USER MOD reduce.3.24.130724 H: found=0, std=0, add=609, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 610 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 704 TYR OH : rot 130:sc= -0.779 USER MOD Set 1.2: A 721 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 688 SER OG : rot 180:sc= 0 USER MOD Single : A 699 LYS NZ :NH3+ 170:sc= -0.0221 (180deg=-0.208) USER MOD Single : A 709 SER OG : rot 180:sc= -0.225 USER MOD Single : A 711 ASN : amide:sc= -0.19 K(o=-0.19,f=-1.2) USER MOD Single : A 714 SER OG : rot 180:sc= 0 USER MOD Single : A 715 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 718 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 723 ASN : amide:sc= -2.9 X(o=-2.9,f=-3.1!) USER MOD Single : A 728 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 735 MET CE :methyl 161:sc= -4.75! (180deg=-5.3!) USER MOD Single : A 736 LYS NZ :NH3+ 146:sc= -6.67! (180deg=-7.07!) USER MOD Single : A 738 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 741 SER OG : rot 180:sc= 0 USER MOD Single : A 742 SER OG : rot 180:sc= 0 USER MOD Single : A 745 THR OG1 : rot 180:sc= 0 USER MOD Single : A 747 SER OG : rot 174:sc= -1.6! USER MOD Single : A 748 GLN : amide:sc= -0.242 K(o=-0.24,f=-1.8) USER MOD Single : A 749 THR OG1 : rot 180:sc= 0 USER MOD Single : A 751 THR OG1 : rot 180:sc= 0 USER MOD Single : A 752 LYS NZ :NH3+ 168:sc= -0.0338 (180deg=-0.224) USER MOD Single : A 756 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 759 ASN : amide:sc=-0.00683 X(o=-0.0068,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 686 -6.515 3.647 -10.804 1.00 0.00 N ATOM 9 CA VAL A 686 -5.615 4.497 -11.573 1.00 0.00 C ATOM 10 C VAL A 686 -4.379 4.849 -10.755 1.00 0.00 C ATOM 11 O VAL A 686 -3.315 5.140 -11.303 1.00 0.00 O ATOM 12 CB VAL A 686 -6.311 5.795 -12.023 1.00 0.00 C ATOM 13 CG1 VAL A 686 -5.464 6.528 -13.052 1.00 0.00 C ATOM 14 CG2 VAL A 686 -7.696 5.494 -12.576 1.00 0.00 C ATOM 0 HA VAL A 686 -5.319 3.935 -12.459 1.00 0.00 H new ATOM 0 HB VAL A 686 -6.425 6.444 -11.155 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -5.973 7.442 -13.357 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -4.497 6.779 -12.615 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -5.314 5.888 -13.922 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -8.173 6.423 -12.889 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -7.608 4.825 -13.432 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -8.301 5.018 -11.804 1.00 0.00 H new ATOM 24 N GLU A 687 -4.536 4.817 -9.440 1.00 0.00 N ATOM 25 CA GLU A 687 -3.444 5.120 -8.523 1.00 0.00 C ATOM 26 C GLU A 687 -2.430 3.981 -8.515 1.00 0.00 C ATOM 27 O GLU A 687 -1.222 4.199 -8.623 1.00 0.00 O ATOM 28 CB GLU A 687 -3.986 5.350 -7.110 1.00 0.00 C ATOM 29 CG GLU A 687 -4.842 6.602 -6.976 1.00 0.00 C ATOM 30 CD GLU A 687 -6.097 6.554 -7.826 1.00 0.00 C ATOM 31 OE1 GLU A 687 -7.108 5.988 -7.360 1.00 0.00 O ATOM 32 OE2 GLU A 687 -6.070 7.084 -8.957 1.00 0.00 O ATOM 0 H GLU A 687 -5.416 4.582 -8.980 1.00 0.00 H new ATOM 0 HA GLU A 687 -2.948 6.030 -8.861 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -4.577 4.484 -6.812 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -3.148 5.418 -6.416 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -5.122 6.734 -5.931 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -4.250 7.472 -7.260 1.00 0.00 H new ATOM 39 N SER A 688 -2.932 2.762 -8.387 1.00 0.00 N ATOM 40 CA SER A 688 -2.078 1.585 -8.374 1.00 0.00 C ATOM 41 C SER A 688 -1.490 1.335 -9.756 1.00 0.00 C ATOM 42 O SER A 688 -0.432 0.727 -9.887 1.00 0.00 O ATOM 43 CB SER A 688 -2.863 0.359 -7.920 1.00 0.00 C ATOM 44 OG SER A 688 -3.478 0.580 -6.662 1.00 0.00 O ATOM 0 H SER A 688 -3.928 2.562 -8.291 1.00 0.00 H new ATOM 0 HA SER A 688 -1.265 1.765 -7.671 1.00 0.00 H new ATOM 0 HB2 SER A 688 -3.624 0.116 -8.662 1.00 0.00 H new ATOM 0 HB3 SER A 688 -2.195 -0.500 -7.855 1.00 0.00 H new ATOM 0 HG SER A 688 -3.976 -0.221 -6.396 1.00 0.00 H new ATOM 50 N ALA A 689 -2.193 1.803 -10.785 1.00 0.00 N ATOM 51 CA ALA A 689 -1.749 1.623 -12.162 1.00 0.00 C ATOM 52 C ALA A 689 -0.358 2.206 -12.385 1.00 0.00 C ATOM 53 O ALA A 689 0.554 1.491 -12.795 1.00 0.00 O ATOM 54 CB ALA A 689 -2.750 2.235 -13.130 1.00 0.00 C ATOM 0 H ALA A 689 -3.073 2.310 -10.689 1.00 0.00 H new ATOM 0 HA ALA A 689 -1.690 0.551 -12.353 1.00 0.00 H new ATOM 0 HB1 ALA A 689 -2.402 2.091 -14.153 1.00 0.00 H new ATOM 0 HB2 ALA A 689 -3.719 1.752 -13.005 1.00 0.00 H new ATOM 0 HB3 ALA A 689 -2.847 3.301 -12.927 1.00 0.00 H new ATOM 60 N VAL A 690 -0.195 3.504 -12.125 1.00 0.00 N ATOM 61 CA VAL A 690 1.107 4.145 -12.292 1.00 0.00 C ATOM 62 C VAL A 690 2.175 3.338 -11.572 1.00 0.00 C ATOM 63 O VAL A 690 3.259 3.093 -12.102 1.00 0.00 O ATOM 64 CB VAL A 690 1.126 5.584 -11.738 1.00 0.00 C ATOM 65 CG1 VAL A 690 0.302 6.516 -12.609 1.00 0.00 C ATOM 66 CG2 VAL A 690 0.634 5.620 -10.301 1.00 0.00 C ATOM 0 H VAL A 690 -0.938 4.124 -11.802 1.00 0.00 H new ATOM 0 HA VAL A 690 1.306 4.186 -13.363 1.00 0.00 H new ATOM 0 HB VAL A 690 2.159 5.932 -11.753 1.00 0.00 H new ATOM 0 HG11 VAL A 690 0.333 7.524 -12.195 1.00 0.00 H new ATOM 0 HG12 VAL A 690 0.711 6.526 -13.619 1.00 0.00 H new ATOM 0 HG13 VAL A 690 -0.730 6.168 -12.639 1.00 0.00 H new ATOM 0 HG21 VAL A 690 0.657 6.646 -9.934 1.00 0.00 H new ATOM 0 HG22 VAL A 690 -0.387 5.242 -10.257 1.00 0.00 H new ATOM 0 HG23 VAL A 690 1.279 4.998 -9.680 1.00 0.00 H new ATOM 76 N LEU A 691 1.845 2.932 -10.356 1.00 0.00 N ATOM 77 CA LEU A 691 2.745 2.144 -9.528 1.00 0.00 C ATOM 78 C LEU A 691 3.088 0.807 -10.182 1.00 0.00 C ATOM 79 O LEU A 691 4.236 0.364 -10.146 1.00 0.00 O ATOM 80 CB LEU A 691 2.106 1.897 -8.169 1.00 0.00 C ATOM 81 CG LEU A 691 1.644 3.147 -7.426 1.00 0.00 C ATOM 82 CD1 LEU A 691 0.920 2.772 -6.142 1.00 0.00 C ATOM 83 CD2 LEU A 691 2.825 4.054 -7.128 1.00 0.00 C ATOM 0 H LEU A 691 0.948 3.139 -9.916 1.00 0.00 H new ATOM 0 HA LEU A 691 3.670 2.708 -9.409 1.00 0.00 H new ATOM 0 HB2 LEU A 691 1.249 1.238 -8.304 1.00 0.00 H new ATOM 0 HB3 LEU A 691 2.821 1.365 -7.541 1.00 0.00 H new ATOM 0 HG LEU A 691 0.946 3.688 -8.065 1.00 0.00 H new ATOM 0 HD11 LEU A 691 0.599 3.678 -5.628 1.00 0.00 H new ATOM 0 HD12 LEU A 691 0.049 2.162 -6.380 1.00 0.00 H new ATOM 0 HD13 LEU A 691 1.593 2.207 -5.497 1.00 0.00 H new ATOM 0 HD21 LEU A 691 2.478 4.941 -6.598 1.00 0.00 H new ATOM 0 HD22 LEU A 691 3.547 3.520 -6.509 1.00 0.00 H new ATOM 0 HD23 LEU A 691 3.299 4.353 -8.063 1.00 0.00 H new ATOM 95 N ARG A 692 2.079 0.169 -10.770 1.00 0.00 N ATOM 96 CA ARG A 692 2.253 -1.123 -11.427 1.00 0.00 C ATOM 97 C ARG A 692 2.670 -2.206 -10.433 1.00 0.00 C ATOM 98 O ARG A 692 3.715 -2.838 -10.597 1.00 0.00 O ATOM 99 CB ARG A 692 3.292 -1.025 -12.548 1.00 0.00 C ATOM 100 CG ARG A 692 2.919 -0.042 -13.642 1.00 0.00 C ATOM 101 CD ARG A 692 3.970 -0.010 -14.739 1.00 0.00 C ATOM 102 NE ARG A 692 3.637 0.948 -15.791 1.00 0.00 N ATOM 103 CZ ARG A 692 4.449 1.243 -16.802 1.00 0.00 C ATOM 104 NH1 ARG A 692 5.637 0.659 -16.899 1.00 0.00 N ATOM 105 NH2 ARG A 692 4.072 2.124 -17.718 1.00 0.00 N ATOM 0 H ARG A 692 1.125 0.530 -10.804 1.00 0.00 H new ATOM 0 HA ARG A 692 1.289 -1.401 -11.854 1.00 0.00 H new ATOM 0 HB2 ARG A 692 4.250 -0.731 -12.119 1.00 0.00 H new ATOM 0 HB3 ARG A 692 3.430 -2.012 -12.990 1.00 0.00 H new ATOM 0 HG2 ARG A 692 1.954 -0.318 -14.068 1.00 0.00 H new ATOM 0 HG3 ARG A 692 2.806 0.954 -13.215 1.00 0.00 H new ATOM 0 HD2 ARG A 692 4.937 0.248 -14.307 1.00 0.00 H new ATOM 0 HD3 ARG A 692 4.070 -1.005 -15.173 1.00 0.00 H new ATOM 0 HE ARG A 692 2.732 1.416 -15.747 1.00 0.00 H new ATOM 0 HH11 ARG A 692 5.931 -0.019 -16.196 1.00 0.00 H new ATOM 0 HH12 ARG A 692 6.256 0.889 -17.676 1.00 0.00 H new ATOM 0 HH21 ARG A 692 3.160 2.575 -17.647 1.00 0.00 H new ATOM 0 HH22 ARG A 692 4.694 2.351 -18.494 1.00 0.00 H new ATOM 119 N GLY A 693 1.855 -2.419 -9.400 1.00 0.00 N ATOM 120 CA GLY A 693 2.174 -3.442 -8.420 1.00 0.00 C ATOM 121 C GLY A 693 1.657 -3.139 -7.024 1.00 0.00 C ATOM 122 O GLY A 693 2.217 -3.624 -6.039 1.00 0.00 O ATOM 0 H GLY A 693 0.990 -1.907 -9.227 1.00 0.00 H new ATOM 0 HA2 GLY A 693 1.757 -4.393 -8.753 1.00 0.00 H new ATOM 0 HA3 GLY A 693 3.256 -3.566 -8.377 1.00 0.00 H new ATOM 126 N PHE A 694 0.596 -2.343 -6.924 1.00 0.00 N ATOM 127 CA PHE A 694 0.027 -2.011 -5.622 1.00 0.00 C ATOM 128 C PHE A 694 -1.491 -2.075 -5.647 1.00 0.00 C ATOM 129 O PHE A 694 -2.106 -2.211 -6.702 1.00 0.00 O ATOM 130 CB PHE A 694 0.463 -0.617 -5.177 1.00 0.00 C ATOM 131 CG PHE A 694 1.923 -0.516 -4.863 1.00 0.00 C ATOM 132 CD1 PHE A 694 2.833 -0.263 -5.867 1.00 0.00 C ATOM 133 CD2 PHE A 694 2.384 -0.673 -3.569 1.00 0.00 C ATOM 134 CE1 PHE A 694 4.179 -0.164 -5.596 1.00 0.00 C ATOM 135 CE2 PHE A 694 3.733 -0.578 -3.288 1.00 0.00 C ATOM 136 CZ PHE A 694 4.630 -0.326 -4.304 1.00 0.00 C ATOM 0 H PHE A 694 0.118 -1.920 -7.719 1.00 0.00 H new ATOM 0 HA PHE A 694 0.399 -2.750 -4.913 1.00 0.00 H new ATOM 0 HB2 PHE A 694 0.219 0.099 -5.962 1.00 0.00 H new ATOM 0 HB3 PHE A 694 -0.110 -0.331 -4.295 1.00 0.00 H new ATOM 0 HD1 PHE A 694 2.485 -0.141 -6.882 1.00 0.00 H new ATOM 0 HD2 PHE A 694 1.684 -0.872 -2.771 1.00 0.00 H new ATOM 0 HE1 PHE A 694 4.879 0.040 -6.393 1.00 0.00 H new ATOM 0 HE2 PHE A 694 4.084 -0.701 -2.274 1.00 0.00 H new ATOM 0 HZ PHE A 694 5.686 -0.256 -4.087 1.00 0.00 H new ATOM 146 N LEU A 695 -2.081 -1.978 -4.466 1.00 0.00 N ATOM 147 CA LEU A 695 -3.527 -2.010 -4.315 1.00 0.00 C ATOM 148 C LEU A 695 -4.011 -0.724 -3.656 1.00 0.00 C ATOM 149 O LEU A 695 -3.335 -0.180 -2.784 1.00 0.00 O ATOM 150 CB LEU A 695 -3.934 -3.216 -3.467 1.00 0.00 C ATOM 151 CG LEU A 695 -5.008 -4.117 -4.076 1.00 0.00 C ATOM 152 CD1 LEU A 695 -5.419 -5.198 -3.090 1.00 0.00 C ATOM 153 CD2 LEU A 695 -6.212 -3.294 -4.502 1.00 0.00 C ATOM 0 H LEU A 695 -1.573 -1.875 -3.588 1.00 0.00 H new ATOM 0 HA LEU A 695 -3.985 -2.096 -5.300 1.00 0.00 H new ATOM 0 HB2 LEU A 695 -3.046 -3.818 -3.274 1.00 0.00 H new ATOM 0 HB3 LEU A 695 -4.291 -2.856 -2.502 1.00 0.00 H new ATOM 0 HG LEU A 695 -4.593 -4.601 -4.960 1.00 0.00 H new ATOM 0 HD11 LEU A 695 -6.184 -5.830 -3.541 1.00 0.00 H new ATOM 0 HD12 LEU A 695 -4.551 -5.806 -2.834 1.00 0.00 H new ATOM 0 HD13 LEU A 695 -5.817 -4.735 -2.187 1.00 0.00 H new ATOM 0 HD21 LEU A 695 -6.967 -3.951 -4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 695 -6.629 -2.783 -3.634 1.00 0.00 H new ATOM 0 HD23 LEU A 695 -5.905 -2.557 -5.244 1.00 0.00 H new ATOM 165 N ILE A 696 -5.181 -0.237 -4.062 1.00 0.00 N ATOM 166 CA ILE A 696 -5.711 0.994 -3.489 1.00 0.00 C ATOM 167 C ILE A 696 -6.263 0.757 -2.091 1.00 0.00 C ATOM 168 O ILE A 696 -7.345 0.193 -1.926 1.00 0.00 O ATOM 169 CB ILE A 696 -6.815 1.624 -4.368 1.00 0.00 C ATOM 170 CG1 ILE A 696 -6.215 2.140 -5.680 1.00 0.00 C ATOM 171 CG2 ILE A 696 -7.519 2.753 -3.616 1.00 0.00 C ATOM 172 CD1 ILE A 696 -7.132 3.070 -6.449 1.00 0.00 C ATOM 0 H ILE A 696 -5.771 -0.668 -4.774 1.00 0.00 H new ATOM 0 HA ILE A 696 -4.873 1.690 -3.438 1.00 0.00 H new ATOM 0 HB ILE A 696 -7.555 0.858 -4.602 1.00 0.00 H new ATOM 0 HG12 ILE A 696 -5.283 2.662 -5.462 1.00 0.00 H new ATOM 0 HG13 ILE A 696 -5.963 1.289 -6.313 1.00 0.00 H new ATOM 0 HG21 ILE A 696 -8.293 3.185 -4.250 1.00 0.00 H new ATOM 0 HG22 ILE A 696 -7.973 2.357 -2.707 1.00 0.00 H new ATOM 0 HG23 ILE A 696 -6.794 3.523 -3.353 1.00 0.00 H new ATOM 0 HD11 ILE A 696 -6.638 3.393 -7.365 1.00 0.00 H new ATOM 0 HD12 ILE A 696 -8.054 2.546 -6.700 1.00 0.00 H new ATOM 0 HD13 ILE A 696 -7.365 3.941 -5.836 1.00 0.00 H new ATOM 184 N LEU A 697 -5.511 1.191 -1.087 1.00 0.00 N ATOM 185 CA LEU A 697 -5.935 1.047 0.295 1.00 0.00 C ATOM 186 C LEU A 697 -6.865 2.200 0.654 1.00 0.00 C ATOM 187 O LEU A 697 -8.057 2.153 0.359 1.00 0.00 O ATOM 188 CB LEU A 697 -4.713 0.994 1.223 1.00 0.00 C ATOM 189 CG LEU A 697 -4.921 0.321 2.587 1.00 0.00 C ATOM 190 CD1 LEU A 697 -5.744 1.207 3.499 1.00 0.00 C ATOM 191 CD2 LEU A 697 -5.579 -1.043 2.428 1.00 0.00 C ATOM 0 H LEU A 697 -4.605 1.645 -1.207 1.00 0.00 H new ATOM 0 HA LEU A 697 -6.479 0.111 0.422 1.00 0.00 H new ATOM 0 HB2 LEU A 697 -3.911 0.471 0.702 1.00 0.00 H new ATOM 0 HB3 LEU A 697 -4.369 2.014 1.394 1.00 0.00 H new ATOM 0 HG LEU A 697 -3.942 0.172 3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 697 -5.880 0.712 4.461 1.00 0.00 H new ATOM 0 HD12 LEU A 697 -5.227 2.155 3.649 1.00 0.00 H new ATOM 0 HD13 LEU A 697 -6.717 1.392 3.045 1.00 0.00 H new ATOM 0 HD21 LEU A 697 -5.715 -1.498 3.409 1.00 0.00 H new ATOM 0 HD22 LEU A 697 -6.549 -0.925 1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 697 -4.945 -1.684 1.816 1.00 0.00 H new ATOM 203 N GLY A 698 -6.320 3.242 1.267 1.00 0.00 N ATOM 204 CA GLY A 698 -7.140 4.389 1.619 1.00 0.00 C ATOM 205 C GLY A 698 -6.374 5.467 2.362 1.00 0.00 C ATOM 206 O GLY A 698 -5.151 5.422 2.442 1.00 0.00 O ATOM 0 H GLY A 698 -5.336 3.316 1.525 1.00 0.00 H new ATOM 0 HA2 GLY A 698 -7.565 4.816 0.711 1.00 0.00 H new ATOM 0 HA3 GLY A 698 -7.975 4.055 2.236 1.00 0.00 H new ATOM 210 N LYS A 699 -7.104 6.443 2.897 1.00 0.00 N ATOM 211 CA LYS A 699 -6.496 7.544 3.643 1.00 0.00 C ATOM 212 C LYS A 699 -6.684 7.343 5.141 1.00 0.00 C ATOM 213 O LYS A 699 -7.362 8.120 5.813 1.00 0.00 O ATOM 214 CB LYS A 699 -7.094 8.883 3.207 1.00 0.00 C ATOM 215 CG LYS A 699 -8.612 8.879 3.141 1.00 0.00 C ATOM 216 CD LYS A 699 -9.153 10.205 2.632 1.00 0.00 C ATOM 217 CE LYS A 699 -10.661 10.155 2.449 1.00 0.00 C ATOM 218 NZ LYS A 699 -11.362 9.792 3.712 1.00 0.00 N ATOM 0 H LYS A 699 -8.120 6.494 2.828 1.00 0.00 H new ATOM 0 HA LYS A 699 -5.428 7.555 3.427 1.00 0.00 H new ATOM 0 HB2 LYS A 699 -6.771 9.659 3.901 1.00 0.00 H new ATOM 0 HB3 LYS A 699 -6.697 9.147 2.227 1.00 0.00 H new ATOM 0 HG2 LYS A 699 -8.946 8.074 2.487 1.00 0.00 H new ATOM 0 HG3 LYS A 699 -9.019 8.675 4.131 1.00 0.00 H new ATOM 0 HD2 LYS A 699 -8.896 10.998 3.334 1.00 0.00 H new ATOM 0 HD3 LYS A 699 -8.678 10.453 1.683 1.00 0.00 H new ATOM 0 HE2 LYS A 699 -11.017 11.125 2.102 1.00 0.00 H new ATOM 0 HE3 LYS A 699 -10.909 9.429 1.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 -12.386 9.932 3.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 -11.173 8.795 3.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 -11.017 10.395 4.486 1.00 0.00 H new ATOM 232 N GLU A 700 -6.072 6.284 5.647 1.00 0.00 N ATOM 233 CA GLU A 700 -6.151 5.933 7.057 1.00 0.00 C ATOM 234 C GLU A 700 -4.935 5.121 7.447 1.00 0.00 C ATOM 235 O GLU A 700 -3.948 5.107 6.731 1.00 0.00 O ATOM 236 CB GLU A 700 -7.419 5.141 7.355 1.00 0.00 C ATOM 237 CG GLU A 700 -7.559 3.887 6.508 1.00 0.00 C ATOM 238 CD GLU A 700 -8.768 3.055 6.889 1.00 0.00 C ATOM 239 OE1 GLU A 700 -8.630 2.173 7.762 1.00 0.00 O ATOM 240 OE2 GLU A 700 -9.851 3.283 6.312 1.00 0.00 O ATOM 0 H GLU A 700 -5.506 5.643 5.091 1.00 0.00 H new ATOM 0 HA GLU A 700 -6.180 6.854 7.640 1.00 0.00 H new ATOM 0 HB2 GLU A 700 -7.425 4.862 8.409 1.00 0.00 H new ATOM 0 HB3 GLU A 700 -8.286 5.781 7.190 1.00 0.00 H new ATOM 0 HG2 GLU A 700 -7.634 4.169 5.458 1.00 0.00 H new ATOM 0 HG3 GLU A 700 -6.659 3.281 6.612 1.00 0.00 H new ATOM 247 N ASP A 701 -4.975 4.505 8.615 1.00 0.00 N ATOM 248 CA ASP A 701 -3.855 3.678 9.047 1.00 0.00 C ATOM 249 C ASP A 701 -2.571 4.498 9.024 1.00 0.00 C ATOM 250 O ASP A 701 -1.474 3.970 8.844 1.00 0.00 O ATOM 251 CB ASP A 701 -3.748 2.459 8.119 1.00 0.00 C ATOM 252 CG ASP A 701 -2.846 1.370 8.668 1.00 0.00 C ATOM 253 OD1 ASP A 701 -2.044 1.660 9.579 1.00 0.00 O ATOM 254 OD2 ASP A 701 -2.946 0.222 8.188 1.00 0.00 O ATOM 0 H ASP A 701 -5.753 4.557 9.272 1.00 0.00 H new ATOM 0 HA ASP A 701 -4.016 3.331 10.068 1.00 0.00 H new ATOM 0 HB2 ASP A 701 -4.744 2.048 7.953 1.00 0.00 H new ATOM 0 HB3 ASP A 701 -3.370 2.781 7.149 1.00 0.00 H new ATOM 259 N ARG A 702 -2.731 5.803 9.212 1.00 0.00 N ATOM 260 CA ARG A 702 -1.611 6.734 9.215 1.00 0.00 C ATOM 261 C ARG A 702 -0.592 6.387 10.296 1.00 0.00 C ATOM 262 O ARG A 702 0.479 6.992 10.360 1.00 0.00 O ATOM 263 CB ARG A 702 -2.115 8.159 9.405 1.00 0.00 C ATOM 264 CG ARG A 702 -3.216 8.274 10.439 1.00 0.00 C ATOM 265 CD ARG A 702 -4.593 8.340 9.791 1.00 0.00 C ATOM 266 NE ARG A 702 -4.756 9.542 8.976 1.00 0.00 N ATOM 267 CZ ARG A 702 -5.934 9.995 8.556 1.00 0.00 C ATOM 268 NH1 ARG A 702 -7.048 9.347 8.868 1.00 0.00 N ATOM 269 NH2 ARG A 702 -5.997 11.097 7.821 1.00 0.00 N ATOM 0 H ARG A 702 -3.638 6.243 9.366 1.00 0.00 H new ATOM 0 HA ARG A 702 -1.110 6.654 8.250 1.00 0.00 H new ATOM 0 HB2 ARG A 702 -1.281 8.795 9.701 1.00 0.00 H new ATOM 0 HB3 ARG A 702 -2.482 8.537 8.451 1.00 0.00 H new ATOM 0 HG2 ARG A 702 -3.172 7.419 11.114 1.00 0.00 H new ATOM 0 HG3 ARG A 702 -3.055 9.166 11.044 1.00 0.00 H new ATOM 0 HD2 ARG A 702 -4.744 7.457 9.170 1.00 0.00 H new ATOM 0 HD3 ARG A 702 -5.360 8.320 10.565 1.00 0.00 H new ATOM 0 HE ARG A 702 -3.919 10.063 8.714 1.00 0.00 H new ATOM 0 HH11 ARG A 702 -7.003 8.498 9.432 1.00 0.00 H new ATOM 0 HH12 ARG A 702 -7.950 9.697 8.544 1.00 0.00 H new ATOM 0 HH21 ARG A 702 -5.142 11.597 7.578 1.00 0.00 H new ATOM 0 HH22 ARG A 702 -6.900 11.444 7.499 1.00 0.00 H new ATOM 283 N ARG A 703 -0.929 5.422 11.150 1.00 0.00 N ATOM 284 CA ARG A 703 -0.022 4.999 12.211 1.00 0.00 C ATOM 285 C ARG A 703 1.312 4.552 11.621 1.00 0.00 C ATOM 286 O ARG A 703 2.305 4.408 12.334 1.00 0.00 O ATOM 287 CB ARG A 703 -0.641 3.864 13.030 1.00 0.00 C ATOM 288 CG ARG A 703 -1.011 2.649 12.199 1.00 0.00 C ATOM 289 CD ARG A 703 -1.585 1.536 13.061 1.00 0.00 C ATOM 290 NE ARG A 703 -2.001 0.385 12.263 1.00 0.00 N ATOM 291 CZ ARG A 703 -2.329 -0.795 12.783 1.00 0.00 C ATOM 292 NH1 ARG A 703 -2.285 -0.979 14.096 1.00 0.00 N ATOM 293 NH2 ARG A 703 -2.701 -1.789 11.990 1.00 0.00 N ATOM 0 H ARG A 703 -1.818 4.922 11.127 1.00 0.00 H new ATOM 0 HA ARG A 703 0.151 5.849 12.872 1.00 0.00 H new ATOM 0 HB2 ARG A 703 0.061 3.562 13.807 1.00 0.00 H new ATOM 0 HB3 ARG A 703 -1.534 4.235 13.534 1.00 0.00 H new ATOM 0 HG2 ARG A 703 -1.739 2.935 11.440 1.00 0.00 H new ATOM 0 HG3 ARG A 703 -0.129 2.285 11.673 1.00 0.00 H new ATOM 0 HD2 ARG A 703 -0.839 1.221 13.790 1.00 0.00 H new ATOM 0 HD3 ARG A 703 -2.439 1.916 13.622 1.00 0.00 H new ATOM 0 HE ARG A 703 -2.042 0.492 11.249 1.00 0.00 H new ATOM 0 HH11 ARG A 703 -1.999 -0.215 14.709 1.00 0.00 H new ATOM 0 HH12 ARG A 703 -2.537 -1.884 14.493 1.00 0.00 H new ATOM 0 HH21 ARG A 703 -2.736 -1.650 10.980 1.00 0.00 H new ATOM 0 HH22 ARG A 703 -2.952 -2.693 12.389 1.00 0.00 H new ATOM 307 N TYR A 704 1.323 4.332 10.306 1.00 0.00 N ATOM 308 CA TYR A 704 2.532 3.921 9.607 1.00 0.00 C ATOM 309 C TYR A 704 3.523 5.079 9.562 1.00 0.00 C ATOM 310 O TYR A 704 4.733 4.887 9.684 1.00 0.00 O ATOM 311 CB TYR A 704 2.196 3.473 8.180 1.00 0.00 C ATOM 312 CG TYR A 704 1.656 2.062 8.081 1.00 0.00 C ATOM 313 CD1 TYR A 704 2.370 0.994 8.607 1.00 0.00 C ATOM 314 CD2 TYR A 704 0.444 1.794 7.447 1.00 0.00 C ATOM 315 CE1 TYR A 704 1.896 -0.298 8.510 1.00 0.00 C ATOM 316 CE2 TYR A 704 -0.032 0.505 7.344 1.00 0.00 C ATOM 317 CZ TYR A 704 0.695 -0.538 7.879 1.00 0.00 C ATOM 318 OH TYR A 704 0.224 -1.826 7.778 1.00 0.00 O ATOM 0 H TYR A 704 0.504 4.433 9.706 1.00 0.00 H new ATOM 0 HA TYR A 704 2.979 3.084 10.143 1.00 0.00 H new ATOM 0 HB2 TYR A 704 1.462 4.161 7.759 1.00 0.00 H new ATOM 0 HB3 TYR A 704 3.094 3.550 7.567 1.00 0.00 H new ATOM 0 HD1 TYR A 704 3.313 1.178 9.101 1.00 0.00 H new ATOM 0 HD2 TYR A 704 -0.130 2.608 7.030 1.00 0.00 H new ATOM 0 HE1 TYR A 704 2.463 -1.117 8.927 1.00 0.00 H new ATOM 0 HE2 TYR A 704 -0.971 0.312 6.846 1.00 0.00 H new ATOM 0 HH TYR A 704 -0.707 -1.859 8.083 1.00 0.00 H new ATOM 328 N GLY A 705 2.985 6.284 9.389 1.00 0.00 N ATOM 329 CA GLY A 705 3.798 7.485 9.333 1.00 0.00 C ATOM 330 C GLY A 705 4.986 7.389 8.386 1.00 0.00 C ATOM 331 O GLY A 705 6.109 7.702 8.780 1.00 0.00 O ATOM 0 H GLY A 705 1.984 6.449 9.285 1.00 0.00 H new ATOM 0 HA2 GLY A 705 3.170 8.322 9.027 1.00 0.00 H new ATOM 0 HA3 GLY A 705 4.163 7.710 10.335 1.00 0.00 H new ATOM 335 N PRO A 706 4.779 6.958 7.126 1.00 0.00 N ATOM 336 CA PRO A 706 5.847 6.856 6.145 1.00 0.00 C ATOM 337 C PRO A 706 5.961 8.119 5.302 1.00 0.00 C ATOM 338 O PRO A 706 6.940 8.859 5.410 1.00 0.00 O ATOM 339 CB PRO A 706 5.407 5.669 5.293 1.00 0.00 C ATOM 340 CG PRO A 706 3.910 5.631 5.396 1.00 0.00 C ATOM 341 CD PRO A 706 3.500 6.519 6.553 1.00 0.00 C ATOM 0 HA PRO A 706 6.830 6.730 6.598 1.00 0.00 H new ATOM 0 HB2 PRO A 706 5.726 5.790 4.258 1.00 0.00 H new ATOM 0 HB3 PRO A 706 5.849 4.741 5.656 1.00 0.00 H new ATOM 0 HG2 PRO A 706 3.455 5.978 4.469 1.00 0.00 H new ATOM 0 HG3 PRO A 706 3.565 4.610 5.558 1.00 0.00 H new ATOM 0 HD2 PRO A 706 2.901 7.365 6.216 1.00 0.00 H new ATOM 0 HD3 PRO A 706 2.900 5.975 7.283 1.00 0.00 H new ATOM 349 N ALA A 707 4.957 8.356 4.464 1.00 0.00 N ATOM 350 CA ALA A 707 4.930 9.539 3.615 1.00 0.00 C ATOM 351 C ALA A 707 6.172 9.627 2.733 1.00 0.00 C ATOM 352 O ALA A 707 6.683 10.716 2.472 1.00 0.00 O ATOM 353 CB ALA A 707 4.805 10.777 4.483 1.00 0.00 C ATOM 0 H ALA A 707 4.150 7.742 4.355 1.00 0.00 H new ATOM 0 HA ALA A 707 4.068 9.468 2.952 1.00 0.00 H new ATOM 0 HB1 ALA A 707 4.785 11.664 3.850 1.00 0.00 H new ATOM 0 HB2 ALA A 707 3.884 10.723 5.063 1.00 0.00 H new ATOM 0 HB3 ALA A 707 5.657 10.834 5.160 1.00 0.00 H new ATOM 359 N LEU A 708 6.650 8.476 2.271 1.00 0.00 N ATOM 360 CA LEU A 708 7.828 8.433 1.413 1.00 0.00 C ATOM 361 C LEU A 708 7.437 8.589 -0.053 1.00 0.00 C ATOM 362 O LEU A 708 6.303 8.950 -0.368 1.00 0.00 O ATOM 363 CB LEU A 708 8.609 7.130 1.619 1.00 0.00 C ATOM 364 CG LEU A 708 7.760 5.871 1.809 1.00 0.00 C ATOM 365 CD1 LEU A 708 6.779 5.698 0.661 1.00 0.00 C ATOM 366 CD2 LEU A 708 8.655 4.648 1.931 1.00 0.00 C ATOM 0 H LEU A 708 6.241 7.564 2.476 1.00 0.00 H new ATOM 0 HA LEU A 708 8.473 9.267 1.690 1.00 0.00 H new ATOM 0 HB2 LEU A 708 9.262 6.979 0.759 1.00 0.00 H new ATOM 0 HB3 LEU A 708 9.252 7.247 2.491 1.00 0.00 H new ATOM 0 HG LEU A 708 7.186 5.981 2.729 1.00 0.00 H new ATOM 0 HD11 LEU A 708 6.188 4.796 0.820 1.00 0.00 H new ATOM 0 HD12 LEU A 708 6.117 6.562 0.615 1.00 0.00 H new ATOM 0 HD13 LEU A 708 7.328 5.611 -0.277 1.00 0.00 H new ATOM 0 HD21 LEU A 708 8.039 3.759 2.066 1.00 0.00 H new ATOM 0 HD22 LEU A 708 9.252 4.542 1.025 1.00 0.00 H new ATOM 0 HD23 LEU A 708 9.316 4.765 2.790 1.00 0.00 H new ATOM 378 N SER A 709 8.382 8.311 -0.944 1.00 0.00 N ATOM 379 CA SER A 709 8.137 8.428 -2.375 1.00 0.00 C ATOM 380 C SER A 709 7.914 7.057 -3.010 1.00 0.00 C ATOM 381 O SER A 709 8.126 6.024 -2.376 1.00 0.00 O ATOM 382 CB SER A 709 9.310 9.135 -3.047 1.00 0.00 C ATOM 383 OG SER A 709 9.090 9.288 -4.438 1.00 0.00 O ATOM 0 H SER A 709 9.323 8.003 -0.700 1.00 0.00 H new ATOM 0 HA SER A 709 7.231 9.017 -2.519 1.00 0.00 H new ATOM 0 HB2 SER A 709 9.458 10.114 -2.590 1.00 0.00 H new ATOM 0 HB3 SER A 709 10.224 8.565 -2.882 1.00 0.00 H new ATOM 0 HG SER A 709 9.857 9.745 -4.842 1.00 0.00 H new ATOM 389 N ILE A 710 7.485 7.062 -4.268 1.00 0.00 N ATOM 390 CA ILE A 710 7.225 5.827 -5.001 1.00 0.00 C ATOM 391 C ILE A 710 8.503 5.034 -5.224 1.00 0.00 C ATOM 392 O ILE A 710 8.515 3.808 -5.113 1.00 0.00 O ATOM 393 CB ILE A 710 6.572 6.116 -6.369 1.00 0.00 C ATOM 394 CG1 ILE A 710 5.072 6.355 -6.211 1.00 0.00 C ATOM 395 CG2 ILE A 710 6.825 4.970 -7.340 1.00 0.00 C ATOM 396 CD1 ILE A 710 4.726 7.475 -5.256 1.00 0.00 C ATOM 0 H ILE A 710 7.309 7.912 -4.804 1.00 0.00 H new ATOM 0 HA ILE A 710 6.540 5.238 -4.391 1.00 0.00 H new ATOM 0 HB ILE A 710 7.026 7.020 -6.776 1.00 0.00 H new ATOM 0 HG12 ILE A 710 4.645 6.580 -7.188 1.00 0.00 H new ATOM 0 HG13 ILE A 710 4.603 5.435 -5.862 1.00 0.00 H new ATOM 0 HG21 ILE A 710 6.356 5.195 -8.298 1.00 0.00 H new ATOM 0 HG22 ILE A 710 7.898 4.844 -7.482 1.00 0.00 H new ATOM 0 HG23 ILE A 710 6.402 4.050 -6.936 1.00 0.00 H new ATOM 0 HD11 ILE A 710 3.643 7.582 -5.198 1.00 0.00 H new ATOM 0 HD12 ILE A 710 5.121 7.245 -4.267 1.00 0.00 H new ATOM 0 HD13 ILE A 710 5.164 8.407 -5.614 1.00 0.00 H new ATOM 408 N ASN A 711 9.574 5.739 -5.559 1.00 0.00 N ATOM 409 CA ASN A 711 10.856 5.101 -5.808 1.00 0.00 C ATOM 410 C ASN A 711 11.251 4.204 -4.637 1.00 0.00 C ATOM 411 O ASN A 711 12.083 3.308 -4.776 1.00 0.00 O ATOM 412 CB ASN A 711 11.931 6.159 -6.056 1.00 0.00 C ATOM 413 CG ASN A 711 13.307 5.557 -6.266 1.00 0.00 C ATOM 414 OD1 ASN A 711 13.439 4.443 -6.776 1.00 0.00 O ATOM 415 ND2 ASN A 711 14.341 6.291 -5.874 1.00 0.00 N ATOM 0 H ASN A 711 9.579 6.754 -5.664 1.00 0.00 H new ATOM 0 HA ASN A 711 10.764 4.478 -6.698 1.00 0.00 H new ATOM 0 HB2 ASN A 711 11.659 6.749 -6.932 1.00 0.00 H new ATOM 0 HB3 ASN A 711 11.964 6.843 -5.208 1.00 0.00 H new ATOM 0 HD21 ASN A 711 15.291 5.938 -5.991 1.00 0.00 H new ATOM 0 HD22 ASN A 711 14.186 7.209 -5.456 1.00 0.00 H new ATOM 422 N GLU A 712 10.639 4.456 -3.486 1.00 0.00 N ATOM 423 CA GLU A 712 10.913 3.683 -2.279 1.00 0.00 C ATOM 424 C GLU A 712 9.861 2.595 -2.104 1.00 0.00 C ATOM 425 O GLU A 712 10.107 1.566 -1.478 1.00 0.00 O ATOM 426 CB GLU A 712 10.915 4.599 -1.055 1.00 0.00 C ATOM 427 CG GLU A 712 11.300 6.032 -1.374 1.00 0.00 C ATOM 428 CD GLU A 712 12.724 6.155 -1.878 1.00 0.00 C ATOM 429 OE1 GLU A 712 13.654 6.133 -1.045 1.00 0.00 O ATOM 430 OE2 GLU A 712 12.910 6.275 -3.107 1.00 0.00 O ATOM 0 H GLU A 712 9.946 5.194 -3.362 1.00 0.00 H new ATOM 0 HA GLU A 712 11.894 3.219 -2.378 1.00 0.00 H new ATOM 0 HB2 GLU A 712 9.924 4.589 -0.602 1.00 0.00 H new ATOM 0 HB3 GLU A 712 11.608 4.201 -0.314 1.00 0.00 H new ATOM 0 HG2 GLU A 712 10.617 6.429 -2.125 1.00 0.00 H new ATOM 0 HG3 GLU A 712 11.181 6.644 -0.480 1.00 0.00 H new ATOM 437 N LEU A 713 8.682 2.855 -2.655 1.00 0.00 N ATOM 438 CA LEU A 713 7.562 1.920 -2.590 1.00 0.00 C ATOM 439 