USER MOD reduce.3.24.130724 H: found=0, std=0, add=730, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 634 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 98 HIS : no HE2:sc= -6.67! C(o=-4.6!,f=-15!) USER MOD Set 1.2: A 119 THR OG1 : rot 111:sc= 2.09 USER MOD Set 2.1: A 65 ASN : amide:sc= 0.324 K(o=0.57,f=-0.53) USER MOD Set 2.2: A 68 SER OG : rot 144:sc= 0.244 USER MOD Single : A 23 SER OG : rot 23:sc= 0.197 USER MOD Single : A 55 SER OG : rot 29:sc= 0.248 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0.421 K(o=0.42,f=-0.67) USER MOD Single : A 77 THR OG1 : rot 70:sc= -3.11! USER MOD Single : A 78 SER OG : rot 147:sc= 0.97 USER MOD Single : A 82 HIS : no HD1:sc= -6.34! C(o=-6.3!,f=-7.9!) USER MOD Single : A 93 THR OG1 : rot 7:sc= -1.16! USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 ASN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 109 ASN : amide:sc= -2.1! C(o=-2.1!,f=-4.4!) USER MOD Single : A 115 SER OG : rot -132:sc= 1.58 USER MOD Single : A 117 ASN :FLIP amide:sc= -0.244 F(o=-4.2,f=-0.24) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -1.37 X(o=-1.4,f=-1.8) USER MOD Single : A 128 SER OG : rot -83:sc= 0.664 USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 138 GLN : amide:sc= -1.38 K(o=-1.4,f=-17!) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 305 N SER A 23 12.893 -0.949 -1.298 1.00 0.00 N ATOM 306 CA SER A 23 12.714 0.286 -2.107 1.00 0.00 C ATOM 307 C SER A 23 11.450 1.086 -1.819 1.00 0.00 C ATOM 308 O SER A 23 10.346 0.652 -2.134 1.00 0.00 O ATOM 309 CB SER A 23 12.688 -0.091 -3.568 1.00 0.00 C ATOM 310 OG SER A 23 13.820 -0.870 -3.917 1.00 0.00 O ATOM 0 HA SER A 23 13.553 0.927 -1.836 1.00 0.00 H new ATOM 0 HB2 SER A 23 11.778 -0.650 -3.786 1.00 0.00 H new ATOM 0 HB3 SER A 23 12.662 0.811 -4.179 1.00 0.00 H new ATOM 0 HG SER A 23 14.175 -1.308 -3.116 1.00 0.00 H new ATOM 315 N VAL A 24 11.606 2.293 -1.313 1.00 0.00 N ATOM 316 CA VAL A 24 10.449 3.070 -0.942 1.00 0.00 C ATOM 317 C VAL A 24 10.536 4.516 -1.418 1.00 0.00 C ATOM 318 O VAL A 24 11.626 5.041 -1.668 1.00 0.00 O ATOM 319 CB VAL A 24 10.259 2.995 0.568 1.00 0.00 C ATOM 320 CG1 VAL A 24 11.233 3.896 1.305 1.00 0.00 C ATOM 321 CG2 VAL A 24 8.822 3.291 0.952 1.00 0.00 C ATOM 0 H VAL A 24 12.505 2.747 -1.153 1.00 0.00 H new ATOM 0 HA VAL A 24 9.579 2.643 -1.441 1.00 0.00 H new ATOM 0 HB VAL A 24 10.480 1.973 0.876 1.00 0.00 H new ATOM 0 HG11 VAL A 24 11.064 3.813 2.379 1.00 0.00 H new ATOM 0 HG12 VAL A 24 12.254 3.594 1.074 1.00 0.00 H new ATOM 0 HG13 VAL A 24 11.081 4.929 0.993 1.00 0.00 H new ATOM 0 HG21 VAL A 24 8.715 3.231 2.035 1.00 0.00 H new ATOM 0 HG22 VAL A 24 8.555 4.293 0.616 1.00 0.00 H new ATOM 0 HG23 VAL A 24 8.162 2.562 0.481 1.00 0.00 H new ATOM 331 N PHE A 25 9.370 5.143 -1.533 1.00 0.00 N ATOM 332 CA PHE A 25 9.235 6.461 -2.130 1.00 0.00 C ATOM 333 C PHE A 25 7.768 6.881 -2.019 1.00 0.00 C ATOM 334 O PHE A 25 7.015 6.198 -1.340 1.00 0.00 O ATOM 335 CB PHE A 25 9.679 6.373 -3.599 1.00 0.00 C ATOM 336 CG PHE A 25 9.778 7.686 -4.317 1.00 0.00 C ATOM 337 CD1 PHE A 25 10.624 8.687 -3.867 1.00 0.00 C ATOM 338 CD2 PHE A 25 9.011 7.913 -5.444 1.00 0.00 C ATOM 339 CE1 PHE A 25 10.702 9.895 -4.536 1.00 0.00 C ATOM 340 CE2 PHE A 25 9.083 9.117 -6.117 1.00 0.00 C ATOM 341 CZ PHE A 25 9.929 10.109 -5.663 1.00 0.00 C ATOM 0 H PHE A 25 8.487 4.745 -1.211 1.00 0.00 H new ATOM 0 HA PHE A 25 9.854 7.201 -1.623 1.00 0.00 H new ATOM 0 HB2 PHE A 25 10.651 5.881 -3.639 1.00 0.00 H new ATOM 0 HB3 PHE A 25 8.977 5.736 -4.136 1.00 0.00 H new ATOM 0 HD1 PHE A 25 11.227 8.523 -2.987 1.00 0.00 H new ATOM 0 HD2 PHE A 25 8.348 7.140 -5.803 1.00 0.00 H new ATOM 0 HE1 PHE A 25 11.365 10.669 -4.179 1.00 0.00 H new ATOM 0 HE2 PHE A 25 8.479 9.282 -6.997 1.00 0.00 H new ATOM 0 HZ PHE A 25 9.987 11.051 -6.187 1.00 0.00 H new ATOM 350 N ARG A 26 7.377 7.996 -2.656 1.00 0.00 N ATOM 351 CA ARG A 26 5.961 8.394 -2.763 1.00 0.00 C ATOM 352 C ARG A 26 5.306 8.392 -1.373 1.00 0.00 C ATOM 353 O ARG A 26 5.641 9.224 -0.528 1.00 0.00 O ATOM 354 CB ARG A 26 5.237 7.422 -3.720 1.00 0.00 C ATOM 355 CG ARG A 26 4.142 8.028 -4.602 1.00 0.00 C ATOM 356 CD ARG A 26 2.939 8.519 -3.807 1.00 0.00 C ATOM 357 NE ARG A 26 1.705 8.505 -4.606 1.00 0.00 N ATOM 358 CZ ARG A 26 1.516 9.216 -5.727 1.00 0.00 C ATOM 359 NH1 ARG A 26 2.486 9.975 -6.215 1.00 0.00 N ATOM 360 NH2 ARG A 26 0.356 9.156 -6.373 1.00 0.00 N ATOM 0 H ARG A 26 8.024 8.642 -3.108 1.00 0.00 H new ATOM 0 HA ARG A 26 5.888 9.405 -3.164 1.00 0.00 H new ATOM 0 HB2 ARG A 26 5.983 6.961 -4.368 1.00 0.00 H new ATOM 0 HB3 ARG A 26 4.794 6.623 -3.125 1.00 0.00 H new ATOM 0 HG2 ARG A 26 4.559 8.860 -5.169 1.00 0.00 H new ATOM 0 HG3 ARG A 26 3.812 7.282 -5.326 1.00 0.00 H new ATOM 0 HD2 ARG A 26 2.807 7.891 -2.926 1.00 0.00 H new ATOM 0 HD3 ARG A 26 3.129 9.532 -3.452 1.00 0.00 H new ATOM 0 HE ARG A 26 0.939 7.913 -4.285 1.00 0.00 H new ATOM 0 HH11 ARG A 26 3.386 10.022 -5.737 1.00 0.00 H new ATOM 0 HH12 ARG A 26 2.333 10.512 -7.068 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -0.396 8.567 -6.016 1.00 0.00 H new ATOM 0 HH22 ARG A 26 0.218 9.699 -7.225 1.00 0.00 H new ATOM 707 N SER A 55 -17.515 -10.440 -4.512 1.00 0.00 N ATOM 708 CA SER A 55 -16.161 -10.136 -4.087 1.00 0.00 C ATOM 709 C SER A 55 -16.056 -8.642 -3.806 1.00 0.00 C ATOM 710 O SER A 55 -16.797 -7.852 -4.388 1.00 0.00 O ATOM 711 CB SER A 55 -15.146 -10.514 -5.174 1.00 0.00 C ATOM 712 OG SER A 55 -15.489 -11.726 -5.826 1.00 0.00 O ATOM 0 HA SER A 55 -15.938 -10.713 -3.189 1.00 0.00 H new ATOM 0 HB2 SER A 55 -15.087 -9.711 -5.909 1.00 0.00 H new ATOM 0 HB3 SER A 55 -14.156 -10.611 -4.727 1.00 0.00 H new ATOM 0 HG SER A 55 -16.462 -11.840 -5.814 1.00 0.00 H new ATOM 717 N ALA A 56 -15.134 -8.260 -2.937 1.00 0.00 N ATOM 718 CA ALA A 56 -14.870 -6.853 -2.658 1.00 0.00 C ATOM 719 C ALA A 56 -13.404 -6.583 -2.899 1.00 0.00 C ATOM 720 O ALA A 56 -12.632 -7.530 -3.069 1.00 0.00 O ATOM 721 CB ALA A 56 -15.230 -6.512 -1.226 1.00 0.00 C ATOM 0 H ALA A 56 -14.551 -8.908 -2.408 1.00 0.00 H new ATOM 0 HA ALA A 56 -15.480 -6.233 -3.315 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -15.025 -5.458 -1.040 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -16.289 -6.710 -1.060 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -14.636 -7.122 -0.546 1.00 0.00 H new ATOM 727 N LEU A 57 -12.996 -5.322 -2.945 1.00 0.00 N ATOM 728 CA LEU A 57 -11.587 -5.053 -3.161 1.00 0.00 C ATOM 729 C LEU A 57 -11.138 -3.662 -2.777 1.00 0.00 C ATOM 730 O LEU A 57 -11.881 -2.682 -2.863 1.00 0.00 O ATOM 731 CB LEU A 57 -11.202 -5.360 -4.622 1.00 0.00 C ATOM 732 CG LEU A 57 -12.106 -4.750 -5.705 1.00 0.00 C ATOM 733 CD1 LEU A 57 -11.796 -3.275 -5.928 1.00 0.00 C ATOM 734 CD2 LEU A 57 -11.968 -5.524 -7.007 1.00 0.00 C ATOM 0 H LEU A 57 -13.594 -4.502 -2.840 1.00 0.00 H new ATOM 0 HA LEU A 57 -11.058 -5.721 -2.482 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -10.183 -5.009 -4.789 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -11.192 -6.442 -4.754 1.00 0.00 H new ATOM 0 HG LEU A 57 -13.136 -4.823 -5.357 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.454 -2.878 -6.700 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -11.953 -2.726 -5.000 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -10.759 -3.165 -6.244 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -12.614 -5.080 -7.764 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -10.933 -5.485 -7.345 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -12.258 -6.562 -6.846 1.00 0.00 H new ATOM 745 N LEU A 58 -9.910 -3.627 -2.297 1.00 0.00 N ATOM 746 CA LEU A 58 -9.145 -2.388 -2.193 1.00 0.00 C ATOM 747 C LEU A 58 -8.264 -2.250 -3.421 1.00 0.00 C ATOM 748 O LEU A 58 -7.369 -3.062 -3.618 1.00 0.00 O ATOM 749 CB LEU A 58 -8.217 -2.402 -0.982 1.00 0.00 C ATOM 750 CG LEU A 58 -8.853 -2.526 0.386 1.00 0.00 C ATOM 751 CD1 LEU A 58 -9.228 -3.968 0.682 1.00 0.00 C ATOM 752 CD2 LEU A 58 -7.885 -1.999 1.419 1.00 0.00 C ATOM 0 H LEU A 58 -9.410 -4.453 -1.967 1.00 0.00 H new ATOM 0 HA LEU A 58 -9.856 -1.567 -2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.518 -3.229 -1.104 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.630 -1.484 -0.998 1.00 0.00 H new ATOM 0 HG LEU A 58 -9.772 -1.941 0.414 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -9.683 -4.030 1.671 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -9.937 -4.320 -0.067 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -8.333 -4.590 0.655 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -8.330 -2.082 2.411 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -6.964 -2.581 1.385 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -7.661 -0.953 1.208 1.00 0.00 H new ATOM 763 N VAL A 59 -8.492 -1.240 -4.232 1.00 0.00 N ATOM 764 CA VAL A 59 -7.701 -1.061 -5.439 1.00 0.00 C ATOM 765 C VAL A 59 -6.793 0.167 -5.320 1.00 0.00 C ATOM 766 O VAL A 59 -7.256 1.266 -5.014 1.00 0.00 O ATOM 767 CB VAL A 59 -8.608 -0.940 -6.697 1.00 0.00 C ATOM 768 CG1 VAL A 59 -9.658 0.145 -6.517 1.00 0.00 C ATOM 769 CG2 VAL A 59 -7.784 -0.672 -7.949 1.00 0.00 C ATOM 0 H VAL A 59 -9.212 -0.533 -4.083 1.00 0.00 H new ATOM 0 HA VAL A 59 -7.076 -1.946 -5.555 1.00 0.00 H new ATOM 0 HB VAL A 59 -9.118 -1.895 -6.820 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -10.276 0.205 -7.413 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -10.285 -0.095 -5.659 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -9.166 1.103 -6.350 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -8.447 -0.593 -8.811 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -7.232 0.260 -7.829 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -7.082 -1.491 -8.105 1.00 0.00 H new ATOM 779 N VAL A 60 -5.494 -0.026 -5.529 1.00 0.00 N ATOM 780 CA VAL A 60 -4.568 1.091 -5.573 1.00 0.00 C ATOM 781 C VAL A 60 -4.843 1.867 -6.854 1.00 0.00 C ATOM 782 O VAL A 60 -4.728 1.331 -7.968 1.00 0.00 O ATOM 783 CB VAL A 60 -3.076 0.638 -5.466 1.00 0.00 C ATOM 784 CG1 VAL A 60 -2.976 -0.707 -4.776 1.00 0.00 C ATOM 785 CG2 VAL A 60 -2.363 0.588 -6.798 1.00 0.00 C ATOM 0 H VAL A 60 -5.065 -0.941 -5.669 1.00 0.00 H new ATOM 0 HA VAL A 60 -4.727 1.733 -4.706 1.00 0.00 H new ATOM 0 HB VAL A 60 -2.573 1.399 -4.870 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -1.930 -1.006 -4.711 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.395 -0.633 -3.773 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.531 -1.451 -5.347 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.333 0.266 -6.647 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.871 -0.117 -7.456 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.371 1.579 -7.252 1.00 0.00 H new ATOM 795 N LYS A 61 -5.269 3.114 -6.672 1.00 0.00 N ATOM 796 CA LYS A 61 -5.746 3.932 -7.768 1.00 0.00 C ATOM 797 C LYS A 61 -4.603 4.298 -8.705 1.00 0.00 C ATOM 798 O LYS A 61 -4.392 3.645 -9.725 1.00 0.00 O ATOM 799 CB LYS A 61 -6.430 5.200 -7.237 1.00 0.00 C ATOM 800 CG LYS A 61 -7.122 6.022 -8.310 1.00 0.00 C ATOM 801 CD LYS A 61 -8.247 5.234 -8.941 1.00 0.00 C ATOM 802 CE LYS A 61 -8.761 5.883 -10.212 1.00 0.00 C ATOM 803 NZ LYS A 61 -9.753 5.017 -10.893 1.00 0.00 N ATOM 0 H LYS A 61 -5.291 3.578 -5.764 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.479 3.353 -8.330 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.163 4.916 -6.482 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -5.685 5.822 -6.741 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -7.514 6.941 -7.875 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.401 6.313 -9.074 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.900 4.225 -9.165 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -9.066 5.138 -8.228 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.216 6.844 -9.974 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -7.927 6.083 -10.