USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 869 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 629 HIS : no HD1:sc= -0.234 X(o=-0.23,f=0) USER MOD Single : A 641 THR OG1 : rot 93:sc= 1.21 USER MOD Single : A 644 CYS SG : rot 86:sc= -0.457! USER MOD Single : A 646 MET CE :methyl -159:sc= -0.101 (180deg=-0.962) USER MOD Single : A 648 THR OG1 : rot 77:sc= 0.109! USER MOD Single : A 653 LYS NZ :NH3+ -166:sc= -0.0151 (180deg=-0.267) USER MOD Single : A 661 SER OG : rot 180:sc= 0 USER MOD Single : A 662 THR OG1 : rot 180:sc= 0 USER MOD Single : A 666 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 671 GLN : amide:sc= 1.17 K(o=1.2,f=-0.13) USER MOD Single : A 677 MET CE :methyl -124:sc= -3.17! (180deg=-11!) USER MOD Single : A 684 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 685 SER OG : rot 180:sc= 0 USER MOD Single : A 686 CYS SG : rot 134:sc= -0.393 USER MOD Single : A 691 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 692 HIS :FLIP no HD1:sc= -0.795 F(o=-1.5,f=-0.8) USER MOD Single : A 696 HIS :FLIP no HD1:sc= -0.123 F(o=-0.85,f=-0.12) USER MOD Single : A 718 THR OG1 : rot 180:sc= -0.197 USER MOD Single : A 720 GLN : amide:sc= -3.16! C(o=-3.2!,f=-16!) USER MOD Single : A 722 SER OG : rot -140:sc= -0.116 USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 LYS NZ :NH3+ -146:sc= -1.27 (180deg=-3.01!) USER MOD Single : A 732 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 736 THR OG1 : rot 70:sc= 0.681 USER MOD Single : A 737 THR OG1 : rot 180:sc= 0 USER MOD Single : A 739 GLN : amide:sc= -0.162 X(o=-0.16,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 13 N GLY A 628 -6.748 6.533 10.066 1.00 0.00 N ATOM 14 CA GLY A 628 -5.768 5.644 9.456 1.00 0.00 C ATOM 15 C GLY A 628 -5.376 6.137 8.068 1.00 0.00 C ATOM 16 O GLY A 628 -6.232 6.338 7.206 1.00 0.00 O ATOM 0 HA2 GLY A 628 -4.882 5.584 10.088 1.00 0.00 H new ATOM 0 HA3 GLY A 628 -6.179 4.637 9.386 1.00 0.00 H new ATOM 20 N HIS A 629 -4.078 6.326 7.859 1.00 0.00 N ATOM 21 CA HIS A 629 -3.575 6.789 6.571 1.00 0.00 C ATOM 22 C HIS A 629 -3.134 5.599 5.722 1.00 0.00 C ATOM 23 O HIS A 629 -2.441 4.707 6.209 1.00 0.00 O ATOM 24 CB HIS A 629 -2.384 7.727 6.787 1.00 0.00 C ATOM 25 CG HIS A 629 -2.804 8.915 7.610 1.00 0.00 C ATOM 26 ND1 HIS A 629 -3.476 9.995 7.060 1.00 0.00 N ATOM 27 CD2 HIS A 629 -2.634 9.217 8.939 1.00 0.00 C ATOM 28 CE1 HIS A 629 -3.681 10.889 8.044 1.00 0.00 C ATOM 29 NE2 HIS A 629 -3.187 10.465 9.211 1.00 0.00 N ATOM 0 H HIS A 629 -3.357 6.166 8.562 1.00 0.00 H new ATOM 0 HA HIS A 629 -4.372 7.324 6.054 1.00 0.00 H new ATOM 0 HB2 HIS A 629 -1.577 7.193 7.290 1.00 0.00 H new ATOM 0 HB3 HIS A 629 -1.995 8.060 5.825 1.00 0.00 H new ATOM 0 HD2 HIS A 629 -2.145 8.582 9.663 1.00 0.00 H new ATOM 0 HE1 HIS A 629 -4.184 11.835 7.907 1.00 0.00 H new ATOM 0 HE2 HIS A 629 -3.210 10.951 10.107 1.00 0.00 H new ATOM 38 N ILE A 630 -3.531 5.589 4.455 1.00 0.00 N ATOM 39 CA ILE A 630 -3.156 4.496 3.563 1.00 0.00 C ATOM 40 C ILE A 630 -2.291 5.014 2.420 1.00 0.00 C ATOM 41 O ILE A 630 -2.574 6.065 1.834 1.00 0.00 O ATOM 42 CB ILE A 630 -4.405 3.818 3.002 1.00 0.00 C ATOM 43 CG1 ILE A 630 -5.280 3.347 4.162 1.00 0.00 C ATOM 44 CG2 ILE A 630 -4.002 2.609 2.152 1.00 0.00 C ATOM 45 CD1 ILE A 630 -6.579 2.752 3.616 1.00 0.00 C ATOM 0 H ILE A 630 -4.105 6.315 4.025 1.00 0.00 H new ATOM 0 HA ILE A 630 -2.583 3.767 4.135 1.00 0.00 H new ATOM 0 HB ILE A 630 -4.955 4.526 2.383 1.00 0.00 H new ATOM 0 HG12 ILE A 630 -4.747 2.602 4.753 1.00 0.00 H new ATOM 0 HG13 ILE A 630 -5.502 4.182 4.826 1.00 0.00 H new ATOM 0 HG21 ILE A 630 -4.896 2.129 1.755 1.00 0.00 H new ATOM 0 HG22 ILE A 630 -3.370 2.938 1.327 1.00 0.00 H new ATOM 0 HG23 ILE A 630 -3.452 1.898 2.769 1.00 0.00 H new ATOM 0 HD11 ILE A 630 -7.202 2.416 4.445 1.00 0.00 H new ATOM 0 HD12 ILE A 630 -7.114 3.510 3.044 1.00 0.00 H new ATOM 0 HD13 ILE A 630 -6.348 1.905 2.970 1.00 0.00 H new ATOM 57 N LEU A 631 -1.235 4.275 2.106 1.00 0.00 N ATOM 58 CA LEU A 631 -0.339 4.680 1.033 1.00 0.00 C ATOM 59 C LEU A 631 -0.569 3.832 -0.206 1.00 0.00 C ATOM 60 O LEU A 631 -0.587 2.602 -0.137 1.00 0.00 O ATOM 61 CB LEU A 631 1.123 4.545 1.467 1.00 0.00 C ATOM 62 CG LEU A 631 2.026 5.108 0.366 1.00 0.00 C ATOM 63 CD1 LEU A 631 1.963 6.637 0.386 1.00 0.00 C ATOM 64 CD2 LEU A 631 3.468 4.650 0.600 1.00 0.00 C ATOM 0 H LEU A 631 -0.981 3.404 2.572 1.00 0.00 H new ATOM 0 HA LEU A 631 -0.551 5.724 0.802 1.00 0.00 H new ATOM 0 HB2 LEU A 631 1.289 5.082 2.401 1.00 0.00 H new ATOM 0 HB3 LEU A 631 1.365 3.499 1.653 1.00 0.00 H new ATOM 0 HG LEU A 631 1.685 4.744 -0.603 1.00 0.00 H new ATOM 0 HD11 LEU A 631 2.606 7.038 -0.398 1.00 0.00 H new ATOM 0 HD12 LEU A 631 0.937 6.961 0.215 1.00 0.00 H new ATOM 0 HD13 LEU A 631 2.302 7.002 1.355 1.00 0.00 H new ATOM 0 HD21 LEU A 631 4.109 5.052 -0.185 1.00 0.00 H new ATOM 0 HD22 LEU A 631 3.812 5.011 1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 631 3.511 3.561 0.582 1.00 0.00 H new ATOM 76 N LEU A 632 -0.733 4.497 -1.341 1.00 0.00 N ATOM 77 CA LEU A 632 -0.949 3.794 -2.592 1.00 0.00 C ATOM 78 C LEU A 632 0.044 4.272 -3.641 1.00 0.00 C ATOM 79 O LEU A 632 0.103 5.458 -3.963 1.00 0.00 O ATOM 80 CB LEU A 632 -2.380 4.016 -3.086 1.00 0.00 C ATOM 81 CG LEU A 632 -2.658 3.093 -4.278 1.00 0.00 C ATOM 82 CD1 LEU A 632 -4.110 2.610 -4.228 1.00 0.00 C ATOM 83 CD2 LEU A 632 -2.430 3.862 -5.583 1.00 0.00 C ATOM 0 H LEU A 632 -0.720 5.514 -1.419 1.00 0.00 H new ATOM 0 HA LEU A 632 -0.798 2.728 -2.422 1.00 0.00 H new ATOM 0 HB2 LEU A 632 -3.089 3.814 -2.283 1.00 0.00 H new ATOM 0 HB3 LEU A 632 -2.518 5.057 -3.378 1.00 0.00 H new ATOM 0 HG LEU A 632 -1.986 2.236 -4.233 1.00 0.00 H new ATOM 0 HD11 LEU A 632 -4.305 1.954 -5.077 1.00 0.00 H new ATOM 0 HD12 LEU A 632 -4.280 2.063 -3.300 1.00 0.00 H new ATOM 0 HD13 LEU A 632 -4.781 3.468 -4.271 1.00 0.00 H new ATOM 0 HD21 LEU A 632 -2.627 3.206 -6.431 1.00 0.00 H new ATOM 0 HD22 LEU A 632 -3.102 4.719 -5.623 1.00 0.00 H new ATOM 0 HD23 LEU A 632 -1.398 4.209 -5.625 1.00 0.00 H new ATOM 95 N LEU A 633 0.821 3.337 -4.168 1.00 0.00 N ATOM 96 CA LEU A 633 1.809 3.660 -5.186 1.00 0.00 C ATOM 97 C LEU A 633 1.371 3.077 -6.518 1.00 0.00 C ATOM 98 O LEU A 633 1.170 1.867 -6.635 1.00 0.00 O ATOM 99 CB LEU A 633 3.172 3.084 -4.794 1.00 0.00 C ATOM 100 CG LEU A 633 4.239 3.569 -5.777 1.00 0.00 C ATOM 101 CD1 LEU A 633 4.704 4.967 -5.378 1.00 0.00 C ATOM 102 CD2 LEU A 633 5.431 2.614 -5.751 1.00 0.00 C ATOM 0 H LEU A 633 0.787 2.351 -3.908 1.00 0.00 H new ATOM 0 HA LEU A 633 1.894 4.743 -5.273 1.00 0.00 H new ATOM 0 HB2 LEU A 633 3.430 3.392 -3.781 1.00 0.00 H new ATOM 0 HB3 LEU A 633 3.131 1.995 -4.795 1.00 0.00 H new ATOM 0 HG LEU A 633 3.817 3.598 -6.781 1.00 0.00 H new ATOM 0 HD11 LEU A 633 5.464 5.311 -6.079 1.00 0.00 H new ATOM 0 HD12 LEU A 633 3.856 5.652 -5.397 1.00 0.00 H new ATOM 0 HD13 LEU A 633 5.124 4.938 -4.373 1.00 0.00 H new ATOM 0 HD21 LEU A 633 6.190 2.961 -6.452 1.00 0.00 H new ATOM 0 HD22 LEU A 633 5.851 2.584 -4.746 1.00 0.00 H new ATOM 0 HD23 LEU A 633 5.103 1.615 -6.037 1.00 0.00 H new ATOM 114 N GLU A 634 1.212 3.933 -7.519 1.00 0.00 N ATOM 115 CA GLU A 634 0.784 3.459 -8.826 1.00 0.00 C ATOM 116 C GLU A 634 1.140 4.458 -9.923 1.00 0.00 C ATOM 117 O GLU A 634 1.479 5.610 -9.650 1.00 0.00 O ATOM 118 CB GLU A 634 -0.727 3.199 -8.808 1.00 0.00 C ATOM 119 CG GLU A 634 -1.143 2.496 -10.102 1.00 0.00 C ATOM 120 CD GLU A 634 -2.629 2.157 -10.067 1.00 0.00 C ATOM 121 OE1 GLU A 634 -3.267 2.463 -9.073 1.00 0.00 O ATOM 122 OE2 GLU A 634 -3.107 1.588 -11.035 1.00 0.00 O ATOM 0 H GLU A 634 1.369 4.939 -7.454 1.00 0.00 H new ATOM 0 HA GLU A 634 1.309 2.529 -9.045 1.00 0.00 H new ATOM 0 HB2 GLU A 634 -0.990 2.584 -7.947 1.00 0.00 H new ATOM 0 HB3 GLU A 634 -1.267 4.140 -8.704 1.00 0.00 H new ATOM 0 HG2 GLU A 634 -0.930 3.138 -10.957 1.00 0.00 H new ATOM 0 HG3 GLU A 634 -0.558 1.585 -10.233 1.00 0.00 H new ATOM 129 N GLU A 635 1.057 3.998 -11.166 1.00 0.00 N ATOM 130 CA GLU A 635 1.363 4.836 -12.317 1.00 0.00 C ATOM 131 C GLU A 635 0.076 5.200 -13.054 1.00 0.00 C ATOM 132 O GLU A 635 -0.950 4.543 -12.885 1.00 0.00 O ATOM 133 CB GLU A 635 2.304 4.086 -13.261 1.00 0.00 C ATOM 134 CG GLU A 635 3.605 3.754 -12.527 1.00 0.00 C ATOM 135 CD GLU A 635 4.579 3.059 -13.474 1.00 0.00 C ATOM 136 OE1 GLU A 635 4.210 2.840 -14.616 1.00 0.00 O ATOM 137 OE2 GLU A 635 5.677 2.749 -13.041 1.00 0.00 O ATOM 0 H GLU A 635 0.779 3.045 -11.402 1.00 0.00 H new ATOM 0 HA GLU A 635 1.847 5.751 -11.975 1.00 0.00 H new ATOM 0 HB2 GLU A 635 1.829 3.170 -13.613 1.00 0.00 H new ATOM 0 HB3 GLU A 635 2.515 4.694 -14.140 1.00 0.00 H new ATOM 0 HG2 GLU A 635 4.054 4.667 -12.136 1.00 0.00 H new ATOM 0 HG3 GLU A 635 3.395 3.111 -11.672 1.00 0.00 H new ATOM 144 N GLU A 636 0.130 6.253 -13.864 1.00 0.00 N ATOM 145 CA GLU A 636 -1.050 6.688 -14.607 1.00 0.00 C ATOM 146 C GLU A 636 -2.059 7.311 -13.646 1.00 0.00 C ATOM 147 O GLU A 636 -2.679 6.614 -12.842 1.00 0.00 O ATOM 148 CB GLU A 636 -1.683 5.490 -15.320 1.00 0.00 C ATOM 149 CG GLU A 636 -2.562 5.971 -16.477 1.00 0.00 C ATOM 150 CD GLU A 636 -1.690 6.470 -17.626 1.00 0.00 C ATOM 151 OE1 GLU A 636 -0.549 6.048 -17.706 1.00 0.00 O ATOM 152 OE2 GLU A 636 -2.181 7.262 -18.415 1.00 0.00 O ATOM 0 H GLU A 636 0.966 6.815 -14.022 1.00 0.00 H new ATOM 0 HA GLU A 636 -0.756 7.430 -15.349 1.00 0.00 H new ATOM 0 HB2 GLU A 636 -0.904 4.827 -15.696 1.00 0.00 H new ATOM 0 HB3 GLU A 636 -2.280 4.912 -14.615 1.00 0.00 H new ATOM 0 HG2 GLU A 636 -3.200 5.157 -16.821 1.00 0.00 H new ATOM 0 HG3 GLU A 636 -3.220 6.770 -16.136 1.00 0.00 H new ATOM 159 N ASP A 637 -2.198 8.630 -13.725 1.00 0.00 N ATOM 160 CA ASP A 637 -3.111 9.359 -12.848 1.00 0.00 C ATOM 161 C ASP A 637 -4.546 8.847 -12.960 1.00 0.00 C ATOM 162 O ASP A 637 -5.264 8.790 -11.963 1.00 0.00 O ATOM 163 CB ASP A 637 -3.081 10.844 -13.208 1.00 0.00 C ATOM 164 CG ASP A 637 -3.565 11.024 -14.641 1.00 0.00 C ATOM 165 OD1 ASP A 637 -3.410 10.095 -15.416 1.00 0.00 O ATOM 166 OD2 ASP A 637 -4.081 12.088 -14.944 1.00 0.00 O ATOM 0 H ASP A 637 -1.691 9.217 -14.387 1.00 0.00 H new ATOM 0 HA ASP A 637 -2.778 9.204 -11.822 1.00 0.00 H new ATOM 0 HB2 ASP A 637 -3.715 11.409 -12.524 1.00 0.00 H new ATOM 0 HB3 ASP A 637 -2.069 11.235 -13.102 1.00 0.00 H new ATOM 171 N GLU A 638 -4.971 8.489 -14.167 1.00 0.00 N ATOM 172 CA GLU A 638 -6.335 8.005 -14.358 1.00 0.00 C ATOM 173 C GLU A 638 -6.560 6.705 -13.599 1.00 0.00 C ATOM 174 O GLU A 638 -7.594 6.524 -12.958 1.00 0.00 O ATOM 175 CB GLU A 638 -6.616 7.778 -15.842 1.00 0.00 C ATOM 176 CG GLU A 638 -8.074 7.337 -16.015 1.00 0.00 C ATOM 177 CD GLU A 638 -8.360 7.017 -17.479 1.00 0.00 C ATOM 178 OE1 GLU A 638 -7.448 7.139 -18.280 1.00 0.00 O ATOM 179 OE2 GLU A 638 -9.487 6.654 -17.776 1.00 0.00 O ATOM 0 H GLU A 638 -4.404 8.523 -15.014 1.00 0.00 H new ATOM 0 HA GLU A 638 -7.016 8.763 -13.971 1.00 0.00 H new ATOM 0 HB2 GLU A 638 -6.431 8.693 -16.404 1.00 0.00 H new ATOM 0 HB3 GLU A 638 -5.944 7.018 -16.240 1.00 0.00 H new ATOM 0 HG2 GLU A 638 -8.271 6.460 -15.399 1.00 0.00 H new ATOM 0 HG3 GLU A 638 -8.743 8.126 -15.671 1.00 0.00 H new ATOM 186 N ALA A 639 -5.588 5.806 -13.671 1.00 0.00 N ATOM 187 CA ALA A 639 -5.695 4.528 -12.979 1.00 0.00 C ATOM 188 C ALA A 639 -5.556 4.718 -11.475 1.00 0.00 C ATOM 189 O ALA A 639 -6.214 4.035 -10.689 1.00 0.00 O ATOM 190 CB ALA A 639 -4.611 3.572 -13.477 1.00 0.00 C ATOM 0 H ALA A 639 -4.723 5.935 -14.197 1.00 0.00 H new ATOM 0 HA ALA A 639 -6.677 4.105 -13.190 1.00 0.00 H new ATOM 0 HB1 ALA A 639 -4.698 2.619 -12.955 1.00 0.00 H new ATOM 0 HB2 ALA A 639 -4.732 3.411 -14.548 1.00 0.00 H new ATOM 0 HB3 ALA A 639 -3.629 4.003 -13.284 1.00 0.00 H new ATOM 196 N ALA A 640 -4.686 5.641 -11.081 1.00 0.00 N ATOM 197 CA ALA A 640 -4.456 5.907 -9.666 1.00 0.00 C ATOM 198 C ALA A 640 -5.684 6.542 -9.022 1.00 0.00 C ATOM 199 O ALA A 640 -6.068 6.182 -7.909 1.00 0.00 O ATOM 200 CB ALA A 640 -3.250 6.834 -9.498 1.00 0.00 C ATOM 0 H ALA A 640 -4.132 6.214 -11.717 1.00 0.00 H new ATOM 0 HA ALA A 640 -4.258 4.957 -9.170 1.00 0.00 H new ATOM 0 HB1 ALA A 640 -3.085 7.028 -8.438 1.00 0.00 H new ATOM 0 HB2 ALA A 640 -2.365 6.360 -9.922 1.00 0.00 H new ATOM 0 HB3 ALA A 640 -3.440 7.775 -10.014 1.00 0.00 H new ATOM 206 N THR A 641 -6.295 7.489 -9.725 1.00 0.00 N ATOM 207 CA THR A 641 -7.476 8.165 -9.204 1.00 0.00 C ATOM 208 C THR A 641 -8.625 7.181 -9.018 1.00 0.00 C ATOM 209 O THR A 641 -9.294 7.186 -7.985 1.00 0.00 O ATOM 210 CB THR A 641 -7.906 9.274 -10.168 1.00 0.00 C ATOM 211 OG1 THR A 641 -6.799 10.123 -10.432 1.00 0.00 O ATOM 212 CG2 THR A 641 -9.039 10.092 -9.546 1.00 0.00 C ATOM 0 H THR A 641 -5.996 7.803 -10.648 1.00 0.00 H new ATOM 0 HA THR A 641 -7.225 8.596 -8.235 1.00 0.00 H new ATOM 0 HB THR A 641 -8.256 8.827 -11.099 1.00 0.00 H new ATOM 0 HG1 THR A 641 -6.338 9.818 -11.241 1.00 0.00 H new ATOM 0 HG21 THR A 641 -9.341 10.880 -10.237 1.00 0.00 H new ATOM 0 HG22 THR A 641 -9.890 9.441 -9.344 1.00 0.00 H new ATOM 0 HG23 THR A 641 -8.695 10.539 -8.613 1.00 0.00 H new ATOM 220 N VAL A 642 -8.849 6.341 -10.025 1.00 0.00 N ATOM 221 CA VAL A 642 -9.924 5.360 -9.963 1.00 0.00 C ATOM 222 C VAL A 642 -9.773 4.466 -8.734 1.00 0.00 C ATOM 223 O VAL A 642 -10.702 4.335 -7.937 1.00 0.00 O ATOM 224 CB VAL A 642 -9.909 4.507 -11.232 1.00 0.00 C ATOM 225 CG1 VAL A 642 -10.954 3.397 -11.120 1.00 0.00 C ATOM 226 CG2 VAL A 642 -10.230 5.390 -12.442 1.00 0.00 C ATOM 0 H VAL A 642 -8.304 6.321 -10.887 1.00 0.00 H new ATOM 0 HA VAL A 642 -10.875 5.888 -9.887 1.00 0.00 H new ATOM 0 HB VAL A 642 -8.922 4.061 -11.356 1.00 0.00 H new ATOM 0 HG11 VAL A 642 -10.940 2.791 -12.026 1.00 0.00 H new ATOM 0 HG12 VAL A 642 -10.726 2.768 -10.260 1.00 0.00 H new ATOM 0 HG13 VAL A 642 -11.942 3.839 -10.994 1.00 0.00 H new ATOM 0 HG21 VAL A 642 -10.220 4.784 -13.348 1.00 0.00 H new ATOM 0 HG22 VAL A 642 -11.216 5.836 -12.315 1.00 0.00 H new ATOM 0 HG23 VAL A 642 -9.483 6.179 -12.525 1.00 0.00 H new ATOM 236 N VAL A 643 -8.598 3.856 -8.581 1.00 0.00 N ATOM 237 CA VAL A 643 -8.351 2.983 -7.435 1.00 0.00 C ATOM 238 C VAL A 643 -8.479 3.766 -6.133 1.00 0.00 C ATOM 239 O VAL A 643 -9.144 3.327 -5.197 1.00 0.00 O ATOM 240 CB VAL A 643 -6.955 2.361 -7.520 1.00 0.00 C ATOM 241 CG1 VAL A 643 -6.720 1.477 -6.294 1.00 0.00 C ATOM 242 CG2 VAL A 643 -6.845 1.508 -8.784 1.00 0.00 C ATOM 0 H VAL A 643 -7.813 3.948 -9.226 1.00 0.00 H new ATOM 0 HA VAL A 643 -9.096 2.187 -7.451 1.00 0.00 H new ATOM 0 HB VAL A 643 -6.208 3.154 -7.553 1.00 0.00 H new ATOM 0 HG11 VAL A 643 -5.727 1.032 -6.351 1.00 0.00 H new ATOM 0 HG12 VAL A 643 -6.796 2.081 -5.390 1.00 0.00 H new ATOM 0 HG13 VAL A 643 -7.470 0.687 -6.266 1.00 0.00 H new ATOM 0 HG21 VAL A 643 -5.850 1.067 -8.840 1.00 0.00 H new ATOM 0 HG22 VAL A 643 -7.592 0.715 -8.754 1.00 0.00 H new ATOM 0 HG23 VAL A 643 -7.015 2.133 -9.661 1.00 0.00 H new ATOM 252 N CYS A 644 -7.840 4.931 -6.086 1.00 0.00 N ATOM 253 CA CYS A 644 -7.889 5.772 -4.897 1.00 0.00 C ATOM 254 C CYS A 644 -9.308 6.269 -4.666 1.00 0.00 C ATOM 255 O CYS A 644 -9.715 6.504 -3.530 1.00 0.00 O ATOM 256 CB CYS A 644 -6.939 6.963 -5.056 1.00 0.00 C ATOM 257 SG CYS A 644 -5.255 6.357 -5.333 1.00 0.00 S ATOM 0 H CYS A 644 -7.286 5.312 -6.853 1.00 0.00 H new ATOM 0 HA CYS A 644 -7.576 5.181 -4.036 1.00 0.00 H new ATOM 0 HB2 CYS A 644 -7.255 7.585 -5.893 1.00 0.00 H new ATOM 0 HB3 CYS A 644 -6.970 7.589 -4.164 1.00 0.00 H new ATOM 0 HG CYS A 644 -5.081 6.124 -6.600 1.00 0.00 H new ATOM 263 N GLU A 645 -10.059 6.428 -5.752 1.00 0.00 N ATOM 264 CA GLU A 645 -11.431 6.903 -5.644 1.00 0.00 C ATOM 265 C GLU A 645 -12.273 5.933 -4.825 1.00 0.00 C ATOM 266 O GLU A 645 -13.033 6.347 -3.950 1.00 0.00 O ATOM 267 CB GLU A 645 -12.060 7.044 -7.032 1.00 0.00 C ATOM 268 CG GLU A 645 -13.437 7.696 -6.885 1.00 0.00 C ATOM 269 CD GLU A 645 -14.201 7.631 -8.203 1.00 0.00 C ATOM 270 OE1 GLU A 645 -13.616 7.208 -9.186 1.00 0.00 O ATOM 271 OE2 GLU A 645 -15.363 8.007 -8.209 1.00 0.00 O ATOM 0 H GLU A 645 -9.745 6.237 -6.704 1.00 0.00 H new ATOM 0 HA GLU A 645 -11.407 7.874 -5.149 1.00 0.00 H new ATOM 0 HB2 GLU A 645 -11.422 7.650 -7.676 1.00 0.00 H new ATOM 0 HB3 GLU A 645 -12.154 6.066 -7.505 1.00 0.00 H new ATOM 0 HG2 GLU A 645 -14.004 7.190 -6.104 1.00 0.00 H new ATOM 0 HG3 GLU A 645 -13.323 8.735 -6.575 1.00 0.00 H new ATOM 278 N MET A 646 -12.141 4.641 -5.116 1.00 0.00 N ATOM 279 CA MET A 646 -12.905 3.630 -4.395 1.00 0.00 C ATOM 280 C MET A 646 -12.407 3.497 -2.959 1.00 0.00 C ATOM 281 O MET A 646 -13.205 3.405 -2.025 1.00 0.00 O ATOM 282 CB MET A 646 -12.793 2.281 -5.104 1.00 0.00 C ATOM 283 CG MET A 646 -13.309 2.406 -6.540 1.00 0.00 C ATOM 284 SD MET A 646 -14.978 3.116 -6.537 1.00 0.00 S ATOM 285 CE MET A 646 -15.814 1.773 -5.656 1.00 0.00 C ATOM 0 H MET A 646 -11.520 4.274 -5.837 1.00 0.00 H new ATOM 0 HA MET A 646 -13.949 3.943 -4.375 1.00 0.00 H new ATOM 0 HB2 MET A 646 -11.755 1.947 -5.108 1.00 0.00 H new ATOM 0 HB3 MET A 646 -13.368 1.528 -4.565 1.00 0.00 H new ATOM 0 HG2 MET A 646 -12.637 3.036 -7.123 1.00 0.00 H new ATOM 0 HG3 MET A 646 -13.322 1.426 -7.018 1.00 0.00 H new ATOM 0 HE1 MET A 646 -16.884 1.813 -5.862 1.00 0.00 H new ATOM 0 HE2 MET A 646 -15.416 0.815 -5.990 1.00 0.00 H new ATOM 0 HE3 MET A 646 -15.647 1.881 -4.584 1.00 0.00 H new ATOM 295 N LEU A 647 -11.086 3.496 -2.779 1.00 0.00 N ATOM 296 CA LEU A 647 -10.523 3.383 -1.438 1.00 0.00 C ATOM 297 C LEU A 647 -10.866 4.632 -0.639 1.00 0.00 C ATOM 298 O LEU A 647 -11.261 4.552 0.524 1.00 0.00 O ATOM 299 CB LEU A 647 -9.001 3.217 -1.503 1.00 0.00 C ATOM 300 CG LEU A 647 -8.650 1.989 -2.346 1.00 0.00 C ATOM 301 CD1 LEU A 647 -7.133 1.785 -2.349 1.00 0.00 C ATOM 302 CD2 LEU A 647 -9.327 0.753 -1.754 1.00 0.00 C ATOM 0 H LEU A 647 -10.399 3.571 -3.530 1.00 0.00 H new ATOM 0 HA LEU A 647 -10.948 2.504 -0.952 1.00 0.00 H new ATOM 0 HB2 LEU A 647 -8.547 4.108 -1.935 1.00 0.00 H new ATOM 0 HB3 LEU A 647 -8.594 3.108 -0.498 1.00 0.00 H new ATOM 0 HG LEU A 647 -8.998 2.141 -3.368 1.00 0.00 H new ATOM 0 HD11 LEU A 647 -6.885 0.910 -2.950 1.00 0.00 H new ATOM 0 HD12 LEU A 647 -6.648 2.665 -2.772 1.00 0.00 H new ATOM 0 HD13 LEU A 647 -6.784 1.634 -1.327 1.00 0.00 H new ATOM 0 HD21 LEU A 647 -9.077 -0.122 -2.355 1.00 0.00 H new ATOM 0 HD22 LEU A 647 -8.980 0.603 -0.732 1.00 0.00 H new ATOM 0 HD23 LEU A 647 -10.408 0.895 -1.753 1.00 0.00 H new ATOM 314 N THR A 648 -10.735 5.786 -1.288 1.00 0.00 N ATOM 315 CA THR A 648 -11.058 7.052 -0.645 1.00 0.00 C ATOM 316 C THR A 648 -12.489 7.004 -0.132 1.00 0.00 C ATOM 317 O THR A 648 -12.792 7.481 0.963 1.00 0.00 O ATOM 318 CB THR A 648 -10.901 8.199 -1.649 1.00 0.00 C ATOM 319 OG1 THR A 648 -9.577 8.196 -2.164 1.00 0.00 O ATOM 320 CG2 THR A 648 -11.172 9.538 -0.961 1.00 0.00 C ATOM 0 H THR A 648 -10.410 5.869 -2.251 1.00 0.00 H new ATOM 0 HA THR A 648 -10.379 7.220 0.191 1.00 0.00 H new ATOM 0 HB THR A 648 -11.615 8.062 -2.461 1.00 0.00 H new ATOM 0 HG1 THR A 648 -9.488 7.487 -2.835 1.00 0.00 H new ATOM 0 HG21 THR A 648 -11.058 10.347 -1.682 1.00 0.00 H new ATOM 0 HG22 THR A 648 -12.188 9.545 -0.565 1.00 0.00 H new ATOM 0 HG23 THR A 648 -10.464 9.677 -0.144 1.00 0.00 H new ATOM 328 N ALA A 649 -13.360 6.410 -0.939 1.00 0.00 N ATOM 329 CA ALA A 649 -14.763 6.275 -0.582 1.00 0.00 C ATOM 330 C ALA A 649 -14.936 5.241 0.528 1.00 0.00 C ATOM 331 O ALA A 649 -15.944 5.237 1.235 1.00 0.00 O ATOM 332 CB ALA A 649 -15.571 5.855 -1.812 1.00 0.00 C ATOM 0 H ALA A 649 -13.116 6.014 -1.847 1.00 0.00 H new ATOM 0 HA ALA A 649 -15.126 7.237 -0.221 1.00 0.00 H new ATOM 0 HB1 ALA A 649 -16.622 5.755 -1.540 1.00 0.00 H new ATOM 0 HB2 ALA A 649 -15.468 6.611 -2.591 1.00 0.00 H new ATOM 0 HB3 ALA A 649 -15.199 4.900 -2.183 1.00 0.00 H new ATOM 338 N ALA A 650 -13.948 4.359 0.671 1.00 0.00 N ATOM 339 CA ALA A 650 -14.007 3.319 1.694 1.00 0.00 C ATOM 340 C ALA A 650 -13.976 3.932 3.094 1.00 0.00 C ATOM 341 O ALA A 650 -14.123 3.227 4.093 1.00 0.00 O ATOM 342 CB ALA A 650 -12.823 2.362 1.533 1.00 0.00 C ATOM 0 H ALA A 650 -13.105 4.344 0.097 1.00 0.00 H new ATOM 0 HA ALA A 650 -14.942 2.772 1.571 1.00 0.00 H new ATOM 0 HB1 ALA A 650 -12.873 1.589 2.300 1.00 0.00 H new ATOM 0 HB2 ALA A 650 -12.861 1.899 0.547 1.00 0.00 H new ATOM 0 HB3 ALA A 650 -11.890 2.916 1.638 1.00 0.00 H new ATOM 348 N GLY A 651 -13.798 5.247 3.158 1.00 0.00 N ATOM 349 CA GLY A 651 -13.763 5.944 4.440 1.00 0.00 C ATOM 350 C GLY A 651 -12.334 6.288 4.851 1.00 0.00 C ATOM 351 O GLY A 651 -12.117 7.160 5.691 1.00 0.00 O ATOM 0 H GLY A 651 -13.676 5.849 2.344 1.00 0.00 H new ATOM 0 HA2 GLY A 651 -14.354 6.858 4.375 1.00 0.00 H new ATOM 0 HA3 GLY A 651 -14.223 5.321 5.207 1.00 0.00 H new ATOM 355 N PHE A 652 -11.368 5.600 4.254 1.00 0.00 N ATOM 356 CA PHE A 652 -9.961 5.844 4.563 1.00 0.00 C ATOM 357 C PHE A 652 -9.338 6.757 3.507 1.00 0.00 C ATOM 358 O PHE A 652 -9.782 6.775 2.361 1.00 0.00 O ATOM 359 CB PHE A 652 -9.201 4.516 4.606 1.00 0.00 C ATOM 360 CG PHE A 652 -9.739 3.654 5.727 1.00 0.00 C ATOM 361 CD1 PHE A 652 -10.873 2.857 5.519 1.00 0.00 C ATOM 362 CD2 PHE A 652 -9.094 3.642 6.970 1.00 0.00 C ATOM 363 CE1 PHE A 652 -11.362 2.050 6.554 1.00 0.00 C ATOM 364 CE2 