C LEU A 713 7.949 0.527 -3.083 1.00 0.00 C ATOM 440 O LEU A 713 7.478 -0.479 -2.550 1.00 0.00 O ATOM 441 CB LEU A 713 6.401 2.462 -3.428 1.00 0.00 C ATOM 442 CG LEU A 713 5.129 2.811 -2.652 1.00 0.00 C ATOM 443 CD1 LEU A 713 5.455 3.599 -1.399 1.00 0.00 C ATOM 444 CD2 LEU A 713 4.187 3.615 -3.526 1.00 0.00 C ATOM 0 H LEU A 713 8.474 3.717 -3.159 1.00 0.00 H new ATOM 0 HA LEU A 713 7.263 1.826 -1.546 1.00 0.00 H new ATOM 0 HB2 LEU A 713 6.741 3.355 -3.952 1.00 0.00 H new ATOM 0 HB3 LEU A 713 6.149 1.722 -4.188 1.00 0.00 H new ATOM 0 HG LEU A 713 4.647 1.878 -2.360 1.00 0.00 H new ATOM 0 HD11 LEU A 713 4.533 3.834 -0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 713 6.105 3.006 -0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 713 5.962 4.524 -1.673 1.00 0.00 H new ATOM 0 HD21 LEU A 713 3.286 3.857 -2.963 1.00 0.00 H new ATOM 0 HD22 LEU A 713 4.678 4.536 -3.839 1.00 0.00 H new ATOM 0 HD23 LEU A 713 3.919 3.030 -4.406 1.00 0.00 H new ATOM 456 N SER A 714 8.803 0.471 -4.099 1.00 0.00 N ATOM 457 CA SER A 714 9.236 -0.804 -4.664 1.00 0.00 C ATOM 458 C SER A 714 10.054 -1.612 -3.661 1.00 0.00 C ATOM 459 O SER A 714 10.259 -2.814 -3.840 1.00 0.00 O ATOM 460 CB SER A 714 10.051 -0.566 -5.937 1.00 0.00 C ATOM 461 OG SER A 714 11.206 0.209 -5.665 1.00 0.00 O ATOM 0 H SER A 714 9.209 1.292 -4.548 1.00 0.00 H new ATOM 0 HA SER A 714 8.344 -1.380 -4.909 1.00 0.00 H new ATOM 0 HB2 SER A 714 10.344 -1.523 -6.369 1.00 0.00 H new ATOM 0 HB3 SER A 714 9.434 -0.058 -6.678 1.00 0.00 H new ATOM 0 HG SER A 714 11.711 0.346 -6.494 1.00 0.00 H new ATOM 467 N ASN A 715 10.520 -0.950 -2.606 1.00 0.00 N ATOM 468 CA ASN A 715 11.318 -1.612 -1.579 1.00 0.00 C ATOM 469 C ASN A 715 10.438 -2.136 -0.448 1.00 0.00 C ATOM 470 O ASN A 715 10.907 -2.859 0.431 1.00 0.00 O ATOM 471 CB ASN A 715 12.363 -0.647 -1.014 1.00 0.00 C ATOM 472 CG ASN A 715 13.296 -0.113 -2.081 1.00 0.00 C ATOM 473 OD1 ASN A 715 13.574 -0.786 -3.074 1.00 0.00 O ATOM 474 ND2 ASN A 715 13.787 1.104 -1.883 1.00 0.00 N ATOM 0 H ASN A 715 10.359 0.043 -2.440 1.00 0.00 H new ATOM 0 HA ASN A 715 11.822 -2.459 -2.044 1.00 0.00 H new ATOM 0 HB2 ASN A 715 11.857 0.187 -0.528 1.00 0.00 H new ATOM 0 HB3 ASN A 715 12.947 -1.157 -0.247 1.00 0.00 H new ATOM 0 HD21 ASN A 715 14.421 1.516 -2.568 1.00 0.00 H new ATOM 0 HD22 ASN A 715 13.531 1.627 -1.046 1.00 0.00 H new ATOM 481 N LEU A 716 9.161 -1.768 -0.476 1.00 0.00 N ATOM 482 CA LEU A 716 8.216 -2.200 0.550 1.00 0.00 C ATOM 483 C LEU A 716 8.055 -3.711 0.556 1.00 0.00 C ATOM 484 O LEU A 716 8.193 -4.370 -0.476 1.00 0.00 O ATOM 485 CB LEU A 716 6.850 -1.552 0.329 1.00 0.00 C ATOM 486 CG LEU A 716 6.780 -0.062 0.654 1.00 0.00 C ATOM 487 CD1 LEU A 716 5.543 0.559 0.030 1.00 0.00 C ATOM 488 CD2 LEU A 716 6.778 0.152 2.160 1.00 0.00 C ATOM 0 H LEU A 716 8.756 -1.172 -1.198 1.00 0.00 H new ATOM 0 HA LEU A 716 8.619 -1.887 1.513 1.00 0.00 H new ATOM 0 HB2 LEU A 716 6.562 -1.695 -0.712 1.00 0.00 H new ATOM 0 HB3 LEU A 716 6.114 -2.076 0.938 1.00 0.00 H new ATOM 0 HG LEU A 716 7.661 0.425 0.235 1.00 0.00 H new ATOM 0 HD11 LEU A 716 5.508 1.621 0.271 1.00 0.00 H new ATOM 0 HD12 LEU A 716 5.579 0.434 -1.052 1.00 0.00 H new ATOM 0 HD13 LEU A 716 4.652 0.068 0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 716 6.728 1.219 2.376 1.00 0.00 H new ATOM 0 HD22 LEU A 716 5.914 -0.348 2.597 1.00 0.00 H new ATOM 0 HD23 LEU A 716 7.691 -0.262 2.588 1.00 0.00 H new ATOM 500 N ALA A 717 7.763 -4.251 1.730 1.00 0.00 N ATOM 501 CA ALA A 717 7.558 -5.680 1.887 1.00 0.00 C ATOM 502 C ALA A 717 6.124 -6.038 1.527 1.00 0.00 C ATOM 503 O ALA A 717 5.184 -5.414 2.016 1.00 0.00 O ATOM 504 CB ALA A 717 7.866 -6.099 3.314 1.00 0.00 C ATOM 0 H ALA A 717 7.663 -3.715 2.592 1.00 0.00 H new ATOM 0 HA ALA A 717 8.233 -6.213 1.217 1.00 0.00 H new ATOM 0 HB1 ALA A 717 7.709 -7.172 3.420 1.00 0.00 H new ATOM 0 HB2 ALA A 717 8.903 -5.859 3.548 1.00 0.00 H new ATOM 0 HB3 ALA A 717 7.207 -5.566 4.000 1.00 0.00 H new ATOM 510 N LYS A 718 5.954 -7.035 0.668 1.00 0.00 N ATOM 511 CA LYS A 718 4.621 -7.446 0.249 1.00 0.00 C ATOM 512 C LYS A 718 3.740 -7.768 1.447 1.00 0.00 C ATOM 513 O LYS A 718 4.218 -8.226 2.485 1.00 0.00 O ATOM 514 CB LYS A 718 4.692 -8.641 -0.695 1.00 0.00 C ATOM 515 CG LYS A 718 4.196 -8.325 -2.098 1.00 0.00 C ATOM 516 CD LYS A 718 5.134 -7.386 -2.838 1.00 0.00 C ATOM 517 CE LYS A 718 4.504 -6.870 -4.125 1.00 0.00 C ATOM 518 NZ LYS A 718 5.459 -6.050 -4.919 1.00 0.00 N ATOM 0 H LYS A 718 6.716 -7.570 0.251 1.00 0.00 H new ATOM 0 HA LYS A 718 4.172 -6.609 -0.286 1.00 0.00 H new ATOM 0 HB2 LYS A 718 5.723 -8.991 -0.751 1.00 0.00 H new ATOM 0 HB3 LYS A 718 4.100 -9.458 -0.282 1.00 0.00 H new ATOM 0 HG2 LYS A 718 4.092 -9.252 -2.662 1.00 0.00 H new ATOM 0 HG3 LYS A 718 3.205 -7.875 -2.039 1.00 0.00 H new ATOM 0 HD2 LYS A 718 5.391 -6.545 -2.194 1.00 0.00 H new ATOM 0 HD3 LYS A 718 6.064 -7.906 -3.069 1.00 0.00 H new ATOM 0 HE2 LYS A 718 4.162 -7.713 -4.726 1.00 0.00 H new ATOM 0 HE3 LYS A 718 3.625 -6.273 -3.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 718 4.993 -5.717 -5.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 718 5.766 -5.232 -4.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 718 6.287 -6.627 -5.170 1.00 0.00 H new ATOM 532 N GLY A 719 2.445 -7.524 1.285 1.00 0.00 N ATOM 533 CA GLY A 719 1.500 -7.768 2.358 1.00 0.00 C ATOM 534 C GLY A 719 1.426 -6.600 3.322 1.00 0.00 C ATOM 535 O GLY A 719 0.621 -6.597 4.253 1.00 0.00 O ATOM 0 H GLY A 719 2.032 -7.160 0.426 1.00 0.00 H new ATOM 0 HA2 GLY A 719 0.512 -7.954 1.937 1.00 0.00 H new ATOM 0 HA3 GLY A 719 1.790 -8.668 2.900 1.00 0.00 H new ATOM 539 N GLU A 720 2.277 -5.605 3.088 1.00 0.00 N ATOM 540 CA GLU A 720 2.332 -4.410 3.926 1.00 0.00 C ATOM 541 C GLU A 720 1.751 -3.205 3.200 1.00 0.00 C ATOM 542 O GLU A 720 1.420 -3.276 2.016 1.00 0.00 O ATOM 543 CB GLU A 720 3.772 -4.109 4.336 1.00 0.00 C ATOM 544 CG GLU A 720 4.408 -5.199 5.180 1.00 0.00 C ATOM 545 CD GLU A 720 3.698 -5.402 6.505 1.00 0.00 C ATOM 546 OE1 GLU A 720 2.718 -6.175 6.542 1.00 0.00 O ATOM 547 OE2 GLU A 720 4.123 -4.787 7.506 1.00 0.00 O ATOM 0 H GLU A 720 2.945 -5.603 2.317 1.00 0.00 H new ATOM 0 HA GLU A 720 1.735 -4.604 4.817 1.00 0.00 H new ATOM 0 HB2 GLU A 720 4.372 -3.960 3.438 1.00 0.00 H new ATOM 0 HB3 GLU A 720 3.793 -3.172 4.893 1.00 0.00 H new ATOM 0 HG2 GLU A 720 4.402 -6.135 4.622 1.00 0.00 H new ATOM 0 HG3 GLU A 720 5.452 -4.946 5.367 1.00 0.00 H new ATOM 554 N LYS A 721 1.608 -2.103 3.926 1.00 0.00 N ATOM 555 CA LYS A 721 1.072 -0.876 3.351 1.00 0.00 C ATOM 556 C LYS A 721 2.045 0.284 3.508 1.00 0.00 C ATOM 557 O LYS A 721 3.081 0.157 4.159 1.00 0.00 O ATOM 558 CB LYS A 721 -0.253 -0.506 4.007 1.00 0.00 C ATOM 559 CG LYS A 721 -1.451 -1.239 3.434 1.00 0.00 C ATOM 560 CD LYS A 721 -2.410 -1.651 4.534 1.00 0.00 C ATOM 561 CE LYS A 721 -1.805 -2.737 5.410 1.00 0.00 C ATOM 562 NZ LYS A 721 -2.750 -3.190 6.469 1.00 0.00 N ATOM 0 H LYS A 721 1.856 -2.034 4.913 1.00 0.00 H new ATOM 0 HA LYS A 721 0.914 -1.062 2.289 1.00 0.00 H new ATOM 0 HB2 LYS A 721 -0.189 -0.715 5.075 1.00 0.00 H new ATOM 0 HB3 LYS A 721 -0.412 0.567 3.901 1.00 0.00 H new ATOM 0 HG2 LYS A 721 -1.966 -0.598 2.718 1.00 0.00 H new ATOM 0 HG3 LYS A 721 -1.116 -2.121 2.889 1.00 0.00 H new ATOM 0 HD2 LYS A 721 -2.661 -0.784 5.145 1.00 0.00 H new ATOM 0 HD3 LYS A 721 -3.340 -2.011 4.094 1.00 0.00 H new ATOM 0 HE2 LYS A 721 -1.521 -3.587 4.790 1.00 0.00 H new ATOM 0 HE3 LYS A 721 -0.893 -2.362 5.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 721 -2.299 -3.930 7.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 721 -3.002 -2.385 7.