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.087 5.486 -11.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.310 4.109 -11.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.559 4.847 -10.258 1.00 0.00 H new ATOM 813 N ARG A 62 -3.856 5.335 -8.349 1.00 0.00 N ATOM 814 CA ARG A 62 -2.707 5.751 -9.135 1.00 0.00 C ATOM 815 C ARG A 62 -1.587 6.258 -8.238 1.00 0.00 C ATOM 816 O ARG A 62 -1.785 7.137 -7.394 1.00 0.00 O ATOM 817 CB ARG A 62 -3.085 6.814 -10.179 1.00 0.00 C ATOM 818 CG ARG A 62 -3.958 6.273 -11.304 1.00 0.00 C ATOM 819 CD ARG A 62 -3.884 7.137 -12.553 1.00 0.00 C ATOM 820 NE ARG A 62 -4.541 8.434 -12.395 1.00 0.00 N ATOM 821 CZ ARG A 62 -4.834 9.236 -13.420 1.00 0.00 C ATOM 822 NH1 ARG A 62 -4.566 8.857 -14.665 1.00 0.00 N ATOM 823 NH2 ARG A 62 -5.417 10.407 -13.208 1.00 0.00 N ATOM 0 H ARG A 62 -4.027 5.903 -7.519 1.00 0.00 H new ATOM 0 HA ARG A 62 -2.349 4.872 -9.672 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -3.610 7.630 -9.682 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -2.174 7.234 -10.606 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -3.646 5.257 -11.548 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -4.992 6.216 -10.964 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -2.838 7.296 -12.816 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -4.344 6.603 -13.384 1.00 0.00 H new ATOM 0 HE ARG A 62 -4.788 8.741 -11.454 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -4.134 7.950 -14.840 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -4.792 9.474 -15.446 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -5.644 10.699 -12.257 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -5.639 11.016 -13.995 1.00 0.00 H new ATOM 834 N GLY A 63 -0.429 5.636 -8.383 1.00 0.00 N ATOM 835 CA GLY A 63 0.765 6.084 -7.717 1.00 0.00 C ATOM 836 C GLY A 63 2.001 5.464 -8.333 1.00 0.00 C ATOM 837 O GLY A 63 2.413 5.849 -9.425 1.00 0.00 O ATOM 0 H GLY A 63 -0.298 4.809 -8.966 1.00 0.00 H new ATOM 0 HA2 GLY A 63 0.832 7.170 -7.776 1.00 0.00 H new ATOM 0 HA3 GLY A 63 0.714 5.825 -6.659 1.00 0.00 H new ATOM 841 N PRO A 64 2.613 4.487 -7.654 1.00 0.00 N ATOM 842 CA PRO A 64 3.778 3.779 -8.163 1.00 0.00 C ATOM 843 C PRO A 64 3.410 2.736 -9.206 1.00 0.00 C ATOM 844 O PRO A 64 3.387 3.028 -10.401 1.00 0.00 O ATOM 845 CB PRO A 64 4.390 3.112 -6.927 1.00 0.00 C ATOM 846 CG PRO A 64 3.573 3.577 -5.775 1.00 0.00 C ATOM 847 CD PRO A 64 2.251 4.018 -6.328 1.00 0.00 C ATOM 0 HA PRO A 64 4.466 4.458 -8.666 1.00 0.00 H new ATOM 0 HB2 PRO A 64 4.362 2.026 -7.014 1.00 0.00 H new ATOM 0 HB3 PRO A 64 5.435 3.396 -6.806 1.00 0.00 H new ATOM 0 HG2 PRO A 64 3.440 2.776 -5.048 1.00 0.00 H new ATOM 0 HG3 PRO A 64 4.068 4.398 -5.257 1.00 0.00 H new ATOM 0 HD2 PRO A 64 1.533 3.199 -6.368 1.00 0.00 H new ATOM 0 HD3 PRO A 64 1.801 4.807 -5.726 1.00 0.00 H new ATOM 852 N ASN A 65 3.105 1.520 -8.751 1.00 0.00 N ATOM 853 CA ASN A 65 2.608 0.487 -9.653 1.00 0.00 C ATOM 854 C ASN A 65 1.273 0.937 -10.185 1.00 0.00 C ATOM 855 O ASN A 65 1.037 0.952 -11.392 1.00 0.00 O ATOM 856 CB ASN A 65 2.413 -0.854 -8.935 1.00 0.00 C ATOM 857 CG ASN A 65 2.144 -1.994 -9.899 1.00 0.00 C ATOM 858 OD1 ASN A 65 2.624 -1.991 -11.030 1.00 0.00 O ATOM 859 ND2 ASN A 65 1.375 -2.975 -9.457 1.00 0.00 N ATOM 0 H ASN A 65 3.192 1.231 -7.777 1.00 0.00 H new ATOM 0 HA ASN A 65 3.339 0.343 -10.449 1.00 0.00 H new ATOM 0 HB2 ASN A 65 3.303 -1.081 -8.348 1.00 0.00 H new ATOM 0 HB3 ASN A 65 1.582 -0.770 -8.235 1.00 0.00 H new ATOM 0 HD21 ASN A 65 1.161 -3.767 -10.062 1.00 0.00 H new ATOM 0 HD22 ASN A 65 0.996 -2.939 -8.511 1.00 0.00 H new ATOM 865 N ALA A 66 0.435 1.371 -9.249 1.00 0.00 N ATOM 866 CA ALA A 66 -0.960 1.727 -9.536 1.00 0.00 C ATOM 867 C ALA A 66 -1.740 0.561 -10.165 1.00 0.00 C ATOM 868 O ALA A 66 -1.165 -0.383 -10.704 1.00 0.00 O ATOM 869 CB ALA A 66 -1.019 2.948 -10.442 1.00 0.00 C ATOM 0 H ALA A 66 0.698 1.487 -8.270 1.00 0.00 H new ATOM 0 HA ALA A 66 -1.436 1.961 -8.584 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -2.060 3.200 -10.646 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.532 3.790 -9.950 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -0.508 2.730 -11.380 1.00 0.00 H new ATOM 875 N GLY A 67 -3.059 0.611 -10.054 1.00 0.00 N ATOM 876 CA GLY A 67 -3.891 -0.377 -10.710 1.00 0.00 C ATOM 877 C GLY A 67 -3.990 -1.678 -9.938 1.00 0.00 C ATOM 878 O GLY A 67 -4.652 -2.614 -10.383 1.00 0.00 O ATOM 0 H GLY A 67 -3.568 1.317 -9.522 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.891 0.033 -10.849 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -3.489 -0.580 -11.703 1.00 0.00 H new ATOM 882 N SER A 68 -3.341 -1.749 -8.783 1.00 0.00 N ATOM 883 CA SER A 68 -3.300 -2.996 -8.026 1.00 0.00 C ATOM 884 C SER A 68 -4.532 -3.094 -7.130 1.00 0.00 C ATOM 885 O SER A 68 -5.274 -2.134 -7.019 1.00 0.00 O ATOM 886 CB SER A 68 -2.023 -3.050 -7.203 1.00 0.00 C ATOM 887 OG SER A 68 -0.919 -2.574 -7.958 1.00 0.00 O ATOM 0 H SER A 68 -2.842 -0.970 -8.353 1.00 0.00 H new ATOM 0 HA SER A 68 -3.305 -3.844 -8.711 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.140 -2.449 -6.301 1.00 0.00 H new ATOM 0 HB3 SER A 68 -1.835 -4.074 -6.881 1.00 0.00 H new ATOM 0 HG SER A 68 -0.308 -2.083 -7.370 1.00 0.00 H new ATOM 892 N ARG A 69 -4.759 -4.237 -6.491 1.00 0.00 N ATOM 893 CA ARG A 69 -5.972 -4.414 -5.690 1.00 0.00 C ATOM 894 C ARG A 69 -5.889 -5.658 -4.815 1.00 0.00 C ATOM 895 O ARG A 69 -5.203 -6.618 -5.166 1.00 0.00 O ATOM 896 CB ARG A 69 -7.211 -4.516 -6.595 1.00 0.00 C ATOM 897 CG ARG A 69 -7.332 -5.826 -7.370 1.00 0.00 C ATOM 898 CD ARG A 69 -6.178 -6.036 -8.337 1.00 0.00 C ATOM 899 NE ARG A 69 -5.425 -7.252 -8.039 1.00 0.00 N ATOM 900 CZ ARG A 69 -4.817 -7.987 -8.969 1.00 0.00 C ATOM 901 NH1 ARG A 69 -4.791 -7.568 -10.228 1.00 0.00 N ATOM 902 NH2 ARG A 69 -4.208 -9.122 -8.639 1.00 0.00 N ATOM 0 H ARG A 69 -4.134 -5.043 -6.508 1.00 0.00 H new ATOM 0 HA ARG A 69 -6.061 -3.539 -5.046 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -8.103 -4.389 -5.981 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -7.193 -3.690 -7.306 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -7.370 -6.658 -6.667 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -8.271 -5.833 -7.923 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -6.564 -6.090 -9.355 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -5.509 -5.176 -8.294 1.00 0.00 H new ATOM 0 HE ARG A 69 -5.361 -7.554 -7.067 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -5.236 -6.686 -10.481 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -4.326 -8.128 -10.942 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -4.204 -9.435 -7.668 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -3.745 -9.679 -9.357 1.00 0.00 H new ATOM 913 N PHE A 70 -6.615 -5.656 -3.695 1.00 0.00 N ATOM 914 CA PHE A 70 -6.689 -6.826 -2.853 1.00 0.00 C ATOM 915 C PHE A 70 -7.929 -7.586 -3.266 1.00 0.00 C ATOM 916 O PHE A 70 -9.019 -6.998 -3.295 1.00 0.00 O ATOM 917 CB PHE A 70 -6.828 -6.492 -1.349 1.00 0.00 C ATOM 918 CG PHE A 70 -5.849 -5.517 -0.753 1.00 0.00 C ATOM 919 CD1 PHE A 70 -5.058 -4.707 -1.539 1.00 0.00 C ATOM 920 CD2 PHE A 70 -5.745 -5.405 0.627 1.00 0.00 C ATOM 921 CE1 PHE A 70 -4.175 -3.816 -0.976 1.00 0.00 C ATOM 922 CE2 PHE A 70 -4.867 -4.507 1.199 1.00 0.00 C ATOM 923 CZ PHE A 70 -4.079 -3.711 0.395 1.00 0.00 C ATOM 0 H PHE A 70 -7.153 -4.856 -3.361 1.00 0.00 H new ATOM 0 HA PHE A 70 -5.765 -7.390 -2.978 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.832 -6.101 -1.184 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.753 -7.425 -0.790 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -5.133 -4.773 -2.614 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.359 -6.028 1.261 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.556 -3.198 -1.609 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.797 -4.428 2.274 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.389 -3.008 0.838 1.00 0.00 H new ATOM 932 N LEU A 71 -7.761 -8.870 -3.570 1.00 0.00 N ATOM 933 CA LEU A 71 -8.846 -9.713 -4.025 1.00 0.00 C ATOM 934 C LEU A 71 -9.581 -10.250 -2.813 1.00 0.00 C ATOM 935 O LEU A 71 -9.173 -11.224 -2.200 1.00 0.00 O ATOM 936 CB LEU A 71 -8.284 -10.847 -4.900 1.00 0.00 C ATOM 937 CG LEU A 71 -9.282 -11.912 -5.380 1.00 0.00 C ATOM 938 CD1 LEU A 71 -9.335 -13.080 -4.403 1.00 0.00 C ATOM 939 CD2 LEU A 71 -10.659 -11.303 -5.600 1.00 0.00 C ATOM 0 H LEU A 71 -6.863 -9.350 -3.505 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.549 -9.145 -4.634 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -7.817 -10.399 -5.777 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.495 -11.349 -4.340 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.938 -12.299 -6.339 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -10.048 -13.823 -4.762 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.347 -13.534 -4.324 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -9.648 -12.721 -3.423 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -11.349 -12.076 -5.940 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -11.023 -10.878 -4.664 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -10.594 -10.518 -6.354 1.00 0.00 H new ATOM 950 N LEU A 72 -10.649 -9.599 -2.439 1.00 0.00 N ATOM 951 CA LEU A 72 -11.367 -10.019 -1.259 1.00 0.00 C ATOM 952 C LEU A 72 -12.490 -10.975 -1.649 1.00 0.00 C ATOM 953 O LEU A 72 -13.649 -10.786 -1.279 1.00 0.00 O ATOM 954 CB LEU A 72 -11.931 -8.820 -0.484 1.00 0.00 C ATOM 955 CG LEU A 72 -10.934 -7.891 0.220 1.00 0.00 C ATOM 956 CD1 LEU A 72 -9.587 -7.835 -0.455 1.00 0.00 C ATOM 957 CD2 LEU A 72 -11.507 -6.505 0.294 1.00 0.00 C ATOM 0 H LEU A 72 -11.039 -8.789 -2.922 1.00 0.00 H new ATOM 0 HA LEU A 72 -10.666 -10.534 -0.602 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -12.517 -8.218 -1.178 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -12.621 -9.202 0.268 1.00 0.00 H new ATOM 0 HG LEU A 72 -10.773 -8.303 1.216 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -8.932 -7.160 0.095 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -9.147 -8.832 -0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -9.706 -7.472 -1.476 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -10.799 -5.845 0.794 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -11.698 -6.136 -0.714 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -12.441 -6.527 0.855 1.00 0.00 H new ATOM 968 N ASP A 73 -12.129 -11.980 -2.434 1.00 0.00 N ATOM 969 CA ASP A 73 -13.064 -13.018 -2.855 1.00 0.00 C ATOM 970 C ASP A 73 -12.793 -14.303 -2.081 1.00 0.00 C ATOM 971 O ASP A 73 -13.647 -15.186 -1.980 1.00 0.00 O ATOM 972 CB ASP A 73 -12.942 -13.260 -4.366 1.00 0.00 C ATOM 973 CG ASP A 73 -13.743 -14.451 -4.853 1.00 0.00 C ATOM 974 OD1 ASP A 73 -14.983 -14.359 -4.909 1.00 0.00 O ATOM 975 OD2 ASP A 73 -13.130 -15.476 -5.221 1.00 0.00 O ATOM 0 H ASP A 73 -11.183 -12.100 -2.797 1.00 0.00 H new ATOM 0 HA ASP A 73 -14.082 -12.690 -2.642 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -13.273 -12.368 -4.897 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -11.892 -13.410 -4.619 1.00 0.00 H new ATOM 979 N GLN A 74 -11.596 -14.393 -1.519 1.00 0.00 N ATOM 980 CA GLN A 74 -11.223 -15.548 -0.710 1.00 0.00 C ATOM 981 C GLN A 74 -11.311 -15.209 0.774 1.00 0.00 C ATOM 982 O GLN A 74 -11.917 -14.210 1.138 1.00 0.00 O ATOM 983 CB GLN A 74 -9.829 -16.054 -1.094 1.00 0.00 C ATOM 984 CG GLN A 74 -8.789 -14.963 -1.222 1.00 0.00 C ATOM 985 CD GLN A 74 -7.473 -15.481 -1.763 1.00 0.00 C ATOM 986 OE1 GLN A 74 -7.274 -15.551 -2.975 1.00 0.00 O ATOM 987 NE2 GLN A 74 -6.561 -15.827 -0.872 1.00 0.00 N ATOM 0 H GLN A 74 -10.868 -13.684 -1.607 1.00 0.00 H new ATOM 0 HA GLN A 74 -11.928 -16.356 -0.908 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -9.496 -16.772 -0.345 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -9.897 -16.589 -2.041 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -9.166 -14.180 -1.880 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -8.623 -14.506 -0.246 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -6.767 -15.753 0.124 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -5.650 -16.168 -1.180 1.00 0.00 H new ATOM 994 N ALA A 75 -10.757 -16.052 1.631 1.00 0.00 N ATOM 995 CA ALA A 75 -10.806 -15.803 3.068 1.00 0.00 C ATOM 996 C ALA A 75 -9.820 -14.711 3.479 1.00 0.00 C ATOM 997 O ALA A 75 -10.132 -13.870 4.326 1.00 0.00 O ATOM 998 CB ALA A 75 -10.539 -17.087 3.842 1.00 0.00 C ATOM 0 H ALA A 75 -10.272 -16.908 1.363 1.00 0.00 H new ATOM 0 HA ALA A 75 -11.809 -15.452 3.311 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -10.579 -16.882 4.912 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -11.294 -17.830 3.586 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -9.552 -17.469 3.583 1.00 0.00 H new ATOM 1004 N ILE A 76 -8.626 -14.730 2.894 1.00 0.00 N ATOM 1005 CA ILE A 76 -7.621 -13.720 3.199 1.00 0.00 C ATOM 1006 C ILE A 76 -6.542 -13.653 2.121 1.00 0.00 C ATOM 1007 O ILE A 76 -6.058 -14.680 1.643 1.00 0.00 O ATOM 1008 CB ILE A 76 -7.013 -13.939 4.620 1.00 0.00 C ATOM 1009 CG1 ILE A 76 -5.786 -13.042 4.887 1.00 0.00 C ATOM 1010 CG2 ILE A 76 -6.664 -15.399 4.848 1.00 0.00 C ATOM 1011 CD1 ILE A 76 -4.455 -13.626 4.435 1.00 0.00 C ATOM 0 H ILE A 76 -8.333 -15.429 2.211 1.00 0.00 H new ATOM 0 HA ILE A 76 -8.120 -12.751 3.205 1.00 0.00 H new ATOM 0 HB ILE A 76 -7.784 -13.648 5.333 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.936 -12.087 4.384 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -5.731 -12.835 5.956 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -6.243 -15.521 5.846 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -7.564 -16.007 4.758 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -5.934 -15.719 4.104 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -3.653 -12.924 4.664 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -4.275 -14.566 4.956 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -4.483 -13.806 3.360 1.00 0.00 H new ATOM 1022 N THR A 77 -6.192 -12.431 1.735 1.00 0.00 N ATOM 1023 CA THR A 77 -5.174 -12.199 0.717 1.00 0.00 C ATOM 1024 C THR A 77 -3.971 -11.456 1.301 1.00 0.00 C ATOM 1025 O THR A 77 -4.137 -10.561 2.129 1.00 0.00 O ATOM 1026 CB THR A 77 -5.728 -11.378 -0.459 1.00 0.00 C ATOM 1027 OG1 THR A 77 -6.418 -10.215 0.010 1.00 0.00 O ATOM 1028 CG2 THR A 77 -6.658 -12.216 -1.302 1.00 0.00 C ATOM 0 H THR A 77 -6.603 -11.579 2.116 1.00 0.00 H new ATOM 0 HA THR A 77 -4.864 -13.180 0.358 1.00 0.00 H new ATOM 0 HB THR A 77 -4.883 -11.061 -1.070 1.00 0.00 H new ATOM 0 HG1 THR A 77 -5.772 -9.580 0.384 1.00 0.00 H new ATOM 0 HG21 THR A 77 -7.039 -11.617 -2.129 1.00 0.00 H new ATOM 0 HG22 THR A 77 -6.116 -13.076 -1.697 1.00 0.00 H new ATOM 0 HG23 THR A 77 -7.491 -12.562 -0.690 1.00 0.00 H new ATOM 1036 N SER A 78 -2.768 -11.818 0.868 1.00 0.00 N ATOM 1037 CA SER A 78 -1.564 -11.098 1.278 1.00 0.00 C ATOM 1038 C SER A 78 -1.355 -9.904 0.351 1.00 0.00 C ATOM 1039 O SER A 78 -1.277 -10.071 -0.868 1.00 0.00 O ATOM 1040 CB SER A 78 -0.356 -12.021 1.232 1.00 0.00 C ATOM 1041 OG SER A 78 -0.546 -13.161 2.050 1.00 0.00 O ATOM 0 H SER A 78 -2.599 -12.601 0.237 1.00 0.00 H new ATOM 0 HA SER A 78 -1.684 -10.744 2.302 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.175 -12.335 0.204 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.531 -11.479 1.561 1.00 0.00 H new ATOM 0 HG SER A 78 -0.092 -13.931 1.648 1.00 0.00 H new ATOM 1046 N ALA A 79 -1.249 -8.708 0.918 1.00 0.00 N ATOM 1047 CA ALA A 79 -1.254 -7.493 0.117 1.00 0.00 C ATOM 1048 C ALA A 79 0.004 -6.663 0.293 1.00 0.00 C ATOM 1049 O ALA A 79 0.152 -5.970 1.299 1.00 0.00 O ATOM 1050 CB ALA A 79 -2.456 -6.663 0.498 1.00 0.00 C ATOM 0 H ALA A 79 -1.159 -8.555 1.922 1.00 0.00 H new ATOM 0 HA ALA A 79 -1.295 -7.792 -0.930 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -2.470 -5.749 -0.096 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.366 -7.233 0.310 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -2.401 -6.407 1.556 1.00 0.00 H new ATOM 1056 N GLY A 80 0.869 -6.676 -0.710 1.00 0.00 N ATOM 1057 CA GLY A 80 2.091 -5.912 -0.649 1.00 0.00 C ATOM 1058 C GLY A 80 3.084 -6.421 -1.659 1.00 0.00 C ATOM 1059 O GLY A 80 2.749 -6.591 -2.829 1.00 0.00 O ATOM 0 H GLY A 80 0.742 -7.208 -1.571 1.00 0.00 H new ATOM 0 HA2 GLY A 80 1.878 -4.860 -0.838 1.00 0.00 H new ATOM 0 HA3 GLY A 80 2.517 -5.976 0.352 1.00 0.00 H new ATOM 1063 N ARG A 81 4.299 -6.682 -1.216 1.00 0.00 N ATOM 1064 CA ARG A 81 5.282 -7.307 -2.069 1.00 0.00 C ATOM 1065 C ARG A 81 4.897 -8.739 -2.357 1.00 0.00 C ATOM 1066 O ARG A 81 4.930 -9.611 -1.479 1.00 0.00 O ATOM 1067 CB ARG A 81 6.671 -7.202 -1.460 1.00 0.00 C ATOM 1068 CG ARG A 81 7.653 -8.285 -1.908 1.00 0.00 C ATOM 1069 CD ARG A 81 7.927 -9.324 -0.822 1.00 0.00 C ATOM 1070 NE ARG A 81 8.727 -8.771 0.272 1.00 0.00 N ATOM 1071 CZ ARG A 81 9.566 -9.505 1.011 1.00 0.00 C ATOM 1072 NH1 ARG A 81 9.692 -10.806 0.776 1.00 0.00 N ATOM 1073 NH2 ARG A 81 10.288 -8.943 1.972 1.00 0.00 N ATOM 0 H ARG A 81 4.625 -6.470 -0.273 1.00 0.00 H new ATOM 0 HA ARG A 81 5.308 -6.777 -3.021 1.00 0.00 H new ATOM 0 HB2 ARG A 81 7.089 -6.227 -1.710 1.00 0.00 H new ATOM 0 HB3 ARG A 81 6.580 -7.241 -0.375 1.00 0.00 H new ATOM 0 HG2 ARG A 81 7.256 -8.786 -2.791 1.00 0.00 H new ATOM 0 HG3 ARG A 81 8.593 -7.817 -2.202 1.00 0.00 H new ATOM 0 HD2 ARG A 81 6.981 -9.696 -0.428 1.00 0.00 H new ATOM 0 HD3 ARG A 81 8.448 -10.176 -1.258 1.00 0.00 H new ATOM 0 HE ARG A 81 8.640 -7.776 0.481 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.149 -11.245 0.032 1.00 0.00 H new ATOM 0 HH12 ARG A 81 10.332 -11.366 1.339 1.00 0.00 H new ATOM 0 HH21 ARG A 81 10.206 -7.942 2.153 1.00 0.00 H new ATOM 0 HH22 ARG A 81 10.925 -9.512 2.530 1.00 0.00 H new ATOM 1084 N HIS A 82 4.487 -8.975 -3.580 1.00 0.00 N ATOM 1085 CA HIS A 82 3.982 -10.263 -3.937 1.00 0.00 C ATOM 1086 C HIS A 82 4.471 -10.704 -5.305 1.00 0.00 C ATOM 1087 O HIS A 82 4.378 -9.959 -6.279 1.00 0.00 O ATOM 1088 CB HIS A 82 2.463 -10.240 -3.914 1.00 0.00 C ATOM 1089 CG HIS A 82 1.894 -11.066 -2.826 1.00 0.00 C ATOM 1090 ND1 HIS A 82 2.657 -11.577 -1.801 1.00 0.00 N ATOM 1091 CD2 HIS A 82 0.653 -11.551 -2.653 1.00 0.00 C ATOM 1092 CE1 HIS A 82 1.904 -12.359 -1.058 1.00 0.00 C ATOM 1093 NE2 HIS A 82 0.684 -12.362 -1.549 1.00 0.00 N ATOM 0 H HIS A 82 4.496 -8.290 -4.336 1.00 0.00 H new ATOM 0 HA HIS A 82 4.354 -10.982 -3.207 1.00 0.00 H new ATOM 0 HB2 HIS A 82 2.121 -9.211 -3.800 1.00 0.00 H new ATOM 0 HB3 HIS A 82 2.084 -10.597 -4.872 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -0.209 -11.341 -3.269 1.00 0.00 H new ATOM 0 HE1 HIS A 82 2.233 -12.908 -0.188 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -0.108 -12.882 -1.171 1.00 0.00 H new ATOM 1133 N ASP A 86 -2.274 -12.822 -4.805 1.00 0.00 N ATOM 1134 CA ASP A 86 -3.470 -12.003 -4.620 1.00 0.00 C ATOM 1135 C ASP A 86 -3.210 -10.555 -5.015 1.00 0.00 C ATOM 1136 O ASP A 86 -3.631 -10.093 -6.079 1.00 0.00 O ATOM 1137 CB ASP A 86 -3.933 -12.040 -3.152 1.00 0.00 C ATOM 1138 CG ASP A 86 -3.684 -13.378 -2.481 1.00 0.00 C ATOM 1139 OD1 ASP A 86 -4.188 -14.404 -2.974 1.00 0.00 O ATOM 1140 OD2 ASP A 86 -2.966 -13.407 -1.454 1.00 0.00 O ATOM 0 HA ASP A 86 -4.248 -12.417 -5.261 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -3.415 -11.259 -2.595 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -4.998 -11.811 -3.108 1.00 0.00 H new ATOM 1144 N ILE A 87 -2.507 -9.845 -4.148 1.00 0.00 N ATOM 1145 CA ILE A 87 -2.276 -8.417 -4.325 1.00 0.00 C ATOM 1146 C ILE A 87 -0.782 -8.081 -4.230 1.00 0.00 C ATOM 1147 O ILE A 87 -0.156 -8.204 -3.174 1.00 0.00 O ATOM 1148 CB ILE A 87 -3.124 -7.587 -3.317 1.00 0.00 C ATOM 1149 CG1 ILE A 87 -2.433 -6.283 -2.910 1.00 0.00 C ATOM 1150 CG2 ILE A 87 -3.507 -8.401 -2.092 1.00 0.00 C ATOM 1151 CD1 ILE A 87 -2.770 -5.108 -3.795 1.00 0.00 C ATOM 0 H ILE A 87 -2.082 -10.236 -3.307 1.00 0.00 H new ATOM 0 HA ILE A 87 -2.603 -8.142 -5.328 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.042 -7.319 -3.841 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -2.709 -6.043 -1.883 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -1.354 -6.436 -2.922 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -4.098 -7.784 -1.415 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.094 -9.267 -2.399 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.604 -8.737 -1.582 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -2.242 -4.223 -3.441 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.468 -5.326 -4.819 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -3.844 -4.926 -3.764 1.00 0.00 H new ATOM 1162 N PHE A 88 -0.224 -7.706 -5.376 1.00 0.00 N ATOM 1163 CA PHE A 88 1.168 -7.285 -5.491 1.00 0.00 C ATOM 1164 C PHE A 88 1.244 -5.792 -5.755 1.00 0.00 C ATOM 1165 O PHE A 88 0.509 -5.260 -6.586 1.00 0.00 O ATOM 1166 CB PHE A 88 1.871 -8.034 -6.629 1.00 0.00 C ATOM 1167 CG PHE A 88 0.958 -8.842 -7.517 1.00 0.00 C ATOM 1168 CD1 PHE A 88 -0.007 -8.230 -8.309 1.00 0.00 C ATOM 1169 CD2 PHE A 88 1.078 -10.223 -7.562 1.00 0.00 C ATOM 1170 CE1 PHE A 88 -0.833 -8.983 -9.120 1.00 0.00 C ATOM 1171 CE2 PHE A 88 0.253 -10.979 -8.372 1.00 0.00 C ATOM 1172 CZ PHE A 88 -0.703 -10.359 -9.150 1.00 0.00 C ATOM 0 H PHE A 88 -0.731 -7.686 -6.261 1.00 0.00 H new ATOM 0 HA PHE A 88 1.668 -7.517 -4.551 1.00 0.00 H new ATOM 0 HB2 PHE A 88 2.406 -7.311 -7.245 1.00 0.00 H new ATOM 0 HB3 PHE A 88 2.618 -8.701 -6.199 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.112 -7.155 -8.290 1.00 0.00 H new ATOM 0 HD2 PHE A 88 1.826 -10.713 -6.956 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -1.580 -8.497 -9.730 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.356 -12.054 -8.396 1.00 0.00 H new ATOM 0 HZ PHE A 88 -1.350 -10.949 -9.783 1.00 0.00 H new ATOM 1181 N LEU A 89 2.125 -5.122 -5.038 1.00 0.00 N ATOM 1182 CA LEU A 89 2.285 -3.688 -5.173 1.00 0.00 C ATOM 1183 C LEU A 89 3.671 -3.354 -5.661 1.00 0.00 C ATOM 1184 O LEU A 89 4.499 -2.877 -4.887 1.00 0.00 O ATOM 1185 CB LEU A 89 2.057 -2.989 -3.836 1.00 0.00 C ATOM 1186 CG LEU A 89 0.630 -2.998 -3.325 1.00 0.00 C ATOM 1187 CD1 LEU A 89 -0.331 -2.613 -4.425 1.00 0.00 C ATOM 1188 CD2 LEU A 89 0.269 -4.339 -2.735 1.00 0.00 C ATOM 0 H LEU A 89 2.745 -5.552 -4.351 1.00 0.00 H new ATOM 0 HA LEU A 89 1.546 -3.341 -5.896 1.00 0.00 H new ATOM 0 HB2 LEU A 89 2.695 -3.459 -3.087 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.384 -1.953 -3.928 1.00 0.00 H new ATOM 0 HG LEU A 89 0.552 -2.257 -2.529 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.350 -2.625 -4.039 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.091 -1.612 -4.784 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.246 -3.323 -5.247 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -0.760 -4.314 -2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.369 -5.111 -3.498 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.937 -4.562 -1.903 1.00 0.00 H new ATOM 1199 N ASP A 90 3.938 -3.635 -6.933 1.00 0.00 N ATOM 1200 CA ASP A 90 5.247 -3.358 -7.532 1.00 0.00 C ATOM 1201 C ASP A 90 6.326 -4.184 -6.828 1.00 0.00 C ATOM 1202 O ASP A 90 7.516 -4.079 -7.133 1.00 0.00 O ATOM 1203 CB ASP A 90 5.553 -1.853 -7.444 1.00 0.00 C ATOM 1204 CG ASP A 90 6.785 -1.437 -8.220 1.00 0.00 C ATOM 1205 OD1 ASP A 90 6.776 -1.546 -9.463 1.00 0.00 O ATOM 1206 OD2 ASP A 90 7.749 -0.951 -7.594 1.00 0.00 O ATOM 0 H ASP A 90 3.265 -4.056 -7.574 1.00 0.00 H new ATOM 0 HA ASP A 90 5.234 -3.642 -8.584 1.00 0.00 H new ATOM 0 HB2 ASP A 90 4.694 -1.294 -7.816 1.00 0.00 H new ATOM 0 HB3 ASP A 90 5.683 -1.578 -6.397 1.00 0.00 H new ATOM 1210 N ASP A 91 5.865 -5.031 -5.902 1.00 0.00 N ATOM 1211 CA ASP A 91 6.716 -5.871 -5.073 1.00 0.00 C ATOM 1212 C ASP A 91 7.554 -5.034 -4.116 1.00 0.00 C ATOM 1213 O ASP A 91 7.201 -4.848 -2.951 1.00 0.00 O ATOM 1214 CB ASP A 91 7.611 -6.751 -5.951 1.00 0.00 C ATOM 1215 CG ASP A 91 8.380 -7.792 -5.165 1.00 0.00 C ATOM 1216 OD1 ASP A 91 9.495 -7.492 -4.695 1.00 0.00 O ATOM 1217 OD2 ASP A 91 7.876 -8.928 -5.030 1.00 0.00 O ATOM 0 H ASP A 91 4.870 -5.149 -5.709 1.00 0.00 H new ATOM 0 HA ASP A 91 6.074 -6.516 -4.473 1.00 0.00 H new ATOM 0 HB2 ASP A 91 6.996 -7.251 -6.699 1.00 0.00 H new ATOM 0 HB3 ASP A 91 8.316 -6.118 -6.490 1.00 0.00 H new ATOM 1221 N VAL A 92 8.613 -4.483 -4.636 1.00 0.00 N ATOM 1222 CA VAL A 92 9.654 -3.889 -3.832 1.00 0.00 C ATOM 1223 C VAL A 92 9.304 -2.468 -3.355 1.00 0.00 C ATOM 1224 O VAL A 92 9.845 -1.465 -3.818 1.00 0.00 O ATOM 1225 CB VAL A 92 10.983 -3.958 -4.603 1.00 0.00 C ATOM 1226 CG1 VAL A 92 10.956 -3.118 -5.878 1.00 0.00 C ATOM 1227 CG2 VAL A 92 12.167 -3.598 -3.711 1.00 0.00 C ATOM 0 H VAL A 92 8.784 -4.431 -5.640 1.00 0.00 H new ATOM 0 HA VAL A 92 9.758 -4.463 -2.911 1.00 0.00 H new ATOM 0 HB VAL A 92 11.115 -4.994 -4.916 1.00 0.00 H new ATOM 0 HG11 VAL A 92 11.916 -3.199 -6.387 1.00 0.00 H new ATOM 0 HG12 VAL A 92 10.165 -3.479 -6.535 1.00 0.00 H new ATOM 0 HG13 VAL A 92 10.767 -2.075 -5.623 1.00 0.00 H new ATOM 0 HG21 VAL A 92 13.089 -3.657 -4.289 1.00 0.00 H new ATOM 0 HG22 VAL A 92 12.041 -2.584 -3.331 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.218 -4.295 -2.875 1.00 0.00 H new ATOM 1237 N THR A 93 8.336 -2.420 -2.447 1.00 0.00 N ATOM 1238 CA THR A 93 8.025 -1.226 -1.666 1.00 0.00 C ATOM 1239 C THR A 93 7.183 -1.606 -0.443 1.00 0.00 C ATOM 1240 O THR A 93 6.749 -0.750 0.332 1.00 0.00 O ATOM 1241 CB THR A 93 7.310 -0.131 -2.511 1.00 0.00 C ATOM 1242 OG1 THR A 93 6.663 0.828 -1.674 1.00 0.00 O ATOM 1243 CG2 THR A 93 6.304 -0.727 -3.488 1.00 0.00 C ATOM 0 H THR A 93 7.738 -3.217 -2.229 1.00 0.00 H new ATOM 0 HA THR A 93 8.970 -0.796 -1.334 1.00 0.00 H new ATOM 0 HB THR A 93 8.086 0.370 -3.089 1.00 0.00 H new ATOM 0 HG1 THR A 93 6.901 0.659 -0.738 1.00 0.00 H new ATOM 0 HG21 THR A 93 5.830 0.074 -4.056 1.00 0.00 H new ATOM 0 HG22 THR A 93 6.818 -1.402 -4.172 1.00 0.00 H new ATOM 0 HG23 THR A 93 5.544 -1.279 -2.936 1.00 0.00 H new ATOM 1251 N VAL A 94 6.973 -2.906 -0.254 1.00 0.00 N ATOM 1252 CA VAL A 94 6.164 -3.402 0.850 1.00 0.00 C ATOM 1253 C VAL A 94 6.806 -4.661 1.419 1.00 0.00 C ATOM 1254 O VAL A 94 7.322 -5.476 0.661 1.00 0.00 O ATOM 1255 CB VAL A 94 4.728 -3.751 0.400 1.00 0.00 C ATOM 1256 CG1 VAL A 94 3.753 -3.572 1.547 1.00 0.00 C ATOM 1257 CG2 VAL A 94 4.299 -2.936 -0.817 1.00 0.00 C ATOM 0 H VAL A 94 7.355 -3.636 -0.855 1.00 0.00 H new ATOM 0 HA VAL A 94 6.111 -2.613 1.600 1.00 0.00 H new ATOM 0 HB VAL A 94 4.722 -4.799 0.101 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.747 -3.822 1.211 1.00 0.00 H new ATOM 0 HG12 VAL A 94 4.035 -4.229 2.370 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.775 -2.536 1.885 1.00 0.00 H new ATOM 0 HG21 VAL A 94 3.283 -3.212 -1.100 1.00 0.00 H new ATOM 0 HG22 VAL A 94 4.331 -1.874 -0.574 1.00 0.00 H new ATOM 0 HG23 VAL A 94 4.975 -3.139 -1.647 1.00 0.00 H new ATOM 1267 N SER A 95 6.772 -4.835 2.738 1.00 0.00 N ATOM 1268 CA SER A 95 7.367 -6.016 3.358 1.00 0.00 C ATOM 1269 C SER A 95 6.462 -7.219 3.148 1.00 0.00 C ATOM 1270 O SER A 95 5.803 -7.683 4.077 1.00 0.00 O ATOM 1271 CB SER A 95 7.611 -5.780 4.853 1.00 0.00 C ATOM 1272 OG SER A 95 8.423 -6.800 5.413 1.00 0.00 O ATOM 0 H SER A 95 6.343 -4.181 3.392 1.00 0.00 H new ATOM 0 HA SER A 95 8.330 -6.211 2.887 1.00 0.00 H new ATOM 0 HB2 SER A 95 8.090 -4.812 4.996 1.00 0.00 H new ATOM 0 HB3 SER A 95 6.656 -5.744 5.378 1.00 0.00 H new ATOM 0 HG SER A 95 8.562 -6.621 6.366 1.00 0.00 H new ATOM 1277 N ARG A 96 6.439 -7.707 1.903 1.00 0.00 N ATOM 1278 CA ARG A 96 5.522 -8.769 1.472 1.00 0.00 C ATOM 1279 C ARG A 96 4.064 -8.314 1.498 1.00 0.00 C ATOM 1280 O ARG A 96 3.320 -8.531 0.545 1.00 0.00 O ATOM 1281 CB ARG A 96 5.713 -10.042 2.306 1.00 0.00 C ATOM 1282 CG ARG A 96 4.424 -10.786 2.588 1.00 0.00 C ATOM 1283 CD ARG A 96 3.815 -11.406 1.345 1.00 0.00 C ATOM 1284 NE ARG A 96 4.311 -12.745 1.106 1.00 0.00 N ATOM 1285 CZ ARG A 96 5.210 -13.078 0.178 1.00 0.00 C ATOM 1286 NH1 ARG A 96 5.763 -12.141 -0.588 1.00 0.00 N ATOM 1287 NH2 ARG A 96 5.564 -14.347 0.025 1.00 0.00 N ATOM 0 H ARG A 96 7.058 -7.376 1.163 1.00 0.00 H new ATOM 0 HA ARG A 96 5.771 -9.001 0.436 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.399 -10.708 1.783 1.00 0.00 H new ATOM 0 HB3 ARG A 96 6.184 -9.778 3.253 1.00 0.00 H new ATOM 0 HG2 ARG A 96 4.616 -11.569 3.322 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.705 -10.100 3.035 1.00 0.00 H new ATOM 0 HD2 ARG A 96 2.730 -11.435 1.449 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.036 -10.778 0.482 1.00 0.00 H new ATOM 0 HE ARG A 96 3.944 -13.493 1.694 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.500 -11.163 -0.467 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.450 -12.401 -1.296 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.149 -15.067 0.616 1.00 0.00 H new ATOM 0 HH22 ARG A 96 6.251 -14.603 -0.684 1.00 0.00 H new ATOM 1298 N ARG A 97 3.653 -7.724 2.586 1.00 0.00 N ATOM 1299 CA ARG A 97 2.297 -7.258 2.723 1.00 0.00 C ATOM 1300 C ARG A 97 2.223 -6.116 3.721 1.00 0.00 C ATOM 1301 O ARG A 97 2.833 -6.158 4.785 1.00 0.00 O ATOM 1302 CB ARG A 97 1.385 -8.416 3.177 1.00 0.00 C ATOM 1303 CG ARG A 97 1.796 -9.022 4.513 1.00 0.00 C ATOM 1304 CD ARG A 97 0.764 -10.002 5.056 1.00 0.00 C ATOM 1305 NE ARG A 97 0.779 -11.287 4.358 1.00 0.00 N ATOM 1306 CZ ARG A 97 1.036 -12.453 4.959 1.00 0.00 C ATOM 1307 NH1 ARG A 97 1.348 -12.488 6.251 1.00 0.00 N ATOM 1308 NH2 ARG A 97 0.965 -13.584 4.268 1.00 0.00 N ATOM 0 H ARG A 97 4.243 -7.552 3.400 1.00 0.00 H new ATOM 0 HA ARG A 97 1.956 -6.893 1.754 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.360 -8.054 3.251 1.00 0.00 H new ATOM 0 HB3 ARG A 97 1.393 -9.195 2.415 1.00 0.00 H new ATOM 0 HG2 ARG A 97 2.751 -9.534 4.397 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.949 -8.223 5.238 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.951 -10.168 6.117 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -0.229 -9.560 4.972 1.00 0.00 H new ATOM 0 HE ARG A 97 0.582 -11.294 3.357 1.00 0.00 H new ATOM 0 HH11 ARG A 97 1.392 -11.622 6.789 1.00 0.00 H new ATOM 0 HH12 ARG A 97 1.543 -13.381 6.705 1.00 0.00 H new ATOM 0 HH21 ARG A 97 0.715 -13.563 3.279 1.00 0.00 H new ATOM 0 HH22 ARG A 97 1.161 -14.474 4.726 1.00 0.00 H new ATOM 1319 N HIS A 98 1.488 -5.084 3.343 1.00 0.00 N ATOM 1320 CA HIS A 98 1.160 -4.005 4.254 1.00 0.00 C ATOM 1321 C HIS A 98 0.156 -4.533 5.237 1.00 0.00 C ATOM 1322 O HIS A 98 0.151 -4.199 6.419 1.00 0.00 O ATOM 1323 CB HIS A 98 0.562 -2.816 3.477 1.00 0.00 C ATOM 1324 CG HIS A 98 -0.932 -2.616 3.640 1.00 0.00 C ATOM 1325 ND1 HIS A 98 -1.466 -1.800 4.611 1.00 0.00 N ATOM 1326 CD2 HIS A 98 -2.000 -3.101 2.940 1.00 0.00 C ATOM 1327 CE1 HIS A 98 -2.780 -1.783 4.507 1.00 0.00 C ATOM 1328 NE2 HIS A 98 -3.131 -2.566 3.507 1.00 0.00 N ATOM 0 H HIS A 98 1.106 -4.972 2.404 1.00 0.00 H new ATOM 0 HA HIS A 98 2.055 -3.655 4.769 1.00 0.00 H new ATOM 0 HB2 HIS A 98 1.070 -1.905 3.794 1.00 0.00 H new ATOM 0 HB3 HIS A 98 0.780 -2.950 2.417 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -0.926 -1.286 5.307 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -1.962 -3.778 2.099 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -3.455 -1.222 5.136 1.00 0.00 H new ATOM 1336 N ALA A 99 -0.696 -5.366 4.695 1.00 0.00 N ATOM 1337 CA ALA A 99 -1.781 -5.938 5.414 1.00 0.00 C ATOM 1338 C ALA A 99 -2.231 -7.167 4.684 1.00 0.00 C ATOM 1339 O ALA A 99 -1.715 -7.489 3.611 1.00 0.00 O ATOM 1340 CB ALA A 99 -2.937 -4.959 5.534 1.00 0.00 C ATOM 0 H ALA A 99 -0.644 -5.665 3.721 1.00 0.00 H new ATOM 0 HA ALA A 99 -1.452 -6.188 6.423 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -3.752 -5.424 6.089 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -2.604 -4.065 6.061 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -3.286 -4.684 4.539 1.00 0.00 H new ATOM 1346 N GLU A 100 -3.176 -7.842 5.259 1.00 0.00 N ATOM 1347 CA GLU A 100 -3.816 -8.943 4.604 1.00 0.00 C ATOM 1348 C GLU A 100 -5.305 -8.808 4.786 1.00 0.00 C ATOM 1349 O GLU A 100 -5.775 -8.446 5.867 1.00 0.00 O ATOM 1350 CB GLU A 100 -3.268 -10.264 5.146 1.00 0.00 C ATOM 1351 CG GLU A 100 -3.115 -10.289 6.658 1.00 0.00 C ATOM 1352 CD GLU A 100 -2.451 -11.553 7.146 1.00 0.00 C ATOM 1353 OE1 GLU A 100 -3.125 -12.598 7.183 1.00 0.00 O ATOM 1354 OE2 GLU A 100 -1.258 -11.506 7.507 1.00 0.00 O ATOM 0 H GLU A 100 -3.527 -7.647 6.197 1.00 0.00 H new ATOM 0 HA GLU A 100 -3.606 -8.937 3.535 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -3.932 -11.074 4.844 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -2.298 -10.460 4.688 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -2.528 -9.427 6.976 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -4.097 -10.195 7.122 1.00 0.00 H new ATOM 1359 N PHE A 101 -6.023 -9.022 3.696 1.00 0.00 N ATOM 1360 CA PHE A 101 -7.460 -8.950 3.695 1.00 0.00 C ATOM 1361 C PHE A 101 -7.984 -9.988 4.643 1.00 0.00 C ATOM 1362 O PHE A 101 -8.093 -11.162 4.317 1.00 0.00 O ATOM 1363 CB PHE A 101 -7.998 -9.137 2.269 1.00 0.00 C ATOM 1364 CG PHE A 101 -9.301 -9.880 2.197 1.00 0.00 C ATOM 1365 CD1 PHE A 101 -10.423 -9.439 2.883 1.00 0.00 C ATOM 1366 CD2 PHE A 101 -9.390 -11.036 1.446 1.00 0.00 C ATOM 1367 CE1 PHE A 101 -11.605 -10.142 2.816 1.00 0.00 C ATOM 1368 CE2 PHE A 101 -10.567 -11.741 1.379 1.00 0.00 C ATOM 1369 CZ PHE A 101 -11.678 -11.293 2.062 1.00 0.00 C ATOM 0 H PHE A 101 -5.617 -9.251 2.789 1.00 0.00 H new ATOM 0 HA PHE A 101 -7.799 -7.970 4.031 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.125 -8.157 1.809 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -7.254 -9.672 1.679 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -10.369 -8.537 3.474 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -8.524 -11.389 0.905 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -12.474 -9.792 3.354 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -10.622 -12.646 0.792 1.00 0.00 H new ATOM 0 HZ PHE A 101 -12.605 -11.844 2.006 1.00 0.00 H new ATOM 1378 N ARG A 102 -8.251 -9.553 5.842 1.00 0.00 N ATOM 1379 CA ARG A 102 -8.712 -10.449 6.839 1.00 0.00 C ATOM 1380 C ARG A 102 -10.233 -10.469 6.846 1.00 0.00 C ATOM 1381 O ARG A 102 -10.865 -9.567 7.404 1.00 0.00 O ATOM 1382 CB ARG A 102 -8.188 -10.030 8.207 1.00 0.00 C ATOM 1383 CG ARG A 102 -8.471 -11.050 9.290 1.00 0.00 C ATOM 1384 CD ARG A 102 -7.819 -12.379 8.963 1.00 0.00 C ATOM 1385 NE ARG A 102 -6.373 -12.248 8.801 1.00 0.00 N ATOM 1386 CZ ARG A 102 -5.497 -12.582 9.759 1.00 0.00 C ATOM 1387 NH1 ARG A 102 -5.930 -12.968 10.951 1.00 0.00 N ATOM 1388 NH2 ARG A 102 -4.196 -12.531 9.535 1.00 0.00 N ATOM 0 H ARG A 102 -8.154 -8.583 6.143 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.342 -11.450 6.616 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -7.112 -9.866 8.143 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -8.639 -9.078 8.486 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -8.099 -10.683 10.247 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -9.547 -11.185 9.397 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -8.033 -13.094 9.758 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -8.253 -12.781 8.047 1.00 0.00 H new ATOM 0 HE ARG A 102 -6.013 -11.886 7.918 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -6.931 -13.011 11.140 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -5.262 -13.222 11.679 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -3.847 -12.235 8.624 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -3.541 -12.788 10.273 1.00 0.00 H new ATOM 1399 N LEU A 103 -10.828 -11.458 6.196 1.00 0.00 N ATOM 1400 CA LEU A 103 -12.269 -11.581 6.231 1.00 0.00 C ATOM 1401 C LEU A 103 -12.687 -12.188 7.555 1.00 0.00 C ATOM 1402 O LEU A 103 -12.468 -13.374 7.811 1.00 0.00 O ATOM 1403 CB LEU A 103 -12.813 -12.416 5.066 1.00 0.00 C ATOM 1404 CG LEU A 103 -14.329 -12.289 4.842 1.00 0.00 C ATOM 1405 CD1 LEU A 103 -14.692 -12.591 3.401 1.00 0.00 C ATOM 1406 CD2 LEU A 103 -15.096 -13.212 5.762 1.00 0.00 C ATOM 0 H LEU A 103 -10.344 -12.171 5.650 1.00 0.00 H new ATOM 0 HA LEU A 103 -12.693 -10.582 6.127 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.298 -12.120 4.152 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.571 -13.464 5.243 1.00 0.00 H new ATOM 0 HG LEU A 103 -14.605 -11.259 5.068 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -15.770 -12.494 3.269 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -14.181 -11.889 2.742 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -14.386 -13.608 3.154 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -16.165 -13.100 5.581 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -14.801 -14.244 5.570 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -14.875 -12.958 6.799 1.00 0.00 H new ATOM 1417 N GLU A 104 -13.268 -11.359 8.393 1.00 0.00 N ATOM 1418 CA GLU A 104 -13.787 -11.794 9.669 1.00 0.00 C ATOM 1419 C GLU A 104 -15.166 -11.198 9.871 1.00 0.00 C ATOM 1420 O GLU A 104 -15.411 -10.048 9.503 1.00 0.00 O ATOM 1421 CB GLU A 104 -12.845 -11.411 10.811 1.00 0.00 C ATOM 1422 CG GLU A 104 -12.384 -9.966 10.782 1.00 0.00 C ATOM 1423 CD GLU A 104 -11.502 -9.630 11.962 1.00 0.00 C ATOM 1424 OE1 GLU A 104 -10.287 -9.909 11.906 1.00 0.00 O ATOM 1425 OE2 GLU A 104 -12.027 -9.110 12.968 1.00 0.00 O ATOM 0 H GLU A 104 -13.394 -10.364 8.208 1.00 0.00 H new ATOM 0 HA GLU A 104 -13.862 -12.881 9.673 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.347 -11.601 11.760 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -11.970 -12.060 10.778 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.839 -9.778 9.857 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -13.253 -9.308 10.780 1.00 0.00 H new ATOM 1430 N ASN A 105 -16.065 -12.004 10.421 1.00 0.00 N ATOM 1431 CA ASN A 105 -17.476 -11.644 10.540 1.00 0.00 C ATOM 1432 C ASN A 105 -18.057 -11.362 9.162 1.00 0.00 C ATOM 1433 O ASN A 105 -18.939 -10.520 9.007 1.00 0.00 O ATOM 1434 CB ASN A 105 -17.675 -10.437 11.468 1.00 0.00 C ATOM 1435 CG ASN A 105 -17.351 -10.757 12.913 1.00 0.00 C ATOM 1436 OD1 ASN A 105 -18.198 -11.267 13.648 1.00 0.00 O ATOM 1437 ND2 ASN A 105 -16.141 -10.438 13.340 1.00 0.00 N ATOM 0 H ASN A 105 -15.839 -12.925 10.797 1.00 0.00 H new ATOM 0 HA ASN A 105 -18.004 -12.487 10.985 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -17.043 -9.615 11.131 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -18.708 -10.095 11.398 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -15.880 -10.613 14.310 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -15.468 -10.017 12.699 1.00 0.00 H new ATOM 1443 N ASN A 106 -17.530 -12.084 8.165 1.00 0.00 N ATOM 1444 CA ASN A 106 -17.961 -11.964 6.766 1.00 0.00 C ATOM 1445 C ASN A 106 -17.589 -10.612 6.171 1.00 0.00 C ATOM 1446 O ASN A 106 -17.995 -10.283 5.053 1.00 0.00 O ATOM 1447 CB ASN A 106 -19.462 -12.192 6.636 1.00 0.00 C ATOM 1448 CG ASN A 106 -19.871 -13.600 7.022 1.00 0.00 C ATOM 1449 OD1 ASN A 106 -19.143 -14.563 6.770 1.00 0.00 O ATOM 1450 ND2 ASN A 106 -21.026 -13.732 7.649 1.00 0.00 N ATOM 0 H ASN A 106 -16.789 -12.771 8.307 1.00 0.00 H new ATOM 0 HA ASN A 106 -17.434 -12.736 6.205 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -19.991 -11.478 7.267 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -19.768 -11.997 5.608 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -21.344 -14.655 7.943 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -21.600 -12.910 7.839 1.00 0.00 H new ATOM 1456 N GLU A 107 -16.796 -9.845 6.901 1.00 0.00 N ATOM 1457 CA GLU A 107 -16.401 -8.522 6.460 1.00 0.00 C ATOM 1458 C GLU A 107 -14.958 -8.530 5.990 1.00 0.00 C ATOM 1459 O GLU A 107 -14.147 -9.327 6.460 1.00 0.00 O ATOM 1460 CB GLU A 107 -16.564 -7.504 7.592 1.00 0.00 C ATOM 1461 CG GLU A 107 -17.976 -7.411 8.154 1.00 0.00 C ATOM 1462 CD GLU A 107 -18.981 -6.908 7.140 1.00 0.00 C ATOM 1463 OE1 GLU A 107 -19.086 -5.677 6.967 1.00 0.00 O ATOM 1464 OE2 GLU A 107 -19.672 -7.740 6.515 1.00 0.00 O ATOM 0 H GLU A 107 -16.413 -10.120 7.806 1.00 0.00 H new ATOM 0 HA GLU A 107 -17.047 -8.236 5.630 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -15.881 -7.765 8.400 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -16.266 -6.521 7.227 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -18.286 -8.394 8.509 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -17.975 -6.746 9.018 1.00 0.00 H new ATOM 1469 N PHE A 108 -14.642 -7.637 5.069 1.00 0.00 N ATOM 1470 CA PHE A 108 -13.293 -7.533 4.543 1.00 0.00 C ATOM 1471 C PHE A 108 -12.573 -6.389 5.240 1.00 0.00 C ATOM 1472 O PHE A 108 -13.057 -5.261 5.252 1.00 0.00 O ATOM 1473 CB PHE A 108 -13.320 -7.313 3.022 1.00 0.00 C ATOM 1474 CG PHE A 108 -14.596 -7.792 2.377 1.00 0.00 C ATOM 1475 CD1 PHE A 108 -14.721 -9.100 1.934 1.00 0.00 C ATOM 1476 CD2 PHE A 108 -15.674 -6.934 2.225 1.00 0.00 C ATOM 1477 CE1 PHE A 108 -15.893 -9.541 1.354 1.00 0.00 C ATOM 1478 CE2 PHE A 108 -16.851 -7.372 1.646 1.00 0.00 C ATOM 1479 CZ PHE A 108 -16.959 -8.677 1.209 1.00 0.00 C ATOM 0 H PHE A 108 -15.304 -6.972 4.669 1.00 0.00 H new ATOM 0 HA PHE A 108 -12.758 -8.463 4.734 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -13.190 -6.251 2.812 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -12.475 -7.833 2.571 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -13.891 -9.782 2.044 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -15.594 -5.911 2.563 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -15.976 -10.563 1.014 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -17.684 -6.694 1.536 1.00 0.00 H new ATOM 0 HZ PHE A 108 -17.876 -9.021 0.754 1.00 0.00 H new ATOM 1488 N ASN A 109 -11.433 -6.688 5.835 1.00 0.00 N ATOM 1489 CA ASN A 109 -10.702 -5.707 6.631 1.00 0.00 C ATOM 1490 C ASN A 109 -9.223 -5.796 6.288 1.00 0.00 C ATOM 1491 O ASN A 109 -8.768 -6.831 5.800 1.00 0.00 O ATOM 1492 CB ASN A 109 -10.869 -6.001 8.131 1.00 0.00 C ATOM 1493 CG ASN A 109 -12.313 -6.169 8.566 1.00 0.00 C ATOM 1494 OD1 ASN A 109 -12.953 -5.221 9.006 1.00 0.00 O ATOM 1495 ND2 ASN A 109 -12.831 -7.383 8.448 1.00 0.00 N ATOM 0 H ASN A 109 -10.988 -7.605 5.784 1.00 0.00 H new ATOM 0 HA ASN A 109 -11.093 -4.714 6.411 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -10.317 -6.908 8.377 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -10.419 -5.189 8.703 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -13.797 -7.555 8.728 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -12.264 -8.145 8.077 1.00 0.00 H new ATOM 1501 N VAL A 110 -8.466 -4.737 6.539 1.00 0.00 N ATOM 1502 CA VAL A 110 -7.023 -4.804 6.350 1.00 0.00 C ATOM 1503 C VAL A 110 -6.298 -4.822 7.677 1.00 0.00 C ATOM 1504 O VAL A 110 -6.451 -3.921 8.494 1.00 0.00 O ATOM 1505 CB VAL A 110 -6.477 -3.653 5.479 1.00 0.00 C ATOM 1506 CG1 VAL A 110 -7.246 -3.605 4.197 1.00 0.00 C ATOM 1507 CG2 VAL A 110 -6.537 -2.299 6.171 1.00 0.00 C ATOM 0 H VAL A 110 -8.817 -3.838 6.868 1.00 0.00 H new ATOM 0 HA VAL A 110 -6.835 -5.738 5.820 1.00 0.00 H new ATOM 0 HB VAL A 110 -5.423 -3.857 5.291 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -6.867 -2.794 3.575 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.132 -4.551 3.669 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.301 -3.434 4.412 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -6.139 -1.533 5.506 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -7.572 -2.062 6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -5.944 -2.331 7.085 1.00 0.00 H new ATOM 1517 N VAL A 111 -5.498 -5.843 7.884 1.00 0.00 N ATOM 1518 CA VAL A 111 -4.724 -5.942 9.106 1.00 0.00 C ATOM 1519 C VAL A 111 -3.296 -5.501 8.845 1.00 0.00 C ATOM 1520 O VAL A 111 -2.549 -6.194 8.160 1.00 0.00 O ATOM 1521 CB VAL A 111 -4.716 -7.383 9.658 1.00 0.00 C ATOM 1522 CG1 VAL