 -2.163 3.910 -8.737 1.00 0.00 N ATOM 2497 CA CYS A 148 -2.074 4.628 -7.432 1.00 0.00 C ATOM 2498 C CYS A 148 -1.255 5.928 -7.583 1.00 0.00 C ATOM 2499 O CYS A 148 -0.964 6.355 -8.684 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.371 3.634 -6.494 1.00 0.00 C ATOM 2501 SG CYS A 148 0.355 3.364 -7.009 1.00 0.00 S ATOM 0 H CYS A 148 -1.269 3.740 -9.198 1.00 0.00 H new ATOM 0 HA CYS A 148 -3.050 4.929 -7.051 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.395 4.013 -5.472 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.908 2.685 -6.495 1.00 0.00 H new ATOM 0 HG CYS A 148 0.462 2.198 -7.575 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.858 6.536 -6.484 1.00 0.00 N ATOM 2507 CA GLY A 149 -0.033 7.777 -6.569 1.00 0.00 C ATOM 2508 C GLY A 149 1.432 7.388 -6.334 1.00 0.00 C ATOM 2509 O GLY A 149 2.074 7.882 -5.427 1.00 0.00 O ATOM 0 H GLY A 149 -1.072 6.223 -5.537 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -0.151 8.247 -7.545 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -0.359 8.503 -5.824 1.00 0.00 H new ATOM 2513 N CYS A 150 1.964 6.491 -7.141 1.00 0.00 N ATOM 2514 CA CYS A 150 3.385 6.055 -6.957 1.00 0.00 C ATOM 2515 C CYS A 150 4.282 6.757 -7.988 1.00 0.00 C ATOM 2516 O CYS A 150 3.893 6.943 -9.123 1.00 0.00 O ATOM 2517 CB CYS A 150 3.346 4.529 -7.179 1.00 0.00 C ATOM 2518 SG CYS A 150 5.010 3.816 -7.255 1.00 0.00 S ATOM 0 H CYS A 150 1.473 6.046 -7.916 1.00 0.00 H new ATOM 0 HA CYS A 150 3.792 6.307 -5.978 1.00 0.00 H new ATOM 0 HB2 CYS A 150 2.786 4.059 -6.371 1.00 0.00 H new ATOM 0 HB3 CYS A 150 2.814 4.310 -8.105 1.00 0.00 H new ATOM 0 HG CYS A 150 5.014 2.810 -8.078 1.00 0.00 H new ATOM 2523 N ARG A 151 5.486 7.134 -7.607 1.00 0.00 N ATOM 2524 CA ARG A 151 6.399 7.810 -8.588 1.00 0.00 C ATOM 2525 C ARG A 151 7.344 6.775 -9.215 1.00 0.00 C ATOM 2526 O ARG A 151 8.548 6.947 -9.214 1.00 0.00 O ATOM 2527 CB ARG A 151 7.191 8.851 -7.784 1.00 0.00 C ATOM 2528 CG ARG A 151 6.228 9.894 -7.213 1.00 0.00 C ATOM 2529 CD ARG A 151 7.027 11.041 -6.590 1.00 0.00 C ATOM 2530 NE ARG A 151 7.583 11.800 -7.752 1.00 0.00 N ATOM 2531 CZ ARG A 151 6.806 12.546 -8.522 1.00 0.00 C ATOM 2532 NH1 ARG A 151 5.517 12.651 -8.297 1.00 0.00 N ATOM 2533 NH2 ARG A 151 7.328 13.193 -9.531 1.00 0.00 N ATOM 0 H ARG A 151 5.870 7.004 -6.671 1.00 0.00 H new ATOM 0 HA ARG A 151 5.846 8.282 -9.400 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.737 8.364 -6.976 1.00 0.00 H new ATOM 0 HB3 ARG A 151 7.930 9.334 -8.423 1.00 0.00 H new ATOM 0 HG2 ARG A 151 5.579 10.275 -8.001 1.00 0.00 H new ATOM 0 HG3 ARG A 151 5.583 9.437 -6.463 1.00 0.00 H new ATOM 0 HD2 ARG A 151 6.391 11.675 -5.972 1.00 0.00 H new ATOM 0 HD3 ARG A 151 7.823 10.664 -5.947 1.00 0.00 H new ATOM 0 HE ARG A 151 8.581 11.742 -7.956 1.00 0.00 H new ATOM 0 HH11 ARG A 151 5.093 12.152 -7.515 1.00 0.00 H new ATOM 0 HH12 ARG A 151 4.939 13.232 -8.904 1.00 0.00 H new ATOM 0 HH21 ARG A 151 8.328 13.121 -9.721 1.00 0.00 H new ATOM 0 HH22 ARG A 151 6.736 13.770 -10.129 1.00 0.00 H new ATOM 2547 N GLY A 152 6.807 5.697 -9.752 1.00 0.00 N ATOM 2548 CA GLY A 152 7.670 4.658 -10.376 1.00 0.00 C ATOM 2549 C GLY A 152 8.522 3.973 -9.300 1.00 0.00 C ATOM 2550 O GLY A 152 9.552 4.483 -8.902 1.00 0.00 O ATOM 0 H GLY A 152 5.806 5.501 -9.780 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.053 3.920 -10.888 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.315 5.112 -11.128 1.00 0.00 H new ATOM 2554 N CYS A 153 8.105 2.813 -8.828 1.00 0.00 N ATOM 2555 CA CYS A 153 8.904 2.100 -7.786 1.00 0.00 C ATOM 2556 C CYS A 153 9.542 0.828 -8.377 1.00 0.00 C ATOM 2557 O CYS A 153 8.877 0.043 -9.026 1.00 0.00 O ATOM 2558 CB CYS A 153 7.914 1.773 -6.648 1.00 0.00 C ATOM 2559 SG CYS A 153 6.689 0.528 -7.161 1.00 0.00 S ATOM 0 H CYS A 153 7.251 2.338 -9.121 1.00 0.00 H new ATOM 0 HA CYS A 153 9.729 2.707 -7.414 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.464 1.407 -5.781 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.401 2.684 -6.339 1.00 0.00 H new ATOM 0 HG CYS A 153 7.176 -0.185 -8.133 1.00 0.00 H new ATOM 2564 N ALA A 154 10.826 0.621 -8.167 1.00 0.00 N ATOM 2565 CA ALA A 154 11.491 -0.595 -8.723 1.00 0.00 C ATOM 2566 C ALA A 154 12.525 -1.133 -7.723 1.00 0.00 C ATOM 2567 O ALA A 154 13.214 -0.367 -7.076 1.00 0.00 O ATOM 2568 CB ALA A 154 12.178 -0.120 -10.000 1.00 0.00 C ATOM 0 H ALA A 154 11.435 1.243 -7.636 1.00 0.00 H new ATOM 0 HA ALA A 154 10.785 -1.402 -8.917 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.692 -0.958 -10.470 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.432 0.280 -10.687 1.00 0.00 H new ATOM 0 HB3 ALA A 154 12.901 0.658 -9.756 1.00 0.00 H new ATOM 2574 N SER A 155 12.643 -2.437 -7.589 1.00 0.00 N ATOM 2575 CA SER A 155 13.641 -2.999 -6.624 1.00 0.00 C ATOM 2576 C SER A 155 14.820 -3.629 -7.385 1.00 0.00 C ATOM 2577 O SER A 155 14.984 -4.833 -7.388 1.00 0.00 O ATOM 2578 CB SER A 155 12.881 -4.062 -5.827 1.00 0.00 C ATOM 2579 OG SER A 155 11.510 -3.695 -5.742 1.00 0.00 O ATOM 0 H SER A 155 12.096 -3.128 -8.102 1.00 0.00 H new ATOM 0 HA SER A 155 14.059 -2.231 -5.973 1.00 0.00 H new ATOM 0 HB2 SER A 155 12.980 -5.034 -6.310 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.306 -4.157 -4.828 1.00 0.00 H new ATOM 0 HG SER A 155 11.020 -4.375 -5.233 1.00 0.00 H new