USER MOD reduce.3.24.130724 H: found=0, std=0, add=536, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 538 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 7 THR OG1 : rot -4:sc= 0.806 USER MOD Single : A 9 CYS SG : rot 180:sc= -0.732 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc= -0.462 K(o=-0.46,f=-1.7) USER MOD Single : A 32 ASN : amide:sc= -0.072 X(o=-0.072,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -92:sc= 0.0542 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN :FLIP amide:sc= -10.1! C(o=-13!,f=-10!) USER MOD Single : A 44 GLN : amide:sc= -0.551 K(o=-0.55,f=-2.7!) USER MOD Single : A 46 LYS NZ :NH3+ -161:sc= -0.0482 (180deg=-0.317) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 41:sc= 0.309 USER MOD Single : A 90 ASN : amide:sc= -0.139 K(o=-0.14,f=-0.79) USER MOD Single : A 91 THR OG1 : rot 52:sc= 0.907 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.726 K(o=-0.73,f=-4.2!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -2.71! C(o=-2.7!,f=-3.6!) USER MOD Single : A 102 THR OG1 : rot -92:sc= 0.945 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.112 USER MOD Single : A 109 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.496) USER MOD Single : A 110 GLN :FLIP amide:sc= -0.0684 F(o=-1.5,f=-0.068) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.533 USER MOD Single : A 114 LYS NZ :NH3+ -109:sc= -1.14 (180deg=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 90 N THR A 7 17.043 1.366 13.230 1.00 0.00 N ATOM 91 CA THR A 7 16.397 1.692 11.965 1.00 0.00 C ATOM 92 C THR A 7 16.365 0.469 11.051 1.00 0.00 C ATOM 93 O THR A 7 17.269 -0.365 11.091 1.00 0.00 O ATOM 94 CB THR A 7 17.139 2.842 11.286 1.00 0.00 C ATOM 95 OG1 THR A 7 18.374 3.097 11.930 1.00 0.00 O ATOM 96 CG2 THR A 7 16.348 4.128 11.284 1.00 0.00 C ATOM 0 HA THR A 7 15.370 1.999 12.163 1.00 0.00 H new ATOM 0 HB THR A 7 17.297 2.522 10.256 1.00 0.00 H new ATOM 0 HG1 THR A 7 18.455 2.524 12.721 1.00 0.00 H new ATOM 0 HG21 THR A 7 16.925 4.909 10.789 1.00 0.00 H new ATOM 0 HG22 THR A 7 15.409 3.977 10.751 1.00 0.00 H new ATOM 0 HG23 THR A 7 16.138 4.428 12.311 1.00 0.00 H new ATOM 104 N PHE A 8 15.322 0.359 10.233 1.00 0.00 N ATOM 105 CA PHE A 8 15.198 -0.779 9.326 1.00 0.00 C ATOM 106 C PHE A 8 14.559 -0.408 7.993 1.00 0.00 C ATOM 107 O PHE A 8 13.536 0.271 7.940 1.00 0.00 O ATOM 108 CB PHE A 8 14.383 -1.906 9.969 1.00 0.00 C ATOM 109 CG PHE A 8 13.193 -1.453 10.779 1.00 0.00 C ATOM 110 CD1 PHE A 8 12.576 -0.228 10.550 1.00 0.00 C ATOM 111 CD2 PHE A 8 12.690 -2.271 11.777 1.00 0.00 C ATOM 112 CE1 PHE A 8 11.486 0.166 11.306 1.00 0.00 C ATOM 113 CE2 PHE A 8 11.602 -1.883 12.533 1.00 0.00 C ATOM 114 CZ PHE A 8 11.000 -0.663 12.298 1.00 0.00 C ATOM 0 H PHE A 8 14.559 1.034 10.179 1.00 0.00 H new ATOM 0 HA PHE A 8 16.216 -1.116 9.131 1.00 0.00 H new ATOM 0 HB2 PHE A 8 14.034 -2.575 9.183 1.00 0.00 H new ATOM 0 HB3 PHE A 8 15.042 -2.488 10.614 1.00 0.00 H new ATOM 0 HD1 PHE A 8 12.951 0.423 9.774 1.00 0.00 H new ATOM 0 HD2 PHE A 8 13.156 -3.227 11.967 1.00 0.00 H new ATOM 0 HE1 PHE A 8 11.016 1.120 11.121 1.00 0.00 H new ATOM 0 HE2 PHE A 8 11.222 -2.533 13.307 1.00 0.00 H new ATOM 0 HZ PHE A 8 10.150 -0.357 12.889 1.00 0.00 H new ATOM 124 N CYS A 9 15.150 -0.904 6.913 1.00 0.00 N ATOM 125 CA CYS A 9 14.614 -0.671 5.582 1.00 0.00 C ATOM 126 C CYS A 9 13.631 -1.794 5.263 1.00 0.00 C ATOM 127 O CYS A 9 13.999 -2.969 5.282 1.00 0.00 O ATOM 128 CB CYS A 9 15.735 -0.629 4.535 1.00 0.00 C ATOM 129 SG CYS A 9 17.327 -0.036 5.160 1.00 0.00 S ATOM 0 H CYS A 9 15.999 -1.469 6.935 1.00 0.00 H new ATOM 0 HA CYS A 9 14.108 0.294 5.555 1.00 0.00 H new ATOM 0 HB2 CYS A 9 15.870 -1.630 4.126 1.00 0.00 H new ATOM 0 HB3 CYS A 9 15.421 0.012 3.711 1.00 0.00 H new ATOM 0 HG CYS A 9 18.201 -0.043 4.197 1.00 0.00 H new ATOM 135 N VAL A 10 12.377 -1.443 5.012 1.00 0.00 N ATOM 136 CA VAL A 10 11.353 -2.448 4.740 1.00 0.00 C ATOM 137 C VAL A 10 10.908 -2.421 3.283 1.00 0.00 C ATOM 138 O VAL A 10 11.024 -1.406 2.609 1.00 0.00 O ATOM 139 CB VAL A 10 10.123 -2.238 5.659 1.00 0.00 C ATOM 140 CG1 VAL A 10 8.944 -1.628 4.907 1.00 0.00 C ATOM 141 CG2 VAL A 10 9.721 -3.546 6.316 1.00 0.00 C ATOM 0 H VAL A 10 12.044 -0.479 4.991 1.00 0.00 H new ATOM 0 HA VAL A 10 11.798 -3.422 4.945 1.00 0.00 H new ATOM 0 HB VAL A 10 10.413 -1.529 6.434 1.00 0.00 H new ATOM 0 HG11 VAL A 10 8.104 -1.499 5.590 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.234 -0.659 4.501 1.00 0.00 H new ATOM 0 HG13 VAL A 10 8.650 -2.290 4.092 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.856 -3.380 6.958 1.00 0.00 H new ATOM 0 HG22 VAL A 10 9.468 -4.276 5.548 1.00 0.00 H new ATOM 0 HG23 VAL A 10 10.550 -3.922 6.915 1.00 0.00 H new ATOM 151 N VAL A 11 10.389 -3.541 2.809 1.00 0.00 N ATOM 152 CA VAL A 11 9.919 -3.637 1.439 1.00 0.00 C ATOM 153 C VAL A 11 8.602 -4.402 1.373 1.00 0.00 C ATOM 154 O VAL A 11 8.529 -5.575 1.742 1.00 0.00 O ATOM 155 CB VAL A 11 10.978 -4.301 0.547 1.00 0.00 C ATOM 156 CG1 VAL A 11 11.485 -5.580 1.186 1.00 0.00 C ATOM 157 CG2 VAL A 11 10.440 -4.560 -0.853 1.00 0.00 C ATOM 0 H VAL A 11 10.283 -4.397 3.354 1.00 0.00 H new ATOM 0 HA VAL A 11 9.745 -2.627 1.067 1.00 0.00 H new ATOM 0 HB VAL A 11 11.818 -3.613 0.450 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.235 -6.037 0.540 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.931 -5.351 2.154 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.654 -6.272 1.324 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.214 -5.031 -1.459 1.00 0.00 H new ATOM 0 HG22 VAL A 11 9.574 -5.220 -0.794 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.146 -3.615 -1.310 1.00 0.00 H new ATOM 167 N VAL A 12 7.561 -3.716 0.920 1.00 0.00 N ATOM 168 CA VAL A 12 6.231 -4.304 0.822 1.00 0.00 C ATOM 169 C VAL A 12 5.966 -4.899 -0.554 1.00 0.00 C ATOM 170 O VAL A 12 5.803 -4.172 -1.532 1.00 0.00 O ATOM 171 CB VAL A 12 5.148 -3.251 1.111 1.00 0.00 C ATOM 172 CG1 VAL A 12 5.259 -2.753 2.541 1.00 0.00 C ATOM 173 CG2 VAL A 12 5.252 -2.093 0.127 1.00 0.00 C ATOM 0 H VAL A 12 7.613 -2.745 0.613 1.00 0.00 H new ATOM 0 HA VAL A 12 6.192 -5.102 1.564 1.00 0.00 H new ATOM 0 HB VAL A 12 4.171 -3.717 0.986 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.485 -2.009 2.728 1.00 0.00 H new ATOM 0 HG12 VAL A 12 5.132 -3.589 3.228 1.00 0.00 H new ATOM 0 HG13 VAL A 12 6.240 -2.303 2.694 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.478 -1.358 0.347 1.00 0.00 H new ATOM 0 HG22 VAL A 12 6.232 -1.626 0.218 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.120 -2.466 -0.889 1.00 0.00 H new ATOM 183 N GLN A 13 5.892 -6.222 -0.621 1.00 0.00 N ATOM 184 CA GLN A 13 5.612 -6.905 -1.877 1.00 0.00 C ATOM 185 C GLN A 13 4.109 -7.122 -2.019 1.00 0.00 C ATOM 186 O GLN A 13 3.514 -7.898 -1.271 1.00 0.00 O ATOM 187 CB GLN A 13 6.349 -8.244 -1.938 1.00 0.00 C ATOM 188 CG GLN A 13 6.918 -8.562 -3.313 1.00 0.00 C ATOM 189 CD GLN A 13 7.093 -10.050 -3.541 1.00 0.00 C ATOM 190 OE1 GLN A 13 6.278 -10.688 -4.209 1.00 0.00 O ATOM 191 NE2 GLN A 13 8.161 -10.612 -2.988 1.00 0.00 N ATOM 0 H GLN A 13 6.022 -6.842 0.178 1.00 0.00 H new ATOM 0 HA GLN A 13 5.964 -6.285 -2.701 1.00 0.00 H new ATOM 0 HB2 GLN A 13 7.161 -8.236 -1.211 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.665 -9.040 -1.644 1.00 0.00 H new ATOM 0 HG2 GLN A 13 6.257 -8.156 -4.079 1.00 0.00 H new ATOM 0 HG3 GLN A 13 7.881 -8.065 -3.427 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.810 -10.046 -2.442 1.00 0.00 H new ATOM 0 HE22 GLN A 13 8.332 -11.610 -3.109 1.00 0.00 H new ATOM 200 N ASN A 14 3.495 -6.424 -2.971 1.00 0.00 N ATOM 201 CA ASN A 14 2.054 -6.540 -3.184 1.00 0.00 C ATOM 202 C ASN A 14 1.730 -7.527 -4.295 1.00 0.00 C ATOM 203 O ASN A 14 2.444 -7.624 -5.292 1.00 0.00 O ATOM 204 CB ASN A 14 1.417 -5.179 -3.514 1.00 0.00 C ATOM 205 CG ASN A 14 2.411 -4.032 -3.522 1.00 0.00 C ATOM 206 OD1 ASN A 14 2.989 -3.688 -2.492 1.00 0.00 O ATOM 207 ND2 ASN A 14 2.611 -3.438 -4.692 1.00 0.00 N ATOM 0 H ASN A 14 3.967 -5.777 -3.603 1.00 0.00 H new ATOM 0 HA ASN A 14 1.634 -6.909 -2.248 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.936 -5.239 -4.490 1.00 0.00 H new ATOM 0 HB3 ASN A 14 0.635 -4.967 -2.785 1.00 