PHE A 652 -9.584 2.837 8.004 1.00 0.00 C ATOM 365 CZ PHE A 652 -10.717 2.040 7.797 1.00 0.00 C ATOM 0 H PHE A 652 -11.530 4.873 3.557 1.00 0.00 H new ATOM 0 HA PHE A 652 -9.895 6.331 5.536 1.00 0.00 H new ATOM 0 HB2 PHE A 652 -9.304 3.996 3.653 1.00 0.00 H new ATOM 0 HB3 PHE A 652 -8.137 4.700 4.755 1.00 0.00 H new ATOM 0 HD1 PHE A 652 -11.370 2.865 4.560 1.00 0.00 H new ATOM 0 HD2 PHE A 652 -8.219 4.254 7.130 1.00 0.00 H new ATOM 0 HE1 PHE A 652 -12.236 1.436 6.394 1.00 0.00 H new ATOM 0 HE2 PHE A 652 -9.088 2.830 8.963 1.00 0.00 H new ATOM 0 HZ PHE A 652 -11.093 1.418 8.596 1.00 0.00 H new ATOM 375 N LYS A 653 -8.313 7.514 3.895 1.00 0.00 N ATOM 376 CA LYS A 653 -7.657 8.421 2.955 1.00 0.00 C ATOM 377 C LYS A 653 -6.476 7.735 2.272 1.00 0.00 C ATOM 378 O LYS A 653 -5.622 7.141 2.929 1.00 0.00 O ATOM 379 CB LYS A 653 -7.167 9.670 3.685 1.00 0.00 C ATOM 380 CG LYS A 653 -8.368 10.446 4.229 1.00 0.00 C ATOM 381 CD LYS A 653 -7.888 11.742 4.887 1.00 0.00 C ATOM 382 CE LYS A 653 -9.066 12.439 5.570 1.00 0.00 C ATOM 383 NZ LYS A 653 -10.068 12.849 4.545 1.00 0.00 N ATOM 0 H LYS A 653 -7.924 7.519 4.838 1.00 0.00 H new ATOM 0 HA LYS A 653 -8.385 8.705 2.195 1.00 0.00 H new ATOM 0 HB2 LYS A 653 -6.501 9.390 4.501 1.00 0.00 H new ATOM 0 HB3 LYS A 653 -6.591 10.299 3.006 1.00 0.00 H new ATOM 0 HG2 LYS A 653 -9.063 10.673 3.421 1.00 0.00 H new ATOM 0 HG3 LYS A 653 -8.909 9.837 4.954 1.00 0.00 H new ATOM 0 HD2 LYS A 653 -7.109 11.524 5.617 1.00 0.00 H new ATOM 0 HD3 LYS A 653 -7.448 12.400 4.138 1.00 0.00 H new ATOM 0 HE2 LYS A 653 -9.527 11.769 6.296 1.00 0.00 H new ATOM 0 HE3 LYS A 653 -8.715 13.312 6.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 653 -10.741 13.520 4.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 653 -9.581 13.303 3.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 653 -10.582 12.010 4.207 1.00 0.00 H new ATOM 397 N VAL A 654 -6.443 7.819 0.946 1.00 0.00 N ATOM 398 CA VAL A 654 -5.375 7.201 0.168 1.00 0.00 C ATOM 399 C VAL A 654 -4.616 8.252 -0.636 1.00 0.00 C ATOM 400 O VAL A 654 -5.223 9.093 -1.300 1.00 0.00 O ATOM 401 CB VAL A 654 -5.977 6.167 -0.785 1.00 0.00 C ATOM 402 CG1 VAL A 654 -4.863 5.339 -1.423 1.00 0.00 C ATOM 403 CG2 VAL A 654 -6.921 5.246 -0.006 1.00 0.00 C ATOM 0 H VAL A 654 -7.143 8.308 0.388 1.00 0.00 H new ATOM 0 HA VAL A 654 -4.678 6.717 0.852 1.00 0.00 H new ATOM 0 HB VAL A 654 -6.533 6.680 -1.569 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -5.298 4.604 -2.101 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -4.195 5.996 -1.980 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -4.300 4.825 -0.644 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -7.351 4.508 -0.684 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -6.365 4.736 0.780 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -7.720 5.838 0.441 1.00 0.00 H new ATOM 413 N ILE A 655 -3.287 8.193 -0.589 1.00 0.00 N ATOM 414 CA ILE A 655 -2.472 9.145 -1.339 1.00 0.00 C ATOM 415 C ILE A 655 -1.795 8.438 -2.511 1.00 0.00 C ATOM 416 O ILE A 655 -1.273 7.333 -2.362 1.00 0.00 O ATOM 417 CB ILE A 655 -1.404 9.785 -0.437 1.00 0.00 C ATOM 418 CG1 ILE A 655 -2.054 10.361 0.828 1.00 0.00 C ATOM 419 CG2 ILE A 655 -0.699 10.916 -1.195 1.00 0.00 C ATOM 420 CD1 ILE A 655 -3.239 11.252 0.447 1.00 0.00 C ATOM 0 H ILE A 655 -2.759 7.508 -0.049 1.00 0.00 H new ATOM 0 HA ILE A 655 -3.126 9.932 -1.714 1.00 0.00 H new ATOM 0 HB ILE A 655 -0.681 9.020 -0.155 1.00 0.00 H new ATOM 0 HG12 ILE A 655 -2.390 9.551 1.475 1.00 0.00 H new ATOM 0 HG13 ILE A 655 -1.322 10.937 1.393 1.00 0.00 H new ATOM 0 HG21 ILE A 655 0.057 11.368 -0.553 1.00 0.00 H new ATOM 0 HG22 ILE A 655 -0.223 10.513 -2.089 1.00 0.00 H new ATOM 0 HG23 ILE A 655 -1.430 11.672 -1.482 1.00 0.00 H new ATOM 0 HD11 ILE A 655 -3.695 11.657 1.350 1.00 0.00 H new ATOM 0 HD12 ILE A 655 -2.891 12.071 -0.182 1.00 0.00 H new ATOM 0 HD13 ILE A 655 -3.976 10.663 -0.099 1.00 0.00 H new ATOM 432 N TRP A 656 -1.814 9.078 -3.677 1.00 0.00 N ATOM 433 CA TRP A 656 -1.199 8.492 -4.862 1.00 0.00 C ATOM 434 C TRP A 656 0.262 8.908 -4.966 1.00 0.00 C ATOM 435 O TRP A 656 0.570 10.081 -5.176 1.00 0.00 O ATOM 436 CB TRP A 656 -1.941 8.949 -6.123 1.00 0.00 C ATOM 437 CG TRP A 656 -1.182 8.499 -7.334 1.00 0.00 C ATOM 438 CD1 TRP A 656 -0.722 7.243 -7.533 1.00 0.00 C ATOM 439 CD2 TRP A 656 -0.780 9.271 -8.509 1.00 0.00 C ATOM 440 NE1 TRP A 656 -0.071 7.192 -8.752 1.00 0.00 N ATOM 441 CE2 TRP A 656 -0.079 8.414 -9.390 1.00 0.00 C ATOM 442 CE3 TRP A 656 -0.956 10.614 -8.894 1.00 0.00 C ATOM 443 CZ2 TRP A 656 0.432 8.871 -10.606 1.00 0.00 C ATOM 444 CZ3 TRP A 656 -0.442 11.076 -10.118 1.00 0.00 C ATOM 445 CH2 TRP A 656 0.249 10.207 -10.972 1.00 0.00 C ATOM 0 H TRP A 656 -2.243 9.991 -3.825 1.00 0.00 H new ATOM 0 HA TRP A 656 -1.259 7.407 -4.775 1.00 0.00 H new ATOM 0 HB2 TRP A 656 -2.949 8.534 -6.136 1.00 0.00 H new ATOM 0 HB3 TRP A 656 -2.043 10.034 -6.126 1.00 0.00 H new ATOM 0 HD1 TRP A 656 -0.843 6.415 -6.851 1.00 0.00 H new ATOM 0 HE1 TRP A 656 0.363 6.351 -9.133 1.00 0.00 H new ATOM 0 HE3 TRP A 656 -1.489 11.293 -8.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 656 0.965 8.196 -11.260 1.00 0.00 H new ATOM 0 HZ3 TRP A 656 -0.581 12.109 -10.402 1.00 0.00 H new ATOM 0 HH2 TRP A 656 0.640 10.569 -11.912 1.00 0.00 H new ATOM 456 N LEU A 657 1.162 7.941 -4.833 1.00 0.00 N ATOM 457 CA LEU A 657 2.585 8.230 -4.933 1.00 0.00 C ATOM 458 C LEU A 657 3.166 7.591 -6.184 1.00 0.00 C ATOM 459 O LEU A 657 2.866 6.440 -6.508 1.00 0.00 O ATOM 460 CB LEU A 657 3.333 7.721 -3.698 1.00 0.00 C ATOM 461 CG LEU A 657 3.257 8.765 -2.583 1.00 0.00 C ATOM 462 CD1 LEU A 657 3.955 10.051 -3.035 1.00 0.00 C ATOM 463 CD2 LEU A 657 1.794 9.070 -2.262 1.00 0.00 C ATOM 0 H LEU A 657 0.935 6.962 -4.658 1.00 0.00 H new ATOM 0 HA LEU A 657 2.707 9.312 -4.993 1.00 0.00 H new ATOM 0 HB2 LEU A 657 2.898 6.781 -3.359 1.00 0.00 H new ATOM 0 HB3 LEU A 657 4.374 7.518 -3.949 1.00 0.00 H new ATOM 0 HG LEU A 657 3.751 8.375 -1.693 1.00 0.00 H new ATOM 0 HD11 LEU A 657 3.900 10.794 -2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 657 5.000 9.838 -3.261 1.00 0.00 H new ATOM 0 HD13 LEU A 657 3.463 10.438 -3.927 1.00 0.00 H new ATOM 0 HD21 LEU A 657 1.743 9.814 -1.467 1.00 0.00 H new ATOM 0 HD22 LEU A 657 1.299 9.456 -3.153 1.00 0.00 H new ATOM 0 HD23 LEU A 657 1.295 8.157 -1.937 1.00 0.00 H new ATOM 475 N VAL A 658 3.993 8.351 -6.886 1.00 0.00 N ATOM 476 CA VAL A 658 4.615 7.864 -8.107 1.00 0.00 C ATOM 477 C VAL A 658 6.132 7.824 -7.940 1.00 0.00 C ATOM 478 O VAL A 658 6.872 7.807 -8.918 1.00 0.00 O ATOM 479 CB VAL A 658 4.243 8.778 -9.279 1.00 0.00 C ATOM 480 CG1 VAL A 658 5.080 10.057 -9.214 1.00 0.00 C ATOM 481 CG2 VAL A 658 4.512 8.054 -10.603 1.00 0.00 C ATOM 0 H VAL A 658 4.248 9.305 -6.632 1.00 0.00 H new ATOM 0 HA VAL A 658 4.255 6.856 -8.312 1.00 0.00 H new ATOM 0 HB VAL A 658 3.185 9.033 -9.217 1.00 0.00 H new ATOM 0 HG11 VAL A 658 4.816 10.708 -10.048 1.00 0.00 H new ATOM 0 HG12 VAL A 658 4.883 10.573 -8.274 1.00 0.00 H new ATOM 0 HG13 VAL A 658 6.138 9.803 -9.274 1.00 0.00 H new ATOM 0 HG21 VAL A 658 4.247 8.706 -11.435 1.00 0.00 H new ATOM 0 HG22 VAL A 658 5.569 7.795 -10.668 1.00 0.00 H new ATOM 0 HG23 VAL A 658 3.912 7.145 -10.649 1.00 0.00 H new ATOM 491 N ASP A 659 6.582 7.816 -6.686 1.00 0.00 N ATOM 492 CA ASP A 659 8.010 7.788 -6.387 1.00 0.00 C ATOM 493 C ASP A 659 8.263 7.082 -5.057 1.00 0.00 C ATOM 494 O ASP A 659 7.322 6.717 -4.353 1.00 0.00 O ATOM 495 CB ASP A 659 8.558 9.214 -6.314 1.00 0.00 C ATOM 496 CG ASP A 659 8.532 9.865 -7.692 1.00 0.00 C ATOM 497 OD1 ASP A 659 8.579 9.140 -8.670 1.00 0.00 O ATOM 498 OD2 ASP A 659 8.461 11.081 -7.748 1.00 0.00 O ATOM 0 H ASP A 659 5.979 7.829 -5.864 1.00 0.00 H new ATOM 0 HA ASP A 659 8.517 7.243 -7.183 1.00 0.00 H new ATOM 0 HB2 ASP A 659 7.964 9.803 -5.615 1.00 0.00 H new ATOM 0 HB3 ASP A 659 9.578 9.199 -5.931 1.00 0.00 H new ATOM 503 N GLY A 660 9.537 6.885 -4.725 1.00 0.00 N ATOM 504 CA GLY A 660 9.897 6.208 -3.482 1.00 0.00 C ATOM 505 C GLY A 660 10.416 7.179 -2.417 1.00 0.00 C ATOM 506 O GLY A 660 9.817 7.317 -1.351 1.00 0.00 O ATOM 0 H GLY A 660 10.330 7.181 -5.293 1.00 0.00 H new ATOM 0 HA2 GLY A 660 9.026 5.679 -3.094 1.00 0.00 H new ATOM 0 HA3 GLY A 660 10.660 5.457 -3.688 1.00 0.00 H new ATOM 510 N SER A 661 11.544 7.828 -2.701 1.00 0.00 N ATOM 511 CA SER A 661 12.149 8.759 -1.746 1.00 0.00 C ATOM 512 C SER A 661 11.188 9.882 -1.356 1.00 0.00 C ATOM 513 O SER A 661 11.171 10.322 -0.204 1.00 0.00 O ATOM 514 CB SER A 661 13.420 9.362 -2.346 1.00 0.00 C ATOM 515 OG SER A 661 14.086 10.135 -1.357 1.00 0.00 O ATOM 0 H SER A 661 12.056 7.729 -3.578 1.00 0.00 H new ATOM 0 HA SER A 661 12.390 8.196 -0.844 1.00 0.00 H new ATOM 0 HB2 SER A 661 14.076 8.570 -2.708 1.00 0.00 H new ATOM 0 HB3 SER A 661 13.170 9.986 -3.204 1.00 0.00 H new ATOM 0 HG SER A 661 14.902 10.521 -1.738 1.00 0.00 H new ATOM 521 N THR A 662 10.394 10.350 -2.310 1.00 0.00 N ATOM 522 CA THR A 662 9.449 11.422 -2.029 1.00 0.00 C ATOM 523 C THR A 662 8.422 10.973 -0.994 1.00 0.00 C ATOM 524 O THR A 662 8.033 11.741 -0.111 1.00 0.00 O ATOM 525 CB THR A 662 8.733 11.839 -3.314 1.00 0.00 C ATOM 526 OG1 THR A 662 9.695 12.188 -4.298 1.00 0.00 O ATOM 527 CG2 THR A 662 7.831 13.041 -3.029 1.00 0.00 C ATOM 0 H THR A 662 10.384 10.010 -3.272 1.00 0.00 H new ATOM 0 HA THR A 662 10.002 12.273 -1.630 1.00 0.00 H new ATOM 0 HB THR A 662 8.126 11.010 -3.678 1.00 0.00 H new ATOM 0 HG1 THR A 662 9.238 12.454 -5.123 1.00 0.00 H new ATOM 0 HG21 THR A 662 7.321 13.338 -3.945 1.00 0.00 H new ATOM 0 HG22 THR A 662 7.093 12.771 -2.274 1.00 0.00 H new ATOM 0 HG23 THR A 662 8.436 13.871 -2.665 1.00 0.00 H new ATOM 535 N ALA A 663 7.988 9.723 -1.110 1.00 0.00 N ATOM 536 CA ALA A 663 7.006 9.181 -0.181 1.00 0.00 C ATOM 537 C ALA A 663 7.571 9.141 1.232 1.00 0.00 C ATOM 538 O ALA A 663 6.874 9.432 2.198 1.00 0.00 O ATOM 539 CB ALA A 663 6.599 7.771 -0.613 1.00 0.00 C ATOM 0 H ALA A 663 8.298 9.072 -1.831 1.00 0.00 H new ATOM 0 HA ALA A 663 6.129 9.829 -0.190 1.00 0.00 H new ATOM 0 HB1 ALA A 663 5.864 7.374 0.087 1.00 0.00 H new ATOM 0 HB2 ALA A 663 6.165 7.808 -1.612 1.00 0.00 H new ATOM 0 HB3 ALA A 663 7.477 7.126 -0.623 1.00 0.00 H new ATOM 545 N LEU A 664 8.841 8.781 1.342 1.00 0.00 N ATOM 546 CA LEU A 664 9.490 8.708 2.644 1.00 0.00 C ATOM 547 C LEU A 664 9.457 10.057 3.346 1.00 0.00 C ATOM 548 O LEU A 664 9.259 10.130 4.560 1.00 0.00 O ATOM 549 CB LEU A 664 10.939 8.254 2.475 1.00 0.00 C ATOM 550 CG LEU A 664 10.957 6.861 1.852 1.00 0.00 C ATOM 551 CD1 LEU