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 721 -3.610 -3.572 6.026 1.00 0.00 H new ATOM 576 N ALA A 722 1.699 1.420 2.906 1.00 0.00 N ATOM 577 CA ALA A 722 2.538 2.614 2.997 1.00 0.00 C ATOM 578 C ALA A 722 1.810 3.841 2.469 1.00 0.00 C ATOM 579 O ALA A 722 1.372 3.862 1.320 1.00 0.00 O ATOM 580 CB ALA A 722 3.839 2.409 2.234 1.00 0.00 C ATOM 0 H ALA A 722 0.850 1.539 2.354 1.00 0.00 H new ATOM 0 HA ALA A 722 2.766 2.781 4.050 1.00 0.00 H new ATOM 0 HB1 ALA A 722 4.452 3.307 2.312 1.00 0.00 H new ATOM 0 HB2 ALA A 722 4.380 1.563 2.658 1.00 0.00 H new ATOM 0 HB3 ALA A 722 3.618 2.210 1.185 1.00 0.00 H new ATOM 586 N ASN A 723 1.743 4.883 3.297 1.00 0.00 N ATOM 587 CA ASN A 723 1.059 6.121 2.934 1.00 0.00 C ATOM 588 C ASN A 723 1.852 6.938 1.926 1.00 0.00 C ATOM 589 O ASN A 723 2.945 7.424 2.217 1.00 0.00 O ATOM 590 CB ASN A 723 0.787 6.961 4.183 1.00 0.00 C ATOM 591 CG ASN A 723 -0.146 6.268 5.156 1.00 0.00 C ATOM 592 OD1 ASN A 723 -1.361 6.451 5.106 1.00 0.00 O ATOM 593 ND2 ASN A 723 0.420 5.464 6.049 1.00 0.00 N ATOM 0 H ASN A 723 2.157 4.893 4.229 1.00 0.00 H new ATOM 0 HA ASN A 723 0.114 5.843 2.466 1.00 0.00 H new ATOM 0 HB2 ASN A 723 1.731 7.180 4.683 1.00 0.00 H new ATOM 0 HB3 ASN A 723 0.354 7.917 3.887 1.00 0.00 H new ATOM 0 HD21 ASN A 723 -0.158 4.970 6.729 1.00 0.00 H new ATOM 0 HD22 ASN A 723 1.433 5.341 6.055 1.00 0.00 H new ATOM 600 N VAL A 724 1.281 7.081 0.735 1.00 0.00 N ATOM 601 CA VAL A 724 1.899 7.852 -0.327 1.00 0.00 C ATOM 602 C VAL A 724 0.879 8.740 -1.020 1.00 0.00 C ATOM 603 O VAL A 724 -0.278 8.357 -1.191 1.00 0.00 O ATOM 604 CB VAL A 724 2.584 6.958 -1.373 1.00 0.00 C ATOM 605 CG1 VAL A 724 3.869 6.384 -0.812 1.00 0.00 C ATOM 606 CG2 VAL A 724 1.651 5.849 -1.834 1.00 0.00 C ATOM 0 H VAL A 724 0.383 6.667 0.484 1.00 0.00 H new ATOM 0 HA VAL A 724 2.661 8.471 0.146 1.00 0.00 H new ATOM 0 HB VAL A 724 2.829 7.569 -2.241 1.00 0.00 H new ATOM 0 HG11 VAL A 724 4.344 5.753 -1.563 1.00 0.00 H new ATOM 0 HG12 VAL A 724 4.543 7.197 -0.542 1.00 0.00 H new ATOM 0 HG13 VAL A 724 3.646 5.789 0.073 1.00 0.00 H new ATOM 0 HG21 VAL A 724 2.159 5.230 -2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 724 1.367 5.234 -0.980 1.00 0.00 H new ATOM 0 HG23 VAL A 724 0.757 6.287 -2.279 1.00 0.00 H new ATOM 616 N LEU A 725 1.313 9.927 -1.417 1.00 0.00 N ATOM 617 CA LEU A 725 0.431 10.869 -2.094 1.00 0.00 C ATOM 618 C LEU A 725 0.147 10.393 -3.511 1.00 0.00 C ATOM 619 O LEU A 725 1.047 9.925 -4.209 1.00 0.00 O ATOM 620 CB LEU A 725 1.050 12.266 -2.141 1.00 0.00 C ATOM 621 CG LEU A 725 2.273 12.473 -1.248 1.00 0.00 C ATOM 622 CD1 LEU A 725 3.013 13.736 -1.652 1.00 0.00 C ATOM 623 CD2 LEU A 725 1.857 12.536 0.213 1.00 0.00 C ATOM 0 H LEU A 725 2.267 10.261 -1.283 1.00 0.00 H new ATOM 0 HA LEU A 725 -0.501 10.920 -1.531 1.00 0.00 H new ATOM 0 HB2 LEU A 725 1.332 12.485 -3.171 1.00 0.00 H new ATOM 0 HB3 LEU A 725 0.288 12.992 -1.858 1.00 0.00 H new ATOM 0 HG LEU A 725 2.947 11.626 -1.375 1.00 0.00 H new ATOM 0 HD11 LEU A 725 3.882 13.871 -1.007 1.00 0.00 H new ATOM 0 HD12 LEU A 725 3.340 13.650 -2.688 1.00 0.00 H new ATOM 0 HD13 LEU A 725 2.349 14.595 -1.551 1.00 0.00 H new ATOM 0 HD21 LEU A 725 2.739 12.684 0.836 1.00 0.00 H new ATOM 0 HD22 LEU A 725 1.166 13.366 0.359 1.00 0.00 H new ATOM 0 HD23 LEU A 725 1.367 11.603 0.492 1.00 0.00 H new ATOM 635 N ILE A 726 -1.104 10.512 -3.931 1.00 0.00 N ATOM 636 CA ILE A 726 -1.492 10.088 -5.269 1.00 0.00 C ATOM 637 C ILE A 726 -1.767 11.278 -6.179 1.00 0.00 C ATOM 638 O ILE A 726 -2.218 11.112 -7.313 1.00 0.00 O ATOM 639 CB ILE A 726 -2.734 9.183 -5.236 1.00 0.00 C ATOM 640 CG1 ILE A 726 -3.741 9.684 -4.197 1.00 0.00 C ATOM 641 CG2 ILE A 726 -2.329 7.744 -4.951 1.00 0.00 C ATOM 642 CD1 ILE A 726 -5.039 8.904 -4.183 1.00 0.00 C ATOM 0 H ILE A 726 -1.864 10.896 -3.369 1.00 0.00 H new ATOM 0 HA ILE A 726 -0.650 9.524 -5.669 1.00 0.00 H new ATOM 0 HB ILE A 726 -3.216 9.217 -6.213 1.00 0.00 H new ATOM 0 HG12 ILE A 726 -3.286 9.632 -3.208 1.00 0.00 H new ATOM 0 HG13 ILE A 726 -3.960 10.734 -4.393 1.00 0.00 H new ATOM 0 HG21 ILE A 726 -3.218 7.113 -4.930 1.00 0.00 H new ATOM 0 HG22 ILE A 726 -1.654 7.394 -5.732 1.00 0.00 H new ATOM 0 HG23 ILE A 726 -1.825 7.692 -3.986 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -5.703 9.316 -3.423 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -5.517 8.976 -5.160 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -4.832 7.858 -3.957 1.00 0.00 H new ATOM 654 N GLY A 727 -1.488 12.476 -5.681 1.00 0.00 N ATOM 655 CA GLY A 727 -1.712 13.675 -6.469 1.00 0.00 C ATOM 656 C GLY A 727 -1.418 14.945 -5.699 1.00 0.00 C ATOM 657 O GLY A 727 -1.999 15.993 -5.980 1.00 0.00 O ATOM 0 H GLY A 727 -1.111 12.640 -4.747 1.00 0.00 H new ATOM 0 HA2 GLY A 727 -1.084 13.642 -7.360 1.00 0.00 H new ATOM 0 HA3 GLY A 727 -2.747 13.693 -6.809 1.00 0.00 H new ATOM 661 N GLN A 728 -0.512 14.851 -4.729 1.00 0.00 N ATOM 662 CA GLN A 728 -0.141 16.003 -3.914 1.00 0.00 C ATOM 663 C GLN A 728 -1.370 16.611 -3.244 1.00 0.00 C ATOM 664 O GLN A 728 -2.050 17.461 -3.821 1.00 0.00 O ATOM 665 CB GLN A 728 0.570 17.053 -4.769 1.00 0.00 C ATOM 666 CG GLN A 728 0.905 18.327 -4.015 1.00 0.00 C ATOM 667 CD GLN A 728 1.691 19.315 -4.856 1.00 0.00 C ATOM 668 OE1 GLN A 728 2.454 18.925 -5.741 1.00 0.00 O ATOM 669 NE2 GLN A 728 1.507 20.600 -4.583 1.00 0.00 N ATOM 0 H GLN A 728 -0.022 13.989 -4.489 1.00 0.00 H new ATOM 0 HA GLN A 728 0.542 15.664 -3.135 1.00 0.00 H new ATOM 0 HB2 GLN A 728 1.490 16.624 -5.166 1.00 0.00 H new ATOM 0 HB3 GLN A 728 -0.060 17.301 -5.623 1.00 0.00 H new ATOM 0 HG2 GLN A 728 -0.018 18.798 -3.677 1.00 0.00 H new ATOM 0 HG3 GLN A 728 1.480 18.076 -3.124 1.00 0.00 H new ATOM 0 HE21 GLN A 728 0.865 20.877 -3.841 1.00 0.00 H new ATOM 0 HE22 GLN A 728 2.008 21.311 -5.116 1.00 0.00 H new ATOM 678 N GLY A 729 -1.650 16.166 -2.024 1.00 0.00 N ATOM 679 CA GLY A 729 -2.798 16.668 -1.293 1.00 0.00 C ATOM 680 C GLY A 729 -3.601 15.553 -0.656 1.00 0.00 C ATOM 681 O GLY A 729 -4.260 15.756 0.365 1.00 0.00 O ATOM 0 H GLY A 729 -1.101 15.465 -1.527 1.00 0.00 H new ATOM 0 HA2 GLY A 729 -2.461 17.359 -0.520 1.00 0.00 H new ATOM 0 HA3 GLY A 729 -3.438 17.234 -1.969 1.00 0.00 H new ATOM 685 N ASP A 730 -3.544 14.371 -1.261 1.00 0.00 N ATOM 686 CA ASP A 730 -4.265 13.213 -0.750 1.00 0.00 C ATOM 687 C ASP A 730 -3.286 12.135 -0.304 1.00 0.00 C ATOM 688 O ASP A 730 -2.609 11.514 -1.129 1.00 0.00 O ATOM 689 CB ASP A 730 -5.209 12.655 -1.817 1.00 0.00 C ATOM 690 CG ASP A 730 -6.097 13.728 -2.419 1.00 0.00 C ATOM 691 OD1 ASP A 730 -5.637 14.430 -3.343 1.00 0.00 O ATOM 692 OD2 ASP A 730 -7.253 13.864 -1.967 1.00 0.00 O ATOM 0 H ASP A 730 -3.004 14.191 -2.108 1.00 0.00 H new ATOM 0 HA ASP A 730 -4.857 13.529 0.109 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -4.623 12.186 -2.607 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -5.832 11.876 -1.377 1.00 0.00 H new ATOM 697 N VAL A 731 -3.217 11.914 1.005 1.00 0.00 N ATOM 698 CA VAL A 731 -2.317 10.919 1.566 1.00 0.00 C ATOM 699 C VAL A 731 -3.035 9.594 1.784 1.00 0.00 C ATOM 700 O VAL A 731 -3.860 9.462 2.689 1.00 0.00 O ATOM 701 CB VAL A 731 -1.723 11.394 2.906 1.00 0.00 C ATOM 702 CG1 VAL A 731 -0.753 10.361 3.459 1.00 0.00 C ATOM 703 CG2 VAL A 731 -1.039 12.743 2.738 1.00 0.00 C ATOM 0 H VAL A 731 -3.776 12.413 1.697 1.00 0.00 H new ATOM 0 HA VAL A 731 -1.509 10.779 0.848 1.00 0.00 H new ATOM 0 HB VAL A 731 -2.537 11.511 3.621 1.00 0.00 H new ATOM 0 HG11 VAL A 731 -0.345 10.715 4.405 1.00 0.00 H new ATOM 0 HG12 VAL A 731 -1.277 9.419 3.620 1.00 0.00 H new ATOM 0 HG13 VAL A 731 0.059 10.207 2.748 1.00 0.00 H new ATOM 0 HG21 VAL A 731 -0.625 13.063 3.694 1.00 0.00 H new ATOM 0 HG22 VAL A 731 -0.236 12.655 2.006 1.00 0.00 H new ATOM 0 HG23 VAL A 731 -1.765 13.479 2.393 1.00 0.00 H new ATOM 713 N VAL A 732 -2.713 8.615 0.947 1.00 0.00 N ATOM 714 CA VAL A 732 -3.317 7.294 1.042 1.00 0.00 C ATOM 715 C VAL A 732 -2.249 6.211 0.940 1.00 0.00 C ATOM 716 O VAL A 732 -1.314 6.323 0.151 1.00 0.00 O ATOM 717 CB VAL A 732 -4.370 7.074 -0.063 1.00 0.00 C ATOM 718 CG1 VAL A 732 -5.474 8.114 0.035 1.00 0.00 C ATOM 719 CG2 VAL A 732 -3.722 7.110 -1.440 1.00 0.00 C ATOM 0 H VAL A 732 -2.034 8.713 0.192 1.00 0.00 H new ATOM 0 HA VAL A 732 -3.811 7.232 2.011 1.00 0.00 H new ATOM 0 HB VAL A 732 -4.813 6.088 0.080 1.00 0.00 H new ATOM 0 HG11 VAL A 732 -6.207 7.942 -0.753 1.00 0.00 H new ATOM 0 HG12 VAL A 732 -5.961 8.037 1.007 1.00 0.00 H new ATOM 0 HG13 VAL A 732 -5.047 9.110 -0.079 1.00 0.00 H new ATOM 0 HG21 VAL A 732 -4.483 6.953 -2.204 1.00 0.00 H new ATOM 0 HG22 VAL A 732 -3.248 8.079 -1.594 1.00 0.00 H new ATOM 0 HG23 VAL A 732 -2.970 6.324 -1.509 1.00 0.00 H new ATOM 729 N LEU A 733 -2.404 5.156 1.728 1.00 0.00 N ATOM 730 CA LEU A 733 -1.443 4.061 1.729 1.00 0.00 C ATOM 731 C LEU A 733 -1.787 3.042 0.662 1.00 0.00 C ATOM 732 O LEU A 733 -2.926 2.974 0.204 1.00 0.00 O ATOM 733 CB LEU A 733 -1.363 3.372 3.100 1.00 0.00 C ATOM 734 CG LEU A 733 -2.701 2.998 3.732 1.00 0.00 C ATOM 735 CD1 LEU A 733 -2.519 1.900 4.765 1.00 0.00 C ATOM 736 CD2 LEU A 733 -3.335 4.210 4.374 1.00 0.00 C ATOM 0 H LEU A 733 -3.184 5.035 2.374 1.00 0.00 H new ATOM 0 HA LEU A 733 -0.467 4.493 1.510 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -0.765 2.466 2.997 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -0.829 4.030 3.786 1.00 0.00 H new ATOM 0 HG LEU A 733 -3.358 2.629 2.945 