A 111 -3.758 -7.503 10.831 1.00 0.00 C ATOM 1523 CG2 VAL A 111 -6.117 -7.806 10.069 1.00 0.00 C ATOM 0 H VAL A 111 -5.365 -6.613 7.229 1.00 0.00 H new ATOM 0 HA VAL A 111 -5.190 -5.293 9.848 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.374 -8.049 8.866 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -3.768 -8.527 11.205 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.750 -7.245 10.506 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.068 -6.824 11.625 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -6.091 -8.825 10.456 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.488 -7.134 10.843 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.779 -7.763 9.204 1.00 0.00 H new ATOM 1533 N ASP A 112 -2.924 -4.356 9.402 1.00 0.00 N ATOM 1534 CA ASP A 112 -1.584 -3.813 9.196 1.00 0.00 C ATOM 1535 C ASP A 112 -0.565 -4.718 9.872 1.00 0.00 C ATOM 1536 O ASP A 112 -0.648 -4.963 11.078 1.00 0.00 O ATOM 1537 CB ASP A 112 -1.461 -2.394 9.750 1.00 0.00 C ATOM 1538 CG ASP A 112 -0.031 -1.878 9.688 1.00 0.00 C ATOM 1539 OD1 ASP A 112 0.637 -2.071 8.651 1.00 0.00 O ATOM 1540 OD2 ASP A 112 0.429 -1.256 10.669 1.00 0.00 O ATOM 0 H ASP A 112 -3.526 -3.787 9.997 1.00 0.00 H new ATOM 0 HA ASP A 112 -1.395 -3.770 8.123 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -2.112 -1.727 9.185 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -1.808 -2.377 10.783 1.00 0.00 H new ATOM 1544 N VAL A 113 0.385 -5.223 9.106 1.00 0.00 N ATOM 1545 CA VAL A 113 1.325 -6.203 9.622 1.00 0.00 C ATOM 1546 C VAL A 113 2.766 -5.793 9.369 1.00 0.00 C ATOM 1547 O VAL A 113 3.691 -6.394 9.915 1.00 0.00 O ATOM 1548 CB VAL A 113 1.089 -7.593 9.001 1.00 0.00 C ATOM 1549 CG1 VAL A 113 -0.228 -8.186 9.483 1.00 0.00 C ATOM 1550 CG2 VAL A 113 1.108 -7.506 7.486 1.00 0.00 C ATOM 0 H VAL A 113 0.526 -4.972 8.127 1.00 0.00 H new ATOM 0 HA VAL A 113 1.153 -6.252 10.697 1.00 0.00 H new ATOM 0 HB VAL A 113 1.896 -8.251 9.323 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -0.372 -9.167 9.031 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -0.206 -8.286 10.568 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -1.049 -7.530 9.195 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.940 -8.496 7.063 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.322 -6.830 7.151 1.00 0.00 H new ATOM 0 HG23 VAL A 113 2.076 -7.130 7.155 1.00 0.00 H new ATOM 1560 N GLY A 114 2.963 -4.778 8.542 1.00 0.00 N ATOM 1561 CA GLY A 114 4.306 -4.330 8.260 1.00 0.00 C ATOM 1562 C GLY A 114 4.510 -3.922 6.815 1.00 0.00 C ATOM 1563 O GLY A 114 5.080 -4.665 6.022 1.00 0.00 O ATOM 0 H GLY A 114 2.223 -4.262 8.066 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.543 -3.485 8.906 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.007 -5.127 8.508 1.00 0.00 H new ATOM 1567 N SER A 115 4.037 -2.742 6.470 1.00 0.00 N ATOM 1568 CA SER A 115 4.266 -2.188 5.150 1.00 0.00 C ATOM 1569 C SER A 115 5.597 -1.450 5.135 1.00 0.00 C ATOM 1570 O SER A 115 5.907 -0.757 6.102 1.00 0.00 O ATOM 1571 CB SER A 115 3.125 -1.243 4.800 1.00 0.00 C ATOM 1572 OG SER A 115 3.369 -0.526 3.605 1.00 0.00 O ATOM 0 H SER A 115 3.489 -2.145 7.089 1.00 0.00 H new ATOM 0 HA SER A 115 4.302 -2.987 4.409 1.00 0.00 H new ATOM 0 HB2 SER A 115 2.202 -1.814 4.697 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.975 -0.540 5.619 1.00 0.00 H new ATOM 0 HG SER A 115 3.184 0.425 3.751 1.00 0.00 H new ATOM 1577 N LEU A 116 6.401 -1.613 4.080 1.00 0.00 N ATOM 1578 CA LEU A 116 7.734 -1.014 4.068 1.00 0.00 C ATOM 1579 C LEU A 116 7.691 0.503 4.362 1.00 0.00 C ATOM 1580 O LEU A 116 8.372 0.962 5.282 1.00 0.00 O ATOM 1581 CB LEU A 116 8.445 -1.333 2.752 1.00 0.00 C ATOM 1582 CG LEU A 116 9.969 -1.163 2.753 1.00 0.00 C ATOM 1583 CD1 LEU A 116 10.345 0.264 2.435 1.00 0.00 C ATOM 1584 CD2 LEU A 116 10.566 -1.583 4.088 1.00 0.00 C ATOM 0 H LEU A 116 6.158 -2.142 3.243 1.00 0.00 H new ATOM 0 HA LEU A 116 8.314 -1.457 4.877 1.00 0.00 H new ATOM 0 HB2 LEU A 116 8.214 -2.362 2.478 1.00 0.00 H new ATOM 0 HB3 LEU A 116 8.029 -0.694 1.973 1.00 0.00 H new ATOM 0 HG LEU A 116 10.379 -1.812 1.979 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.430 0.364 2.441 1.00 0.00 H new ATOM 0 HD12 LEU A 116 9.961 0.531 1.450 1.00 0.00 H new ATOM 0 HD13 LEU A 116 9.915 0.929 3.184 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.648 -1.452 4.060 1.00 0.00 H new ATOM 0 HD22 LEU A 116 10.146 -0.968 4.884 1.00 0.00 H new ATOM 0 HD23 LEU A 116 10.332 -2.631 4.278 1.00 0.00 H new ATOM 1595 N ASN A 117 6.897 1.285 3.614 1.00 0.00 N ATOM 1596 CA ASN A 117 6.709 2.703 3.974 1.00 0.00 C ATOM 1597 C ASN A 117 5.811 2.813 5.197 1.00 0.00 C ATOM 1598 O ASN A 117 6.000 3.677 6.053 1.00 0.00 O ATOM 1599 CB ASN A 117 6.088 3.524 2.832 1.00 0.00 C ATOM 1600 CG ASN A 117 4.624 3.901 3.070 1.00 0.00 C ATOM 1601 OD1 ASN A 117 3.711 3.111 2.540 1.00 0.00 O flip ATOM 1602 ND2 ASN A 117 4.317 4.910 3.698 1.00 0.00 N flip ATOM 0 H ASN A 117 6.390 0.976 2.784 1.00 0.00 H new ATOM 0 HA ASN A 117 7.699 3.109 4.183 1.00 0.00 H new ATOM 0 HB2 ASN A 117 6.670 4.435 2.693 1.00 0.00 H new ATOM 0 HB3 ASN A 117 6.161 2.954 1.906 1.00 0.00 H new ATOM 0 HD21 ASN A 117 5.044 5.503 4.097 1.00 0.00 H new ATOM 0 HD22 ASN A 117 3.335 5.155 3.821 1.00 0.00 H new ATOM 1608 N GLY A 118 4.837 1.916 5.269 1.00 0.00 N ATOM 1609 CA GLY A 118 3.839 1.981 6.310 1.00 0.00 C ATOM 1610 C GLY A 118 2.431 1.811 5.763 1.00 0.00 C ATOM 1611 O GLY A 118 2.228 1.714 4.530 1.00 0.00 O ATOM 0 H GLY A 118 4.723 1.139 4.618 1.00 0.00 H new ATOM 0 HA2 GLY A 118 4.036 1.205 7.050 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.914 2.939 6.825 1.00 0.00 H new ATOM 1615 N THR A 119 1.487 1.693 6.690 1.00 0.00 N ATOM 1616 CA THR A 119 0.068 1.605 6.386 1.00 0.00 C ATOM 1617 C THR A 119 -0.667 2.860 6.849 1.00 0.00 C ATOM 1618 O THR A 119 -0.514 3.284 7.995 1.00 0.00 O ATOM 1619 CB THR A 119 -0.555 0.388 7.090 1.00 0.00 C ATOM 1620 OG1 THR A 119 -0.012 -0.821 6.545 1.00 0.00 O ATOM 1621 CG2 THR A 119 -2.074 0.383 6.959 1.00 0.00 C ATOM 0 H THR A 119 1.692 1.655 7.689 1.00 0.00 H new ATOM 0 HA THR A 119 -0.032 1.503 5.305 1.00 0.00 H new ATOM 0 HB THR A 119 -0.311 0.452 8.151 1.00 0.00 H new ATOM 0 HG1 THR A 119 0.560 -1.253 7.213 1.00 0.00 H new ATOM 0 HG21 THR A 119 -2.480 -0.491 7.468 1.00 0.00 H new ATOM 0 HG22 THR A 119 -2.481 1.288 7.410 1.00 0.00 H new ATOM 0 HG23 THR A 119 -2.348 0.349 5.905 1.00 0.00 H new ATOM 1629 N TYR A 120 -1.464 3.445 5.968 1.00 0.00 N ATOM 1630 CA TYR A 120 -2.314 4.566 6.348 1.00 0.00 C ATOM 1631 C TYR A 120 -3.695 4.436 5.721 1.00 0.00 C ATOM 1632 O TYR A 120 -3.874 4.690 4.539 1.00 0.00 O ATOM 1633 CB TYR A 120 -1.670 5.895 5.940 1.00 0.00 C ATOM 1634 CG TYR A 120 -0.518 6.303 6.825 1.00 0.00 C ATOM 1635 CD1 TYR A 120 -0.737 7.065 7.963 1.00 0.00 C ATOM 1636 CD2 TYR A 120 0.784 5.919 6.531 1.00 0.00 C ATOM 1637 CE1 TYR A 120 0.308 7.436 8.783 1.00 0.00 C ATOM 1638 CE2 TYR A 120 1.836 6.283 7.348 1.00 0.00 C ATOM 1639 CZ TYR A 120 1.593 7.042 8.472 1.00 0.00 C ATOM 1640 OH TYR A 120 2.639 7.405 9.291 1.00 0.00 O ATOM 0 H TYR A 120 -1.541 3.165 4.990 1.00 0.00 H new ATOM 0 HA TYR A 120 -2.425 4.551 7.432 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -1.318 5.818 4.911 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -2.428 6.678 5.960 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -1.742 7.373 8.211 1.00 0.00 H new ATOM 0 HD2 TYR A 120 0.977 5.326 5.649 1.00 0.00 H new ATOM 0 HE1 TYR A 120 0.121 8.032 9.664 1.00 0.00 H new ATOM 0 HE2 TYR A 120 2.843 5.975 7.108 1.00 0.00 H new ATOM 0 HH TYR A 120 3.477 7.046 8.930 1.00 0.00 H new ATOM 1649 N VAL A 121 -4.674 4.049 6.520 1.00 0.00 N ATOM 1650 CA VAL A 121 -6.049 3.960 6.048 1.00 0.00 C ATOM 1651 C VAL A 121 -6.801 5.193 6.518 1.00 0.00 C ATOM 1652 O VAL A 121 -6.783 5.499 7.704 1.00 0.00 O ATOM 1653 CB VAL A 121 -6.765 2.692 6.575 1.00 0.00 C ATOM 1654 CG1 VAL A 121 -8.185 2.586 6.041 1.00 0.00 C ATOM 1655 CG2 VAL A 121 -5.989 1.445 6.218 1.00 0.00 C ATOM 0 H VAL A 121 -4.545 3.791 7.498 1.00 0.00 H new ATOM 0 HA VAL A 121 -6.034 3.899 4.960 1.00 0.00 H new ATOM 0 HB VAL A 121 -6.814 2.781 7.660 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -8.655 1.684 6.433 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -8.758 3.459 6.355 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -8.162 2.539 4.952 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -6.513 0.569 6.600 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -5.899 1.371 5.134 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -4.995 1.495 6.662 1.00 0.00 H new ATOM 1665 N ASN A 122 -7.431 5.909 5.588 1.00 0.00 N ATOM 1666 CA ASN A 122 -8.144 7.151 5.911 1.00 0.00 C ATOM 1667 C ASN A 122 -7.136 8.192 6.405 1.00 0.00 C ATOM 1668 O ASN A 122 -7.497 9.132 7.111 1.00 0.00 O ATOM 1669 CB ASN A 122 -9.223 6.934 6.998 1.00 0.00 C ATOM 1670 CG ASN A 122 -9.964 5.606 6.894 1.00 0.00 C ATOM 1671 OD1 ASN A 122 -10.328 5.018 7.912 1.00 0.00 O ATOM 1672 ND2 ASN A 122 -10.228 5.137 5.685 1.00 0.00 N ATOM 0 H ASN A 122 -7.464 5.652 4.601 1.00 0.00 H new ATOM 0 HA ASN A 122 -8.646 7.495 5.006 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -8.751 6.997 7.979 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -9.948 7.746 6.940 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -10.747 4.265 5.578 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -9.913 5.647 4.860 1.00 0.00 H new ATOM 1678 N ARG A 123 -5.870 7.998 6.014 1.00 0.00 N ATOM 1679 CA ARG A 123 -4.745 8.806 6.498 1.00 0.00 C ATOM 1680 C ARG A 123 -4.562 8.675 8.014 1.00 0.00 C ATOM 1681 O ARG A 123 -4.264 9.653 8.704 1.00 0.00 O ATOM 1682 CB ARG A 123 -4.885 10.280 6.097 1.00 0.00 C ATOM 1683 CG ARG A 123 -4.816 10.512 4.596 1.00 0.00 C ATOM 1684 CD ARG A 123 -3.951 11.719 4.257 1.00 0.00 C ATOM 1685 NE ARG A 123 -2.555 11.503 4.633 1.00 0.00 N ATOM 1686 CZ ARG A 123 -1.706 12.465 4.995 1.00 0.00 C ATOM 1687 NH1 ARG A 123 -2.080 13.741 4.977 1.00 0.00 N ATOM 1688 NH2 ARG A 123 -0.475 12.146 5.361 1.00 0.00 N ATOM 0 H ARG A 123 -5.597 7.273 5.350 1.00 0.00 H new ATOM 0 HA ARG A 123 -3.850 8.413 6.016 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -5.835 10.661 6.472 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -4.097 10.856 6.582 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -4.412 9.625 4.108 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -5.822 10.662 4.203 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -4.013 11.923 3.188 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -4.335 12.599 4.773 1.00 0.00 H new ATOM 0 HE ARG A 123 -2.204 10.545 4.617 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -3.024 13.992 4.684 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -1.422 14.469 5.256 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -0.181 11.169 5.365 1.00 0.00 H new ATOM 0 HH22 ARG A 123 0.180 12.877 5.639 1.00 0.00 H new ATOM 1699 N GLU A 124 -4.766 7.466 8.528 1.00 0.00 N ATOM 1700 CA GLU A 124 -4.416 7.146 9.900 1.00 0.00 C ATOM 1701 C GLU A 124 -3.867 5.719 9.968 1.00 0.00 C ATOM 1702 O GLU A 124 -4.287 4.845 