0.00 H new ATOM 0 HD21 ASN A 14 3.268 -2.661 -4.764 1.00 0.00 H new ATOM 0 HD22 ASN A 14 2.108 -3.759 -5.519 1.00 0.00 H new ATOM 482 N ASP A 31 6.748 -4.251 -5.574 1.00 0.00 N ATOM 483 CA ASP A 31 7.223 -4.016 -4.217 1.00 0.00 C ATOM 484 C ASP A 31 7.985 -2.698 -4.125 1.00 0.00 C ATOM 485 O ASP A 31 8.655 -2.289 -5.073 1.00 0.00 O ATOM 486 CB ASP A 31 8.121 -5.169 -3.764 1.00 0.00 C ATOM 487 CG ASP A 31 9.371 -5.295 -4.610 1.00 0.00 C ATOM 488 OD1 ASP A 31 9.299 -5.005 -5.824 1.00 0.00 O ATOM 489 OD2 ASP A 31 10.424 -5.684 -4.062 1.00 0.00 O ATOM 0 HA ASP A 31 6.355 -3.958 -3.560 1.00 0.00 H new ATOM 0 HB2 ASP A 31 8.404 -5.017 -2.722 1.00 0.00 H new ATOM 0 HB3 ASP A 31 7.560 -6.102 -3.809 1.00 0.00 H new ATOM 494 N ASN A 32 7.881 -2.040 -2.975 1.00 0.00 N ATOM 495 CA ASN A 32 8.563 -0.771 -2.756 1.00 0.00 C ATOM 496 C ASN A 32 9.433 -0.844 -1.508 1.00 0.00 C ATOM 497 O ASN A 32 9.000 -1.352 -0.475 1.00 0.00 O ATOM 498 CB ASN A 32 7.545 0.363 -2.620 1.00 0.00 C ATOM 499 CG ASN A 32 7.979 1.620 -3.347 1.00 0.00 C ATOM 500 OD1 ASN A 32 8.166 2.672 -2.735 1.00 0.00 O ATOM 501 ND2 ASN A 32 8.143 1.518 -4.660 1.00 0.00 N ATOM 0 H ASN A 32 7.330 -2.365 -2.180 1.00 0.00 H new ATOM 0 HA ASN A 32 9.201 -0.569 -3.616 1.00 0.00 H new ATOM 0 HB2 ASN A 32 6.583 0.033 -3.013 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.397 0.590 -1.564 1.00 0.00 H new ATOM 0 HD21 ASN A 32 8.435 2.331 -5.202 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.977 0.626 -5.127 1.00 0.00 H new ATOM 508 N SER A 33 10.657 -0.335 -1.604 1.00 0.00 N ATOM 509 CA SER A 33 11.572 -0.354 -0.470 1.00 0.00 C ATOM 510 C SER A 33 11.374 0.865 0.411 1.00 0.00 C ATOM 511 O SER A 33 11.070 1.958 -0.067 1.00 0.00 O ATOM 512 CB SER A 33 13.027 -0.409 -0.923 1.00 0.00 C ATOM 513 OG SER A 33 13.286 -1.570 -1.692 1.00 0.00 O ATOM 0 H SER A 33 11.036 0.093 -2.449 1.00 0.00 H new ATOM 0 HA SER A 33 11.346 -1.255 0.101 1.00 0.00 H new ATOM 0 HB2 SER A 33 13.260 0.478 -1.512 1.00 0.00 H new ATOM 0 HB3 SER A 33 13.682 -0.395 -0.052 1.00 0.00 H new ATOM 0 HG SER A 33 14.226 -1.576 -1.969 1.00 0.00 H new ATOM 519 N LEU A 34 11.554 0.658 1.700 1.00 0.00 N ATOM 520 CA LEU A 34 11.407 1.717 2.679 1.00 0.00 C ATOM 521 C LEU A 34 12.755 2.014 3.333 1.00 0.00 C ATOM 522 O LEU A 34 13.527 1.103 3.625 1.00 0.00 O ATOM 523 CB LEU A 34 10.357 1.302 3.726 1.00 0.00 C ATOM 524 CG LEU A 34 10.191 2.210 4.934 1.00 0.00 C ATOM 525 CD1 LEU A 34 11.124 1.734 6.028 1.00 0.00 C ATOM 526 CD2 LEU A 34 10.436 3.675 4.596 1.00 0.00 C ATOM 0 H LEU A 34 11.806 -0.247 2.098 1.00 0.00 H new ATOM 0 HA LEU A 34 11.065 2.629 2.189 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.392 1.224 3.225 1.00 0.00 H new ATOM 0 HB3 LEU A 34 10.612 0.305 4.084 1.00 0.00 H new ATOM 0 HG LEU A 34 9.158 2.151 5.277 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.017 2.376 6.902 1.00 0.00 H new ATOM 0 HD12 LEU A 34 10.874 0.708 6.298 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.153 1.775 5.672 1.00 0.00 H new ATOM 0 HD21 LEU A 34 10.305 4.282 5.492 1.00 0.00 H new ATOM 0 HD22 LEU A 34 11.452 3.797 4.220 1.00 0.00 H new ATOM 0 HD23 LEU A 34 9.726 3.996 3.833 1.00 0.00 H new ATOM 538 N ALA A 35 13.027 3.292 3.560 1.00 0.00 N ATOM 539 CA ALA A 35 14.268 3.724 4.175 1.00 0.00 C ATOM 540 C ALA A 35 14.289 3.324 5.637 1.00 0.00 C ATOM 541 O ALA A 35 13.251 3.074 6.235 1.00 0.00 O ATOM 542 CB ALA A 35 14.443 5.222 4.029 1.00 0.00 C ATOM 0 H ALA A 35 12.393 4.055 3.322 1.00 0.00 H new ATOM 0 HA ALA A 35 15.099 3.235 3.667 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.379 5.526 4.497 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.463 5.485 2.971 1.00 0.00 H new ATOM 0 HB3 ALA A 35 13.612 5.734 4.514 1.00 0.00 H new ATOM 548 N ALA A 36 15.470 3.227 6.200 1.00 0.00 N ATOM 549 CA ALA A 36 15.600 2.799 7.582 1.00 0.00 C ATOM 550 C ALA A 36 15.066 3.856 8.537 1.00 0.00 C ATOM 551 O ALA A 36 15.673 4.905 8.747 1.00 0.00 O ATOM 552 CB ALA A 36 17.053 2.480 7.894 1.00 0.00 C ATOM 0 H ALA A 36 16.351 3.436 5.731 1.00 0.00 H new ATOM 0 HA ALA A 36 15.004 1.897 7.719 1.00 0.00 H new ATOM 0 HB1 ALA A 36 17.140 2.160 8.932 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.399 1.681 7.238 1.00 0.00 H new ATOM 0 HB3 ALA A 36 17.663 3.369 7.736 1.00 0.00 H new ATOM 558 N VAL A 37 13.893 3.549 9.099 1.00 0.00 N ATOM 559 CA VAL A 37 13.206 4.432 10.033 1.00 0.00 C ATOM 560 C VAL A 37 12.916 3.709 11.345 1.00 0.00 C ATOM 561 O VAL A 37 13.044 2.487 11.432 1.00 0.00 O ATOM 562 CB VAL A 37 11.872 4.937 9.441 1.00 0.00 C ATOM 563 CG1 VAL A 37 11.335 6.117 10.235 1.00 0.00 C ATOM 564 CG2 VAL A 37 12.035 5.302 7.972 1.00 0.00 C ATOM 0 H VAL A 37 13.396 2.678 8.915 1.00 0.00 H new ATOM 0 HA VAL A 37 13.863 5.281 10.218 1.00 0.00 H new ATOM 0 HB VAL A 37 11.146 4.127 9.511 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.395 6.453 9.797 1.00 0.00 H new ATOM 0 HG12 VAL A 37 11.166 5.814 11.268 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.059 6.932 10.210 1.00 0.00 H new ATOM 0 HG21 VAL A 37 11.082 5.655 7.577 1.00 0.00 H new ATOM 0 HG22 VAL A 37 12.783 6.089 7.873 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.357 4.424 7.412 1.00 0.00 H new ATOM 574 N SER A 38 12.526 4.467 12.366 1.00 0.00 N ATOM 575 CA SER A 38 12.220 3.897 13.672 1.00 0.00 C ATOM 576 C SER A 38 11.158 2.804 13.569 1.00 0.00 C ATOM 577 O SER A 38 11.427 1.638 13.856 1.00 0.00 O ATOM 578 CB SER A 38 11.747 4.993 14.628 1.00 0.00 C ATOM 579 OG SER A 38 11.094 6.037 13.926 1.00 0.00 O ATOM 0 H SER A 38 12.415 5.479 12.313 1.00 0.00 H new ATOM 0 HA SER A 38 13.133 3.446 14.061 1.00 0.00 H new ATOM 0 HB2 SER A 38 11.068 4.567 15.367 1.00 0.00 H new ATOM 0 HB3 SER A 38 12.600 5.396 15.174 1.00 0.00 H new ATOM 0 HG SER A 38 11.745 6.731 13.692 1.00 0.00 H new ATOM 585 N GLU A 39 9.947 3.189 13.171 1.00 0.00 N ATOM 586 CA GLU A 39 8.849 2.230 13.049 1.00 0.00 C ATOM 587 C GLU A 39 7.722 2.743 12.147 1.00 0.00 C ATOM 588 O GLU A 39 6.873 1.965 11.714 1.00 0.00 O ATOM 589 CB GLU A 39 8.290 1.894 14.432 1.00 0.00 C ATOM 590 CG GLU A 39 7.910 0.432 14.595 1.00 0.00 C ATOM 591 CD GLU A 39 6.951 0.204 15.747 1.00 0.00 C ATOM 592 OE1 GLU A 39 6.878 1.075 16.640 1.00 0.00 O ATOM 593 OE2 GLU A 39 6.272 -0.844 15.755 1.00 0.00 O ATOM 0 H GLU A 39 9.702 4.149 12.929 1.00 0.00 H new ATOM 0 HA GLU A 39 9.257 1.333 12.584 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.031 2.155 15.188 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.412 2.512 14.620 1.00 0.00 H new ATOM 0 HG2 GLU A 39 7.455 0.074 13.672 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.812 -0.158 14.756 1.00 0.00 H new ATOM 600 N SER A 40 7.703 4.049 11.880 1.00 0.00 N ATOM 601 CA SER A 40 6.664 4.653 11.044 1.00 0.00 C ATOM 602 C SER A 40 6.346 3.796 9.818 1.00 0.00 C ATOM 603 O SER A 40 5.188 3.685 9.416 1.00 0.00 O ATOM 604 CB SER A 40 7.096 6.051 10.598 1.00 0.00 C ATOM 605 OG SER A 40 7.139 6.947 11.695 1.00 0.00 O ATOM 0 H SER A 40 8.396 4.710 12.231 1.00 0.00 H new ATOM 0 HA SER A 40 5.759 4.721 11.647 1.00 0.00 H new ATOM 0 HB2 SER A 40 8.078 5.999 10.129 1.00 0.00 H new ATOM 0 HB3 SER A 40 6.403 6.426 9.845 1.00 0.00 H new ATOM 0 HG SER A 40 7.419 7.833 11.383 1.00 0.00 H new ATOM 611 N GLN A 41 7.372 3.191 9.230 1.00 0.00 N ATOM 612 CA GLN A 41 7.187 2.348 8.053 1.00 0.00 C ATOM 613 C GLN A 41 6.323 1.136 8.371 1.00 0.00 C ATOM 614 O GLN A 41 5.333 0.869 7.690 1.00 0.00 O ATOM 615 CB GLN A 41 8.535 1.890 7.499 1.00 0.00 C ATOM 616 CG GLN A 41 9.464 1.262 8.527 1.00 0.00 C ATOM 617 CD GLN A 41 9.483 -0.262 8.503 1.00 0.00 C ATOM 618 OE1 GLN A 41 8.494 -0.886 7.867 1.00 0.00 O flip ATOM 619 NE2 GLN A 41 10.392 -0.879 9.055 1.00 0.00 N flip ATOM 0 H GLN A 41 8.338 3.268 9.547 1.00 0.00 H new ATOM 0 HA GLN A 41 6.677 2.947 7.299 1.00 0.00 H new ATOM 0 HB2 GLN A 41 8.358 1.169 6.701 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.038 2.746 7.050 1.00 0.00 H new ATOM 0 HG2 GLN A 41 10.476 1.630 8.358 1.00 0.00 H new ATOM 0 HG3 GLN A 41 9.166 1.595 9.521 1.00 0.00 H new ATOM 0 HE21 GLN A 41 11.136 -0.371 9.534 1.00 0.00 H new ATOM 0 HE22 GLN A 41 10.403 -1.899 9.034 1.00 0.00 H new ATOM 628 N LEU A 42 6.714 0.394 9.399 