A 664 12.396 6.345 1.802 1.00 0.00 C ATOM 552 CD2 LEU A 664 10.103 5.916 2.700 1.00 0.00 C ATOM 0 H LEU A 664 9.439 8.537 0.553 1.00 0.00 H new ATOM 0 HA LEU A 664 8.948 7.987 3.256 1.00 0.00 H new ATOM 0 HB2 LEU A 664 11.481 8.956 1.842 1.00 0.00 H new ATOM 0 HB3 LEU A 664 11.444 8.240 3.441 1.00 0.00 H new ATOM 0 HG LEU A 664 10.553 6.907 0.840 1.00 0.00 H new ATOM 0 HD11 LEU A 664 12.410 5.350 1.357 1.00 0.00 H new ATOM 0 HD12 LEU A 664 13.004 7.020 1.200 1.00 0.00 H new ATOM 0 HD13 LEU A 664 12.800 6.296 2.813 1.00 0.00 H new ATOM 0 HD21 LEU A 664 10.114 4.920 2.257 1.00 0.00 H new ATOM 0 HD22 LEU A 664 10.508 5.868 3.711 1.00 0.00 H new ATOM 0 HD23 LEU A 664 9.078 6.286 2.736 1.00 0.00 H new ATOM 564 N ASP A 665 9.658 11.120 2.581 1.00 0.00 N ATOM 565 CA ASP A 665 9.658 12.461 3.150 1.00 0.00 C ATOM 566 C ASP A 665 8.301 12.810 3.750 1.00 0.00 C ATOM 567 O ASP A 665 8.219 13.314 4.871 1.00 0.00 O ATOM 568 CB ASP A 665 10.004 13.481 2.068 1.00 0.00 C ATOM 569 CG ASP A 665 11.448 13.291 1.623 1.00 0.00 C ATOM 570 OD1 ASP A 665 12.151 12.532 2.270 1.00 0.00 O ATOM 571 OD2 ASP A 665 11.829 13.902 0.639 1.00 0.00 O ATOM 0 H ASP A 665 9.822 11.082 1.575 1.00 0.00 H new ATOM 0 HA ASP A 665 10.405 12.487 3.944 1.00 0.00 H new ATOM 0 HB2 ASP A 665 9.333 13.364 1.217 1.00 0.00 H new ATOM 0 HB3 ASP A 665 9.861 14.492 2.449 1.00 0.00 H new ATOM 576 N GLN A 666 7.235 12.552 3.001 1.00 0.00 N ATOM 577 CA GLN A 666 5.893 12.860 3.483 1.00 0.00 C ATOM 578 C GLN A 666 5.288 11.691 4.248 1.00 0.00 C ATOM 579 O GLN A 666 4.657 11.879 5.289 1.00 0.00 O ATOM 580 CB GLN A 666 4.988 13.223 2.312 1.00 0.00 C ATOM 581 CG GLN A 666 5.437 14.559 1.715 1.00 0.00 C ATOM 582 CD GLN A 666 4.450 14.998 0.642 1.00 0.00 C ATOM 583 OE1 GLN A 666 3.687 14.107 0.075 1.00 0.00 O flip ATOM 584 NE2 GLN A 666 4.380 16.181 0.305 1.00 0.00 N flip ATOM 0 H GLN A 666 7.271 12.136 2.070 1.00 0.00 H new ATOM 0 HA GLN A 666 5.975 13.707 4.165 1.00 0.00 H new ATOM 0 HB2 GLN A 666 5.027 12.442 1.553 1.00 0.00 H new ATOM 0 HB3 GLN A 666 3.953 13.291 2.646 1.00 0.00 H new ATOM 0 HG2 GLN A 666 5.499 15.316 2.497 1.00 0.00 H new ATOM 0 HG3 GLN A 666 6.435 14.460 1.287 1.00 0.00 H new ATOM 0 HE21 GLN A 666 4.979 16.875 0.752 1.00 0.00 H new ATOM 0 HE22 GLN A 666 3.723 16.466 -0.421 1.00 0.00 H new ATOM 593 N LEU A 667 5.469 10.489 3.723 1.00 0.00 N ATOM 594 CA LEU A 667 4.920 9.303 4.366 1.00 0.00 C ATOM 595 C LEU A 667 5.283 9.265 5.844 1.00 0.00 C ATOM 596 O LEU A 667 4.481 8.835 6.673 1.00 0.00 O ATOM 597 CB LEU A 667 5.420 8.033 3.686 1.00 0.00 C ATOM 598 CG LEU A 667 4.702 6.837 4.307 1.00 0.00 C ATOM 599 CD1 LEU A 667 4.434 5.781 3.235 1.00 0.00 C ATOM 600 CD2 LEU A 667 5.578 6.233 5.407 1.00 0.00 C ATOM 0 H LEU A 667 5.986 10.308 2.862 1.00 0.00 H new ATOM 0 HA LEU A 667 3.835 9.353 4.270 1.00 0.00 H new ATOM 0 HB2 LEU A 667 5.227 8.076 2.614 1.00 0.00 H new ATOM 0 HB3 LEU A 667 6.498 7.935 3.812 1.00 0.00 H new ATOM 0 HG LEU A 667 3.754 7.167 4.732 1.00 0.00 H new ATOM 0 HD11 LEU A 667 3.922 4.930 3.683 1.00 0.00 H new ATOM 0 HD12 LEU A 667 3.809 6.209 2.451 1.00 0.00 H new ATOM 0 HD13 LEU A 667 5.380 5.450 2.806 1.00 0.00 H new ATOM 0 HD21 LEU A 667 5.067 5.379 5.851 1.00 0.00 H new ATOM 0 HD22 LEU A 667 6.526 5.906 4.979 1.00 0.00 H new ATOM 0 HD23 LEU A 667 5.766 6.983 6.175 1.00 0.00 H new ATOM 612 N ASP A 668 6.489 9.711 6.176 1.00 0.00 N ATOM 613 CA ASP A 668 6.915 9.707 7.569 1.00 0.00 C ATOM 614 C ASP A 668 5.922 10.490 8.415 1.00 0.00 C ATOM 615 O ASP A 668 5.634 10.123 9.555 1.00 0.00 O ATOM 616 CB ASP A 668 8.304 10.334 7.700 1.00 0.00 C ATOM 617 CG ASP A 668 8.754 10.293 9.158 1.00 0.00 C ATOM 618 OD1 ASP A 668 8.024 9.745 9.967 1.00 0.00 O ATOM 619 OD2 ASP A 668 9.821 10.810 9.444 1.00 0.00 O ATOM 0 H ASP A 668 7.176 10.073 5.515 1.00 0.00 H new ATOM 0 HA ASP A 668 6.956 8.676 7.919 1.00 0.00 H new ATOM 0 HB2 ASP A 668 9.016 9.796 7.075 1.00 0.00 H new ATOM 0 HB3 ASP A 668 8.283 11.364 7.345 1.00 0.00 H new ATOM 624 N LEU A 669 5.395 11.564 7.844 1.00 0.00 N ATOM 625 CA LEU A 669 4.424 12.388 8.546 1.00 0.00 C ATOM 626 C LEU A 669 3.051 11.717 8.533 1.00 0.00 C ATOM 627 O LEU A 669 2.227 11.951 9.418 1.00 0.00 O ATOM 628 CB LEU A 669 4.341 13.771 7.890 1.00 0.00 C ATOM 629 CG LEU A 669 5.724 14.427 7.906 1.00 0.00 C ATOM 630 CD1 LEU A 669 5.613 15.885 7.455 1.00 0.00 C ATOM 631 CD2 LEU A 669 6.300 14.379 9.321 1.00 0.00 C ATOM 0 H LEU A 669 5.622 11.883 6.902 1.00 0.00 H new ATOM 0 HA LEU A 669 4.745 12.505 9.581 1.00 0.00 H new ATOM 0 HB2 LEU A 669 3.983 13.678 6.865 1.00 0.00 H new ATOM 0 HB3 LEU A 669 3.624 14.396 8.423 1.00 0.00 H new ATOM 0 HG LEU A 669 6.381 13.886 7.225 1.00 0.00 H new ATOM 0 HD11 LEU A 669 6.601 16.346 7.469 1.00 0.00 H new ATOM 0 HD12 LEU A 669 5.209 15.923 6.444 1.00 0.00 H new ATOM 0 HD13 LEU A 669 4.951 16.426 8.131 1.00 0.00 H new ATOM 0 HD21 LEU A 669 7.285 14.847 9.329 1.00 0.00 H new ATOM 0 HD22 LEU A 669 5.638 14.915 10.002 1.00 0.00 H new ATOM 0 HD23 LEU A 669 6.389 13.341 9.643 1.00 0.00 H new ATOM 643 N LEU A 670 2.812 10.886 7.517 1.00 0.00 N ATOM 644 CA LEU A 670 1.532 10.190 7.386 1.00 0.00 C ATOM 645 C LEU A 670 1.391 9.065 8.417 1.00 0.00 C ATOM 646 O LEU A 670 0.287 8.775 8.875 1.00 0.00 O ATOM 647 CB LEU A 670 1.401 9.607 5.975 1.00 0.00 C ATOM 648 CG LEU A 670 1.579 10.711 4.934 1.00 0.00 C ATOM 649 CD1 LEU A 670 1.254 10.156 3.545 1.00 0.00 C ATOM 650 CD2 LEU A 670 0.639 11.879 5.251 1.00 0.00 C ATOM 0 H LEU A 670 3.484 10.680 6.778 1.00 0.00 H new ATOM 0 HA LEU A 670 0.739 10.916 7.566 1.00 0.00 H new ATOM 0 HB2 LEU A 670 2.149 8.829 5.823 1.00 0.00 H new ATOM 0 HB3 LEU A 670 0.424 9.138 5.856 1.00 0.00 H new ATOM 0 HG LEU A 670 2.610 11.064 4.955 1.00 0.00 H new ATOM 0 HD11 LEU A 670 1.380 10.942 2.800 1.00 0.00 H new ATOM 0 HD12 LEU A 670 1.926 9.329 3.317 1.00 0.00 H new ATOM 0 HD13 LEU A 670 0.223 9.801 3.527 1.00 0.00 H new ATOM 0 HD21 LEU A 670 0.770 12.664 4.506 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -0.394 11.530 5.233 1.00 0.00 H new ATOM 0 HD23 LEU A 670 0.871 12.275 6.240 1.00 0.00 H new ATOM 662 N GLN A 671 2.502 8.424 8.773 1.00 0.00 N ATOM 663 CA GLN A 671 2.457 7.328 9.742 1.00 0.00 C ATOM 664 C GLN A 671 1.317 6.370 9.401 1.00 0.00 C ATOM 665 O GLN A 671 0.408 6.148 10.203 1.00 0.00 O ATOM 666 CB GLN A 671 2.250 7.880 11.155 1.00 0.00 C ATOM 667 CG GLN A 671 3.374 8.864 11.494 1.00 0.00 C ATOM 668 CD GLN A 671 4.584 8.108 12.035 1.00 0.00 C ATOM 669 OE1 GLN A 671 4.506 7.485 13.094 1.00 0.00 O ATOM 670 NE2 GLN A 671 5.704 8.126 11.367 1.00 0.00 N ATOM 0 H GLN A 671 3.432 8.639 8.412 1.00 0.00 H new ATOM 0 HA GLN A 671 3.405 6.791 9.700 1.00 0.00 H new ATOM 0 HB2 GLN A 671 1.284 8.379 11.223 1.00 0.00 H new ATOM 0 HB3 GLN A 671 2.238 7.063 11.877 1.00 0.00 H new ATOM 0 HG2 GLN A 671 3.655 9.428 10.605 1.00 0.00 H new ATOM 0 HG3 GLN A 671 3.026 9.586 12.233 1.00 0.00 H new ATOM 0 HE21 GLN A 671 5.766 8.643 10.490 1.00 0.00 H new ATOM 0 HE22 GLN A 671 6.518 7.623 11.722 1.00 0.00 H new ATOM 679 N PRO A 672 1.358 5.816 8.224 1.00 0.00 N ATOM 680 CA PRO A 672 0.316 4.870 7.722 1.00 0.00 C ATOM 681 C PRO A 672 0.407 3.488 8.371 1.00 0.00 C ATOM 682 O PRO A 672 1.488 3.038 8.752 1.00 0.00 O ATOM 683 CB PRO A 672 0.598 4.793 6.220 1.00 0.00 C ATOM 684 CG PRO A 672 2.045 5.137 6.064 1.00 0.00 C ATOM 685 CD PRO A 672 2.419 6.039 7.240 1.00 0.00 C ATOM 0 HA PRO A 672 -0.691 5.213 7.959 1.00 0.00 H new ATOM 0 HB2 PRO A 672 0.388 3.796 5.832 1.00 0.00 H new ATOM 0 HB3 PRO A 672 -0.032 5.489 5.667 1.00 0.00 H new ATOM 0 HG2 PRO A 672 2.657 4.235 6.060 1.00 0.00 H new ATOM 0 HG3 PRO A 672 2.220 5.646 5.116 1.00 0.00 H new ATOM 0 HD2 PRO A 672 3.397 5.779 7.645 1.00 0.00 H new ATOM 0 HD3 PRO A 672 2.467 7.085 6.938 1.00 0.00 H new ATOM 693 N ILE A 673 -0.741 2.821 8.488 1.00 0.00 N ATOM 694 CA ILE A 673 -0.793 1.489 9.084 1.00 0.00 C ATOM 695 C ILE A 673 -0.866 0.414 8.001 1.00 0.00 C ATOM 696 O ILE A 673 -0.565 -0.753 8.250 1.00 0.00 O ATOM 697 CB ILE A 673 -2.016 1.373 9.998 1.00 0.00 C ATOM 698 CG1 ILE A 673 -3.291 1.443 9.153 1.00 0.00 C ATOM 699 CG2 ILE A 673 -2.013 2.512 11.015 1.00 0.00 C ATOM 700 CD1 ILE A 673 -4.518 1.329 10.063 1.00 0.00 C ATOM 0 H ILE A 673 -1.644 3.181 8.179 1.00 0.00 H new ATOM 0 HA ILE A 673 0.116 1.340 9.667 1.00 0.00 H new ATOM 0 HB ILE A 673 -1.981 0.421 10.528 1.00 0.00 H new ATOM 0 HG12 ILE A 673 -3.322 2.382 8.600 1.00 0.00 H new ATOM 0 HG13 ILE A 673 -3.296 0.639 8.417 1.00 0.00 H new ATOM 0 HG21 ILE A 673 -2.886 2.424 11.662 1.00 0.00 H new ATOM 0 HG22 ILE A 673 -1.107 2.459 11.618 1.00 0.00 H new ATOM 0 HG23 ILE A 673 -2.045 3.467 10.491 1.00 0.00 H new ATOM 0 HD11 ILE A 673 -5.424 1.379 9.460 1.00 0.00 H new ATOM 0 HD12 ILE A 673 -4.489 0.379 10.596 1.00 0.00 H new ATOM 0 HD13 ILE A 673 -4.515 2.148 10.782 1.00 0.00 H new ATOM 712 N VAL A 674 -1.269 0.818 6.801 1.00 0.00 N ATOM 713 CA VAL A 674 -1.386 -0.116 5.685 1.00 0.00 C ATOM 714 C VAL A 674 -0.827 0.506 4.410 1.00 0.00 C ATOM 715 O VAL A 674 -1.059 1.683 4.129 1.00 0.00 O ATOM 716 CB VAL A 674 -2.858 -0.493 5.489 1.00 0.00 C ATOM 717 CG1 VAL A 674 -3.023 -1.328 4.215 1.00 0.00 C ATOM 718 CG2 VAL A 674 -3.335 -1.308 6.696 1.00 0.00 C ATOM 0 H VAL A 674 -1.519 1.781 6.576 1.00 0.00 H new ATOM 0 HA VAL A 674 -0.810 -1.014 5.909 1.00 0.00 H new ATOM 0 HB VAL A 674 -3.451 0.417 5.397 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -4.073 -1.590 4.085 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -2.685 -0.750 3.355 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -2.429 -2.238 4.297 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -4.382 -1.579 6.561 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -2.735 -2.213 6.784 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -3.228 -0.712 7.603 1.00 0.00 H new ATOM 728 N ILE A 675 -0.079 -0.284 3.647 1.00 0.00 N ATOM 729 CA ILE A 675 0.516 0.218 2.416 1.00 0.00 C ATOM 730 C ILE A 675 0.175 -0.680 1.229 1.00 0.00 C ATOM 731 O ILE A 675 0.542 -1.855 1.199 1.00 0.00 O ATOM 732 CB ILE A 675 2.034 0.294 2.573 1.00 0.00 C ATOM 733 CG1 ILE A 675 2.379 1.151 3.793 1.00 0.00 C ATOM 734 CG2 ILE A 675 2.646 0.927 1.322 1.00 0.00 C ATOM 735 CD1 ILE A 675 3.887 1.108 4.031 1.00 0.00 C ATOM 0 H ILE A 675 0.127 -1.261 3.856 1.00 0.00 H new ATOM 0 HA ILE A 675 0.109 1.211 2.224 1.00 0.00 H new ATOM 0 HB ILE A 675 2.434 -0.711 2.707 1.00 0.00 H new ATOM 0 HG12 ILE A 675 2.054 2.179 3.633 1.00 0.00 H new ATOM 0 HG13 ILE A 675 1.850 0.782 4.672 1.00 0.00 H new ATOM 0 HG21 ILE A 675 3.729 0.981 1.434 