9.204 1.00 0.00 O ATOM 1703 CB GLU A 124 -5.628 7.290 10.833 1.00 0.00 C ATOM 1704 CG GLU A 124 -6.695 6.224 10.640 1.00 0.00 C ATOM 1705 CD GLU A 124 -7.741 6.229 11.737 1.00 0.00 C ATOM 1706 OE1 GLU A 124 -7.416 5.835 12.877 1.00 0.00 O ATOM 1707 OE2 GLU A 124 -8.897 6.611 11.463 1.00 0.00 O ATOM 0 H GLU A 124 -5.175 6.690 8.008 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.653 7.849 10.234 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -5.282 7.259 11.866 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -6.078 8.270 10.677 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -7.184 6.377 9.678 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -6.219 5.244 10.603 1.00 0.00 H new ATOM 1712 N PRO A 125 -2.886 5.475 10.844 1.00 0.00 N ATOM 1713 CA PRO A 125 -2.350 4.135 11.066 1.00 0.00 C ATOM 1714 C PRO A 125 -3.399 3.217 11.684 1.00 0.00 C ATOM 1715 O PRO A 125 -3.927 3.506 12.760 1.00 0.00 O ATOM 1716 CB PRO A 125 -1.194 4.352 12.049 1.00 0.00 C ATOM 1717 CG PRO A 125 -0.908 5.814 12.012 1.00 0.00 C ATOM 1718 CD PRO A 125 -2.203 6.481 11.658 1.00 0.00 C ATOM 0 HA PRO A 125 -2.037 3.660 10.136 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -1.468 4.031 13.054 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -0.317 3.773 11.758 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -0.540 6.164 12.977 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -0.138 6.042 11.275 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -2.779 6.739 12.547 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -2.041 7.405 11.104 1.00 0.00 H new ATOM 1723 N VAL A 126 -3.692 2.108 11.021 1.00 0.00 N ATOM 1724 CA VAL A 126 -4.751 1.214 11.475 1.00 0.00 C ATOM 1725 C VAL A 126 -4.193 -0.132 11.898 1.00 0.00 C ATOM 1726 O VAL A 126 -3.016 -0.422 11.697 1.00 0.00 O ATOM 1727 CB VAL A 126 -5.823 0.979 10.385 1.00 0.00 C ATOM 1728 CG1 VAL A 126 -6.407 2.299 9.912 1.00 0.00 C ATOM 1729 CG2 VAL A 126 -5.259 0.181 9.215 1.00 0.00 C ATOM 0 H VAL A 126 -3.215 1.805 10.171 1.00 0.00 H new ATOM 0 HA VAL A 126 -5.215 1.707 12.329 1.00 0.00 H new ATOM 0 HB VAL A 126 -6.626 0.390 10.828 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -7.159 2.110 9.146 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -6.869 2.815 10.754 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -5.613 2.920 9.497 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -6.037 0.033 8.467 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -4.427 0.726 8.770 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -4.909 -0.788 9.571 1.00 0.00 H new ATOM 1739 N ASP A 127 -5.055 -0.941 12.486 1.00 0.00 N ATOM 1740 CA ASP A 127 -4.707 -2.301 12.861 1.00 0.00 C ATOM 1741 C ASP A 127 -5.483 -3.284 11.999 1.00 0.00 C ATOM 1742 O ASP A 127 -4.939 -4.281 11.531 1.00 0.00 O ATOM 1743 CB ASP A 127 -5.017 -2.540 14.339 1.00 0.00 C ATOM 1744 CG ASP A 127 -4.720 -3.961 14.772 1.00 0.00 C ATOM 1745 OD1 ASP A 127 -3.565 -4.240 15.160 1.00 0.00 O ATOM 1746 OD2 ASP A 127 -5.639 -4.808 14.725 1.00 0.00 O ATOM 0 H ASP A 127 -6.013 -0.676 12.717 1.00 0.00 H new ATOM 0 HA ASP A 127 -3.639 -2.450 12.702 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -4.432 -1.849 14.946 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -6.068 -2.318 14.527 1.00 0.00 H new ATOM 1750 N SER A 128 -6.758 -2.981 11.786 1.00 0.00 N ATOM 1751 CA SER A 128 -7.637 -3.812 10.971 1.00 0.00 C ATOM 1752 C SER A 128 -8.900 -3.040 10.603 1.00 0.00 C ATOM 1753 O SER A 128 -9.893 -3.037 11.333 1.00 0.00 O ATOM 1754 CB SER A 128 -7.958 -5.114 11.711 1.00 0.00 C ATOM 1755 OG SER A 128 -8.051 -4.902 13.111 1.00 0.00 O ATOM 0 H SER A 128 -7.212 -2.153 12.173 1.00 0.00 H new ATOM 0 HA SER A 128 -7.132 -4.074 10.041 1.00 0.00 H new ATOM 0 HB2 SER A 128 -8.897 -5.524 11.340 1.00 0.00 H new ATOM 0 HB3 SER A 128 -7.184 -5.853 11.504 1.00 0.00 H new ATOM 0 HG SER A 128 -7.153 -4.915 13.504 1.00 0.00 H new ATOM 1760 N ALA A 129 -8.838 -2.375 9.457 1.00 0.00 N ATOM 1761 CA ALA A 129 -9.918 -1.510 9.004 1.00 0.00 C ATOM 1762 C ALA A 129 -10.711 -2.158 7.890 1.00 0.00 C ATOM 1763 O ALA A 129 -10.150 -2.622 6.899 1.00 0.00 O ATOM 1764 CB ALA A 129 -9.364 -0.169 8.550 1.00 0.00 C ATOM 0 H ALA A 129 -8.043 -2.419 8.819 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.594 -1.347 9.844 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.182 0.468 8.214 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.848 0.312 9.381 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -8.664 -0.324 7.729 1.00 0.00 H new ATOM 1770 N VAL A 130 -12.018 -2.189 8.081 1.00 0.00 N ATOM 1771 CA VAL A 130 -12.937 -2.734 7.100 1.00 0.00 C ATOM 1772 C VAL A 130 -13.067 -1.788 5.908 1.00 0.00 C ATOM 1773 O VAL A 130 -12.829 -0.580 6.023 1.00 0.00 O ATOM 1774 CB VAL A 130 -14.326 -2.977 7.741 1.00 0.00 C ATOM 1775 CG1 VAL A 130 -14.898 -1.676 8.260 1.00 0.00 C ATOM 1776 CG2 VAL A 130 -15.289 -3.651 6.770 1.00 0.00 C ATOM 0 H VAL A 130 -12.472 -1.836 8.923 1.00 0.00 H new ATOM 0 HA VAL A 130 -12.541 -3.687 6.748 1.00 0.00 H new ATOM 0 HB VAL A 130 -14.192 -3.659 8.581 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -15.874 -1.861 8.708 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -14.228 -1.258 9.011 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -15.005 -0.971 7.436 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -16.251 -3.803 7.259 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -15.424 -3.018 5.893 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -14.881 -4.614 6.463 1.00 0.00 H new ATOM 1786 N LEU A 131 -13.423 -2.355 4.768 1.00 0.00 N ATOM 1787 CA LEU A 131 -13.637 -1.580 3.545 1.00 0.00 C ATOM 1788 C LEU A 131 -14.781 -0.580 3.708 1.00 0.00 C ATOM 1789 O LEU A 131 -15.587 -0.668 4.636 1.00 0.00 O ATOM 1790 CB LEU A 131 -13.971 -2.482 2.352 1.00 0.00 C ATOM 1791 CG LEU A 131 -12.811 -3.211 1.665 1.00 0.00 C ATOM 1792 CD1 LEU A 131 -12.138 -4.184 2.606 1.00 0.00 C ATOM 1793 CD2 LEU A 131 -13.345 -3.912 0.433 1.00 0.00 C ATOM 0 H LEU A 131 -13.572 -3.358 4.658 1.00 0.00 H new ATOM 0 HA LEU A 131 -12.702 -1.052 3.358 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -14.687 -3.232 2.688 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -14.476 -1.873 1.602 1.00 0.00 H new ATOM 0 HG LEU A 131 -12.050 -2.488 1.370 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -11.320 -4.684 2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -11.746 -3.644 3.468 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -12.863 -4.926 2.942 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -12.532 -4.436 -0.069 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -14.113 -4.628 0.726 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -13.776 -3.176 -0.246 1.00 0.00 H new ATOM 1804 N ALA A 132 -14.846 0.351 2.770 1.00 0.00 N ATOM 1805 CA ALA A 132 -15.900 1.345 2.707 1.00 0.00 C ATOM 1806 C ALA A 132 -16.083 1.756 1.253 1.00 0.00 C ATOM 1807 O ALA A 132 -15.433 1.195 0.375 1.00 0.00 O ATOM 1808 CB ALA A 132 -15.564 2.549 3.582 1.00 0.00 C ATOM 0 H ALA A 132 -14.158 0.437 2.022 1.00 0.00 H new ATOM 0 HA ALA A 132 -16.831 0.924 3.088 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -16.369 3.281 3.518 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -15.448 2.226 4.617 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -14.634 3.001 3.237 1.00 0.00 H new ATOM 1814 N ASN A 133 -16.960 2.709 0.987 1.00 0.00 N ATOM 1815 CA ASN A 133 -17.213 3.131 -0.388 1.00 0.00 C ATOM 1816 C ASN A 133 -16.475 4.419 -0.730 1.00 0.00 C ATOM 1817 O ASN A 133 -16.998 5.513 -0.521 1.00 0.00 O ATOM 1818 CB ASN A 133 -18.713 3.326 -0.639 1.00 0.00 C ATOM 1819 CG ASN A 133 -19.468 2.019 -0.784 1.00 0.00 C ATOM 1820 OD1 ASN A 133 -19.986 1.470 0.189 1.00 0.00 O ATOM 1821 ND2 ASN A 133 -19.549 1.519 -2.008 1.00 0.00 N ATOM 0 H ASN A 133 -17.505 3.203 1.693 1.00 0.00 H new ATOM 0 HA ASN A 133 -16.840 2.335 -1.032 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -19.142 3.897 0.185 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -18.850 3.920 -1.543 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -20.055 0.648 -2.171 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.106 2.005 -2.788 1.00 0.00 H new ATOM 1827 N GLY A 134 -15.257 4.295 -1.249 1.00 0.00 N ATOM 1828 CA GLY A 134 -14.583 5.457 -1.801 1.00 0.00 C ATOM 1829 C GLY A 134 -13.451 5.992 -0.948 1.00 0.00 C ATOM 1830 O GLY A 134 -12.876 7.028 -1.272 1.00 0.00 O ATOM 0 H GLY A 134 -14.730 3.423 -1.297 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -14.190 5.200 -2.784 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -15.316 6.250 -1.948 1.00 0.00 H new ATOM 1834 N ASP A 135 -13.120 5.314 0.141 1.00 0.00 N ATOM 1835 CA ASP A 135 -12.032 5.785 0.995 1.00 0.00 C ATOM 1836 C ASP A 135 -10.730 5.110 0.602 1.00 0.00 C ATOM 1837 O ASP A 135 -10.739 4.103 -0.109 1.00 0.00 O ATOM 1838 CB ASP A 135 -12.328 5.540 2.467 1.00 0.00 C ATOM 1839 CG ASP A 135 -11.701 6.604 3.347 1.00 0.00 C ATOM 1840 OD1 ASP A 135 -10.461 6.607 3.495 1.00 0.00 O ATOM 1841 OD2 ASP A 135 -12.446 7.456 3.869 1.00 0.00 O ATOM 0 H ASP A 135 -13.575 4.456 0.452 1.00 0.00 H new ATOM 0 HA ASP A 135 -11.937 6.861 0.851 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -13.406 5.526 2.624 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -11.951 4.559 2.756 1.00 0.00 H new ATOM 1845 N GLU A 136 -9.618 5.631 1.096 1.00 0.00 N ATOM 1846 CA GLU A 136 -8.326 5.278 0.545 1.00 0.00 C ATOM 1847 C GLU A 136 -7.322 4.803 1.614 1.00 0.00 C ATOM 1848 O GLU A 136 -7.387 5.201 2.783 1.00 0.00 O ATOM 1849 CB GLU A 136 -7.795 6.475 -0.263 1.00 0.00 C ATOM 1850 CG GLU A 136 -7.272 7.631 0.567 1.00 0.00 C ATOM 1851 CD GLU A 136 -7.484 8.962 -0.127 1.00 0.00 C ATOM 1852 OE1 GLU A 136 -6.693 9.301 -1.033 1.00 0.00 O ATOM 1853 OE2 GLU A 136 -8.467 9.660 0.213 1.00 0.00 O ATOM 0 H GLU A 136 -9.587 6.294 1.871 1.00 0.00 H new ATOM 0 HA GLU A 136 -8.451 4.420 -0.115 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -6.995 6.126 -0.916 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -8.595 6.843 -0.906 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -7.775 7.641 1.534 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -6.209 7.487 0.762 1.00 0.00 H new ATOM 1858 N VAL A 137 -6.409 3.920 1.186 1.00 0.00 N ATOM 1859 CA VAL A 137 -5.373 3.338 2.050 1.00 0.00 C ATOM 1860 C VAL A 137 -4.002 3.563 1.427 1.00 0.00 C ATOM 1861 O VAL A 137 -3.859 3.506 0.213 1.00 0.00 O ATOM 1862 CB VAL A 137 -5.551 1.800 2.250 1.00 0.00 C ATOM 1863 CG1 VAL A 137 -4.540 1.243 3.258 1.00 0.00 C ATOM 1864 CG2 VAL A 137 -6.971 1.470 2.672 1.00 0.00 C ATOM 0 H VAL A 137 -6.369 3.587 0.223 1.00 0.00 H new ATOM 0 HA VAL A 137 -5.464 3.830 3.019 1.00 0.00 H new ATOM 0 HB VAL A 137 -5.359 1.320 1.291 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -4.693 0.170 3.372 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.528 1.429 2.899 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -4.679 1.734 4.221 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -7.070 0.393 2.805 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.198 