1.00 0.00 N ATOM 629 CA LEU A 42 5.987 -0.803 9.797 1.00 0.00 C ATOM 630 C LEU A 42 4.531 -0.490 10.124 1.00 0.00 C ATOM 631 O LEU A 42 3.657 -1.344 9.982 1.00 0.00 O ATOM 632 CB LEU A 42 6.664 -1.456 11.004 1.00 0.00 C ATOM 633 CG LEU A 42 5.944 -2.683 11.569 1.00 0.00 C ATOM 634 CD1 LEU A 42 6.473 -3.955 10.926 1.00 0.00 C ATOM 635 CD2 LEU A 42 6.099 -2.743 13.081 1.00 0.00 C ATOM 0 H LEU A 42 7.532 0.601 9.973 1.00 0.00 H new ATOM 0 HA LEU A 42 6.002 -1.496 8.955 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.675 -1.747 10.720 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.756 -0.712 11.795 1.00 0.00 H new ATOM 0 HG LEU A 42 4.883 -2.597 11.336 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.950 -4.817 11.340 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.309 -3.914 9.849 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.540 -4.048 11.127 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.581 -3.622 13.465 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.157 -2.805 13.336 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.670 -1.845 13.527 1.00 0.00 H new ATOM 647 N ALA A 43 4.276 0.733 10.569 1.00 0.00 N ATOM 648 CA ALA A 43 2.925 1.144 10.923 1.00 0.00 C ATOM 649 C ALA A 43 2.191 1.751 9.733 1.00 0.00 C ATOM 650 O ALA A 43 1.004 1.496 9.533 1.00 0.00 O ATOM 651 CB ALA A 43 2.967 2.129 12.078 1.00 0.00 C ATOM 0 H ALA A 43 4.985 1.456 10.693 1.00 0.00 H new ATOM 0 HA ALA A 43 2.374 0.255 11.229 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.952 2.431 12.336 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.436 1.657 12.942 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.544 3.007 11.787 1.00 0.00 H new ATOM 657 N GLN A 44 2.896 2.554 8.946 1.00 0.00 N ATOM 658 CA GLN A 44 2.295 3.193 7.781 1.00 0.00 C ATOM 659 C GLN A 44 1.822 2.148 6.775 1.00 0.00 C ATOM 660 O GLN A 44 0.752 2.284 6.180 1.00 0.00 O ATOM 661 CB GLN A 44 3.290 4.145 7.116 1.00 0.00 C ATOM 662 CG GLN A 44 2.629 5.223 6.274 1.00 0.00 C ATOM 663 CD GLN A 44 2.339 4.763 4.859 1.00 0.00 C ATOM 664 OE1 GLN A 44 3.049 3.920 4.310 1.00 0.00 O ATOM 665 NE2 GLN A 44 1.291 5.315 4.260 1.00 0.00 N ATOM 0 H GLN A 44 3.880 2.778 9.092 1.00 0.00 H new ATOM 0 HA GLN A 44 1.432 3.767 8.120 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.898 4.619 7.887 1.00 0.00 H new ATOM 0 HB3 GLN A 44 3.967 3.568 6.486 1.00 0.00 H new ATOM 0 HG2 GLN A 44 1.698 5.530 6.750 1.00 0.00 H new ATOM 0 HG3 GLN A 44 3.275 6.100 6.241 1.00 0.00 H new ATOM 0 HE21 GLN A 44 0.730 6.010 4.752 1.00 0.00 H new ATOM 0 HE22 GLN A 44 1.047 5.044 3.307 1.00 0.00 H new ATOM 674 N LEU A 45 2.627 1.110 6.587 1.00 0.00 N ATOM 675 CA LEU A 45 2.295 0.043 5.652 1.00 0.00 C ATOM 676 C LEU A 45 1.282 -0.924 6.254 1.00 0.00 C ATOM 677 O LEU A 45 0.371 -1.392 5.571 1.00 0.00 O ATOM 678 CB LEU A 45 3.561 -0.709 5.247 1.00 0.00 C ATOM 679 CG LEU A 45 4.794 0.172 5.054 1.00 0.00 C ATOM 680 CD1 LEU A 45 6.052 -0.673 4.989 1.00 0.00 C ATOM 681 CD2 LEU A 45 4.649 1.031 3.809 1.00 0.00 C ATOM 0 H LEU A 45 3.516 0.984 7.071 1.00 0.00 H new ATOM 0 HA LEU A 45 1.845 0.495 4.768 1.00 0.00 H new ATOM 0 HB2 LEU A 45 3.782 -1.457 6.008 1.00 0.00 H new ATOM 0 HB3 LEU A 45 3.367 -1.246 4.319 1.00 0.00 H new ATOM 0 HG LEU A 45 4.880 0.836 5.914 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.918 -0.026 4.851 1.00 0.00 H new ATOM 0 HD12 LEU A 45 6.162 -1.234 5.917 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.981 -1.367 4.152 1.00 0.00 H new ATOM 0 HD21 LEU A 45 5.537 1.651 3.689 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.534 0.389 2.936 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.771 1.670 3.908 1.00 0.00 H new ATOM 692 N LYS A 46 1.453 -1.223 7.536 1.00 0.00 N ATOM 693 CA LYS A 46 0.559 -2.138 8.237 1.00 0.00 C ATOM 694 C LYS A 46 -0.854 -1.562 8.356 1.00 0.00 C ATOM 695 O LYS A 46 -1.793 -2.278 8.702 1.00 0.00 O ATOM 696 CB LYS A 46 1.110 -2.456 9.628 1.00 0.00 C ATOM 697 CG LYS A 46 0.264 -3.454 10.406 1.00 0.00 C ATOM 698 CD LYS A 46 -0.320 -2.832 11.664 1.00 0.00 C ATOM 699 CE LYS A 46 0.723 -2.716 12.764 1.00 0.00 C ATOM 700 NZ LYS A 46 1.134 -4.050 13.283 1.00 0.00 N ATOM 0 H LYS A 46 2.204 -0.844 8.113 1.00 0.00 H new ATOM 0 HA LYS A 46 0.501 -3.056 7.652 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.121 -2.850 9.527 1.00 0.00 H new ATOM 0 HB3 LYS A 46 1.184 -1.531 10.200 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.543 -3.820 9.772 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.874 -4.317 10.675 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.717 -1.844 11.432 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -1.156 -3.437 12.016 1.00 0.00 H new ATOM 0 HE2 LYS A 46 1.598 -2.190 12.381 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.323 -2.116 13.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 1.580 -3.937 14.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 0.297 -4.661 13.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 1.812 -4.485 12.625 1.00 0.00 H new ATOM 714 N ALA A 47 -0.999 -0.270 8.070 1.00 0.00 N ATOM 715 CA ALA A 47 -2.300 0.392 8.150 1.00 0.00 C ATOM 716 C ALA A 47 -3.387 -0.424 7.454 1.00 0.00 C ATOM 717 O ALA A 47 -4.559 -0.356 7.826 1.00 0.00 O ATOM 718 CB ALA A 47 -2.219 1.785 7.546 1.00 0.00 C ATOM 0 H ALA A 47 -0.233 0.339 7.781 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.568 0.474 9.203 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -3.194 2.267 7.612 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.484 2.376 8.092 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.920 1.711 6.500 1.00 0.00 H new ATOM 724 N ASP A 48 -2.992 -1.192 6.444 1.00 0.00 N ATOM 725 CA ASP A 48 -3.935 -2.019 5.700 1.00 0.00 C ATOM 726 C ASP A 48 -3.438 -3.459 5.596 1.00 0.00 C ATOM 727 O ASP A 48 -2.464 -3.739 4.895 1.00 0.00 O ATOM 728 CB ASP A 48 -4.160 -1.442 4.301 1.00 0.00 C ATOM 729 CG ASP A 48 -2.863 -1.068 3.612 1.00 0.00 C ATOM 730 OD1 ASP A 48 -2.152 -1.983 3.148 1.00 0.00 O ATOM 731 OD2 ASP A 48 -2.558 0.141 3.538 1.00 0.00 O ATOM 0 H ASP A 48 -2.026 -1.259 6.122 1.00 0.00 H new ATOM 0 HA ASP A 48 -4.881 -2.020 6.242 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -4.694 -2.172 3.692 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -4.797 -0.560 4.373 1.00 0.00 H new ATOM 736 N PRO A 49 -4.101 -4.397 6.295 1.00 0.00 N ATOM 737 CA PRO A 49 -3.720 -5.814 6.278 1.00 0.00 C ATOM 738 C PRO A 49 -3.567 -6.365 4.862 1.00 0.00 C ATOM 739 O PRO A 49 -2.877 -7.362 4.648 1.00 0.00 O ATOM 740 CB PRO A 49 -4.885 -6.500 6.992 1.00 0.00 C ATOM 741 CG PRO A 49 -5.442 -5.454 7.892 1.00 0.00 C ATOM 742 CD PRO A 49 -5.273 -4.153 7.160 1.00 0.00 C ATOM 0 HA PRO A 49 -2.751 -5.978 6.750 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -5.633 -6.851 6.282 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -4.548 -7.370 7.556 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -6.492 -5.646 8.112 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -4.915 -5.438 8.846 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -6.158 -3.903 6.576 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.100 -3.325 7.847 1.00 0.00 H new ATOM 750 N ARG A 50 -4.215 -5.712 3.899 1.00 0.00 N ATOM 751 CA ARG A 50 -4.151 -6.138 2.503 1.00 0.00 C ATOM 752 C ARG A 50 -2.718 -6.456 2.083 1.00 0.00 C ATOM 753 O ARG A 50 -2.395 -7.597 1.752 1.00 0.00 O ATOM 754 CB ARG A 50 -4.730 -5.054 1.592 1.00 0.00 C ATOM 755 CG ARG A 50 -6.224 -4.843 1.773 1.00 0.00 C ATOM 756 CD ARG A 50 -7.029 -5.915 1.057 1.00 0.00 C ATOM 757 NE ARG A 50 -7.345 -7.040 1.935 1.00 0.00 N ATOM 758 CZ ARG A 50 -8.161 -6.954 2.983 1.00 0.00 C ATOM 759 NH1 ARG A 50 -8.742 -5.800 3.288 1.00 0.00 N ATOM 760 NH2 ARG A 50 -8.396 -8.024 3.729 1.00 0.00 N ATOM 0 H ARG A 50 -4.791 -4.886 4.060 1.00 0.00 H new ATOM 0 HA ARG A 50 -4.744 -7.047 2.405 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -4.213 -4.114 1.785 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.532 -5.320 0.554 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.468 -4.852 2.835 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -6.503 -3.861 1.391 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -7.954 -5.481 0.677 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.468 -6.275 0.195 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.916 -7.943 1.733 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -8.564 -4.973 2.718 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.366 -5.740 4.092 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -7.952 -8.913 3.500 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -9.021 -7.958 4.532 1.00 0.00 H new ATOM 774 N LEU A 51 -1.861 -5.440 2.103 1.00 0.00 N ATOM 775 CA LEU A 51 -0.463 -5.614 1.728 1.00 0.00 C ATOM 776 C LEU A 51 0.320 -6.284 2.855 1.00 0.00 C ATOM 777 O LEU A 51 -0.191 -6.451 3.962 1.00 0.00 O ATOM 778 CB LEU A 51 0.163 -4.265 1.374 1.00 0.00 C ATOM 779 CG LEU A 51 -0.306 -3.663 0.047 1.00 0.00 C ATOM 780 CD1 LEU A 51 -1.692 -3.053 0.195 1.00 0.00 C ATOM 781 CD2 LEU A 51 0.686 -2.621 -0.443 1.00 0.00 C ATOM 0 H LEU A 51 -2.110 -4.489 2.375 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.421 -6.260 0.851 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.057 -3.558 2.174 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.246 -4.382 1.340 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.361 -4.462 -0.693 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.007 -2.630 -0.759 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.398 -3.825 0.501 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.665 -2.266 0.949 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.338 -2.203 -1.387 1.00 0.00 H new ATOM 0 HD22 LEU A 51 0.772 -1.825 0.296 1.00 0.00 H new ATOM 0 HD23 LEU A 51 1.660 -3.087 -0.590 1.00 0.00 H new ATOM 793 N VAL A 52 1.557 -6.677 2.565 1.00 0.00 N ATOM 794 CA VAL A 52 2.400 -7.343 3.556 1.00 0.00 C ATOM 795 C VAL A 52 3.674 -6.550 3.837 1.00 0.00 C ATOM 796 O VAL A 52 4.581 -6.498 3.008 1.00 0.00 O ATOM 797 CB VAL A 52 2.802 -8.755 3.091 1.00 0.00 C ATOM 798 CG1 VAL A 52 3.267 -9.605 4.263 1.00 0.00 C ATOM 799 CG2 VAL A 52 1.655 -9.431 2.354 1.00 0.00 C ATOM 0 H VAL A 52 1.998 -6.547 1.655 1.00 0.00 H new ATOM 0 HA VAL A 52 1.806 -7.410 4.467 1.00 0.00 H new ATOM 0 HB VAL A 52 3.637 -8.653 2.398 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.545 -10.597 3.906 1.00 0.00 H new ATOM 0 HG12 VAL A 52 4.130 -9.134 4.734 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.460 -9.694 4.991 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.964 -10.427 2.036 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.794 -9.513 3.018 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.385 -8.838 1.480 1.00 0.00 H new ATOM 809 N VAL A 53 3.737 -5.948 5.018 1.00 0.00 N ATOM 810 CA VAL A 53 4.906 -5.170 5.423 1.00 0.00 C ATOM 811 C VAL A 53 5.724 -5.935 6.459 1.00 0.00 C ATOM 812 O VAL A 53 5.284 -6.137 7.591 1.00 0.00 O ATOM 813 CB VAL A 53 4.497 -3.792 5.986 1.00 0.00 C ATOM 814 CG1 VAL A 53 3.307 -3.919 6.925 1.00 0.00 C ATOM 815 CG2 VAL A 53 5.663 -3.107 6.690 1.00 0.00 C ATOM 0 H VAL A 53 2.993 -5.982 5.714 1.00 0.00 H new ATOM 0 HA VAL A 53 5.518 -5.007 4.536 1.00 0.00 H new ATOM 0 HB VAL A 53 4.204 -3.169 5.141 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.039 -2.934 7.308 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.460 -4.341 6.384 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.568 -4.573 7.757 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.339 -2.140 7.074 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.005 -3.729 7.517 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.480 -2.962 5.983 1.00 0.00 H new ATOM 825 N GLN A 54 6.913 -6.366 6.055 1.00 0.00 N ATOM 826 CA GLN A 54 7.797 -7.124 6.940 1.00 0.00 C ATOM 827 C GLN A 54 9.192 -6.508 7.002 1.00 0.00 C ATOM 828 O GLN A 54 9.800 -6.225 5.971 1.00 0.00 O ATOM 829 CB GLN A 54 7.892 -8.577 6.470 1.00 0.00 C ATOM 830 CG GLN A 54 6.730 -9.442 6.928 1.00 0.00 C ATOM 831 CD GLN A 54 7.093 -10.913 7.006 1.00 0.00 C ATOM 832 OE1 GLN A 54 7.431 -11.423 8.073 1.00 0.00 O ATOM 833 NE2 GLN A 54 7.023 -11.600 5.873 1.00 0.00 N ATOM 0 H GLN A 54 7.290 -6.205 5.121 1.00 0.00 H new ATOM 0 HA GLN A 54 7.370 -7.092 7.942 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.941 -8.595 5.381 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.823 -9.009 6.838 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.393 -9.102 7.907 1.00 0.00 H new ATOM 0 HG3 GLN A 54 5.894 -9.314 6.241 1.00 0.00 H new ATOM 0 HE21 GLN A 54 6.737 -11.135 5.011 1.00 0.00 H new ATOM 0 HE22 GLN A 54 7.255 -12.593 5.864 1.00 0.00 H new ATOM 842 N ILE A 55 9.696 -6.319 8.220 1.00 0.00 N ATOM 843 CA ILE A 55 11.025 -5.745 8.430 1.00 0.00 C ATOM 844 C ILE A 55 12.097 -6.830 8.430 1.00 0.00 C ATOM 845 O ILE A 55 11.865 -7.947 8.895 1.00 0.00 O ATOM 846 CB ILE A 55 11.098 -4.975 9.764 1.00 0.00 C ATOM 847 CG1 ILE A 55 10.879 -5.924 10.946 1.00 0.00 C ATOM 848 CG2 ILE A 55 10.074 -3.853 9.784 1.00 0.00 C ATOM 849 CD1 ILE A 55 12.157 -6.538 11.473 1.00 0.00 C ATOM 0 H ILE A 55 9.202 -6.556 9.080 1.00 0.00 H new ATOM 0 HA ILE A 55 11.206 -5.055 7.606 1.00 0.00 H new ATOM 0 HB ILE A 55 12.092 -4.538 9.856 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.388 -5.380 11.752 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.201 -6.721 10.641 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.138 -3.319 10.732 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.274 -3.163 8.964 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.074 -4.271 9.670 1.00 0.00 H new ATOM 0 HD11 ILE A 55 11.926 -7.198 12.309 1.00 0.00 H new ATOM 0 HD12 ILE A 55 12.639 -7.111 10.681 1.00 0.00 H new ATOM 0 HD13 ILE A 55 12.828 -5.748 11.810 1.00 0.00 H new ATOM 861 N THR A 56 13.273 -6.493 7.911 1.00 0.00 N ATOM 862 CA THR A 56 14.382 -7.434 7.856 1.00 0.00 C ATOM 863 C THR A 56 15.598 -6.877 8.589 1.00 0.00 C ATOM 864 O THR A 56 16.289 -5.993 8.084 1.00 0.00 O ATOM 865 CB THR A 56 14.746 -7.744 6.402 1.00 0.00 C ATOM 866 OG1 THR A 56 14.903 -6.548 5.659 1.00 0.00 O ATOM 867 CG2 THR A 56 13.712 -8.592 5.695 1.00 0.00 C ATOM 0 H THR A 56 13.481 -5.573 7.522 1.00 0.00 H new ATOM 0 HA THR A 56 14.071 -8.356 8.348 1.00 0.00 H new ATOM 0 HB THR A 56 15.680 -8.304 6.450 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.382 -5.887 6.201 1.00 0.00 H new ATOM 0 HG21 THR A 56 14.031 -8.775 4.669 1.00 0.00 H new ATOM 0 HG22 THR A 56 13.603 -9.543 6.216 1.00 0.00 H new ATOM 0 HG23 THR A 56 12.755 -8.070 5.690 1.00 0.00 H new ATOM 1312 N LEU A 89 -16.068 -23.562 -10.124 1.00 0.00 N ATOM 1313 CA LEU A 89 -17.443 -23.782 -9.692 1.00 0.00 C ATOM 1314 C LEU A 89 -18.253 -22.488 -9.754 1.00 0.00 C ATOM 1315 O LEU A 89 -19.484 -22.516 -9.746 1.00 0.00 O ATOM 1316 CB LEU A 89 -17.463 -24.346 -8.270 1.00 0.00 C ATOM 1317 CG LEU A 89 -18.853 -24.658 -7.712 1.00 0.00 C ATOM 1318 CD1 LEU A 89 -19.506 -25.786 -8.498 1.00 0.00 C ATOM 1319 CD2 LEU A 89 -18.764 -25.014 -6.234 1.00 0.00 C ATOM 0 HA LEU A 89 -17.901 -24.502 -10.370 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -16.868 -25.259 -8.250 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -16.974 -23.632 -7.606 1.00 0.00 H new ATOM 0 HG LEU A 89 -19.474 -23.768 -7.815 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -20.494 -25.993 -8.086 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.603 -25.492 -9.543 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -18.889 -26.682 -8.429 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -19.761 -25.233 -5.852 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -18.127 -25.889 -6.108 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -18.341 -24.175 -5.682 1.00 0.00 H new ATOM 1331 N ASN A 90 -17.556 -21.353 -9.814 1.00 0.00 N ATOM 1332 CA ASN A 90 -18.211 -20.048 -9.874 1.00 0.00 C ATOM 1333 C ASN A 90 -19.302 -20.019 -10.945 1.00 0.00 C ATOM 1334 O ASN A 90 -20.414 -19.554 -10.696 1.00 0.00 O ATOM 1335 CB ASN A 90 -17.181 -18.952 -10.152 1.00 0.00 C ATOM 1336 CG ASN A 90 -16.616 -18.354 -8.879 1.00 0.00 C ATOM 1337 OD1 ASN A 90 -17.337 -18.147 -7.903 1.00 0.00 O ATOM 1338 ND2 ASN A 90 -15.319 -18.071 -8.882 1.00 0.00 N ATOM 0 H ASN A 90 -16.537 -21.312 -9.822 1.00 0.00 H new ATOM 0 HA ASN A 90 -18.680 -19.867 -8.907 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -16.367 -19.365 -10.749 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -17.644 -18.164 -10.746 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -14.884 -17.666 -8.053 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -14.758 -18.259 -9.713 1.00 0.00 H new ATOM 1345 N THR A 91 -18.976 -20.511 -12.138 1.00 0.00 N ATOM 1346 CA THR A 91 -19.930 -20.530 -13.246 1.00 0.00 C ATOM 1347 C THR A 91 -21.162 -21.395 -12.940 1.00 0.00 C ATOM 1348 O THR A 91 -22.135 -21.377 -13.693 1.00 0.00 O ATOM 1349 CB THR A 91 -19.249 -21.038 -14.519 1.00 0.00 C ATOM 1350 OG1 THR A 91 -18.443 -22.172 -14.240 1.00 0.00 O ATOM 1351 CG2 THR A 91 -18.372 -19.998 -15.184 1.00 0.00 C ATOM 0 H THR A 91 -18.061 -20.901 -12.363 1.00 0.00 H new ATOM 0 HA THR A 91 -20.273 -19.506 -13.391 1.00 0.00 H new ATOM 0 HB THR A 91 -20.061 -21.292 -15.200 1.00 0.00 H new ATOM 0 HG1 THR A 91 -18.972 -22.837 -13.752 1.00 0.00 H new ATOM 0 HG21 THR A 91 -17.919 -20.423 -16.080 1.00 0.00 H new ATOM 0 HG22 THR A 91 -18.977 -19.133 -15.458 1.00 0.00 H new ATOM 0 HG23 THR A 91 -17.588 -19.688 -14.493 1.00 0.00 H new ATOM 1359 N PHE A 92 -21.124 -22.146 -11.839 1.00 0.00 N ATOM 1360 CA PHE A 92 -22.242 -23.001 -11.456 1.00 0.00 C ATOM 1361 C PHE A 92 -23.080 -22.331 -10.370 1.00 0.00 C ATOM 1362 O PHE A 92 -22.538 -21.743 -9.433 1.00 0.00 O ATOM 1363 CB PHE A 92 -21.719 -24.349 -10.962 1.00 0.00 C ATOM 1364 CG PHE A 92 -20.873 -25.077 -11.972 1.00 0.00 C ATOM 1365 CD1 PHE A 92 -19.650 -24.562 -12.372 1.00 0.00 C ATOM 1366 CD2 PHE A 92 -21.303 -26.274 -12.521 1.00 0.00 C ATOM 1367 CE1 PHE A 92 -18.871 -25.229 -13.299 1.00 0.00 C ATOM 1368 CE2 PHE A 92 -20.529 -26.945 -13.448 1.00 0.00 C ATOM 1369 CZ PHE A 92 -19.311 -26.422 -13.838 1.00 0.00 C ATOM 0 H PHE A 92 -20.331 -22.178 -11.199 1.00 0.00 H new ATOM 0 HA PHE A 92 -22.875 -23.162 -12.329 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -21.133 -24.192 -10.056 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -22.565 -24.979 -10.689 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -19.302 -23.629 -11.955 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -22.254 -26.687 -12.221 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -17.919 -24.818 -13.601 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -20.876 -27.878 -13.868 1.00 0.00 H new ATOM 0 HZ PHE A 92 -18.704 -26.945 -14.563 1.00 0.00 H new ATOM 1379 N THR A 93 -24.404 -22.413 -10.499 1.00 0.00 N ATOM 1380 CA THR A 93 -25.299 -21.800 -9.522 1.00 0.00 C ATOM 1381 C THR A 93 -26.260 -22.829 -8.915 1.00 0.00 C ATOM 1382 O THR A 93 -25.907 -23.525 -7.964 1.00 0.00 O ATOM 1383 CB THR A 93 -26.077 -20.647 -10.166 1.00 0.00 C ATOM 1384 OG1 THR A 93 -26.266 -20.880 -11.551 1.00 0.00 O ATOM 1385 CG2 THR A 93 -25.391 -19.306 -10.016 1.00 0.00 C ATOM 0 H THR A 93 -24.876 -22.894 -11.264 1.00 0.00 H new ATOM 0 HA THR A 93 -24.689 -21.404 -8.710 1.00 0.00 H new ATOM 0 HB THR A 93 -27.030 -20.612 -9.638 1.00 0.00 H new ATOM 0 HG1 THR A 93 -26.766 -20.134 -11.943 1.00 0.00 H new ATOM 0 HG21 THR A 93 -25.994 -18.534 -10.494 1.00 0.00 H new ATOM 0 HG22 THR A 93 -25.275 -19.073 -8.958 1.00 0.00 H new ATOM 0 HG23 THR A 93 -24.410 -19.344 -10.489 1.00 0.00 H new ATOM 1393 N VAL A 94 -27.474 -22.922 -9.460 1.00 0.00 N ATOM 1394 CA VAL A 94 -28.469 -23.866 -8.955 1.00 0.00 C ATOM 1395 C VAL A 94 -29.296 -24.463 -10.093 1.00 0.00 C ATOM 1396 O VAL A 94 -29.702 -25.623 -10.040 1.00 0.00 O ATOM 1397 CB VAL A 94 -29.416 -23.202 -7.937 1.00 0.00 C ATOM 1398 CG1 VAL A 94 -28.720 -23.025 -6.596 1.00 0.00 C ATOM 1399 CG2 VAL A 94 -29.920 -21.865 -8.462 1.00 0.00 C ATOM 0 H VAL A 94 -27.790 -22.357 -10.248 1.00 0.00 H new ATOM 0 HA VAL A 94 -27.917 -24.663 -8.456 1.00 0.00 H new ATOM 0 HB VAL A 94 -30.276 -23.856 -7.793 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -29.404 -22.555 -5.890 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -28.416 -23.999 -6.212 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -27.840 -22.394 -6.723 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -30.587 -21.414 -7.727 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -29.074 -21.201 -8.640 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -30.461 -22.021 -9.395 1.00 0.00 H new ATOM 1409 N GLU A 95 -29.540 -23.664 -11.119 1.00 0.00 N ATOM 1410 CA GLU A 95 -30.300 -24.111 -12.277 1.00 0.00 C ATOM 1411 C GLU A 95 -29.410 -24.862 -13.268 1.00 0.00 C ATOM 1412 O GLU A 95 -29.903 -25.593 -14.128 1.00 0.00 O ATOM 1413 CB GLU A 95 -30.964 -22.920 -12.970 1.00 0.00 C ATOM 1414 CG GLU A 95 -29.973 -21.926 -13.554 1.00 0.00 C ATOM 1415 CD GLU A 95 -30.655 -20.772 -14.263 1.00 0.00 C ATOM 1416 OE1 GLU A 95 -31.796 -20.435 -13.886 1.00 0.00 O ATOM 1417 OE2 GLU A 95 -30.046 -20.206 -15.196 1.00 0.00 O ATOM 0 H GLU A 95 -29.221 -22.697 -11.174 1.00 0.00 H new ATOM 0 HA GLU A 95 -31.072 -24.796 -11.925 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -31.610 -23.288 -13.767 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -31.604 -22.404 -12.254 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -29.342 -21.535 -12.755 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -29.317 -22.442 -14.255 1.00 0.00 H new ATOM 1424 N GLN A 96 -28.099 -24.639 -13.174 1.00 0.00 N ATOM 1425 CA GLN A 96 -27.146 -25.252 -14.093 1.00 0.00 C ATOM 1426 C GLN A 96 -26.753 -26.666 -13.693 1.00 0.00 C ATOM 1427 O GLN A 96 -26.579 -27.527 -14.553 1.00 0.00 O ATOM 1428 CB GLN A 96 -25.889 -24.380 -14.193 1.00 0.00 C ATOM 1429 CG GLN A 96 -25.981 -23.299 -15.260 1.00 0.00 C ATOM 1430 CD GLN A 96 -25.961 -23.863 -16.667 1.00 0.00 C ATOM 1431 OE1 GLN A 96 -26.276 -25.033 -16.883 1.00 0.00 O ATOM 1432 NE2 GLN A 96 -25.590 -23.029 -17.632 1.00 0.00 N ATOM 0 H GLN A 96 -27.674 -24.037 -12.469 1.00 0.00 H new ATOM 0 HA GLN A 96 -27.643 -25.321 -15.061 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -25.705 -23.910 -13.227 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -25.031 -25.017 -14.406 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -26.898 -22.728 -15.115 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -25.150 -22.604 -15.140 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -25.337 -22.067 -17.406 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -25.558 -23.351 -18.599 1.00 0.00 H new ATOM 1441 N LEU A 97 -26.600 -26.912 -12.402 1.00 0.00 N ATOM 1442 CA LEU A 97 -26.211 -28.243 -11.950 1.00 0.00 C ATOM 1443 C LEU A 97 -27.375 -29.208 -12.086 1.00 0.00 C ATOM 1444 O LEU A 97 -27.223 -30.316 -12.595 1.00 0.00 O ATOM 1445 CB LEU A 97 -25.667 -28.254 -10.508 1.00 0.00 C ATOM 1446 CG LEU A 97 -25.957 -27.033 -9.635 1.00 0.00 C ATOM 1447 CD1 LEU A 97 -25.328 -25.770 -10.209 1.00 0.00 C ATOM 1448 CD2 LEU A 97 -27.447 -26.870 -9.450 1.00 0.00 C ATOM 0 H LEU A 97 -26.735 -26.225 -11.660 1.00 0.00 H new ATOM 0 HA LEU A 97 -25.394 -28.567 -12.594 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -26.070 -29.132 -10.003 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -24.586 -28.383 -10.557 1.00 0.00 H new ATOM 0 HG LEU A 97 -25.502 -27.197 -8.658 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -25.556 -24.923 -9.561 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -24.247 -25.898 -10.272 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -25.730 -25.583 -11.205 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -27.643 -25.998 -8.827 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -27.922 -26.736 -10.422 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -27.853 -27.759 -8.968 1.00 0.00 H new ATOM 1460 N LYS A 98 -28.540 -28.773 -11.640 1.00 0.00 N ATOM 1461 CA LYS A 98 -29.737 -29.587 -11.721 1.00 0.00 C ATOM 1462 C LYS A 98 -30.071 -29.922 -13.175 1.00 0.00 C ATOM 1463 O LYS A 98 -30.527 -31.025 -13.471 1.00 0.00 O ATOM 1464 CB LYS A 98 -30.910 -28.854 -11.065 1.00 0.00 C ATOM 1465 CG LYS A 98 -31.661 -29.688 -10.041 1.00 0.00 C ATOM 1466 CD LYS A 98 -32.534 -28.820 -9.146 1.00 0.00 C ATOM 1467 CE LYS A 98 -31.702 -27.934 -8.228 1.00 0.00 C ATOM 1468 NZ LYS A 98 -32.519 -26.852 -7.610 1.00 0.00 N ATOM 0 H LYS A 98 -28.682 -27.856 -11.216 1.00 0.00 H new ATOM 0 HA LYS A 98 -29.556 -30.522 -11.190 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -30.537 -27.951 -10.581 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -31.606 -28.535 -11.841 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -32.281 -30.423 -10.554 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -30.949 -30.242 -9.429 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -33.181 -28.197 -9.764 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -33.184 -29.456 -8.545 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -31.254 -28.544 -7.443 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -30.883 -27.492 -8.