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -3.485 1.649 5.203 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -2.097 1.016 4.286 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -1.844 2.246 5.548 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -4.289 3.928 4.821 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -2.673 4.600 5.147 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -3.501 4.977 3.618 1.00 0.00 H new ATOM 748 N VAL A 734 -0.792 2.272 0.239 1.00 0.00 N ATOM 749 CA VAL A 734 -1.015 1.262 -0.770 1.00 0.00 C ATOM 750 C VAL A 734 -0.841 -0.116 -0.190 1.00 0.00 C ATOM 751 O VAL A 734 -0.270 -0.278 0.886 1.00 0.00 O ATOM 752 CB VAL A 734 -0.097 1.424 -1.986 1.00 0.00 C ATOM 753 CG1 VAL A 734 -0.937 1.838 -3.173 1.00 0.00 C ATOM 754 CG2 VAL A 734 1.008 2.436 -1.715 1.00 0.00 C ATOM 0 H VAL A 734 0.167 2.332 0.580 1.00 0.00 H new ATOM 0 HA VAL A 734 -2.041 1.393 -1.113 1.00 0.00 H new ATOM 0 HB VAL A 734 0.393 0.474 -2.199 1.00 0.00 H new ATOM 0 HG11 VAL A 734 -0.297 1.958 -4.047 1.00 0.00 H new ATOM 0 HG12 VAL A 734 -1.686 1.072 -3.373 1.00 0.00 H new ATOM 0 HG13 VAL A 734 -1.434 2.783 -2.955 1.00 0.00 H new ATOM 0 HG21 VAL A 734 1.642 2.528 -2.597 1.00 0.00 H new ATOM 0 HG22 VAL A 734 0.565 3.405 -1.484 1.00 0.00 H new ATOM 0 HG23 VAL A 734 1.609 2.101 -0.870 1.00 0.00 H new ATOM 764 N MET A 735 -1.332 -1.101 -0.920 1.00 0.00 N ATOM 765 CA MET A 735 -1.262 -2.483 -0.491 1.00 0.00 C ATOM 766 C MET A 735 -0.572 -3.335 -1.542 1.00 0.00 C ATOM 767 O MET A 735 -1.038 -3.451 -2.671 1.00 0.00 O ATOM 768 CB MET A 735 -2.671 -2.995 -0.233 1.00 0.00 C ATOM 769 CG MET A 735 -2.880 -3.486 1.188 1.00 0.00 C ATOM 770 SD MET A 735 -2.879 -5.284 1.321 1.00 0.00 S ATOM 771 CE MET A 735 -1.227 -5.661 0.750 1.00 0.00 C ATOM 0 H MET A 735 -1.788 -0.965 -1.822 1.00 0.00 H new ATOM 0 HA MET A 735 -0.678 -2.546 0.427 1.00 0.00 H new ATOM 0 HB2 MET A 735 -3.384 -2.198 -0.443 1.00 0.00 H new ATOM 0 HB3 MET A 735 -2.888 -3.808 -0.926 1.00 0.00 H new ATOM 0 HG2 MET A 735 -2.095 -3.080 1.826 1.00 0.00 H new ATOM 0 HG3 MET A 735 -3.828 -3.100 1.564 1.00 0.00 H new ATOM 0 HE1 MET A 735 -0.948 -6.662 1.080 1.00 0.00 H new ATOM 0 HE2 MET A 735 -1.199 -5.617 -0.339 1.00 0.00 H new ATOM 0 HE3 MET A 735 -0.526 -4.935 1.161 1.00 0.00 H new ATOM 781 N LYS A 736 0.538 -3.938 -1.157 1.00 0.00 N ATOM 782 CA LYS A 736 1.306 -4.765 -2.075 1.00 0.00 C ATOM 783 C LYS A 736 0.554 -6.049 -2.441 1.00 0.00 C ATOM 784 O LYS A 736 -0.598 -6.242 -2.056 1.00 0.00 O ATOM 785 CB LYS A 736 2.674 -5.085 -1.473 1.00 0.00 C ATOM 786 CG LYS A 736 3.087 -4.132 -0.363 1.00 0.00 C ATOM 787 CD LYS A 736 3.533 -2.798 -0.920 1.00 0.00 C ATOM 788 CE LYS A 736 2.970 -1.647 -0.104 1.00 0.00 C ATOM 789 NZ LYS A 736 3.512 -1.631 1.281 1.00 0.00 N ATOM 0 H LYS A 736 0.929 -3.872 -0.217 1.00 0.00 H new ATOM 0 HA LYS A 736 1.451 -4.203 -2.998 1.00 0.00 H new ATOM 0 HB2 LYS A 736 2.661 -6.102 -1.081 1.00 0.00 H new ATOM 0 HB3 LYS A 736 3.425 -5.057 -2.263 1.00 0.00 H new ATOM 0 HG2 LYS A 736 2.251 -3.982 0.320 1.00 0.00 H new ATOM 0 HG3 LYS A 736 3.897 -4.575 0.217 1.00 0.00 H new ATOM 0 HD2 LYS A 736 4.622 -2.747 -0.922 1.00 0.00 H new ATOM 0 HD3 LYS A 736 3.207 -2.706 -1.956 1.00 0.00 H new ATOM 0 HE2 LYS A 736 3.205 -0.704 -0.597 1.00 0.00 H new ATOM 0 HE3 LYS A 736 1.883 -1.725 -0.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 736 3.608 -0.647 1.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 736 2.864 -2.142 1.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 736 4.444 -2.093 1.294 1.00 0.00 H new ATOM 803 N ARG A 737 1.214 -6.917 -3.202 1.00 0.00 N ATOM 804 CA ARG A 737 0.615 -8.178 -3.648 1.00 0.00 C ATOM 805 C ARG A 737 0.413 -9.175 -2.513 1.00 0.00 C ATOM 806 O ARG A 737 -0.554 -9.937 -2.525 1.00 0.00 O ATOM 807 CB ARG A 737 1.490 -8.821 -4.725 1.00 0.00 C ATOM 808 CG ARG A 737 1.683 -7.953 -5.958 1.00 0.00 C ATOM 809 CD ARG A 737 2.496 -8.671 -7.024 1.00 0.00 C ATOM 810 NE ARG A 737 2.683 -7.847 -8.215 1.00 0.00 N ATOM 811 CZ ARG A 737 3.348 -8.248 -9.295 1.00 0.00 C ATOM 812 NH1 ARG A 737 3.892 -9.458 -9.335 1.00 0.00 N ATOM 813 NH2 ARG A 737 3.471 -7.437 -10.337 1.00 0.00 N ATOM 0 H ARG A 737 2.170 -6.772 -3.526 1.00 0.00 H new ATOM 0 HA ARG A 737 -0.368 -7.930 -4.048 1.00 0.00 H new ATOM 0 HB2 ARG A 737 2.466 -9.051 -4.298 1.00 0.00 H new ATOM 0 HB3 ARG A 737 1.043 -9.768 -5.026 1.00 0.00 H new ATOM 0 HG2 ARG A 737 0.711 -7.677 -6.365 1.00 0.00 H new ATOM 0 HG3 ARG A 737 2.186 -7.027 -5.678 1.00 0.00 H new ATOM 0 HD2 ARG A 737 3.469 -8.944 -6.615 1.00 0.00 H new ATOM 0 HD3 ARG A 737 1.994 -9.598 -7.300 1.00 0.00 H new ATOM 0 HE ARG A 737 2.280 -6.910 -8.219 1.00 0.00 H new ATOM 0 HH11 ARG A 737 3.801 -10.085 -8.535 1.00 0.00 H new ATOM 0 HH12 ARG A 737 4.401 -9.761 -10.165 1.00 0.00 H new ATOM 0 HH21 ARG A 737 3.056 -6.506 -10.310 1.00 0.00 H new ATOM 0 HH22 ARG A 737 3.981 -7.744 -11.165 1.00 0.00 H new ATOM 827 N LYS A 738 1.325 -9.166 -1.544 1.00 0.00 N ATOM 828 CA LYS A 738 1.283 -10.096 -0.417 1.00 0.00 C ATOM 829 C LYS A 738 1.655 -11.510 -0.870 1.00 0.00 C ATOM 830 O LYS A 738 2.258 -12.270 -0.111 1.00 0.00 O ATOM 831 CB LYS A 738 -0.096 -10.098 0.258 1.00 0.00 C ATOM 832 CG LYS A 738 -0.288 -11.230 1.256 1.00 0.00 C ATOM 833 CD LYS A 738 0.690 -11.134 2.416 1.00 0.00 C ATOM 834 CE LYS A 738 0.570 -12.333 3.343 1.00 0.00 C ATOM 835 NZ LYS A 738 1.530 -12.258 4.478 1.00 0.00 N ATOM 0 H LYS A 738 2.111 -8.517 -1.517 1.00 0.00 H new ATOM 0 HA LYS A 738 2.015 -9.758 0.316 1.00 0.00 H new ATOM 0 HB2 LYS A 738 -0.242 -9.146 0.769 1.00 0.00 H new ATOM 0 HB3 LYS A 738 -0.866 -10.168 -0.510 1.00 0.00 H new ATOM 0 HG2 LYS A 738 -1.308 -11.208 1.639 1.00 0.00 H new ATOM 0 HG3 LYS A 738 -0.158 -12.186 0.750 1.00 0.00 H new ATOM 0 HD2 LYS A 738 1.708 -11.070 2.031 1.00 0.00 H new ATOM 0 HD3 LYS A 738 0.503 -10.218 2.977 1.00 0.00 H new ATOM 0 HE2 LYS A 738 -0.447 -12.391 3.731 1.00 0.00 H new ATOM 0 HE3 LYS A 738 0.748 -13.248 2.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 738 1.415 -13.094 5.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 738 2.502 -12.229 4.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 738 1.344 -11.398 5.033 1.00 0.00 H new ATOM 849 N ARG A 739 1.307 -11.851 -2.113 1.00 0.00 N ATOM 850 CA ARG A 739 1.602 -13.171 -2.660 1.00 0.00 C ATOM 851 C ARG A 739 1.148 -13.284 -4.114 1.00 0.00 C ATOM 852 O ARG A 739 1.951 -13.566 -5.004 1.00 0.00 O ATOM 853 CB ARG A 739 0.913 -14.252 -1.826 1.00 0.00 C ATOM 854 CG ARG A 739 1.162 -15.665 -2.327 1.00 0.00 C ATOM 855 CD ARG A 739 0.413 -16.690 -1.493 1.00 0.00 C ATOM 856 NE ARG A 739 0.600 -18.048 -1.996 1.00 0.00 N ATOM 857 CZ ARG A 739 0.221 -19.139 -1.336 1.00 0.00 C ATOM 858 NH1 ARG A 739 -0.351 -19.033 -0.144 1.00 0.00 N ATOM 859 NH2 ARG A 739 0.417 -20.338 -1.866 1.00 0.00 N ATOM 0 H ARG A 739 0.820 -11.228 -2.758 1.00 0.00 H new ATOM 0 HA ARG A 739 2.682 -13.312 -2.624 1.00 0.00 H new ATOM 0 HB2 ARG A 739 1.257 -14.176 -0.795 1.00 0.00 H new ATOM 0 HB3 ARG A 739 -0.160 -14.063 -1.819 1.00 0.00 H new ATOM 0 HG2 ARG A 739 0.850 -15.743 -3.368 1.00 0.00 H new ATOM 0 HG3 ARG A 739 2.230 -15.880 -2.297 1.00 0.00 H new ATOM 0 HD2 ARG A 739 0.755 -16.636 -0.460 1.00 0.00 H new ATOM 0 HD3 ARG A 739 -0.650 -16.448 -1.490 1.00 0.00 H new ATOM 0 HE ARG A 739 1.047 -18.167 -2.905 1.00 0.00 H new ATOM 0 HH11 ARG A 739 -0.502 -18.113 0.269 1.00 0.00 H new ATOM 0 HH12 ARG A 739 -0.640 -19.872 0.359 1.00 0.00 H new ATOM 0 HH21 ARG A 739 0.859 -20.425 -2.781 1.00 0.00 H new ATOM 0 HH22 ARG A 739 0.126 -21.174 -1.359 1.00 0.00 H new ATOM 873 N ASP A 740 -0.145 -13.066 -4.342 1.00 0.00 N ATOM 874 CA ASP A 740 -0.725 -13.155 -5.681 1.00 0.00 C ATOM 875 C ASP A 740 0.071 -12.340 -6.698 1.00 0.00 C ATOM 876 O ASP A 740 0.825 -11.438 -6.336 1.00 0.00 O ATOM 877 CB ASP A 740 -2.178 -12.678 -5.656 1.00 0.00 C ATOM 878 CG ASP A 740 -2.317 -11.274 -5.101 1.00 0.00 C ATOM 879 OD1 ASP A 740 -2.143 -10.310 -5.875 1.00 0.00 O ATOM 880 OD2 ASP A 740 -2.600 -11.139 -3.892 1.00 0.00 O ATOM 0 H ASP A 740 -0.815 -12.825 -3.612 1.00 0.00 H new ATOM 0 HA ASP A 740 -0.688 -14.200 -5.988 1.00 0.00 H new ATOM 0 HB2 ASP A 740 -2.585 -12.708 -6.667 1.00 0.00 H new ATOM 0 HB3 ASP A 740 -2.772 -13.364 -5.053 1.00 0.00 H new ATOM 885 N SER A 741 -0.107 -12.671 -7.975 1.00 0.00 N ATOM 886 CA SER A 741 0.588 -11.977 -9.053 1.00 0.00 C ATOM 887 C SER A 741 -0.337 -10.981 -9.742 1.00 0.00 C ATOM 888 O SER A 741 0.004 -10.417 -10.781 1.00 0.00 O ATOM 889 CB SER A 741 1.123 -12.983 -10.073 1.00 0.00 C