1.974 3.611 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -7.667 1.806 1.903 1.00 0.00 H new ATOM 1874 N GLN A 138 -3.008 3.843 2.244 1.00 0.00 N ATOM 1875 CA GLN A 138 -1.638 3.848 1.779 1.00 0.00 C ATOM 1876 C GLN A 138 -0.956 2.550 2.157 1.00 0.00 C ATOM 1877 O GLN A 138 -0.956 2.151 3.325 1.00 0.00 O ATOM 1878 CB GLN A 138 -0.843 5.016 2.361 1.00 0.00 C ATOM 1879 CG GLN A 138 0.646 4.982 2.004 1.00 0.00 C ATOM 1880 CD GLN A 138 0.892 4.924 0.530 1.00 0.00 C ATOM 1881 OE1 GLN A 138 1.068 3.851 -0.015 1.00 0.00 O ATOM 1882 NE2 GLN A 138 0.889 6.070 -0.127 1.00 0.00 N ATOM 0 H GLN A 138 -3.123 4.070 3.232 1.00 0.00 H new ATOM 0 HA GLN A 138 -1.665 3.958 0.695 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -1.273 5.951 2.003 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -0.948 5.012 3.446 1.00 0.00 H new ATOM 0 HG2 GLN A 138 1.133 5.867 2.413 1.00 0.00 H new ATOM 0 HG3 GLN A 138 1.108 4.116 2.478 1.00 0.00 H new ATOM 0 HE21 GLN A 138 0.737 6.945 0.375 1.00 0.00 H new ATOM 0 HE22 GLN A 138 1.039 6.080 -1.136 1.00 0.00 H new ATOM 1889 N ILE A 139 -0.396 1.883 1.165 1.00 0.00 N ATOM 1890 CA ILE A 139 0.478 0.752 1.415 1.00 0.00 C ATOM 1891 C ILE A 139 1.676 0.848 0.495 1.00 0.00 C ATOM 1892 O ILE A 139 1.515 1.109 -0.688 1.00 0.00 O ATOM 1893 CB ILE A 139 -0.224 -0.630 1.259 1.00 0.00 C ATOM 1894 CG1 ILE A 139 0.166 -1.386 -0.018 1.00 0.00 C ATOM 1895 CG2 ILE A 139 -1.734 -0.494 1.330 1.00 0.00 C ATOM 1896 CD1 ILE A 139 -0.591 -0.947 -1.242 1.00 0.00 C ATOM 0 H ILE A 139 -0.531 2.105 0.179 1.00 0.00 H new ATOM 0 HA ILE A 139 0.788 0.804 2.459 1.00 0.00 H new ATOM 0 HB ILE A 139 0.132 -1.224 2.100 1.00 0.00 H new ATOM 0 HG12 ILE A 139 1.233 -1.253 -0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -0.001 -2.452 0.137 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -2.193 -1.476 1.218 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -2.016 -0.069 2.293 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -2.078 0.161 0.530 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -0.259 -1.528 -2.103 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -1.658 -1.106 -1.086 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -0.405 0.111 -1.425 1.00 0.00 H new ATOM 1907 N GLY A 140 2.873 0.695 1.039 1.00 0.00 N ATOM 1908 CA GLY A 140 4.057 0.731 0.185 1.00 0.00 C ATOM 1909 C GLY A 140 4.381 2.138 -0.275 1.00 0.00 C ATOM 1910 O GLY A 140 5.316 2.748 0.221 1.00 0.00 O ATOM 0 H GLY A 140 3.052 0.549 2.033 1.00 0.00 H new ATOM 0 HA2 GLY A 140 4.909 0.322 0.728 1.00 0.00 H new ATOM 0 HA3 GLY A 140 3.897 0.093 -0.684 1.00 0.00 H new ATOM 1914 N LYS A 141 3.622 2.634 -1.240 1.00 0.00 N ATOM 1915 CA LYS A 141 3.695 4.027 -1.649 1.00 0.00 C ATOM 1916 C LYS A 141 2.574 4.371 -2.640 1.00 0.00 C ATOM 1917 O LYS A 141 2.692 5.291 -3.445 1.00 0.00 O ATOM 1918 CB LYS A 141 5.074 4.341 -2.241 1.00 0.00 C ATOM 1919 CG LYS A 141 5.573 3.346 -3.270 1.00 0.00 C ATOM 1920 CD LYS A 141 6.784 3.878 -4.017 1.00 0.00 C ATOM 1921 CE LYS A 141 7.699 2.747 -4.433 1.00 0.00 C ATOM 1922 NZ LYS A 141 8.398 3.017 -5.715 1.00 0.00 N ATOM 0 H LYS A 141 2.939 2.083 -1.760 1.00 0.00 H new ATOM 0 HA LYS A 141 3.555 4.650 -0.766 1.00 0.00 H new ATOM 0 HB2 LYS A 141 5.039 5.329 -2.701 1.00 0.00 H new ATOM 0 HB3 LYS A 141 5.798 4.393 -1.428 1.00 0.00 H new ATOM 0 HG2 LYS A 141 5.831 2.409 -2.776 1.00 0.00 H new ATOM 0 HG3 LYS A 141 4.776 3.123 -3.979 1.00 0.00 H new ATOM 0 HD2 LYS A 141 6.459 4.431 -4.898 1.00 0.00 H new ATOM 0 HD3 LYS A 141 7.329 4.578 -3.384 1.00 0.00 H new ATOM 0 HE2 LYS A 141 8.438 2.576 -3.650 1.00 0.00 H new ATOM 0 HE3 LYS A 141 7.117 1.830 -4.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 9.011 2.211 -5.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 7.697 3.153 -6.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 8.977 3.876 -5.621 1.00 0.00 H new ATOM 1932 N PHE A 142 1.461 3.651 -2.522 1.00 0.00 N ATOM 1933 CA PHE A 142 0.360 3.720 -3.477 1.00 0.00 C ATOM 1934 C PHE A 142 -0.869 4.305 -2.797 1.00 0.00 C ATOM 1935 O PHE A 142 -1.114 4.035 -1.621 1.00 0.00 O ATOM 1936 CB PHE A 142 -0.008 2.316 -4.011 1.00 0.00 C ATOM 1937 CG PHE A 142 1.172 1.444 -4.323 1.00 0.00 C ATOM 1938 CD1 PHE A 142 2.139 1.198 -3.364 1.00 0.00 C ATOM 1939 CD2 PHE A 142 1.316 0.879 -5.574 1.00 0.00 C ATOM 1940 CE1 PHE A 142 3.227 0.416 -3.646 1.00 0.00 C ATOM 1941 CE2 PHE A 142 2.408 0.091 -5.862 1.00 0.00 C ATOM 1942 CZ PHE A 142 3.363 -0.140 -4.898 1.00 0.00 C ATOM 0 H PHE A 142 1.297 2.999 -1.755 1.00 0.00 H new ATOM 0 HA PHE A 142 0.680 4.348 -4.309 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -0.632 1.812 -3.273 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -0.609 2.430 -4.913 1.00 0.00 H new ATOM 0 HD1 PHE A 142 2.034 1.629 -2.379 1.00 0.00 H new ATOM 0 HD2 PHE A 142 0.567 1.056 -6.332 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.976 0.236 -2.889 1.00 0.00 H new ATOM 0 HE2 PHE A 142 2.515 -0.346 -6.844 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.220 -0.758 -5.124 1.00 0.00 H new ATOM 1951 N ARG A 143 -1.637 5.098 -3.526 1.00 0.00 N ATOM 1952 CA ARG A 143 -2.892 5.604 -3.001 1.00 0.00 C ATOM 1953 C ARG A 143 -4.010 4.630 -3.368 1.00 0.00 C ATOM 1954 O ARG A 143 -4.477 4.615 -4.507 1.00 0.00 O ATOM 1955 CB ARG A 143 -3.205 6.997 -3.565 1.00 0.00 C ATOM 1956 CG ARG A 143 -4.258 7.738 -2.758 1.00 0.00 C ATOM 1957 CD ARG A 143 -5.088 8.686 -3.609 1.00 0.00 C ATOM 1958 NE ARG A 143 -4.333 9.828 -4.140 1.00 0.00 N ATOM 1959 CZ ARG A 143 -4.919 10.966 -4.517 1.00 0.00 C ATOM 1960 NH1 ARG A 143 -6.202 11.174 -4.240 1.00 0.00 N ATOM 1961 NH2 ARG A 143 -4.217 11.913 -5.124 1.00 0.00 N ATOM 0 H ARG A 143 -1.416 5.402 -4.474 1.00 0.00 H new ATOM 0 HA ARG A 143 -2.812 5.692 -1.917 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -2.290 7.588 -3.588 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -3.547 6.898 -4.595 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -4.917 7.015 -2.278 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -3.770 8.302 -1.963 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -5.518 8.129 -4.442 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -5.920 9.060 -3.012 1.00 0.00 H new ATOM 0 HE ARG A 143 -3.320 9.748 -4.224 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -6.737 10.464 -3.740 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -6.651 12.043 -4.527 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -3.223 11.774 -5.305 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -4.671 12.781 -5.410 1.00 0.00 H new ATOM 1972 N LEU A 144 -4.411 3.802 -2.418 1.00 0.00 N ATOM 1973 CA LEU A 144 -5.424 2.783 -2.667 1.00 0.00 C ATOM 1974 C LEU A 144 -6.772 3.306 -2.295 1.00 0.00 C ATOM 1975 O LEU A 144 -6.862 4.229 -1.528 1.00 0.00 O ATOM 1976 CB LEU A 144 -5.190 1.527 -1.832 1.00 0.00 C ATOM 1977 CG LEU A 144 -3.940 0.733 -2.147 1.00 0.00 C ATOM 1978 CD1 LEU A 144 -2.699 1.440 -1.644 1.00 0.00 C ATOM 1979 CD2 LEU A 144 -4.060 -0.652 -1.551 1.00 0.00 C ATOM 0 H LEU A 144 -4.051 3.814 -1.464 1.00 0.00 H new ATOM 0 HA LEU A 144 -5.364 2.535 -3.727 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -5.155 1.816 -0.782 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -6.052 0.870 -1.953 1.00 0.00 H new ATOM 0 HG LEU A 144 -3.841 0.645 -3.229 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -1.818 0.845 -1.885 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -2.619 2.417 -2.120 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -2.766 1.568 -0.564 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -3.161 -1.225 -1.777 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -4.178 -0.574 -0.470 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -4.928 -1.157 -1.975 1.00 0.00 H new ATOM 1990 N VAL A 145 -7.808 2.718 -2.841 1.00 0.00 N ATOM 1991 CA VAL A 145 -9.160 2.987 -2.398 1.00 0.00 C ATOM 1992 C VAL A 145 -9.954 1.691 -2.421 1.00 0.00 C ATOM 1993 O VAL A 145 -9.759 0.859 -3.302 1.00 0.00 O ATOM 1994 CB VAL A 145 -9.852 4.076 -3.261 1.00 0.00 C ATOM 1995 CG1 VAL A 145 -9.041 4.377 -4.508 1.00 0.00 C ATOM 1996 CG2 VAL A 145 -11.270 3.666 -3.628 1.00 0.00 C ATOM 0 H VAL A 145 -7.742 2.042 -3.602 1.00 0.00 H new ATOM 0 HA VAL A 145 -9.120 3.378 -1.381 1.00 0.00 H new ATOM 0 HB VAL A 145 -9.908 4.986 -2.664 1.00 0.00 H new ATOM 0 HG11 VAL A 145 -9.547 5.143 -5.095 1.00 0.00 H new ATOM 0 HG12 VAL A 145 -8.052 4.734 -4.221 1.00 0.00 H new ATOM 0 HG13 VAL A 145 -8.940 3.470 -5.104 1.00 0.00 H new ATOM 0 HG21 VAL A 145 -11.730 4.448 -4.232 1.00 0.00 H new ATOM 0 HG22 VAL A 145 -11.244 2.736 -4.196 1.00 0.00 H new ATOM 0 HG23 VAL A 145 -11.853 3.520 -2.719 1.00 0.00 H new ATOM 2006 N PHE A 146 -10.834 1.505 -1.460 1.00 0.00 N ATOM 2007 CA PHE A 146 -11.624 0.283 -1.415 1.00 0.00 C ATOM 2008 C PHE A 146 -13.066 0.544 -1.813 1.00 0.00 C ATOM 2009 O PHE A 146 -13.601 1.634 -1.585 1.00 0.00 O ATOM 2010 CB PHE A 146 -11.547 -0.406 -0.044 1.00 0.00 C ATOM 2011 CG PHE A 146 -11.464 0.516 1.142 1.00 0.00 C ATOM 2012 CD1 PHE A 146 -12.390 1.522 1.335 1.00 0.00 C ATOM 2013 CD2 PHE A 146 -10.457 0.352 2.078 1.00 0.00 C ATOM 2014 CE1 PHE A 146 -12.316 2.348 2.437 1.00 0.00 C ATOM 2015 CE2 PHE A 146 -10.376 1.178 3.183 1.00 0.00 C ATOM 2016 CZ PHE A 146 -11.307 2.177 3.364 1.00 0.00 C ATOM 0 H PHE A 146 -11.022 2.169 -0.709 1.00 0.00 H new ATOM 0 HA PHE A 146 -11.190 -0.401 -2.144 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -12.425 -1.042 0.073 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -10.676 -1.061 -0.035 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -13.182 1.664 0.614 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -9.726 -0.431 1.943 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -13.048 3.130 2.575 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -9.584 1.040 3.904 1.00 0.00 H new ATOM 0 HZ PHE A 146 -11.248 2.824 4.227 1.00 0.00 H new ATOM 2025 N LEU A 147 -13.675 -0.451 -2.448 1.00 0.00 N ATOM 2026 CA LEU A 147 -15.055 -0.356 -2.900 1.00 0.00 C ATOM 2027 C LEU A 147 -15.843 -1.588 -2.474 1.00 0.00 C ATOM 2028 O LEU A 147 -15.289 -2.682 -2.336 1.00 0.00 O ATOM 2029 CB LEU A 147 -15.145 -0.226 -4.434 1.00 0.00 C ATOM 2030 CG LEU A 147 -14.724 1.117 -5.043 1.00 0.00 C ATOM 2031 CD1 LEU A 147 -15.352 2.278 -4.289 1.00 0.00 C ATOM 2032 CD2 LEU A 147 -13.211 1.249 -5.087 1.00 0.00 C ATOM 0 H LEU A 147 -13.227 -1.342 -2.662 1.00 0.00 H new ATOM 0 HA LEU A 147 -15.477 0.539 -2.442 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -14.528 -1.008 -4.877 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -16.175 -0.425 -4.731 1.00 0.00 H new ATOM 0 HG LEU A 147 -15.090 1.147 -6.069 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -15.037 3.218 -4.741 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -16.438 2.198 -4.337 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -15.032 2.251 -3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -12.942 2.211 -5.524 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -12.811 1.185 -4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -12.793 0.446 -5.694 1.00 0.00 H new