1.00 0.00 H new ATOM 0 HG22 ILE A 675 2.401 0.320 0.450 1.00 0.00 H new ATOM 0 HG23 ILE A 675 2.244 1.932 1.189 1.00 0.00 H new ATOM 0 HD11 ILE A 675 4.136 1.718 4.900 1.00 0.00 H new ATOM 0 HD12 ILE A 675 4.198 0.079 4.209 1.00 0.00 H new ATOM 0 HD13 ILE A 675 4.405 1.497 3.154 1.00 0.00 H new ATOM 747 N LEU A 676 -0.514 -0.110 0.248 1.00 0.00 N ATOM 748 CA LEU A 676 -0.892 -0.848 -0.950 1.00 0.00 C ATOM 749 C LEU A 676 -0.012 -0.423 -2.118 1.00 0.00 C ATOM 750 O LEU A 676 0.155 0.769 -2.372 1.00 0.00 O ATOM 751 CB LEU A 676 -2.358 -0.562 -1.280 1.00 0.00 C ATOM 752 CG LEU A 676 -2.847 -1.511 -2.377 1.00 0.00 C ATOM 753 CD1 LEU A 676 -4.333 -1.796 -2.163 1.00 0.00 C ATOM 754 CD2 LEU A 676 -2.655 -0.859 -3.752 1.00 0.00 C ATOM 0 H LEU A 676 -0.823 0.862 0.259 1.00 0.00 H new ATOM 0 HA LEU A 676 -0.759 -1.915 -0.774 1.00 0.00 H new ATOM 0 HB2 LEU A 676 -2.970 -0.682 -0.386 1.00 0.00 H new ATOM 0 HB3 LEU A 676 -2.470 0.472 -1.607 1.00 0.00 H new ATOM 0 HG LEU A 676 -2.277 -2.439 -2.334 1.00 0.00 H new ATOM 0 HD11 LEU A 676 -4.690 -2.472 -2.941 1.00 0.00 H new ATOM 0 HD12 LEU A 676 -4.478 -2.258 -1.186 1.00 0.00 H new ATOM 0 HD13 LEU A 676 -4.893 -0.862 -2.209 1.00 0.00 H new ATOM 0 HD21 LEU A 676 -3.005 -1.539 -4.529 1.00 0.00 H new ATOM 0 HD22 LEU A 676 -3.226 0.069 -3.798 1.00 0.00 H new ATOM 0 HD23 LEU A 676 -1.598 -0.643 -3.908 1.00 0.00 H new ATOM 766 N MET A 677 0.549 -1.393 -2.831 1.00 0.00 N ATOM 767 CA MET A 677 1.405 -1.071 -3.967 1.00 0.00 C ATOM 768 C MET A 677 1.140 -1.999 -5.146 1.00 0.00 C ATOM 769 O MET A 677 1.076 -3.223 -4.994 1.00 0.00 O ATOM 770 CB MET A 677 2.874 -1.175 -3.558 1.00 0.00 C ATOM 771 CG MET A 677 3.189 -0.098 -2.521 1.00 0.00 C ATOM 772 SD MET A 677 4.955 -0.125 -2.137 1.00 0.00 S ATOM 773 CE MET A 677 4.952 1.293 -1.018 1.00 0.00 C ATOM 0 H MET A 677 0.431 -2.390 -2.648 1.00 0.00 H new ATOM 0 HA MET A 677 1.178 -0.051 -4.277 1.00 0.00 H new ATOM 0 HB2 MET A 677 3.079 -2.163 -3.146 1.00 0.00 H new ATOM 0 HB3 MET A 677 3.516 -1.054 -4.431 1.00 0.00 H new ATOM 0 HG2 MET A 677 2.904 0.883 -2.902 1.00 0.00 H new ATOM 0 HG3 MET A 677 2.607 -0.269 -1.616 1.00 0.00 H new ATOM 0 HE1 MET A 677 5.668 2.036 -1.370 1.00 0.00 H new ATOM 0 HE2 MET A 677 3.955 1.733 -0.992 1.00 0.00 H new ATOM 0 HE3 MET A 677 5.231 0.967 -0.016 1.00 0.00 H new ATOM 783 N ALA A 678 1.006 -1.406 -6.325 1.00 0.00 N ATOM 784 CA ALA A 678 0.781 -2.180 -7.535 1.00 0.00 C ATOM 785 C ALA A 678 2.052 -2.932 -7.907 1.00 0.00 C ATOM 786 O ALA A 678 3.157 -2.479 -7.609 1.00 0.00 O ATOM 787 CB ALA A 678 0.366 -1.260 -8.685 1.00 0.00 C ATOM 0 H ALA A 678 1.049 -0.397 -6.467 1.00 0.00 H new ATOM 0 HA ALA A 678 -0.021 -2.895 -7.352 1.00 0.00 H new ATOM 0 HB1 ALA A 678 0.201 -1.853 -9.584 1.00 0.00 H new ATOM 0 HB2 ALA A 678 -0.554 -0.739 -8.420 1.00 0.00 H new ATOM 0 HB3 ALA A 678 1.155 -0.531 -8.871 1.00 0.00 H new ATOM 793 N TRP A 679 1.900 -4.077 -8.557 1.00 0.00 N ATOM 794 CA TRP A 679 3.065 -4.857 -8.953 1.00 0.00 C ATOM 795 C TRP A 679 3.186 -4.989 -10.471 1.00 0.00 C ATOM 796 O TRP A 679 4.283 -5.199 -10.987 1.00 0.00 O ATOM 797 CB TRP A 679 3.022 -6.250 -8.325 1.00 0.00 C ATOM 798 CG TRP A 679 4.407 -6.622 -7.915 1.00 0.00 C ATOM 799 CD1 TRP A 679 5.074 -7.729 -8.313 1.00 0.00 C ATOM 800 CD2 TRP A 679 5.311 -5.886 -7.047 1.00 0.00 C ATOM 801 NE1 TRP A 679 6.334 -7.717 -7.740 1.00 0.00 N ATOM 802 CE2 TRP A 679 6.526 -6.600 -6.950 1.00 0.00 C ATOM 803 CE3 TRP A 679 5.192 -4.677 -6.342 1.00 0.00 C ATOM 804 CZ2 TRP A 679 7.587 -6.130 -6.177 1.00 0.00 C ATOM 805 CZ3 TRP A 679 6.256 -4.201 -5.564 1.00 0.00 C ATOM 806 CH2 TRP A 679 7.452 -4.925 -5.483 1.00 0.00 C ATOM 0 H TRP A 679 1.000 -4.481 -8.818 1.00 0.00 H new ATOM 0 HA TRP A 679 3.940 -4.317 -8.590 1.00 0.00 H new ATOM 0 HB2 TRP A 679 2.356 -6.257 -7.462 1.00 0.00 H new ATOM 0 HB3 TRP A 679 2.629 -6.976 -9.037 1.00 0.00 H new ATOM 0 HD1 TRP A 679 4.688 -8.495 -8.969 1.00 0.00 H new ATOM 0 HE1 TRP A 679 7.035 -8.444 -7.883 1.00 0.00 H new ATOM 0 HE3 TRP A 679 4.274 -4.110 -6.400 1.00 0.00 H new ATOM 0 HZ2 TRP A 679 8.506 -6.693 -6.115 1.00 0.00 H new ATOM 0 HZ3 TRP A 679 6.153 -3.271 -5.024 1.00 0.00 H new ATOM 0 HH2 TRP A 679 8.270 -4.552 -4.884 1.00 0.00 H new ATOM 817 N PRO A 680 2.105 -4.879 -11.197 1.00 0.00 N ATOM 818 CA PRO A 680 2.138 -5.002 -12.681 1.00 0.00 C ATOM 819 C PRO A 680 3.234 -4.150 -13.332 1.00 0.00 C ATOM 820 O PRO A 680 3.882 -4.600 -14.278 1.00 0.00 O ATOM 821 CB PRO A 680 0.742 -4.564 -13.121 1.00 0.00 C ATOM 822 CG PRO A 680 -0.134 -4.833 -11.941 1.00 0.00 C ATOM 823 CD PRO A 680 0.738 -4.640 -10.700 1.00 0.00 C ATOM 0 HA PRO A 680 2.381 -6.018 -12.993 1.00 0.00 H new ATOM 0 HB2 PRO A 680 0.726 -3.508 -13.393 1.00 0.00 H new ATOM 0 HB3 PRO A 680 0.410 -5.123 -13.996 1.00 0.00 H new ATOM 0 HG2 PRO A 680 -0.985 -4.152 -11.927 1.00 0.00 H new ATOM 0 HG3 PRO A 680 -0.536 -5.845 -11.979 1.00 0.00 H new ATOM 0 HD2 PRO A 680 0.631 -3.637 -10.287 1.00 0.00 H new ATOM 0 HD3 PRO A 680 0.471 -5.341 -9.909 1.00 0.00 H new ATOM 831 N PRO A 681 3.467 -2.946 -12.861 1.00 0.00 N ATOM 832 CA PRO A 681 4.523 -2.069 -13.443 1.00 0.00 C ATOM 833 C PRO A 681 5.923 -2.647 -13.229 1.00 0.00 C ATOM 834 O PRO A 681 6.146 -3.413 -12.292 1.00 0.00 O ATOM 835 CB PRO A 681 4.377 -0.737 -12.699 1.00 0.00 C ATOM 836 CG PRO A 681 3.076 -0.803 -11.973 1.00 0.00 C ATOM 837 CD PRO A 681 2.773 -2.283 -11.748 1.00 0.00 C ATOM 0 HA PRO A 681 4.404 -1.966 -14.522 1.00 0.00 H new ATOM 0 HB2 PRO A 681 5.203 -0.588 -12.004 1.00 0.00 H new ATOM 0 HB3 PRO A 681 4.391 0.101 -13.396 1.00 0.00 H new ATOM 0 HG2 PRO A 681 3.136 -0.272 -11.023 1.00 0.00 H new ATOM 0 HG3 PRO A 681 2.284 -0.330 -12.554 1.00 0.00 H new ATOM 0 HD2 PRO A 681 3.143 -2.627 -10.782 1.00 0.00 H new ATOM 0 HD3 PRO A 681 1.701 -2.481 -11.768 1.00 0.00 H new ATOM 845 N PRO A 682 6.866 -2.292 -14.063 1.00 0.00 N ATOM 846 CA PRO A 682 8.270 -2.786 -13.937 1.00 0.00 C ATOM 847 C PRO A 682 8.847 -2.532 -12.541 1.00 0.00 C ATOM 848 O PRO A 682 9.825 -3.162 -12.142 1.00 0.00 O ATOM 849 CB PRO A 682 9.044 -1.983 -14.987 1.00 0.00 C ATOM 850 CG PRO A 682 8.028 -1.495 -15.964 1.00 0.00 C ATOM 851 CD PRO A 682 6.703 -1.388 -15.215 1.00 0.00 C ATOM 0 HA PRO A 682 8.331 -3.864 -14.086 1.00 0.00 H new ATOM 0 HB2 PRO A 682 9.575 -1.149 -14.527 1.00 0.00 H new ATOM 0 HB3 PRO A 682 9.792 -2.604 -15.480 1.00 0.00 H new ATOM 0 HG2 PRO A 682 8.319 -0.527 -16.372 1.00 0.00 H new ATOM 0 HG3 PRO A 682 7.941 -2.183 -16.805 1.00 0.00 H new ATOM 0 HD2 PRO A 682 6.508 -0.365 -14.894 1.00 0.00 H new ATOM 0 HD3 PRO A 682 5.865 -1.690 -15.843 1.00 0.00 H new ATOM 859 N ASP A 683 8.233 -1.601 -11.807 1.00 0.00 N ATOM 860 CA ASP A 683 8.694 -1.265 -10.461 1.00 0.00 C ATOM 861 C ASP A 683 10.123 -0.723 -10.504 1.00 0.00 C ATOM 862 O ASP A 683 10.841 -0.926 -11.484 1.00 0.00 O ATOM 863 CB ASP A 683 8.631 -2.503 -9.562 1.00 0.00 C ATOM 864 CG ASP A 683 7.184 -2.970 -9.418 1.00 0.00 C ATOM 865 OD1 ASP A 683 6.299 -2.212 -9.776 1.00 0.00 O ATOM 866 OD2 ASP A 683 6.984 -4.080 -8.952 1.00 0.00 O ATOM 0 H ASP A 683 7.421 -1.070 -12.121 1.00 0.00 H new ATOM 0 HA ASP A 683 8.041 -0.493 -10.053 1.00 0.00 H new ATOM 0 HB2 ASP A 683 9.239 -3.302 -9.986 1.00 0.00 H new ATOM 0 HB3 ASP A 683 9.047 -2.272 -8.581 1.00 0.00 H new ATOM 871 N GLN A 684 10.525 -0.028 -9.439 1.00 0.00 N ATOM 872 CA GLN A 684 11.870 0.548 -9.370 1.00 0.00 C ATOM 873 C GLN A 684 12.082 1.299 -8.054 1.00 0.00 C ATOM 874 O GLN A 684 12.693 0.776 -7.121 1.00 0.00 O ATOM 875 CB GLN A 684 12.094 1.505 -10.546 1.00 0.00 C ATOM 876 CG GLN A 684 13.502 2.106 -10.464 1.00 0.00 C ATOM 877 CD GLN A 684 13.770 2.978 -11.686 1.00 0.00 C ATOM 878 OE1 GLN A 684 12.929 3.072 -12.580 1.00 0.00 O ATOM 879 NE2 GLN A 684 14.904 3.619 -11.781 1.00 0.00 N ATOM 0 H GLN A 684 9.945 0.149 -8.619 1.00 0.00 H new ATOM 0 HA GLN A 684 12.588 -0.270 -9.422 1.00 0.00 H new ATOM 0 HB2 GLN A 684 11.970 0.973 -11.489 1.00 0.00 H new ATOM 0 HB3 GLN A 684 11.348 2.299 -10.528 1.00 0.00 H new ATOM 0 HG2 GLN A 684 13.600 2.700 -9.555 1.00 0.00 H new ATOM 0 HG3 GLN A 684 14.243 1.309 -10.406 1.00 0.00 H new ATOM 0 HE21 GLN A 684 15.599 3.539 -11.039 1.00 0.00 H new ATOM 0 HE22 GLN A 684 15.095 4.200 -12.598 1.00 0.00 H new ATOM 888 N SER A 685 11.582 2.530 -7.990 1.00 0.00 N ATOM 889 CA SER A 685 11.732 3.345 -6.789 1.00 0.00 C ATOM 890 C SER A 685 11.017 2.696 -5.608 1.00 0.00 C ATOM 891 O SER A 685 11.451 2.815 -4.464 1.00 0.00 O ATOM 892 CB SER A 685 11.154 4.741 -7.027 1.00 0.00 C ATOM 893 OG SER A 685 11.781 5.328 -8.161 1.00 0.00 O ATOM 0 H SER A 685 11.073 2.982 -8.750 1.00 0.00 H new ATOM 0 HA SER A 685 12.795 3.425 -6.560 1.00 0.00 H new ATOM 0 HB2 SER A 685 10.077 4.678 -7.186 1.00 0.00 H new ATOM 0 HB3 SER A 685 11.311 5.366 -6.148 1.00 0.00 H new ATOM 0 HG SER A 685 11.409 6.222 -8.314 1.00 0.00 H new ATOM 899 N CYS A 686 9.917 2.012 -5.894 1.00 0.00 N ATOM 900 CA CYS A 686 9.146 1.352 -4.847 1.00 0.00 C ATOM 901 C CYS A 686 9.990 0.304 -4.135 1.00 0.00 C ATOM 902 O CYS A 686 9.721 -0.053 -2.986 1.00 0.00 O ATOM 903 CB CYS A 686 7.912 0.687 -5.452 1.00 0.00 C ATOM 904 SG CYS A 686 8.379 -0.909 -6.165 1.00 0.00 S ATOM 0 H CYS A 686 9.540 1.900 -6.835 1.00 0.00 H new ATOM 0 HA CYS A 686 8.838 2.105 -4.122 1.00 0.00 H new ATOM 0 HB2 CYS A 686 7.149 0.547 -4.687 1.00 0.00 H new ATOM 0 HB3 CYS A 686 7.479 1.328 -6.220 1.00 0.00 H new ATOM 0 HG CYS A 686 7.515 -1.813 -5.809 1.00 0.00 H new ATOM 910 N LEU A 687 11.010 -0.190 -4.827 1.00 0.00 N ATOM 911 CA LEU A 687 11.886 -1.200 -4.252 1.00 0.00 C ATOM 912 C LEU A 687 12.639 -0.625 -3.056 1.00 0.00 C ATOM 913 O LEU A 687 12.893 -1.329 -2.080 1.00 0.00 O ATOM 914 CB LEU A 687 12.880 -1.694 -5.307 1.00 0.00 C ATOM 915 CG LEU A 687 12.111 -2.242 -6.512 1.00 0.00 C ATOM 916 CD1 LEU A 687 13.098 -2.752 -7.560 1.00 0.00 C ATOM 917 CD2 LEU A 687 11.207 -3.395 -6.065 1.00 0.00 C ATOM 0 H LEU A 687 11.248 0.090 -5.778 1.00 0.00 H new ATOM 0 HA LEU A 687 11.279 -2.040 -3.915 1.00 0.00 H new ATOM 0 HB2 LEU A 687 13.532 -0.878 -5.618 1.00 0.00 H new ATOM 0 HB3 LEU A 687 13.519 -2.470 -4.886 1.00 0.00 H new ATOM 0 HG LEU A 687 11.501 -1.447 -6.941 1.00 0.00 H new ATOM 0 HD11 LEU A 687 12.549 -3.142 -8.417 1.00 0.00 H new ATOM 0 HD12 LEU A 687 13.741 -1.933 -7.883 1.00 0.00 H new ATOM 0 HD13 LEU A 687 13.709 -3.545 -7.129 1.00 0.00 H new ATOM 0 HD21 LEU A 687 10.661 -3.783 -6.925 1.00 0.00 H new ATOM 0 HD22 LEU A 687 11.817 -4.189 -5.634 1.00 0.00 H new ATOM 0 HD23 LEU A 687 10.500 -3.034 -5.318 1.00 0.00 H new ATOM 929 N LEU A 688 12.993 0.656 -3.138 