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -31.916 -26.271 -6.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -32.926 -26.255 -8.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -33.286 -27.274 -7.048 1.00 0.00 H new ATOM 1482 N ALA A 99 -29.847 -28.967 -14.079 1.00 0.00 N ATOM 1483 CA ALA A 99 -30.135 -29.183 -15.494 1.00 0.00 C ATOM 1484 C ALA A 99 -28.983 -29.861 -16.217 1.00 0.00 C ATOM 1485 O ALA A 99 -29.173 -30.506 -17.248 1.00 0.00 O ATOM 1486 CB ALA A 99 -30.493 -27.868 -16.172 1.00 0.00 C ATOM 0 H ALA A 99 -29.470 -28.045 -13.858 1.00 0.00 H new ATOM 0 HA ALA A 99 -30.991 -29.855 -15.551 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -30.705 -28.048 -17.226 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -31.373 -27.440 -15.693 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -29.658 -27.174 -16.083 1.00 0.00 H new ATOM 1492 N GLN A 100 -27.793 -29.707 -15.675 1.00 0.00 N ATOM 1493 CA GLN A 100 -26.603 -30.304 -16.271 1.00 0.00 C ATOM 1494 C GLN A 100 -26.398 -31.733 -15.780 1.00 0.00 C ATOM 1495 O GLN A 100 -26.094 -32.627 -16.569 1.00 0.00 O ATOM 1496 CB GLN A 100 -25.366 -29.454 -15.976 1.00 0.00 C ATOM 1497 CG GLN A 100 -24.111 -29.939 -16.682 1.00 0.00 C ATOM 1498 CD GLN A 100 -22.934 -29.004 -16.488 1.00 0.00 C ATOM 1499 OE1 GLN A 100 -23.086 -27.896 -15.972 1.00 0.00 O ATOM 1500 NE2 GLN A 100 -21.752 -29.446 -16.900 1.00 0.00 N ATOM 0 H GLN A 100 -27.618 -29.175 -14.823 1.00 0.00 H new ATOM 0 HA GLN A 100 -26.752 -30.337 -17.350 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -25.564 -28.424 -16.272 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -25.188 -29.448 -14.901 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -23.849 -30.929 -16.309 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -24.315 -30.043 -17.748 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -21.672 -30.371 -17.322 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.923 -28.861 -16.794 1.00 0.00 H new ATOM 1509 N LEU A 101 -26.571 -31.952 -14.477 1.00 0.00 N ATOM 1510 CA LEU A 101 -26.406 -33.286 -13.909 1.00 0.00 C ATOM 1511 C LEU A 101 -27.314 -34.276 -14.625 1.00 0.00 C ATOM 1512 O LEU A 101 -26.887 -35.360 -15.021 1.00 0.00 O ATOM 1513 CB LEU A 101 -26.737 -33.296 -12.409 1.00 0.00 C ATOM 1514 CG LEU A 101 -25.556 -33.115 -11.437 1.00 0.00 C ATOM 1515 CD1 LEU A 101 -25.882 -33.742 -10.093 1.00 0.00 C ATOM 1516 CD2 LEU A 101 -24.266 -33.709 -11.992 1.00 0.00 C ATOM 0 H LEU A 101 -26.823 -31.230 -13.802 1.00 0.00 H new ATOM 0 HA LEU A 101 -25.364 -33.576 -14.041 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -27.461 -32.504 -12.215 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -27.228 -34.241 -12.175 1.00 0.00 H new ATOM 0 HG LEU A 101 -25.398 -32.044 -11.309 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -25.039 -33.607 -9.415 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -26.766 -33.263 -9.673 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -26.075 -34.807 -10.225 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -23.459 -33.560 -11.275 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -24.403 -34.776 -12.167 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -24.013 -33.217 -12.931 1.00 0.00 H new ATOM 1528 N THR A 102 -28.574 -33.887 -14.789 1.00 0.00 N ATOM 1529 CA THR A 102 -29.549 -34.732 -15.460 1.00 0.00 C ATOM 1530 C THR A 102 -29.122 -34.991 -16.891 1.00 0.00 C ATOM 1531 O THR A 102 -29.222 -36.111 -17.391 1.00 0.00 O ATOM 1532 CB THR A 102 -30.932 -34.084 -15.440 1.00 0.00 C ATOM 1533 OG1 THR A 102 -30.833 -32.686 -15.222 1.00 0.00 O ATOM 1534 CG2 THR A 102 -31.834 -34.660 -14.376 1.00 0.00 C ATOM 0 H THR A 102 -28.942 -32.992 -14.466 1.00 0.00 H new ATOM 0 HA THR A 102 -29.602 -35.681 -14.926 1.00 0.00 H new ATOM 0 HB THR A 102 -31.368 -34.292 -16.417 1.00 0.00 H new ATOM 0 HG1 THR A 102 -30.897 -32.499 -14.262 1.00 0.00 H new ATOM 0 HG21 THR A 102 -32.802 -34.160 -14.410 1.00 0.00 H new ATOM 0 HG22 THR A 102 -31.970 -35.727 -14.553 1.00 0.00 H new ATOM 0 HG23 THR A 102 -31.382 -34.509 -13.395 1.00 0.00 H new ATOM 1542 N GLU A 103 -28.634 -33.946 -17.547 1.00 0.00 N ATOM 1543 CA GLU A 103 -28.182 -34.071 -18.922 1.00 0.00 C ATOM 1544 C GLU A 103 -26.881 -34.864 -19.001 1.00 0.00 C ATOM 1545 O GLU A 103 -26.419 -35.213 -20.087 1.00 0.00 O ATOM 1546 CB GLU A 103 -28.009 -32.692 -19.564 1.00 0.00 C ATOM 1547 CG GLU A 103 -29.157 -32.298 -20.477 1.00 0.00 C ATOM 1548 CD GLU A 103 -30.336 -31.723 -19.717 1.00 0.00 C ATOM 1549 OE1 GLU A 103 -30.686 -32.279 -18.655 1.00 0.00 O ATOM 1550 OE2 GLU A 103 -30.908 -30.715 -20.183 1.00 0.00 O ATOM 0 H GLU A 103 -28.542 -33.010 -17.151 1.00 0.00 H new ATOM 0 HA GLU A 103 -28.946 -34.616 -19.477 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -27.908 -31.944 -18.777 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -27.081 -32.680 -20.135 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -28.804 -31.564 -21.202 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -29.484 -33.172 -21.041 1.00 0.00 H new ATOM 1557 N ARG A 104 -26.302 -35.151 -17.842 1.00 0.00 N ATOM 1558 CA ARG A 104 -25.061 -35.913 -17.771 1.00 0.00 C ATOM 1559 C ARG A 104 -25.339 -37.378 -17.431 1.00 0.00 C ATOM 1560 O ARG A 104 -24.474 -38.237 -17.602 1.00 0.00 O ATOM 1561 CB ARG A 104 -24.125 -35.304 -16.725 1.00 0.00 C ATOM 1562 CG ARG A 104 -22.650 -35.492 -17.046 1.00 0.00 C ATOM 1563 CD ARG A 104 -21.821 -34.303 -16.586 1.00 0.00 C ATOM 1564 NE ARG A 104 -21.390 -33.470 -17.706 1.00 0.00 N ATOM 1565 CZ ARG A 104 -20.489 -33.848 -18.609 1.00 0.00 C ATOM 1566 NH1 ARG A 104 -19.920 -35.046 -18.529 1.00 0.00 N ATOM 1567 NH2 ARG A 104 -20.157 -33.029 -19.597 1.00 0.00 N ATOM 0 H ARG A 104 -26.673 -34.867 -16.935 1.00 0.00 H new ATOM 0 HA ARG A 104 -24.581 -35.871 -18.749 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -24.336 -34.238 -16.637 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -24.337 -35.752 -15.754 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -22.285 -36.399 -16.564 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -22.525 -35.629 -18.120 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -22.406 -33.701 -15.890 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -20.946 -34.660 -16.042 1.00 0.00 H new ATOM 0 HE ARG A 104 -21.805 -32.543 -17.801 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -20.173 -35.681 -17.772 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -19.230 -35.330 -19.224 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -20.592 -32.109 -19.665 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -19.466 -33.319 -20.289 1.00 0.00 H new ATOM 1581 N GLY A 105 -26.552 -37.657 -16.954 1.00 0.00 N ATOM 1582 CA GLY A 105 -26.918 -39.017 -16.606 1.00 0.00 C ATOM 1583 C GLY A 105 -26.598 -39.366 -15.164 1.00 0.00 C ATOM 1584 O GLY A 105 -25.955 -40.381 -14.895 1.00 0.00 O ATOM 0 H GLY A 105 -27.285 -36.964 -16.803 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -27.985 -39.156 -16.780 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -26.395 -39.709 -17.266 1.00 0.00 H new ATOM 1588 N ILE A 106 -27.045 -38.527 -14.234 1.00 0.00 N ATOM 1589 CA ILE A 106 -26.797 -38.763 -12.817 1.00 0.00 C ATOM 1590 C ILE A 106 -28.074 -38.571 -11.997 1.00 0.00 C ATOM 1591 O ILE A 106 -28.352 -37.477 -11.506 1.00 0.00 O ATOM 1592 CB ILE A 106 -25.694 -37.824 -12.287 1.00 0.00 C ATOM 1593 CG1 ILE A 106 -25.474 -38.025 -10.782 1.00 0.00 C ATOM 1594 CG2 ILE A 106 -26.044 -36.377 -12.595 1.00 0.00 C ATOM 1595 CD1 ILE A 106 -24.283 -38.899 -10.457 1.00 0.00 C ATOM 0 H ILE A 106 -27.579 -37.681 -14.436 1.00 0.00 H new ATOM 0 HA ILE A 106 -26.463 -39.795 -12.711 1.00 0.00 H new ATOM 0 HB ILE A 106 -24.761 -38.071 -12.793 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -25.340 -37.052 -10.309 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -26.370 -38.469 -10.348 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -25.258 -35.724 -12.216 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -26.136 -36.246 -13.673 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -26.990 -36.122 -12.117 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -24.188 -38.997 -9.376 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -24.423 -39.885 -10.900 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -23.378 -38.445 -10.861 1.00 0.00 H new ATOM 1607 N THR A 107 -28.844 -39.644 -11.853 1.00 0.00 N ATOM 1608 CA THR A 107 -30.090 -39.600 -11.093 1.00 0.00 C ATOM 1609 C THR A 107 -29.843 -39.136 -9.659 1.00 0.00 C ATOM 1610 O THR A 107 -28.738 -39.271 -9.133 1.00 0.00 O ATOM 1611 CB THR A 107 -30.751 -40.981 -11.091 1.00 0.00 C ATOM 1612 OG1 THR A 107 -29.791 -41.996 -11.324 1.00 0.00 O ATOM 1613 CG2 THR A 107 -31.835 -41.126 -12.136 1.00 0.00 C ATOM 0 H THR A 107 -28.628 -40.557 -12.253 1.00 0.00 H new ATOM 0 HA THR A 107 -30.756 -38.883 -11.572 1.00 0.00 H new ATOM 0 HB THR A 107 -31.203 -41.084 -10.105 1.00 0.00 H new ATOM 0 HG1 THR A 107 -30.232 -42.871 -11.317 1.00 0.00 H new ATOM 0 HG21 THR A 107 -32.262 -42.127 -12.081 1.00 0.00 H new ATOM 0 HG22 THR A 107 -32.616 -40.388 -11.955 1.00 0.00 H new ATOM 0 HG23 THR A 107 -31.409 -40.967 -13.127 1.00 0.00 H new ATOM 1621 N PHE A 108 -30.883 -38.594 -9.029 1.00 0.00 N ATOM 1622 CA PHE A 108 -30.781 -38.115 -7.653 1.00 0.00 C ATOM 1623 C PHE A 108 -32.073 -38.405 -6.877 1.00 0.00 C ATOM 1624 O PHE A 108 -32.330 -39.550 -6.511 1.00 0.00 O ATOM 1625 CB PHE A 108 -30.435 -36.616 -7.617 1.00 0.00 C ATOM 1626 CG PHE A 108 -31.046 -35.801 -8.731 1.00 0.00 C ATOM 1627 CD1 PHE A 108 -32.266 -36.156 -9.292 1.00 0.00 C ATOM 1628 CD2 PHE A 108 -30.395 -34.677 -9.216 1.00 0.00 C ATOM 1629 CE1 PHE A 108 -32.818 -35.408 -10.313 1.00 0.00 C ATOM 1630 CE2 PHE A 108 -30.945 -33.927 -10.236 1.00 0.00 C ATOM 1631 CZ PHE A 108 -32.158 -34.292 -10.787 1.00 0.00 C ATOM 0 H PHE A 108 -31.805 -38.476 -9.449 1.00 0.00 H new ATOM 0 HA PHE A 108 -29.970 -38.655 -7.165 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -30.762 -36.204 -6.662 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -29.351 -36.506 -7.657 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -32.789 -37.027 -8.925 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -29.446 -34.385 -8.791 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -33.767 -35.696 -10.741 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -30.426 -33.054 -10.604 1.00 0.00 H new ATOM 0 HZ PHE A 108 -32.589 -33.706 -11.586 1.00 0.00 H new ATOM 1641 N LYS A 109 -32.884 -37.371 -6.625 1.00 0.00 N ATOM 1642 CA LYS A 109 -34.141 -37.532 -5.894 1.00 0.00 C ATOM 1643 C LYS A 109 -33.962 -38.409 -4.656 1.00 0.00 C ATOM 1644 O LYS A 109 -34.873 -39.139 -4.265 1.00 0.00 O ATOM 1645 CB LYS A 109 -35.223 -38.120 -6.807 1.00 0.00 C ATOM 1646 CG LYS A 109 -35.004 -39.582 -7.175 1.00 0.00 C ATOM 1647 CD LYS A 109 -34.231 -39.719 -8.478 1.00 0.00 C ATOM 1648 CE LYS A 109 -35.143 -40.106 -9.632 1.00 0.00 C ATOM 1649 NZ LYS A 109 -34.949 -39.221 -10.815 1.00 0.00 N ATOM 0 H LYS A 109 -32.690 -36.414 -6.918 1.00 0.00 H new ATOM 0 HA LYS A 109 -34.457 -36.543 -5.562 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -36.190 -38.022 -6.314 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -35.270 -37.530 -7.722 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -34.460 -40.082 -6.374 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -35.967 -40.083 -7.268 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -33.733 -38.777 -8.707 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -33.451 -40.472 -8.362 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -34.949 -41.140 -9.917 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -36.182 -40.054 -9.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -35.296 -39.702 -11.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -35.478 -38.336 -10.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -33.937 -39.006 -10.926 1.00 0.00 H new ATOM 1663 N GLN A 110 -32.785 -38.329 -4.040 1.00 0.00 N ATOM 1664 CA GLN A 110 -32.494 -39.114 -2.844 1.00 0.00 C ATOM 1665 C GLN A 110 -31.081 -38.844 -2.336 1.00 0.00 C ATOM 1666 O GLN A 110 -30.836 -38.846 -1.130 1.00 0.00 O ATOM 1667 CB GLN A 110 -32.667 -40.609 -3.129 1.00 0.00 C ATOM 1668 CG GLN A 110 -31.830 -41.112 -4.295 1.00 0.00 C ATOM 1669 CD GLN A 110 -30.869 -42.214 -3.894 1.00 0.00 C ATOM 1670 OE1 GLN A 110 -29.850 -41.859 -3.120 1.00 0.00 O flip ATOM 1671 NE2 GLN A 110 -31.041 -43.372 -4.274 1.00 0.00 N flip ATOM 0 H GLN A 110 -32.019 -37.730 -4.349 1.00 0.00 H new ATOM 0 HA GLN A 110 -33.200 -38.813 -2.070 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -32.403 -41.173 -2.234 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -33.718 -40.811 -3.335 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -32.491 -41.480 -5.079 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -31.266 -40.280 -4.718 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -31.838 -43.601 -4.868 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -30.387 -44.103 -3.995 1.00 0.00 H new ATOM 1680 N SER A 111 -30.152 -38.617 -3.260 1.00 0.00 N ATOM 1681 CA SER A 111 -28.765 -38.350 -2.895 1.00 0.00 C ATOM 1682 C SER A 111 -28.381 -36.910 -3.216 1.00 0.00 C ATOM 1683 O SER A 111 -27.564 -36.306 -2.521 1.00 0.00 O ATOM 1684 CB SER A 111 -27.832 -39.316 -3.628 1.00 0.00 C ATOM 1685 OG SER A 111 -26.487 -38.872 -3.566 1.00 0.00 O ATOM 0 H SER A 111 -30.334 -38.613 -4.264 1.00 0.00 H new ATOM 0 HA SER A 111 -28.663 -38.499 -1.820 1.00 0.00 H new ATOM 0 HB2 SER A 111 -27.911 -40.309 -3.186 1.00 0.00 H new ATOM 0 HB3 SER A 111 -28.141 -39.405 -4.669 1.00 0.00 H new ATOM 0 HG SER A 111 -25.911 -39.507 -4.040 1.00 0.00 H new ATOM 1691 N ALA A 112 -28.975 -36.361 -4.272 1.00 0.00 N ATOM 1692 CA ALA A 112 -28.691 -34.991 -4.679 1.00 0.00 C ATOM 1693 C ALA A 112 -29.916 -34.100 -4.513 1.00 0.00 C ATOM 1694 O ALA A 112 -30.958 -34.338 -5.123 1.00 0.00 O ATOM 1695 CB ALA A 112 -28.205 -34.955 -6.120 1.00 0.00 C ATOM 0 H ALA A 112 -29.655 -36.844 -4.860 1.00 0.00 H new ATOM 0 HA ALA A 112 -27.904 -34.606 -4.031 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -27.997 -33.925 -6.408 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -27.295 -35.548 -6.212 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -28.974 -35.367 -6.774 1.00 0.00 H new ATOM 1701 N THR A 113 -29.781 -33.069 -3.686 1.00 0.00 N ATOM 1702 CA THR A 113 -30.873 -32.136 -3.440 1.00 0.00 C ATOM 1703 C THR A 113 -30.538 -30.759 -4.000 1.00 0.00 C ATOM 1704 O THR A 113 -31.285 -30.210 -4.810 1.00 0.00 O ATOM 1705 CB THR A 113 -31.162 -32.037 -1.942 1.00 0.00 C ATOM 1706 OG1 THR A 113 -30.189 -31.236 -1.295 1.00 0.00 O ATOM 1707 CG2 THR A 113 -31.184 -33.381 -1.252 1.00 0.00 C ATOM 0 H THR A 113 -28.924 -32.859 -3.174 1.00 0.00 H new ATOM 0 HA THR A 113 -31.763 -32.510 -3.946 1.00 0.00 H new ATOM 0 HB THR A 113 -32.153 -31.590 -1.866 1.00 0.00 H new ATOM 0 HG1 THR A 113 -30.392 -31.184 -0.338 1.00 0.00 H new ATOM 0 HG21 THR A 113 -31.394 -33.242 -0.191 1.00 0.00 H new ATOM 0 HG22 THR A 113 -31.959 -34.006 -1.697 1.00 0.00 H new ATOM 0 HG23 THR A 113 -30.215 -33.866 -1.369 1.00 0.00 H new ATOM 1715 N LYS A 114 -29.406 -30.208 -3.572 1.00 0.00 N ATOM 1716 CA LYS A 114 -28.976 -28.898 -4.045 1.00 0.00 C ATOM 1717 C LYS A 114 -27.523 -28.624 -3.692 1.00 0.00 C ATOM 1718 O LYS A 114 -26.777 -28.071 -4.498 1.00 0.00 O ATOM 1719 CB LYS A 114 -29.878 -27.798 -3.478 1.00 0.00 C ATOM 1720 CG LYS A 114 -30.124 -26.652 -4.448 1.00 0.00 C ATOM 1721 CD LYS A 114 -29.314 -25.421 -4.075 1.00 0.00 C ATOM 1722 CE LYS A 114 -29.787 -24.817 -2.763 1.00 0.00 C ATOM 1723 NZ LYS A 114 -28.988 -25.306 -1.605 1.00 0.00 N ATOM 0 H LYS A 114 -28.774 -30.646 -2.902 1.00 0.00 H new ATOM 0 HA LYS A 114 -29.060 -28.898 -5.132 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -30.836 -28.235 -3.195 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -29.426 -27.402 -2.568 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -29.864 -26.967 -5.458 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -31.185 -26.402 -4.455 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -28.260 -25.689 -3.994 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -29.394 -24.678 -4.868 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -29.718 -23.731 -2.818 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -30.838 -25.063 -2.