ATOM 890 OG SER A 741 2.041 -13.881 -9.470 1.00 0.00 O ATOM 0 H SER A 741 -0.728 -13.417 -8.287 1.00 0.00 H new ATOM 0 HA SER A 741 1.425 -11.429 -8.620 1.00 0.00 H new ATOM 0 HB2 SER A 741 0.294 -13.542 -10.507 1.00 0.00 H new ATOM 0 HB3 SER A 741 1.612 -12.452 -10.890 1.00 0.00 H new ATOM 0 HG SER A 741 2.368 -14.515 -10.142 1.00 0.00 H new ATOM 896 N SER A 742 -1.509 -10.771 -9.153 1.00 0.00 N ATOM 897 CA SER A 742 -2.484 -9.840 -9.705 1.00 0.00 C ATOM 898 C SER A 742 -1.907 -8.429 -9.755 1.00 0.00 C ATOM 899 O SER A 742 -1.127 -8.037 -8.887 1.00 0.00 O ATOM 900 CB SER A 742 -3.764 -9.852 -8.868 1.00 0.00 C ATOM 901 OG SER A 742 -4.350 -11.142 -8.849 1.00 0.00 O ATOM 0 H SER A 742 -1.806 -11.233 -8.294 1.00 0.00 H new ATOM 0 HA SER A 742 -2.723 -10.156 -10.720 1.00 0.00 H new ATOM 0 HB2 SER A 742 -3.539 -9.537 -7.849 1.00 0.00 H new ATOM 0 HB3 SER A 742 -4.475 -9.132 -9.275 1.00 0.00 H new ATOM 0 HG SER A 742 -5.166 -11.123 -8.306 1.00 0.00 H new ATOM 907 N ILE A 743 -2.294 -7.674 -10.777 1.00 0.00 N ATOM 908 CA ILE A 743 -1.817 -6.306 -10.943 1.00 0.00 C ATOM 909 C ILE A 743 -2.327 -5.421 -9.823 1.00 0.00 C ATOM 910 O ILE A 743 -1.883 -4.286 -9.647 1.00 0.00 O ATOM 911 CB ILE A 743 -2.245 -5.741 -12.305 1.00 0.00 C ATOM 912 CG1 ILE A 743 -3.770 -5.607 -12.375 1.00 0.00 C ATOM 913 CG2 ILE A 743 -1.743 -6.663 -13.398 1.00 0.00 C ATOM 914 CD1 ILE A 743 -4.272 -5.019 -13.677 1.00 0.00 C ATOM 0 H ILE A 743 -2.938 -7.987 -11.504 1.00 0.00 H new ATOM 0 HA ILE A 743 -0.728 -6.322 -10.903 1.00 0.00 H new ATOM 0 HB ILE A 743 -1.815 -4.748 -12.439 1.00 0.00 H new ATOM 0 HG12 ILE A 743 -4.219 -6.590 -12.234 1.00 0.00 H new ATOM 0 HG13 ILE A 743 -4.109 -4.981 -11.550 1.00 0.00 H new ATOM 0 HG21 ILE A 743 -2.042 -6.271 -14.370 1.00 0.00 H new ATOM 0 HG22 ILE A 743 -0.656 -6.726 -13.350 1.00 0.00 H new ATOM 0 HG23 ILE A 743 -2.170 -7.656 -13.261 1.00 0.00 H new ATOM 0 HD11 ILE A 743 -5.360 -4.955 -13.652 1.00 0.00 H new ATOM 0 HD12 ILE A 743 -3.853 -4.022 -13.811 1.00 0.00 H new ATOM 0 HD13 ILE A 743 -3.965 -5.656 -14.506 1.00 0.00 H new ATOM 926 N LEU A 744 -3.272 -5.962 -9.078 1.00 0.00 N ATOM 927 CA LEU A 744 -3.857 -5.276 -7.936 1.00 0.00 C ATOM 928 C LEU A 744 -4.558 -3.976 -8.330 1.00 0.00 C ATOM 929 O LEU A 744 -4.655 -3.052 -7.522 1.00 0.00 O ATOM 930 CB LEU A 744 -2.779 -4.983 -6.887 1.00 0.00 C ATOM 931 CG LEU A 744 -2.126 -6.206 -6.249 1.00 0.00 C ATOM 932 CD1 LEU A 744 -1.085 -5.760 -5.236 1.00 0.00 C ATOM 933 CD2 LEU A 744 -3.170 -7.094 -5.587 1.00 0.00 C ATOM 0 H LEU A 744 -3.658 -6.891 -9.246 1.00 0.00 H new ATOM 0 HA LEU A 744 -4.612 -5.942 -7.518 1.00 0.00 H new ATOM 0 HB2 LEU A 744 -2.000 -4.379 -7.352 1.00 0.00 H new ATOM 0 HB3 LEU A 744 -3.222 -4.377 -6.097 1.00 0.00 H new ATOM 0 HG LEU A 744 -1.637 -6.790 -7.029 1.00 0.00 H new ATOM 0 HD11 LEU A 744 -0.621 -6.635 -4.782 1.00 0.00 H new ATOM 0 HD12 LEU A 744 -0.323 -5.163 -5.737 1.00 0.00 H new ATOM 0 HD13 LEU A 744 -1.564 -5.161 -4.462 1.00 0.00 H new ATOM 0 HD21 LEU A 744 -2.681 -7.959 -5.139 1.00 0.00 H new ATOM 0 HD22 LEU A 744 -3.689 -6.530 -4.812 1.00 0.00 H new ATOM 0 HD23 LEU A 744 -3.889 -7.430 -6.335 1.00 0.00 H new ATOM 945 N THR A 745 -5.051 -3.901 -9.562 1.00 0.00 N ATOM 946 CA THR A 745 -5.746 -2.703 -10.022 1.00 0.00 C ATOM 947 C THR A 745 -6.819 -3.040 -11.051 1.00 0.00 C ATOM 948 O THR A 745 -6.553 -3.714 -12.046 1.00 0.00 O ATOM 949 CB THR A 745 -4.771 -1.668 -10.617 1.00 0.00 C ATOM 950 OG1 THR A 745 -5.502 -0.560 -11.154 1.00 0.00 O ATOM 951 CG2 THR A 745 -3.909 -2.286 -11.706 1.00 0.00 C ATOM 0 H THR A 745 -4.984 -4.647 -10.254 1.00 0.00 H new ATOM 0 HA THR A 745 -6.223 -2.267 -9.144 1.00 0.00 H new ATOM 0 HB THR A 745 -4.117 -1.323 -9.816 1.00 0.00 H new ATOM 0 HG1 THR A 745 -4.876 0.094 -11.529 1.00 0.00 H new ATOM 0 HG21 THR A 745 -3.232 -1.531 -12.106 1.00 0.00 H new ATOM 0 HG22 THR A 745 -3.329 -3.109 -11.288 1.00 0.00 H new ATOM 0 HG23 THR A 745 -4.547 -2.662 -12.506 1.00 0.00 H new ATOM 959 N ASP A 746 -8.037 -2.565 -10.800 1.00 0.00 N ATOM 960 CA ASP A 746 -9.157 -2.811 -11.701 1.00 0.00 C ATOM 961 C ASP A 746 -10.290 -1.823 -11.442 1.00 0.00 C ATOM 962 O ASP A 746 -10.985 -1.404 -12.369 1.00 0.00 O ATOM 963 CB ASP A 746 -9.665 -4.244 -11.534 1.00 0.00 C ATOM 964 CG ASP A 746 -10.778 -4.578 -12.507 1.00 0.00 C ATOM 965 OD1 ASP A 746 -11.956 -4.336 -12.169 1.00 0.00 O ATOM 966 OD2 ASP A 746 -10.472 -5.084 -13.608 1.00 0.00 O ATOM 0 H ASP A 746 -8.272 -2.007 -9.979 1.00 0.00 H new ATOM 0 HA ASP A 746 -8.807 -2.674 -12.724 1.00 0.00 H new ATOM 0 HB2 ASP A 746 -8.838 -4.939 -11.679 1.00 0.00 H new ATOM 0 HB3 ASP A 746 -10.023 -4.383 -10.514 1.00 0.00 H new ATOM 971 N SER A 747 -10.474 -1.455 -10.177 1.00 0.00 N ATOM 972 CA SER A 747 -11.523 -0.515 -9.798 1.00 0.00 C ATOM 973 C SER A 747 -11.038 0.431 -8.703 1.00 0.00 C ATOM 974 O SER A 747 -10.441 -0.002 -7.716 1.00 0.00 O ATOM 975 CB SER A 747 -12.767 -1.268 -9.324 1.00 0.00 C ATOM 976 OG SER A 747 -13.858 -0.383 -9.139 1.00 0.00 O ATOM 0 H SER A 747 -9.910 -1.794 -9.398 1.00 0.00 H new ATOM 0 HA SER A 747 -11.779 0.077 -10.677 1.00 0.00 H new ATOM 0 HB2 SER A 747 -13.034 -2.032 -10.054 1.00 0.00 H new ATOM 0 HB3 SER A 747 -12.550 -1.783 -8.388 1.00 0.00 H new ATOM 0 HG SER A 747 -14.665 -0.898 -8.931 1.00 0.00 H new ATOM 982 N GLN A 748 -11.297 1.722 -8.886 1.00 0.00 N ATOM 983 CA GLN A 748 -10.882 2.731 -7.917 1.00 0.00 C ATOM 984 C GLN A 748 -11.990 3.023 -6.908 1.00 0.00 C ATOM 985 O GLN A 748 -11.815 3.839 -6.003 1.00 0.00 O ATOM 986 CB GLN A 748 -10.479 4.021 -8.634 1.00 0.00 C ATOM 987 CG GLN A 748 -11.592 4.622 -9.477 1.00 0.00 C ATOM 988 CD GLN A 748 -11.173 5.907 -10.165 1.00 0.00 C ATOM 989 OE1 GLN A 748 -10.002 6.097 -10.492 1.00 0.00 O ATOM 990 NE2 GLN A 748 -12.133 6.797 -10.390 1.00 0.00 N ATOM 0 H GLN A 748 -11.792 2.094 -9.696 1.00 0.00 H new ATOM 0 HA GLN A 748 -10.023 2.336 -7.374 1.00 0.00 H new ATOM 0 HB2 GLN A 748 -10.160 4.754 -7.893 1.00 0.00 H new ATOM 0 HB3 GLN A 748 -9.620 3.818 -9.273 1.00 0.00 H new ATOM 0 HG2 GLN A 748 -11.905 3.897 -10.228 1.00 0.00 H new ATOM 0 HG3 GLN A 748 -12.457 4.819 -8.844 1.00 0.00 H new ATOM 0 HE21 GLN A 748 -13.091 6.598 -10.102 1.00 0.00 H new ATOM 0 HE22 GLN A 748 -11.912 7.680 -10.851 1.00 0.00 H new ATOM 999 N THR A 749 -13.130 2.357 -7.071 1.00 0.00 N ATOM 1000 CA THR A 749 -14.261 2.555 -6.170 1.00 0.00 C ATOM 1001 C THR A 749 -13.882 2.220 -4.732 1.00 0.00 C ATOM 1002 O THR A 749 -14.434 2.781 -3.786 1.00 0.00 O ATOM 1003 CB THR A 749 -15.473 1.699 -6.586 1.00 0.00 C ATOM 1004 OG1 THR A 749 -16.608 2.034 -5.777 1.00 0.00 O ATOM 1005 CG2 THR A 749 -15.168 0.216 -6.444 1.00 0.00 C ATOM 0 H THR A 749 -13.295 1.679 -7.815 1.00 0.00 H new ATOM 0 HA THR A 749 -14.535 3.608 -6.235 1.00 0.00 H new ATOM 0 HB THR A 749 -15.693 1.909 -7.633 1.00 0.00 H new ATOM 0 HG1 THR A 749 -17.375 1.488 -6.047 1.00 0.00 H new ATOM 0 HG21 THR A 749 -16.040 -0.365 -6.744 1.00 0.00 H new ATOM 0 HG22 THR A 749 -14.322 -0.044 -7.080 1.00 0.00 H new ATOM 0 HG23 THR A 749 -14.923 -0.007 -5.406 1.00 0.00 H new ATOM 1013 N ALA A 750 -12.934 1.301 -4.577 1.00 0.00 N ATOM 1014 CA ALA A 750 -12.476 0.891 -3.257 1.00 0.00 C ATOM 1015 C ALA A 750 -11.430 1.861 -2.722 1.00 0.00 C ATOM 1016 O ALA A 750 -10.230 1.588 -2.779 1.00 0.00 O ATOM 1017 CB ALA A 750 -11.916 -0.523 -3.307 1.00 0.00 C ATOM 0 H ALA A 750 -12.469 0.827 -5.351 1.00 0.00 H new ATOM 0 HA ALA A 750 -13.329 0.904 -2.579 1.00 0.00 H new ATOM 0 HB1 ALA A 750 -11.578 -0.816 -2.313 1.00 0.00 H new ATOM 0 HB2 ALA A 750 -12.693 -1.210 -3.643 1.00 0.00 H new ATOM 0 HB3 ALA A 750 -11.076 -0.557 -4.001 1.00 0.00 H new ATOM 1023 N THR A 751 -11.890 2.998 -2.207 1.00 0.00 N ATOM 1024 CA THR A 751 -10.988 4.009 -1.671 1.00 0.00 C ATOM 1025 C THR A 751 -10.844 3.881 -0.160 1.00 0.00 C ATOM 1026 O THR A 751 -9.765 4.106 0.383 1.00 0.00 O ATOM 1027 CB THR A 751 -11.465 5.433 -2.018 1.00 0.00 C ATOM 1028 OG1 THR A 751 -11.648 5.556 -3.433 1.00 0.00 O ATOM 1029 CG2 THR A 751 -10.462 6.475 -1.543 1.00 0.00 C ATOM 0 H THR A 751 -12.879 3.240 -2.150 1.00 0.00 H new ATOM 0 HA THR A 751 -10.017 3.839 -2.136 1.00 0.00 H new ATOM 0 HB THR A 751 -12.413 5.606 -1.509 1.00 0.00 H new ATOM 0 HG1 THR A 751 -11.953 6.463 -3.646 1.00 0.00 H new ATOM 0 HG21 THR A 751 -10.823 7.471 -1.800 1.00 0.00 H new ATOM 0 HG22 THR A 751 -10.344 6.400 -0.462 1.00 0.00 H new ATOM 0 HG23 THR A 751 -9.500 6.301 -2.026 1.00 0.00 H new ATOM 1037 N LYS A 752 -11.934 3.533 0.521 1.00 0.00 N ATOM 1038 CA LYS A 752 -11.896 3.363 1.970 1.00 0.00 C ATOM 1039 C LYS A 752 -10.798 2.371 2.335 1.00 0.00 C ATOM 1040 O LYS A 752 -10.026 2.589 3.267 1.00 0.00 O ATOM 1041 CB LYS A 752 -13.249 2.873 2.491 1.00 0.00 C ATOM 1042 CG LYS A 752 -14.385 3.852 2.248 1.00 0.00 C ATOM 1043 CD LYS A 752 -15.699 3.330 2.808 1.00 0.00 C ATOM 1044 CE LYS A 752 -16.824 4.336 2.618 1.00 0.00 C ATOM 1045 NZ LYS A 752 -17.054 4.645 1.181 1.00 0.00 N ATOM 0 H LYS A 752 -12.846 3.365 0.097 1.00 0.00 H new ATOM 0 HA LYS A 752 -11.682 4.325 2.435 1.00 0.00 H new ATOM 0 HB2 LYS A 752 -13.490 1.923 2.014 1.00 0.00 H new ATOM 0 HB3 LYS A 752 -13.169 2.681 3.561 1.00 0.00 H new ATOM 0 HG2 LYS A 752 -14.146 4.810 2.710 1.00 0.00 H new ATOM 0 HG3 LYS A 752 -14.490 4.031 1.178 1.00 0.00 H new ATOM 0 HD2 LYS A 752 -15.960 2.394 2.315 1.00 0.00 H new ATOM 0 HD3 LYS A 752 -15.582 3.110 3.869 1.00 0.00 H new ATOM 0 HE2 LYS A 752 -17.741 3.942 3.056 1.00 0.00 H new ATOM 0 HE3 LYS A 752 -16.584 5.255 3.