1.00 0.00 N ATOM 930 CA LEU A 688 13.717 1.307 -2.049 1.00 0.00 C ATOM 931 C LEU A 688 12.800 1.573 -0.852 1.00 0.00 C ATOM 932 O LEU A 688 13.220 1.448 0.299 1.00 0.00 O ATOM 933 CB LEU A 688 14.347 2.621 -2.543 1.00 0.00 C ATOM 934 CG LEU A 688 13.330 3.768 -2.489 1.00 0.00 C ATOM 935 CD1 LEU A 688 13.499 4.552 -1.185 1.00 0.00 C ATOM 936 CD2 LEU A 688 13.569 4.704 -3.675 1.00 0.00 C ATOM 0 H LEU A 688 12.793 1.257 -3.937 1.00 0.00 H new ATOM 0 HA LEU A 688 14.509 0.634 -1.720 1.00 0.00 H new ATOM 0 HB2 LEU A 688 15.213 2.868 -1.929 1.00 0.00 H new ATOM 0 HB3 LEU A 688 14.706 2.496 -3.564 1.00 0.00 H new ATOM 0 HG LEU A 688 12.320 3.359 -2.534 1.00 0.00 H new ATOM 0 HD11 LEU A 688 12.774 5.365 -1.153 1.00 0.00 H new ATOM 0 HD12 LEU A 688 13.336 3.887 -0.337 1.00 0.00 H new ATOM 0 HD13 LEU A 688 14.507 4.963 -1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 688 12.850 5.522 -3.643 1.00 0.00 H new ATOM 0 HD22 LEU A 688 14.580 5.108 -3.622 1.00 0.00 H new ATOM 0 HD23 LEU A 688 13.448 4.150 -4.606 1.00 0.00 H new ATOM 948 N LEU A 689 11.551 1.943 -1.124 1.00 0.00 N ATOM 949 CA LEU A 689 10.601 2.226 -0.051 1.00 0.00 C ATOM 950 C LEU A 689 10.368 0.985 0.808 1.00 0.00 C ATOM 951 O LEU A 689 10.400 1.056 2.037 1.00 0.00 O ATOM 952 CB LEU A 689 9.272 2.704 -0.645 1.00 0.00 C ATOM 953 CG LEU A 689 8.387 3.296 0.458 1.00 0.00 C ATOM 954 CD1 LEU A 689 7.450 4.341 -0.150 1.00 0.00 C ATOM 955 CD2 LEU A 689 7.553 2.189 1.112 1.00 0.00 C ATOM 0 H LEU A 689 11.176 2.053 -2.066 1.00 0.00 H new ATOM 0 HA LEU A 689 11.018 3.010 0.581 1.00 0.00 H new ATOM 0 HB2 LEU A 689 9.457 3.453 -1.415 1.00 0.00 H new ATOM 0 HB3 LEU A 689 8.759 1.871 -1.126 1.00 0.00 H new ATOM 0 HG LEU A 689 9.021 3.761 1.213 1.00 0.00 H new ATOM 0 HD11 LEU A 689 6.820 4.763 0.632 1.00 0.00 H new ATOM 0 HD12 LEU A 689 8.039 5.135 -0.609 1.00 0.00 H new ATOM 0 HD13 LEU A 689 6.823 3.871 -0.907 1.00 0.00 H new ATOM 0 HD21 LEU A 689 6.927 2.619 1.894 1.00 0.00 H new ATOM 0 HD22 LEU A 689 6.921 1.717 0.360 1.00 0.00 H new ATOM 0 HD23 LEU A 689 8.217 1.442 1.548 1.00 0.00 H new ATOM 967 N LEU A 690 10.139 -0.153 0.156 1.00 0.00 N ATOM 968 CA LEU A 690 9.911 -1.399 0.881 1.00 0.00 C ATOM 969 C LEU A 690 11.146 -1.781 1.688 1.00 0.00 C ATOM 970 O LEU A 690 11.039 -2.215 2.834 1.00 0.00 O ATOM 971 CB LEU A 690 9.579 -2.529 -0.097 1.00 0.00 C ATOM 972 CG LEU A 690 8.347 -2.152 -0.922 1.00 0.00 C ATOM 973 CD1 LEU A 690 8.024 -3.283 -1.902 1.00 0.00 C ATOM 974 CD2 LEU A 690 7.157 -1.936 0.017 1.00 0.00 C ATOM 0 H LEU A 690 10.107 -0.238 -0.860 1.00 0.00 H new ATOM 0 HA LEU A 690 9.072 -1.248 1.560 1.00 0.00 H new ATOM 0 HB2 LEU A 690 10.427 -2.713 -0.756 1.00 0.00 H new ATOM 0 HB3 LEU A 690 9.393 -3.453 0.450 1.00 0.00 H new ATOM 0 HG LEU A 690 8.545 -1.236 -1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 690 7.146 -3.015 -2.490 1.00 0.00 H new ATOM 0 HD12 LEU A 690 8.873 -3.441 -2.568 1.00 0.00 H new ATOM 0 HD13 LEU A 690 7.823 -4.199 -1.347 1.00 0.00 H new ATOM 0 HD21 LEU A 690 6.277 -1.667 -0.567 1.00 0.00 H new ATOM 0 HD22 LEU A 690 6.959 -2.854 0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 690 7.387 -1.133 0.717 1.00 0.00 H new ATOM 986 N GLN A 691 12.318 -1.625 1.078 1.00 0.00 N ATOM 987 CA GLN A 691 13.566 -1.967 1.749 1.00 0.00 C ATOM 988 C GLN A 691 13.767 -1.107 2.990 1.00 0.00 C ATOM 989 O GLN A 691 14.242 -1.588 4.021 1.00 0.00 O ATOM 990 CB GLN A 691 14.749 -1.765 0.800 1.00 0.00 C ATOM 991 CG GLN A 691 16.009 -2.358 1.432 1.00 0.00 C ATOM 992 CD GLN A 691 17.190 -2.226 0.473 1.00 0.00 C ATOM 993 OE1 GLN A 691 17.011 -1.848 -0.683 1.00 0.00 O ATOM 994 NE2 GLN A 691 18.394 -2.511 0.891 1.00 0.00 N ATOM 0 H GLN A 691 12.428 -1.267 0.129 1.00 0.00 H new ATOM 0 HA GLN A 691 13.511 -3.014 2.048 1.00 0.00 H new ATOM 0 HB2 GLN A 691 14.548 -2.245 -0.158 1.00 0.00 H new ATOM 0 HB3 GLN A 691 14.893 -0.703 0.601 1.00 0.00 H new ATOM 0 HG2 GLN A 691 16.232 -1.845 2.368 1.00 0.00 H new ATOM 0 HG3 GLN A 691 15.844 -3.408 1.675 1.00 0.00 H new ATOM 0 HE21 GLN A 691 18.540 -2.824 1.851 1.00 0.00 H new ATOM 0 HE22 GLN A 691 19.189 -2.420 0.258 1.00 0.00 H new ATOM 1003 N HIS A 692 13.416 0.168 2.882 1.00 0.00 N ATOM 1004 CA HIS A 692 13.580 1.082 4.004 1.00 0.00 C ATOM 1005 C HIS A 692 12.813 0.584 5.225 1.00 0.00 C ATOM 1006 O HIS A 692 13.382 0.441 6.305 1.00 0.00 O ATOM 1007 CB HIS A 692 13.090 2.479 3.625 1.00 0.00 C ATOM 1008 CG HIS A 692 13.498 3.446 4.700 1.00 0.00 C ATOM 1009 ND1 HIS A 692 13.345 3.417 6.064 1.00 0.00 N flip ATOM 1010 CD2 HIS A 692 14.179 4.620 4.420 1.00 0.00 C flip ATOM 1011 CE1 HIS A 692 13.923 4.552 6.624 1.00 0.00 C flip ATOM 1012 NE2 HIS A 692 14.410 5.243 5.591 1.00 0.00 N flip ATOM 0 H HIS A 692 13.021 0.588 2.041 1.00 0.00 H new ATOM 0 HA HIS A 692 14.641 1.127 4.251 1.00 0.00 H new ATOM 0 HB2 HIS A 692 13.513 2.780 2.667 1.00 0.00 H new ATOM 0 HB3 HIS A 692 12.006 2.480 3.509 1.00 0.00 H new ATOM 0 HD2 HIS A 692 14.471 4.971 3.441 1.00 0.00 H new ATOM 0 HE1 HIS A 692 13.968 4.817 7.670 1.00 0.00 H new ATOM 0 HE2 HIS A 692 14.898 6.135 5.678 1.00 0.00 H new ATOM 1021 N LEU A 693 11.520 0.315 5.052 1.00 0.00 N ATOM 1022 CA LEU A 693 10.705 -0.170 6.162 1.00 0.00 C ATOM 1023 C LEU A 693 11.318 -1.434 6.765 1.00 0.00 C ATOM 1024 O LEU A 693 11.284 -1.635 7.979 1.00 0.00 O ATOM 1025 CB LEU A 693 9.279 -0.477 5.688 1.00 0.00 C ATOM 1026 CG LEU A 693 8.658 0.759 5.027 1.00 0.00 C ATOM 1027 CD1 LEU A 693 7.200 0.462 4.666 1.00 0.00 C ATOM 1028 CD2 LEU A 693 8.704 1.947 5.993 1.00 0.00 C ATOM 0 H LEU A 693 11.021 0.423 4.169 1.00 0.00 H new ATOM 0 HA LEU A 693 10.672 0.611 6.921 1.00 0.00 H new ATOM 0 HB2 LEU A 693 9.295 -1.306 4.981 1.00 0.00 H new ATOM 0 HB3 LEU A 693 8.667 -0.791 6.534 1.00 0.00 H new ATOM 0 HG LEU A 693 9.222 1.004 4.127 1.00 0.00 H new ATOM 0 HD11 LEU A 693 6.756 1.339 4.196 1.00 0.00 H new ATOM 0 HD12 LEU A 693 7.161 -0.380 3.974 1.00 0.00 H new ATOM 0 HD13 LEU A 693 6.644 0.215 5.571 1.00 0.00 H new ATOM 0 HD21 LEU A 693 8.261 2.821 5.516 1.00 0.00 H new ATOM 0 HD22 LEU A 693 8.144 1.704 6.896 1.00 0.00 H new ATOM 0 HD23 LEU A 693 9.740 2.163 6.255 1.00 0.00 H new ATOM 1040 N ARG A 694 11.870 -2.284 5.903 1.00 0.00 N ATOM 1041 CA ARG A 694 12.483 -3.532 6.348 1.00 0.00 C ATOM 1042 C ARG A 694 13.705 -3.263 7.220 1.00 0.00 C ATOM 1043 O ARG A 694 13.929 -3.953 8.214 1.00 0.00 O ATOM 1044 CB ARG A 694 12.900 -4.366 5.134 1.00 0.00 C ATOM 1045 CG ARG A 694 13.376 -5.745 5.596 1.00 0.00 C ATOM 1046 CD ARG A 694 12.217 -6.743 5.525 1.00 0.00 C ATOM 1047 NE ARG A 694 10.993 -6.141 6.047 1.00 0.00 N ATOM 1048 CZ ARG A 694 10.132 -6.847 6.774 1.00 0.00 C ATOM 1049 NH1 ARG A 694 10.370 -8.104 7.034 1.00 0.00 N ATOM 1050 NH2 ARG A 694 9.046 -6.283 7.227 1.00 0.00 N ATOM 0 H ARG A 694 11.905 -2.132 4.895 1.00 0.00 H new ATOM 0 HA ARG A 694 11.748 -4.079 6.939 1.00 0.00 H new ATOM 0 HB2 ARG A 694 12.060 -4.472 4.447 1.00 0.00 H new ATOM 0 HB3 ARG A 694 13.696 -3.859 4.589 1.00 0.00 H new ATOM 0 HG2 ARG A 694 14.200 -6.085 4.968 1.00 0.00 H new ATOM 0 HG3 ARG A 694 13.756 -5.686 6.616 1.00 0.00 H new ATOM 0 HD2 ARG A 694 12.063 -7.058 4.493 1.00 0.00 H new ATOM 0 HD3 ARG A 694 12.463 -7.637 6.098 1.00 0.00 H new ATOM 0 HE ARG A 694 10.795 -5.160 5.850 1.00 0.00 H new ATOM 0 HH11 ARG A 694 11.218 -8.547 6.679 1.00 0.00 H new ATOM 0 HH12 ARG A 694 9.708 -8.644 7.592 1.00 0.00 H new ATOM 0 HH21 ARG A 694 8.858 -5.301 7.023 1.00 0.00 H new ATOM 0 HH22 ARG A 694 8.385 -6.824 7.785 1.00 0.00 H new ATOM 1064 N GLU A 695 14.499 -2.267 6.835 1.00 0.00 N ATOM 1065 CA GLU A 695 15.705 -1.923 7.585 1.00 0.00 C ATOM 1066 C GLU A 695 15.372 -1.307 8.938 1.00 0.00 C ATOM 1067 O GLU A 695 16.040 -1.582 9.934 1.00 0.00 O ATOM 1068 CB GLU A 695 16.556 -0.946 6.775 1.00 0.00 C ATOM 1069 CG GLU A 695 17.174 -1.683 5.588 1.00 0.00 C ATOM 1070 CD GLU A 695 18.083 -0.744 4.805 1.00 0.00 C ATOM 1071 OE1 GLU A 695 17.937 0.457 4.960 1.00 0.00 O ATOM 1072 OE2 GLU A 695 18.916 -1.240 4.064 1.00 0.00 O ATOM 0 H GLU A 695 14.331 -1.687 6.013 1.00 0.00 H new ATOM 0 HA GLU A 695 16.260 -2.844 7.762 1.00 0.00 H new ATOM 0 HB2 GLU A 695 15.943 -0.116 6.424 1.00 0.00 H new ATOM 0 HB3 GLU A 695 17.339 -0.521 7.402 1.00 0.00 H new ATOM 0 HG2 GLU A 695 17.743 -2.543 5.940 1.00 0.00 H new ATOM 0 HG3 GLU A 695 16.387 -2.066 4.938 1.00 0.00 H new ATOM 1079 N HIS A 696 14.344 -0.470 8.970 1.00 0.00 N ATOM 1080 CA HIS A 696 13.949 0.179 10.210 1.00 0.00 C ATOM 1081 C HIS A 696 12.756 -0.531 10.833 1.00 0.00 C ATOM 1082 O HIS A 696 12.185 -0.054 11.810 1.00 0.00 O ATOM 1083 CB HIS A 696 13.607 1.646 9.942 1.00 0.00 C ATOM 1084 CG HIS A 696 14.867 2.397 9.607 1.00 0.00 C ATOM 1085 ND1 HIS A 696 16.054 1.995 9.041 1.00 0.00 N flip ATOM 1086 CD2 HIS A 696 15.008 3.755 9.852 1.00 0.00 C flip ATOM 1087 CE1 HIS A 696 16.918 3.083 8.939 1.00 0.00 C flip ATOM 1088 NE2 HIS A 696 16.239 4.117 9.442 1.00 0.00 N flip ATOM 0 H HIS A 696 13.774 -0.227 8.160 1.00 0.00 H new ATOM 0 HA HIS A 696 14.783 0.127 10.910 1.00 0.00 H new ATOM 0 HB2 HIS A 696 12.896 1.721 9.120 1.00 0.00 H new ATOM 0 HB3 HIS A 696 13.130 2.086 10.818 1.00 0.00 H new ATOM 0 HD2 HIS A 696 14.265 4.404 10.292 1.00 0.00 H new ATOM 0 HE1 HIS A 696 17.921 3.089 8.539 1.00 0.00 H new ATOM 0 HE2 HIS A 696 16.608 5.066 9.508 1.00 0.00 H new ATOM 1168 N PRO A 702 5.535 -2.066 12.218 1.00 0.00 N ATOM 1169 CA PRO A 702 5.478 -2.645 10.846 1.00 0.00 C ATOM 1170 C PRO A 702 4.073 -2.600 10.248 1.00 0.00 C ATOM 1171 O PRO A 702 3.186 -3.337 10.674 1.00 0.00 O ATOM 1172 CB PRO A 702 5.936 -4.087 11.063 1.00 0.00 C ATOM 1173 CG PRO A 702 6.864 -4.018 12.228 1.00 0.00 C ATOM 1174 CD PRO A 702 6.336 -2.905 13.127 1.00 0.00 C ATOM 0 HA PRO A 702 6.093 -2.090 10.137 1.00 0.00 H new ATOM 0 HB2 PRO A 702 5.091 -4.744 11.268 1.00 0.00 H new ATOM 0 HB3 PRO A 702 6.438 -4.480 10.179 1.00 0.00 H new ATOM 0 HG2 PRO A 702 6.891 -4.969 12.761 1.00 0.00 H new ATOM 0 HG3 PRO A 702 7.882 -3.805 11.903 1.00 0.00 H new ATOM 0 HD2 PRO A 702 5.730 -3.303 13.941 1.00 0.00 H new ATOM 0 HD3 PRO A 702 7.149 -2.339 13.581 1.00 0.00 H new ATOM 1182 N PRO A 703 3.857 -1.756 9.272 1.00 0.00 N ATOM 1183 CA PRO A 703 2.530 -1.629 8.615 1.00 0.00 C ATOM 1184 C PRO A 703 2.239 -2.800 7.678 1.00 0.00 C ATOM 1185 O PRO A 703 3.157 -3.398 7.114 1.00 0.00 O ATOM 1186 CB PRO A 703 2.616 -0.308 7.846 1.00 0.00 C ATOM 1187 CG PRO A 703 4.071 -0.017 7.659 1.00 0.00 C ATOM 1188 CD PRO A 703 4.851 -0.838 8.692 1.00 0.00 C ATOM 0 HA PRO A 703 1.715 -1.641 9.339 1.00 0.00 H new ATOM 0 HB2 PRO A 703 2.110 -0.386 6.884 