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -29.570 -25.946 -1.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -28.151 -25.817 -1.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -28.684 -24.497 -1.026 1.00 0.00 H new ATOM 1737 N ALA A 115 -27.116 -29.018 -2.496 1.00 0.00 N ATOM 1738 CA ALA A 115 -25.742 -28.813 -2.072 1.00 0.00 C ATOM 1739 C ALA A 115 -24.846 -29.924 -2.601 1.00 0.00 C ATOM 1740 O ALA A 115 -23.633 -29.755 -2.722 1.00 0.00 O ATOM 1741 CB ALA A 115 -25.659 -28.733 -0.554 1.00 0.00 C ATOM 0 H ALA A 115 -27.712 -29.478 -1.808 1.00 0.00 H new ATOM 0 HA ALA A 115 -25.392 -27.867 -2.485 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -24.622 -28.579 -0.254 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -26.267 -27.900 -0.200 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -26.028 -29.662 -0.120 1.00 0.00 H new ATOM 1747 N GLU A 116 -25.454 -31.062 -2.919 1.00 0.00 N ATOM 1748 CA GLU A 116 -24.713 -32.202 -3.440 1.00 0.00 C ATOM 1749 C GLU A 116 -24.541 -32.114 -4.951 1.00 0.00 C ATOM 1750 O GLU A 116 -23.493 -32.483 -5.483 1.00 0.00 O ATOM 1751 CB GLU A 116 -25.415 -33.509 -3.070 1.00 0.00 C ATOM 1752 CG GLU A 116 -25.881 -33.563 -1.624 1.00 0.00 C ATOM 1753 CD GLU A 116 -25.368 -34.789 -0.892 1.00 0.00 C ATOM 1754 OE1 GLU A 116 -25.150 -35.827 -1.552 1.00 0.00 O ATOM 1755 OE2 GLU A 116 -25.184 -34.710 0.341 1.00 0.00 O ATOM 0 H GLU A 116 -26.458 -31.218 -2.825 1.00 0.00 H new ATOM 0 HA GLU A 116 -23.722 -32.186 -2.986 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -26.275 -33.648 -3.725 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -24.736 -34.341 -3.255 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -25.544 -32.666 -1.104 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -26.971 -33.557 -1.597 1.00 0.00 H new ATOM 1762 N LEU A 117 -25.572 -31.637 -5.646 1.00 0.00 N ATOM 1763 CA LEU A 117 -25.507 -31.528 -7.100 1.00 0.00 C ATOM 1764 C LEU A 117 -24.752 -30.280 -7.528 1.00 0.00 C ATOM 1765 O LEU A 117 -24.227 -30.214 -8.639 1.00 0.00 O ATOM 1766 CB LEU A 117 -26.914 -31.624 -7.732 1.00 0.00 C ATOM 1767 CG LEU A 117 -27.771 -30.356 -7.861 1.00 0.00 C ATOM 1768 CD1 LEU A 117 -29.239 -30.732 -7.729 1.00 0.00 C ATOM 1769 CD2 LEU A 117 -27.408 -29.299 -6.838 1.00 0.00 C ATOM 0 H LEU A 117 -26.450 -31.324 -5.232 1.00 0.00 H new ATOM 0 HA LEU A 117 -24.938 -32.377 -7.479 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -26.796 -32.042 -8.732 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -27.485 -32.347 -7.150 1.00 0.00 H new ATOM 0 HG LEU A 117 -27.577 -29.921 -8.841 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -29.854 -29.836 -7.820 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -29.506 -31.437 -8.516 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -29.411 -31.193 -6.756 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -28.045 -28.425 -6.976 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -27.553 -29.699 -5.834 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -26.365 -29.011 -6.967 1.00 0.00 H new ATOM 1781 N ILE A 118 -24.662 -29.305 -6.634 1.00 0.00 N ATOM 1782 CA ILE A 118 -23.925 -28.091 -6.927 1.00 0.00 C ATOM 1783 C ILE A 118 -22.438 -28.301 -6.627 1.00 0.00 C ATOM 1784 O ILE A 118 -21.573 -27.685 -7.249 1.00 0.00 O ATOM 1785 CB ILE A 118 -24.498 -26.867 -6.150 1.00 0.00 C ATOM 1786 CG1 ILE A 118 -24.353 -25.582 -6.971 1.00 0.00 C ATOM 1787 CG2 ILE A 118 -23.852 -26.689 -4.777 1.00 0.00 C ATOM 1788 CD1 ILE A 118 -23.000 -25.420 -7.631 1.00 0.00 C ATOM 0 H ILE A 118 -25.088 -29.333 -5.708 1.00 0.00 H new ATOM 0 HA ILE A 118 -24.038 -27.867 -7.988 1.00 0.00 H new ATOM 0 HB ILE A 118 -25.556 -27.071 -5.988 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -25.125 -25.566 -7.740 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -24.533 -24.726 -6.321 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -24.288 -25.823 -4.279 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -24.027 -27.580 -4.174 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -22.779 -26.537 -4.897 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -22.979 -24.486 -8.193 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -22.222 -25.402 -6.867 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -22.823 -26.255 -8.309 1.00 0.00 H new ATOM 1800 N ALA A 119 -22.152 -29.195 -5.675 1.00 0.00 N ATOM 1801 CA ALA A 119 -20.780 -29.508 -5.298 1.00 0.00 C ATOM 1802 C ALA A 119 -20.198 -30.608 -6.180 1.00 0.00 C ATOM 1803 O ALA A 119 -19.003 -30.620 -6.472 1.00 0.00 O ATOM 1804 CB ALA A 119 -20.715 -29.917 -3.834 1.00 0.00 C ATOM 0 H ALA A 119 -22.859 -29.713 -5.153 1.00 0.00 H new ATOM 0 HA ALA A 119 -20.180 -28.610 -5.443 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -19.684 -30.148 -3.566 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -21.077 -29.099 -3.211 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -21.337 -30.797 -3.674 1.00 0.00 H new ATOM 1810 N LEU A 120 -21.052 -31.543 -6.587 1.00 0.00 N ATOM 1811 CA LEU A 120 -20.627 -32.663 -7.421 1.00 0.00 C ATOM 1812 C LEU A 120 -19.940 -32.180 -8.693 1.00 0.00 C ATOM 1813 O LEU A 120 -19.022 -32.828 -9.196 1.00 0.00 O ATOM 1814 CB LEU A 120 -21.826 -33.546 -7.777 1.00 0.00 C ATOM 1815 CG LEU A 120 -21.833 -34.924 -7.115 1.00 0.00 C ATOM 1816 CD1 LEU A 120 -21.994 -34.792 -5.609 1.00 0.00 C ATOM 1817 CD2 LEU A 120 -22.940 -35.789 -7.699 1.00 0.00 C ATOM 0 H LEU A 120 -22.045 -31.547 -6.352 1.00 0.00 H new ATOM 0 HA LEU A 120 -19.907 -33.249 -6.849 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -22.740 -33.021 -7.499 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -21.852 -33.679 -8.859 1.00 0.00 H new ATOM 0 HG LEU A 120 -20.877 -35.408 -7.315 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -21.997 -35.783 -5.155 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -21.166 -34.210 -5.204 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -22.935 -34.288 -5.386 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -22.931 -36.766 -7.217 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -23.904 -35.310 -7.529 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -22.779 -35.912 -8.770 1.00 0.00 H new ATOM 1829 N PHE A 121 -20.396 -31.049 -9.217 1.00 0.00 N ATOM 1830 CA PHE A 121 -19.822 -30.499 -10.440 1.00 0.00 C ATOM 1831 C PHE A 121 -18.414 -29.952 -10.208 1.00 0.00 C ATOM 1832 O PHE A 121 -17.589 -29.944 -11.121 1.00 0.00 O ATOM 1833 CB PHE A 121 -20.717 -29.399 -10.999 1.00 0.00 C ATOM 1834 CG PHE A 121 -21.731 -29.909 -11.977 1.00 0.00 C ATOM 1835 CD1 PHE A 121 -21.355 -30.286 -13.255 1.00 0.00 C ATOM 1836 CD2 PHE A 121 -23.059 -30.014 -11.615 1.00 0.00 C ATOM 1837 CE1 PHE A 121 -22.291 -30.758 -14.154 1.00 0.00 C ATOM 1838 CE2 PHE A 121 -23.998 -30.482 -12.506 1.00 0.00 C ATOM 1839 CZ PHE A 121 -23.616 -30.855 -13.779 1.00 0.00 C ATOM 0 H PHE A 121 -21.156 -30.498 -8.818 1.00 0.00 H new ATOM 0 HA PHE A 121 -19.753 -31.313 -11.162 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -21.232 -28.904 -10.176 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -20.097 -28.646 -11.486 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -20.319 -30.210 -13.552 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -23.365 -29.725 -10.620 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -21.987 -31.051 -15.148 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -25.034 -30.557 -12.209 1.00 0.00 H new ATOM 0 HZ PHE A 121 -24.352 -31.222 -14.480 1.00 0.00 H new