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 752 -17.947 5.168 1.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 752 -16.269 5.225 0.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 752 -17.107 3.759 0.639 1.00 0.00 H new ATOM 1059 N ARG A 753 -10.745 1.284 1.573 1.00 0.00 N ATOM 1060 CA ARG A 753 -9.746 0.238 1.755 1.00 0.00 C ATOM 1061 C ARG A 753 -9.815 -0.744 0.593 1.00 0.00 C ATOM 1062 O ARG A 753 -10.839 -0.843 -0.084 1.00 0.00 O ATOM 1063 CB ARG A 753 -9.932 -0.495 3.085 1.00 0.00 C ATOM 1064 CG ARG A 753 -8.963 -0.036 4.166 1.00 0.00 C ATOM 1065 CD ARG A 753 -8.951 -0.998 5.344 1.00 0.00 C ATOM 1066 NE ARG A 753 -10.276 -1.147 5.941 1.00 0.00 N ATOM 1067 CZ ARG A 753 -10.514 -1.839 7.052 1.00 0.00 C ATOM 1068 NH1 ARG A 753 -9.521 -2.444 7.689 1.00 0.00 N ATOM 1069 NH2 ARG A 753 -11.749 -1.925 7.527 1.00 0.00 N ATOM 0 H ARG A 753 -11.396 1.103 0.809 1.00 0.00 H new ATOM 0 HA ARG A 753 -8.762 0.707 1.776 1.00 0.00 H new ATOM 0 HB2 ARG A 753 -10.953 -0.345 3.435 1.00 0.00 H new ATOM 0 HB3 ARG A 753 -9.804 -1.565 2.923 1.00 0.00 H new ATOM 0 HG2 ARG A 753 -7.959 0.042 3.748 1.00 0.00 H new ATOM 0 HG3 ARG A 753 -9.244 0.959 4.510 1.00 0.00 H new ATOM 0 HD2 ARG A 753 -8.591 -1.972 5.013 1.00 0.00 H new ATOM 0 HD3 ARG A 753 -8.251 -0.639 6.099 1.00 0.00 H new ATOM 0 HE ARG A 753 -11.065 -0.694 5.479 1.00 0.00 H new ATOM 0 HH11 ARG A 753 -8.569 -2.380 7.328 1.00 0.00 H new ATOM 0 HH12 ARG A 753 -9.709 -2.973 8.540 1.00 0.00 H new ATOM 0 HH21 ARG A 753 -12.516 -1.461 7.041 1.00 0.00 H new ATOM 0 HH22 ARG A 753 -11.932 -2.455 8.379 1.00 0.00 H new ATOM 1083 N ILE A 754 -8.721 -1.459 0.362 1.00 0.00 N ATOM 1084 CA ILE A 754 -8.651 -2.423 -0.731 1.00 0.00 C ATOM 1085 C ILE A 754 -9.868 -3.341 -0.763 1.00 0.00 C ATOM 1086 O ILE A 754 -10.459 -3.649 0.273 1.00 0.00 O ATOM 1087 CB ILE A 754 -7.372 -3.270 -0.644 1.00 0.00 C ATOM 1088 CG1 ILE A 754 -7.310 -4.006 0.697 1.00 0.00 C ATOM 1089 CG2 ILE A 754 -6.155 -2.377 -0.830 1.00 0.00 C ATOM 1090 CD1 ILE A 754 -6.142 -4.961 0.809 1.00 0.00 C ATOM 0 H ILE A 754 -7.868 -1.390 0.917 1.00 0.00 H new ATOM 0 HA ILE A 754 -8.635 -1.844 -1.654 1.00 0.00 H new ATOM 0 HB ILE A 754 -7.381 -4.018 -1.437 1.00 0.00 H new ATOM 0 HG12 ILE A 754 -7.248 -3.273 1.502 1.00 0.00 H new ATOM 0 HG13 ILE A 754 -8.237 -4.560 0.841 1.00 0.00 H new ATOM 0 HG21 ILE A 754 -5.249 -2.979 -0.768 1.00 0.00 H new ATOM 0 HG22 ILE A 754 -6.204 -1.894 -1.806 1.00 0.00 H new ATOM 0 HG23 ILE A 754 -6.139 -1.616 -0.049 1.00 0.00 H new ATOM 0 HD11 ILE A 754 -6.161 -5.447 1.785 1.00 0.00 H new ATOM 0 HD12 ILE A 754 -6.213 -5.716 0.026 1.00 0.00 H new ATOM 0 HD13 ILE A 754 -5.209 -4.409 0.697 1.00 0.00 H new ATOM 1102 N ARG A 755 -10.231 -3.770 -1.966 1.00 0.00 N ATOM 1103 CA ARG A 755 -11.382 -4.646 -2.161 1.00 0.00 C ATOM 1104 C ARG A 755 -10.989 -6.117 -2.058 1.00 0.00 C ATOM 1105 O ARG A 755 -11.829 -7.004 -2.214 1.00 0.00 O ATOM 1106 CB ARG A 755 -12.025 -4.364 -3.524 1.00 0.00 C ATOM 1107 CG ARG A 755 -11.021 -4.122 -4.645 1.00 0.00 C ATOM 1108 CD ARG A 755 -10.366 -5.416 -5.105 1.00 0.00 C ATOM 1109 NE ARG A 755 -9.394 -5.187 -6.173 1.00 0.00 N ATOM 1110 CZ ARG A 755 -8.676 -6.154 -6.735 1.00 0.00 C ATOM 1111 NH1 ARG A 755 -8.817 -7.411 -6.334 1.00 0.00 N ATOM 1112 NH2 ARG A 755 -7.814 -5.866 -7.701 1.00 0.00 N ATOM 0 H ARG A 755 -9.742 -3.524 -2.827 1.00 0.00 H new ATOM 0 HA ARG A 755 -12.103 -4.439 -1.370 1.00 0.00 H new ATOM 0 HB2 ARG A 755 -12.661 -5.207 -3.795 1.00 0.00 H new ATOM 0 HB3 ARG A 755 -12.672 -3.492 -3.435 1.00 0.00 H new ATOM 0 HG2 ARG A 755 -11.525 -3.650 -5.488 1.00 0.00 H new ATOM 0 HG3 ARG A 755 -10.254 -3.428 -4.302 1.00 0.00 H new ATOM 0 HD2 ARG A 755 -9.870 -5.892 -4.259 1.00 0.00 H new ATOM 0 HD3 ARG A 755 -11.133 -6.107 -5.455 1.00 0.00 H new ATOM 0 HE ARG A 755 -9.259 -4.232 -6.505 1.00 0.00 H new ATOM 0 HH11 ARG A 755 -9.479 -7.638 -5.592 1.00 0.00 H new ATOM 0 HH12 ARG A 755 -8.264 -8.150 -6.768 1.00 0.00 H new ATOM 0 HH21 ARG A 755 -7.702 -4.902 -8.013 1.00 0.00 H new ATOM 0 HH22 ARG A 755 -7.264 -6.609 -8.132 1.00 0.00 H new ATOM 1126 N MET A 756 -9.711 -6.372 -1.793 1.00 0.00 N ATOM 1127 CA MET A 756 -9.215 -7.739 -1.672 1.00 0.00 C ATOM 1128 C MET A 756 -8.634 -7.989 -0.284 1.00 0.00 C ATOM 1129 O MET A 756 -8.212 -7.056 0.400 1.00 0.00 O ATOM 1130 CB MET A 756 -8.155 -8.010 -2.742 1.00 0.00 C ATOM 1131 CG MET A 756 -7.731 -9.468 -2.827 1.00 0.00 C ATOM 1132 SD MET A 756 -9.100 -10.568 -3.237 1.00 0.00 S ATOM 1133 CE MET A 756 -8.249 -12.139 -3.357 1.00 0.00 C ATOM 0 H MET A 756 -9.002 -5.652 -1.658 1.00 0.00 H new ATOM 0 HA MET A 756 -10.053 -8.420 -1.818 1.00 0.00 H new ATOM 0 HB2 MET A 756 -8.542 -7.696 -3.712 1.00 0.00 H new ATOM 0 HB3 MET A 756 -7.278 -7.397 -2.535 1.00 0.00 H new ATOM 0 HG2 MET A 756 -6.949 -9.572 -3.579 1.00 0.00 H new ATOM 0 HG3 MET A 756 -7.298 -9.773 -1.874 1.00 0.00 H new ATOM 0 HE1 MET A 756 -8.965 -12.922 -3.606 1.00 0.00 H new ATOM 0 HE2 MET A 756 -7.488 -12.082 -4.135 1.00 0.00 H new ATOM 0 HE3 MET A 756 -7.775 -12.370 -2.403 1.00 0.00 H new ATOM 1143 N ALA A 757 -8.620 -9.252 0.131 1.00 0.00 N ATOM 1144 CA ALA A 757 -8.088 -9.625 1.437 1.00 0.00 C ATOM 1145 C ALA A 757 -6.618 -10.017 1.339 1.00 0.00 C ATOM 1146 O ALA A 757 -6.209 -10.696 0.397 1.00 0.00 O ATOM 1147 CB ALA A 757 -8.902 -10.765 2.031 1.00 0.00 C ATOM 0 H ALA A 757 -8.972 -10.035 -0.419 1.00 0.00 H new ATOM 0 HA ALA A 757 -8.162 -8.758 2.094 1.00 0.00 H new ATOM 0 HB1 ALA A 757 -8.495 -11.034 3.006 1.00 0.00 H new ATOM 0 HB2 ALA A 757 -9.939 -10.450 2.146 1.00 0.00 H new ATOM 0 HB3 ALA A 757 -8.856 -11.629 1.368 1.00 0.00 H new ATOM 1153 N ILE A 758 -5.826 -9.585 2.317 1.00 0.00 N ATOM 1154 CA ILE A 758 -4.400 -9.893 2.336 1.00 0.00 C ATOM 1155 C ILE A 758 -4.171 -11.388 2.531 1.00 0.00 C ATOM 1156 O ILE A 758 -3.381 -12.003 1.815 1.00 0.00 O ATOM 1157 CB ILE A 758 -3.658 -9.122 3.450 1.00 0.00 C ATOM 1158 CG1 ILE A 758 -4.056 -7.645 3.444 1.00 0.00 C ATOM 1159 CG2 ILE A 758 -2.152 -9.265 3.276 1.00 0.00 C ATOM 1160 CD1 ILE A 758 -5.216 -7.324 4.362 1.00 0.00 C ATOM 0 H ILE A 758 -6.147 -9.022 3.105 1.00 0.00 H new ATOM 0 HA ILE A 758 -4.000 -9.581 1.371 1.00 0.00 H new ATOM 0 HB ILE A 758 -3.943 -9.549 4.412 1.00 0.00 H new ATOM 0 HG12 ILE A 758 -3.195 -7.045 3.737 1.00 0.00 H new ATOM 0 HG13 ILE A 758 -4.317 -7.352 2.427 1.00 0.00 H new ATOM 0 HG21 ILE A 758 -1.641 -8.717 4.067 1.00 0.00 H new ATOM 0 HG22 ILE A 758 -1.878 -10.319 3.329 1.00 0.00 H new ATOM 0 HG23 ILE A 758 -1.858 -8.862 2.307 1.00 0.00 H new ATOM 0 HD11 ILE A 758 -5.441 -6.259 4.305 1.00 0.00 H new ATOM 0 HD12 ILE A 758 -6.091 -7.897 4.056 1.00 0.00 H new ATOM 0 HD13 ILE A 758 -4.952 -7.584 5.387 1.00 0.00 H new ATOM 1172 N ASN A 759 -4.868 -11.966 3.504 1.00 0.00 N ATOM 1173 CA ASN A 759 -4.746 -13.390 3.793 1.00 0.00 C ATOM 1174 C ASN A 759 -5.730 -14.200 2.955 1.00 0.00 C ATOM 1175 O ASN A 759 -5.327 -14.693 1.881 1.00 0.00 O ATOM 1176 CB ASN A 759 -4.986 -13.654 5.281 1.00 0.00 C ATOM 1177 CG ASN A 759 -4.966 -15.133 5.617 1.00 0.00 C ATOM 1178 OD1 ASN A 759 -5.992 -15.810 5.548 1.00 0.00 O ATOM 1179 ND2 ASN A 759 -3.796 -15.641 5.986 1.00 0.00 N ATOM 1180 OXT ASN A 759 -6.898 -14.333 3.378 1.00 0.00 O ATOM 0 H ASN A 759 -5.524 -11.469 4.106 1.00 0.00 H new ATOM 0 HA ASN A 759 -3.734 -13.702 3.536 1.00 0.00 H new ATOM 0 HB2 ASN A 759 -4.222 -13.141 5.866 1.00 0.00 H new ATOM 0 HB3 ASN A 759 -5.948 -13.231 5.572 1.00 0.00 H new ATOM 0 HD21 ASN A 759 -3.722 -16.630 6.226 1.00 0.00 H new ATOM 0 HD22 ASN A 759 -2.971 -15.043 6.029 1.00 0.00 H new