1.00 0.00 H new ATOM 0 HB3 PRO A 703 2.128 0.495 8.399 1.00 0.00 H new ATOM 0 HG2 PRO A 703 4.386 -0.277 6.648 1.00 0.00 H new ATOM 0 HG3 PRO A 703 4.267 1.047 7.790 1.00 0.00 H new ATOM 0 HD2 PRO A 703 5.670 -1.385 8.225 1.00 0.00 H new ATOM 0 HD3 PRO A 703 5.291 -0.197 9.456 1.00 0.00 H new ATOM 1196 N LEU A 704 0.959 -3.119 7.513 1.00 0.00 N ATOM 1197 CA LEU A 704 0.560 -4.218 6.638 1.00 0.00 C ATOM 1198 C LEU A 704 0.697 -3.787 5.180 1.00 0.00 C ATOM 1199 O LEU A 704 0.384 -2.647 4.836 1.00 0.00 O ATOM 1200 CB LEU A 704 -0.894 -4.611 6.930 1.00 0.00 C ATOM 1201 CG LEU A 704 -1.049 -4.930 8.421 1.00 0.00 C ATOM 1202 CD1 LEU A 704 -2.462 -5.450 8.696 1.00 0.00 C ATOM 1203 CD2 LEU A 704 -0.030 -5.999 8.819 1.00 0.00 C ATOM 0 H LEU A 704 0.185 -2.637 7.970 1.00 0.00 H new ATOM 0 HA LEU A 704 1.205 -5.077 6.821 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -1.565 -3.799 6.650 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -1.175 -5.477 6.331 1.00 0.00 H new ATOM 0 HG LEU A 704 -0.879 -4.024 9.002 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -2.567 -5.675 9.757 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -3.191 -4.691 8.413 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -2.636 -6.355 8.114 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -0.138 -6.228 9.879 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -0.202 -6.902 8.233 1.00 0.00 H new ATOM 0 HD23 LEU A 704 0.978 -5.630 8.628 1.00 0.00 H new ATOM 1215 N VAL A 705 1.178 -4.688 4.326 1.00 0.00 N ATOM 1216 CA VAL A 705 1.352 -4.345 2.919 1.00 0.00 C ATOM 1217 C VAL A 705 0.599 -5.305 2.001 1.00 0.00 C ATOM 1218 O VAL A 705 0.736 -6.525 2.099 1.00 0.00 O ATOM 1219 CB VAL A 705 2.836 -4.343 2.554 1.00 0.00 C ATOM 1220 CG1 VAL A 705 2.990 -3.896 1.101 1.00 0.00 C ATOM 1221 CG2 VAL A 705 3.589 -3.368 3.464 1.00 0.00 C ATOM 0 H VAL A 705 1.448 -5.639 4.576 1.00 0.00 H new ATOM 0 HA VAL A 705 0.937 -3.347 2.775 1.00 0.00 H new ATOM 0 HB VAL A 705 3.245 -5.345 2.681 1.00 0.00 H new ATOM 0 HG11 VAL A 705 4.046 -3.892 0.832 1.00 0.00 H new ATOM 0 HG12 VAL A 705 2.452 -4.585 0.449 1.00 0.00 H new ATOM 0 HG13 VAL A 705 2.581 -2.892 0.984 1.00 0.00 H new ATOM 0 HG21 VAL A 705 4.647 -3.369 3.202 1.00 0.00 H new ATOM 0 HG22 VAL A 705 3.184 -2.364 3.336 1.00 0.00 H new ATOM 0 HG23 VAL A 705 3.473 -3.676 4.503 1.00 0.00 H new ATOM 1231 N LEU A 706 -0.185 -4.726 1.098 1.00 0.00 N ATOM 1232 CA LEU A 706 -0.961 -5.501 0.136 1.00 0.00 C ATOM 1233 C LEU A 706 -0.482 -5.198 -1.286 1.00 0.00 C ATOM 1234 O LEU A 706 -0.290 -4.036 -1.643 1.00 0.00 O ATOM 1235 CB LEU A 706 -2.444 -5.151 0.273 1.00 0.00 C ATOM 1236 CG LEU A 706 -3.282 -6.119 -0.564 1.00 0.00 C ATOM 1237 CD1 LEU A 706 -4.698 -6.193 0.009 1.00 0.00 C ATOM 1238 CD2 LEU A 706 -3.348 -5.630 -2.014 1.00 0.00 C ATOM 0 H LEU A 706 -0.300 -3.716 1.012 1.00 0.00 H new ATOM 0 HA LEU A 706 -0.823 -6.564 0.336 1.00 0.00 H new ATOM 0 HB2 LEU A 706 -2.745 -5.205 1.319 1.00 0.00 H new ATOM 0 HB3 LEU A 706 -2.618 -4.126 -0.056 1.00 0.00 H new ATOM 0 HG LEU A 706 -2.822 -7.107 -0.537 1.00 0.00 H new ATOM 0 HD11 LEU A 706 -5.296 -6.883 -0.587 1.00 0.00 H new ATOM 0 HD12 LEU A 706 -4.656 -6.546 1.039 1.00 0.00 H new ATOM 0 HD13 LEU A 706 -5.153 -5.203 -0.017 1.00 0.00 H new ATOM 0 HD21 LEU A 706 -3.946 -6.324 -2.605 1.00 0.00 H new ATOM 0 HD22 LEU A 706 -3.804 -4.641 -2.044 1.00 0.00 H new ATOM 0 HD23 LEU A 706 -2.340 -5.577 -2.426 1.00 0.00 H new ATOM 1250 N PHE A 707 -0.278 -6.240 -2.090 1.00 0.00 N ATOM 1251 CA PHE A 707 0.190 -6.046 -3.462 1.00 0.00 C ATOM 1252 C PHE A 707 -0.845 -6.519 -4.482 1.00 0.00 C ATOM 1253 O PHE A 707 -1.450 -7.583 -4.327 1.00 0.00 O ATOM 1254 CB PHE A 707 1.490 -6.815 -3.685 1.00 0.00 C ATOM 1255 CG PHE A 707 2.588 -6.243 -2.821 1.00 0.00 C ATOM 1256 CD1 PHE A 707 3.381 -5.196 -3.303 1.00 0.00 C ATOM 1257 CD2 PHE A 707 2.823 -6.768 -1.544 1.00 0.00 C ATOM 1258 CE1 PHE A 707 4.409 -4.674 -2.509 1.00 0.00 C ATOM 1259 CE2 PHE A 707 3.849 -6.243 -0.750 1.00 0.00 C ATOM 1260 CZ PHE A 707 4.643 -5.197 -1.233 1.00 0.00 C ATOM 0 H PHE A 707 -0.426 -7.213 -1.822 1.00 0.00 H new ATOM 0 HA PHE A 707 0.355 -4.978 -3.603 1.00 0.00 H new ATOM 0 HB2 PHE A 707 1.343 -7.869 -3.449 1.00 0.00 H new ATOM 0 HB3 PHE A 707 1.778 -6.761 -4.735 1.00 0.00 H new ATOM 0 HD1 PHE A 707 3.200 -4.791 -4.288 1.00 0.00 H new ATOM 0 HD2 PHE A 707 2.213 -7.578 -1.172 1.00 0.00 H new ATOM 0 HE1 PHE A 707 5.022 -3.867 -2.882 1.00 0.00 H new ATOM 0 HE2 PHE A 707 4.028 -6.645 0.236 1.00 0.00 H new ATOM 0 HZ PHE A 707 5.436 -4.794 -0.621 1.00 0.00 H new ATOM 1270 N LEU A 708 -1.027 -5.725 -5.536 1.00 0.00 N ATOM 1271 CA LEU A 708 -1.974 -6.069 -6.597 1.00 0.00 C ATOM 1272 C LEU A 708 -1.254 -6.674 -7.799 1.00 0.00 C ATOM 1273 O LEU A 708 -0.073 -6.410 -8.023 1.00 0.00 O ATOM 1274 CB LEU A 708 -2.751 -4.829 -7.037 1.00 0.00 C ATOM 1275 CG LEU A 708 -3.521 -4.270 -5.847 1.00 0.00 C ATOM 1276 CD1 LEU A 708 -4.339 -3.062 -6.295 1.00 0.00 C ATOM 1277 CD2 LEU A 708 -4.458 -5.351 -5.305 1.00 0.00 C ATOM 0 H LEU A 708 -0.534 -4.843 -5.678 1.00 0.00 H new ATOM 0 HA LEU A 708 -2.668 -6.809 -6.198 1.00 0.00 H new ATOM 0 HB2 LEU A 708 -2.066 -4.076 -7.428 1.00 0.00 H new ATOM 0 HB3 LEU A 708 -3.439 -5.084 -7.843 1.00 0.00 H new ATOM 0 HG LEU A 708 -2.824 -3.964 -5.067 1.00 0.00 H new ATOM 0 HD11 LEU A 708 -4.891 -2.661 -5.445 1.00 0.00 H new ATOM 0 HD12 LEU A 708 -3.671 -2.296 -6.688 1.00 0.00 H new ATOM 0 HD13 LEU A 708 -5.040 -3.366 -7.072 1.00 0.00 H new ATOM 0 HD21 LEU A 708 -5.013 -4.958 -4.453 1.00 0.00 H new ATOM 0 HD22 LEU A 708 -5.157 -5.651 -6.086 1.00 0.00 H new ATOM 0 HD23 LEU A 708 -3.873 -6.215 -4.990 1.00 0.00 H new ATOM 1289 N GLY A 709 -1.980 -7.479 -8.572 1.00 0.00 N ATOM 1290 CA GLY A 709 -1.406 -8.112 -9.756 1.00 0.00 C ATOM 1291 C GLY A 709 -0.683 -9.405 -9.396 1.00 0.00 C ATOM 1292 O GLY A 709 -1.213 -10.243 -8.668 1.00 0.00 O ATOM 0 H GLY A 709 -2.959 -7.707 -8.401 1.00 0.00 H new ATOM 0 HA2 GLY A 709 -2.195 -8.323 -10.477 1.00 0.00 H new ATOM 0 HA3 GLY A 709 -0.710 -7.425 -10.237 1.00 0.00 H new ATOM 1296 N GLU A 710 0.528 -9.562 -9.920 1.00 0.00 N ATOM 1297 CA GLU A 710 1.320 -10.764 -9.661 1.00 0.00 C ATOM 1298 C GLU A 710 2.144 -10.615 -8.378 1.00 0.00 C ATOM 1299 O GLU A 710 2.521 -9.507 -7.997 1.00 0.00 O ATOM 1300 CB GLU A 710 2.272 -11.011 -10.837 1.00 0.00 C ATOM 1301 CG GLU A 710 1.479 -11.454 -12.069 1.00 0.00 C ATOM 1302 CD GLU A 710 0.781 -10.255 -12.702 1.00 0.00 C ATOM 1303 OE1 GLU A 710 1.435 -9.534 -13.438 1.00 0.00 O ATOM 1304 OE2 GLU A 710 -0.397 -10.075 -12.443 1.00 0.00 O ATOM 0 H GLU A 710 0.983 -8.877 -10.524 1.00 0.00 H new ATOM 0 HA GLU A 710 0.636 -11.604 -9.543 1.00 0.00 H new ATOM 0 HB2 GLU A 710 2.830 -10.102 -11.061 1.00 0.00 H new ATOM 0 HB3 GLU A 710 3.002 -11.775 -10.570 1.00 0.00 H new ATOM 0 HG2 GLU A 710 2.147 -11.920 -12.793 1.00 0.00 H new ATOM 0 HG3 GLU A 710 0.742 -12.206 -11.786 1.00 0.00 H new ATOM 1311 N PRO A 711 2.434 -11.709 -7.721 1.00 0.00 N ATOM 1312 CA PRO A 711 3.243 -11.715 -6.462 1.00 0.00 C ATOM 1313 C PRO A 711 4.674 -11.235 -6.690 1.00 0.00 C ATOM 1314 O PRO A 711 5.141 -11.155 -7.827 1.00 0.00 O ATOM 1315 CB PRO A 711 3.239 -13.185 -6.026 1.00 0.00 C ATOM 1316 CG PRO A 711 2.928 -13.959 -7.263 1.00 0.00 C ATOM 1317 CD PRO A 711 2.022 -13.067 -8.104 1.00 0.00 C ATOM 0 HA PRO A 711 2.826 -11.039 -5.716 1.00 0.00 H new ATOM 0 HB2 PRO A 711 4.205 -13.476 -5.612 1.00 0.00 H new ATOM 0 HB3 PRO A 711 2.493 -13.364 -5.252 1.00 0.00 H new ATOM 0 HG2 PRO A 711 3.840 -14.210 -7.805 1.00 0.00 H new ATOM 0 HG3 PRO A 711 2.433 -14.899 -7.020 1.00 0.00 H new ATOM 0 HD2 PRO A 711 2.161 -13.244 -9.171 1.00 0.00 H new ATOM 0 HD3 PRO A 711 0.969 -13.244 -7.886 1.00 0.00 H new ATOM 1325 N PRO A 712 5.370 -10.923 -5.629 1.00 0.00 N ATOM 1326 CA PRO A 712 6.783 -10.450 -5.698 1.00 0.00 C ATOM 1327 C PRO A 712 7.712 -11.502 -6.288 1.00 0.00 C ATOM 1328 O PRO A 712 7.388 -12.689 -6.314 1.00 0.00 O ATOM 1329 CB PRO A 712 7.162 -10.161 -4.244 1.00 0.00 C ATOM 1330 CG PRO A 712 6.156 -10.879 -3.406 1.00 0.00 C ATOM 1331 CD PRO A 712 4.884 -10.991 -4.244 1.00 0.00 C ATOM 0 HA PRO A 712 6.878 -9.579 -6.346 1.00 0.00 H new ATOM 0 HB2 PRO A 712 8.171 -10.511 -4.027 1.00 0.00 H new ATOM 0 HB3 PRO A 712 7.145 -9.090 -4.042 1.00 0.00 H new ATOM 0 HG2 PRO A 712 6.522 -11.866 -3.124 1.00 0.00 H new ATOM 0 HG3 PRO A 712 5.963 -10.335 -2.482 1.00 0.00 H new ATOM 0 HD2 PRO A 712 4.358 -11.926 -4.050 1.00 0.00 H new ATOM 0 HD3 PRO A 712 4.188 -10.182 -4.024 1.00 0.00 H new ATOM 1339 N VAL A 713 8.872 -11.058 -6.758 1.00 0.00 N ATOM 1340 CA VAL A 713 9.851 -11.968 -7.339 1.00 0.00 C ATOM 1341 C VAL A 713 10.817 -12.465 -6.270 1.00 0.00 C ATOM 1342 O VAL A 713 11.940 -12.870 -6.574 1.00 0.00 O ATOM 1343 CB VAL A 713 10.633 -11.265 -8.445 1.00 0.00 C ATOM 1344 CG1 VAL A 713 11.199 -12.312 -9.407 1.00 0.00 C ATOM 1345 CG2 VAL A 713 9.697 -10.322 -9.202 1.00 0.00 C ATOM 0 H VAL A 713 9.156 -10.078 -6.748 1.00 0.00 H new ATOM 0 HA VAL A 713 9.318 -12.820 -7.760 1.00 0.00 H new ATOM 0 HB VAL A 713 11.452 -10.692 -8.012 1.00 0.00 H new ATOM 0 HG11 VAL A 713 11.758 -11.814 -10.199 1.00 0.00 H new ATOM 0 HG12 VAL A 713 11.861 -12.985 -8.863 1.00 0.00 H new ATOM 0 HG13 VAL A 713 10.381 -12.883 -9.845 1.00 0.00 H new ATOM 0 HG21 VAL A 713 10.251 -9.817 -9.993 1.00 0.00 H new ATOM 0 HG22 VAL A 713 8.880 -10.895 -9.640 1.00 0.00 H new ATOM 0 HG23 VAL A 713 9.292 -9.581 -8.513 1.00 0.00 H new ATOM 1355 N ASP A 714 10.377 -12.422 -5.019 1.00 0.00 N ATOM 1356 CA ASP A 714 11.212 -12.859 -3.909 1.00 0.00 C ATOM 1357 C ASP A 714 10.346 -13.144 -2.683 1.00 0.00 C ATOM 1358 O ASP A 714 9.367 -12.443 -2.429 1.00 0.00 O ATOM 1359 CB ASP A 714 12.235 -11.771 -3.575 1.00 0.00 C ATOM 1360 CG ASP A 714 13.541 -12.024 -4.324 1.00 0.00 C ATOM 1361 OD1 ASP A 714 13.600 -12.990 -5.067 1.00 0.00 O ATOM 1362 OD2 ASP A 714 14.463 -11.247 -4.143 1.00 0.00 O ATOM 0 H ASP A 714 9.451 -12.090 -4.749 1.00 0.00 H new ATOM 0 HA ASP A 714 11.734 -13.772 -4.195 1.00 0.00 H new ATOM 0 HB2 ASP A 714 11.837 -10.793 -3.845 1.00 0.00 H new ATOM 0 HB3 ASP A 714 12.421 -11.754 -2.501 1.00 0.00 H new ATOM 1367 N PRO A 715 10.674 -14.170 -1.938 1.00 0.00 N ATOM 1368 CA PRO A 715 9.896 -14.573 -0.727 1.00 0.00 C ATOM 1369 C PRO A 715 10.043 -13.588 0.431 1.00 0.00 C ATOM 1370 O PRO A 715 9.255 -13.615 1.378 1.00 0.00 O ATOM 1371 CB PRO A 715 10.476 -15.941 -0.355 1.00 0.00 C ATOM 1372 CG PRO A 715 11.851 -15.961 -0.930 1.00 0.00 C ATOM 1373 CD PRO A 715 11.826 -15.055 -2.164 1.00 0.00 C ATOM 0 HA PRO A 715 8.826 -14.596 -0.932 1.00 0.00 H new ATOM 0 HB2 PRO A 715 10.501 -16.076 0.726 1.00 0.00 H new ATOM 0 HB3 PRO A 715 9.868 -16.749 -0.763 1.00 0.00 H new ATOM 0 HG2 PRO A 715 12.580 -15.604 -0.202 1.00 0.00 H new ATOM 0 HG3 PRO A 715 12.142 -16.976 -1.201 1.00 0.00 H new ATOM 0 HD2 PRO A 715 12.752 -14.487 -2.260 1.00 0.00 H new ATOM 0 HD3 PRO A 715 11.710 -15.633 -3.081 1.00 0.00 H new ATOM 1381 N LEU A 716 11.045 -12.718 0.356 1.00 0.00 N ATOM 1382 CA LEU A 716 11.255 -11.739 1.417 1.00 0.00 C ATOM 1383 C LEU A 716 10.140 -10.704 1.399 1.00 0.00 C ATOM 1384 O LEU A 716 9.694 -10.235 2.448 1.00 0.00 O ATOM 1385 CB LEU A 716 12.613 -11.054 1.254 1.00 0.00 C ATOM 1386 CG LEU A 716 13.727 -12.071 1.521 1.00 0.00 C ATOM 1387 CD1 LEU A 716 14.052 -12.840 0.235 1.00 0.00 C ATOM 1388 CD2 LEU A 716 14.979 -11.338 2.007 1.00 0.00 C ATOM 0 H LEU A 716 11.713 -12.670 -0.413 1.00 0.00 H new ATOM 0 HA LEU A 716 11.243 -12.257 2.376 1.00 0.00 H new ATOM 0 HB2 LEU A 716 12.710 -10.647 0.247 1.00 0.00 H new ATOM 0 HB3 LEU A 716 12.696 -10.216 1.946 1.00 0.00 H new ATOM 0 HG LEU A 716 13.395 -12.775 2.284 1.00 0.00 H new ATOM 0 HD11 LEU A 716 14.845 -13.561 0.433 1.00 0.00 H new ATOM 0 HD12 LEU A 716 13.161 -13.365 -0.110 1.00 0.00 H new ATOM 0 HD13 LEU A 716 14.381 -12.141 -0.534 1.00 0.00 H new ATOM 0 HD21 LEU A 716 15.773 -12.060 2.197 1.00 0.00 H new ATOM 0 HD22 LEU A 716 15.306 -10.632 1.244 1.00 0.00 H new ATOM 0 HD23 LEU A 716 14.751 -10.799 2.926 1.00 0.00 H new ATOM 1400 N LEU A 717 9.670 -10.370 0.202 1.00 0.00 N ATOM 1401 CA LEU A 717 8.584 -9.409 0.074 1.00 0.00 C ATOM 1402 C LEU A 717 7.272 -10.081 0.464 1.00 0.00 C ATOM 1403 O LEU A 717 6.367 -9.436 0.994 1.00 0.00 O ATOM 1404 CB LEU A 717 8.485 -8.888 -1.365 1.00 0.00 C ATOM 1405 CG LEU A 717 9.777 -8.167 -1.755 1.00 0.00 C ATOM 1406 CD1 LEU A 717 9.659 -7.656 -3.194 1.00 0.00 C ATOM 1407 CD2 LEU A 717 10.006 -6.981 -0.817 1.00 0.00 C ATOM 0 H LEU A 717 10.018 -10.745 -0.680 1.00 0.00 H new ATOM 0 HA LEU A 717 8.783 -8.564 0.734 1.00 0.00 H new ATOM 0 HB2 LEU A 717 8.302 -9.717 -2.048 1.00 0.00 H new ATOM 0 HB3 LEU A 717 7.638 -8.208 -1.456 1.00 0.00 H new ATOM 0 HG LEU A 717 10.615 -8.860 -1.678 1.00 0.00 H new ATOM 0 HD11 LEU A 717 10.578 -7.142 -3.474 1.00 0.00 H new ATOM 0 HD12 LEU A 717 9.495 -8.498 -3.867 1.00 0.00 H new ATOM 0 HD13 LEU A 717 8.820 -6.964 -3.267 1.00 0.00 H new ATOM 0 HD21 LEU A 717 10.927 -6.469 -1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 717 9.168 -6.289 -0.894 1.00 0.00 H new ATOM 0 HD23 LEU A 717 10.087 -7.339 0.209 1.00 0.00 H new ATOM 1419 N THR A 718 7.180 -11.386 0.206 1.00 0.00 N ATOM 1420 CA THR A 718 5.976 -12.135 0.551 1.00 0.00 C ATOM 1421 C THR A 718 5.782 -12.150 2.066 1.00 0.00 C ATOM 1422 O THR A 718 4.675 -11.942 2.557 1.00 0.00 O ATOM 1423 CB THR A 718 6.061 -13.571 0.017 1.00 0.00 C ATOM 1424 OG1 THR A 718 6.318 -13.540 -1.381 1.00 0.00 O ATOM 1425 CG2 THR A 718 4.731 -14.283 0.274 1.00 0.00 C ATOM 0 H THR A 718 7.915 -11.939 -0.235 1.00 0.00 H new ATOM 0 HA THR A 718 5.120 -11.644 0.088 1.00 0.00 H new ATOM 0 HB THR A 718 6.866 -14.104 0.523 1.00 0.00 H new ATOM 0 HG1 THR A 718 6.374 -14.456 -1.724 1.00 0.00 H new ATOM 0 HG21 THR A 718 4.786 -15.304 -0.104 1.00 0.00 H new ATOM 0 HG22 THR A 718 4.530 -14.303 1.345 1.00 0.00 H new ATOM 0 HG23 THR A 718 3.929 -13.750 -0.236 1.00 0.00 H new ATOM 1433 N ALA A 719 6.869 -12.384 2.806 1.00 0.00 N ATOM 1434 CA ALA A 719 6.792 -12.405 4.266 1.00 0.00 C ATOM 1435 C ALA A 719 6.403 -11.027 4.786 1.00 0.00 C ATOM 1436 O ALA A 719 5.606 -10.900 5.717 1.00 0.00 O ATOM 1437 CB ALA A 719 8.140 -12.808 4.864 1.00 0.00 C ATOM 0 H ALA A 719 7.799 -12.559 2.424 1.00 0.00 H new ATOM 0 HA ALA A 719 6.037 -13.134 4.562 1.00 0.00 H new ATOM 0 HB1 ALA A 719 8.067 -12.819 5.951 1.00 0.00 H new ATOM 0 HB2 ALA A 719 8.413 -13.801 4.509 1.00 0.00 H new ATOM 0 HB3 ALA A 719 8.902 -12.091 4.559 1.00 0.00 H new ATOM 1443 N GLN A 720 6.968 -9.998 4.165 1.00 0.00 N ATOM 1444 CA GLN A 720 6.677 -8.622 4.548 1.00 0.00 C ATOM 1445 C GLN A 720 5.282 -8.238 4.073 1.00 0.00 C ATOM 1446 O GLN A 720 4.611 -7.403 4.680 1.00 0.00 O ATOM 1447 CB GLN A 720 7.706 -7.677 3.925 1.00 0.00 C ATOM 1448 CG GLN A 720 7.484 -6.259 4.453 1.00 0.00 C ATOM 1449 CD GLN A 720 8.552 -5.321 3.895 1.00 0.00 C ATOM 1450 OE1 GLN A 720 9.665 -5.271 4.416 1.00 0.00 O ATOM 1451 NE2 GLN A 720 8.280 -4.574 2.860 1.00 0.00 N ATOM 0 H GLN A 720 7.630 -10.091 3.394 1.00 0.00 H new ATOM 0 HA GLN A 720 6.725 -8.540 5.634 1.00 0.00 H new ATOM 0 HB2 GLN A 720 8.715 -8.012 4.165 1.00 0.00 H new ATOM 0 HB3 GLN A 720 7.616 -7.690 2.839 1.00 0.00 H new ATOM 0 HG2 GLN A 720 6.493 -5.906 4.167 1.00 0.00 H new ATOM 0 HG3 GLN A 720 7.520 -6.258 5.542 1.00 0.00 H new ATOM 0 HE21 GLN A 720 7.357 -4.617 2.429 1.00 0.00 H new ATOM 0 HE22 GLN A 720 8.991 -3.948 2.482 1.00 0.00 H new ATOM 1460 N ALA A 721 4.856 -8.856 2.979 1.00 0.00 N ATOM 1461 CA ALA A 721 3.543 -8.578 2.416 1.00 0.00 C ATOM 1462 C ALA A 721 2.441 -9.090 3.329 1.00 0.00 C ATOM 1463 O ALA A 721 2.548 -10.171 3.911 1.00 0.00 O ATOM 1464 CB ALA A 721 3.407 -9.247 1.050 1.00 0.00 C ATOM 0 H ALA A 721 5.399 -9.551 2.466 1.00 0.00 H new ATOM 0 HA ALA A 721 3.445 -7.497 2.312 1.00 0.00 H new ATOM 0 HB1 ALA A 721 2.421 -9.033 0.637 1.00 0.00 H new ATOM 0 HB2 ALA A 721 4.174 -8.861 0.378 1.00 0.00 H new ATOM 0 HB3 ALA A 721 3.529 -10.325 1.159 1.00 0.00 H new ATOM 1470 N SER A 722 1.380 -8.307 3.440 1.00 0.00 N ATOM 1471 CA SER A 722 0.250 -8.683 4.273 1.00 0.00 C ATOM 1472 C SER A 722 -0.731 -9.535 3.479 1.00 0.00 C ATOM 1473 O SER A 722 -1.450 -10.360 4.041 1.00 0.00 O ATOM 1474 CB SER A 722 -0.447 -7.427 4.790 1.00 0.00 C ATOM 1475 OG SER A 722 -1.507 -7.804 5.662 1.00 0.00 O ATOM 0 H SER A 722 1.278 -7.410 2.965 1.00 0.00 H new ATOM 0 HA SER A 722 0.612 -9.267 5.119 1.00 0.00 H new ATOM 0 HB2 SER A 722 0.265 -6.793 5.317 1.00 0.00 H new ATOM 0 HB3 SER A 722 -0.837 -6.844 3.956 1.00 0.00 H new ATOM 0 HG SER A 722 -2.282 -7.225 5.505 1.00 0.00 H new ATOM 1481 N ALA A 723 -0.756 -9.322 2.169 1.00 0.00 N ATOM 1482 CA ALA A 723 -1.652 -10.067 1.295 1.00 0.00 C ATOM 1483 C ALA A 723 -1.329 -9.772 -0.163 1.00 0.00 C ATOM 1484 O ALA A 723 -0.568 -8.853 -0.466 1.00 0.00 O ATOM 1485 CB ALA A 723 -3.105 -9.681 1.582 1.00 0.00 C ATOM 0 H ALA A 723 -0.167 -8.641 1.690 1.00 0.00 H new ATOM 0 HA ALA A 723 -1.516 -11.132 1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -3.768 -10.243 0.924 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -3.344 -9.911 2.620 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -3.239 -8.614 1.407 1.00 0.00 H new ATOM 1491 N ILE A 724 -1.907 -10.557 -1.061 1.00 0.00 N ATOM 1492 CA ILE A 724 -1.672 -10.368 -2.483 1.00 0.00 C ATOM 1493 C ILE A 724 -2.883 -10.832 -3.279 1.00 0.00 C ATOM 1494 O ILE A 724 -3.195 -12.022 -3.314 1.00 0.00 O ATOM 1495 CB ILE A 724 -0.442 -11.164 -2.927 1.00 0.00 C ATOM 1496 CG1 ILE A 724 0.775 -10.750 -2.094 1.00 0.00 C ATOM 1497 CG2 ILE A 724 -0.163 -10.884 -4.404 1.00 0.00 C ATOM 1498 CD1 ILE A 724 2.000 -11.538 -2.559 1.00 0.00 C ATOM 0 H ILE A 724 -2.537 -11.325 -0.831 1.00 0.00 H new ATOM 0 HA ILE A 724 -1.501 -9.307 -2.666 1.00 0.00 H new ATOM 0 HB ILE A 724 -0.632 -12.228 -2.783 1.00 0.00 H new ATOM 0 HG12 ILE A 724 0.955 -9.680 -2.200 1.00 0.00 H new ATOM 0 HG13 ILE A 724 0.587 -10.938 -1.037 1.00 0.00 H new ATOM 0 HG21 ILE A 724 0.713 -11.450 -4.723 1.00 0.00 H new ATOM 0 HG22 ILE A 724 -1.025 -11.183 -5.000 1.00 0.00 H new ATOM 0 HG23 ILE A 724 0.023 -9.819 -4.544 1.00 0.00 H new ATOM 0 HD11 ILE A 724 2.867 -11.245 -1.967 1.00 0.00 H new ATOM 0 HD12 ILE A 724 1.817 -12.605 -2.430 1.00 0.00 H new ATOM 0 HD13 ILE A 724 2.190 -11.327 -3.611 1.00 0.00 H new ATOM 1510 N LEU A 725 -3.561 -9.887 -3.918 1.00 0.00 N ATOM 1511 CA LEU A 725 -4.733 -10.219 -4.713 1.00 0.00 C ATOM 1512 C LEU A 725 -4.401 -10.135 -6.196 1.00 0.00 C ATOM 1513 O LEU A 725 -3.732 -9.202 -6.643 1.00 0.00 O ATOM 1514 CB LEU A 725 -5.895 -9.273 -4.381 1.00 0.00 C ATOM 1515 CG LEU A 725 -6.392 -9.542 -2.954 1.00 0.00 C ATOM 1516 CD1 LEU A 725 -5.405 -8.961 -1.939 1.00 0.00 C ATOM 1517 CD2 LEU A 725 -7.760 -8.880 -2.760 1.00 0.00 C ATOM 0 H LEU A 725 -3.322 -8.896 -3.901 1.00 0.00 H new ATOM 0 HA LEU A 725 -5.035 -11.238 -4.473 1.00 0.00 H new ATOM 0 HB2 LEU A 725 -5.570 -8.237 -4.474 1.00 0.00 H new ATOM 0 HB3 LEU A 725 -6.708 -9.417 -5.092 1.00 0.00 H new ATOM 0 HG LEU A 725 -6.475 -10.618 -2.802 1.00 0.00 H new ATOM 0 HD11 LEU A 725 -5.765 -9.156 -0.929 1.00 0.00 H new ATOM 0 HD12 LEU A 725 -4.429 -9.427 -2.073 1.00 0.00 H new ATOM 0 HD13 LEU A 725 -5.317 -7.885 -2.091 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -8.116 -9.069 -1.747 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -7.670 -7.805 -2.918 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -8.469 -9.294 -3.477 1.00 0.00 H new ATOM 1529 N SER A 726 -4.864 -11.119 -6.953 1.00 0.00 N ATOM 1530 CA SER A 726 -4.606 -11.153 -8.385 1.00 0.00 C ATOM 1531 C SER A 726 -5.366 -10.040 -9.095 1.00 0.00 C ATOM 1532 O SER A 726 -4.805 -8.990 -9.406 1.00 0.00 O ATOM 1533 CB SER A 726 -5.030 -12.504 -8.957 1.00 0.00 C ATOM 1534 OG SER A 726 -4.576 -12.607 -10.299 1.00 0.00 O ATOM 0 H SER A 726 -5.417 -11.901 -6.602 1.00 0.00 H new ATOM 0 HA SER A 726 -3.538 -11.007 -8.545 1.00 0.00 H new ATOM 0 HB2 SER A 726 -4.614 -13.313 -8.357 1.00 0.00 H new ATOM 0 HB3 SER A 726 -6.115 -12.604 -8.919 1.00 0.00 H new ATOM 0 HG SER A 726 -4.845 -13.474 -10.670 1.00 0.00 H new ATOM 1540 N LYS A 727 -6.645 -10.279 -9.352 1.00 0.00 N ATOM 1541 CA LYS A 727 -7.470 -9.291 -10.029 1.00 0.00 C ATOM 1542 C LYS A 727 -8.382 -8.584 -9.028 1.00 0.00 C ATOM 1543 O LYS A 727 -9.078 -9.235 -8.251 1.00 0.00 O ATOM 1544 CB LYS A 727 -8.313 -9.975 -11.105 1.00 0.00 C ATOM 1545 CG LYS A 727 -8.442 -9.046 -12.311 1.00 0.00 C ATOM 1546 CD LYS A 727 -9.103 -9.796 -13.468 1.00 0.00 C ATOM 1547 CE LYS A 727 -10.622 -9.633 -13.381 1.00 0.00 C ATOM 1548 NZ LYS A 727 -11.135 -10.381 -12.196 1.00 0.00 N ATOM 0 H LYS A 727 -7.130 -11.142 -9.104 1.00 0.00 H new ATOM 0 HA LYS A 727 -6.821 -8.549 -10.495 1.00 0.00 H new ATOM 0 HB2 LYS A 727 -7.849 -10.915 -11.404 1.00 0.00 H new ATOM 0 HB3 LYS A 727 -9.300 -10.217 -10.711 1.00 0.00 H new ATOM 0 HG2 LYS A 727 -9.035 -8.170 -12.046 1.00 0.00 H new ATOM 0 HG3 LYS A 727 -7.458 -8.686 -12.612 1.00 0.00 H new ATOM 0 HD2 LYS A 727 -8.739 -9.410 -14.420 1.00 0.00 H new ATOM 0 HD3 LYS A 727 -8.837 -10.852 -13.430 1.00 0.00 H new ATOM 0 HE2 LYS A 727 -10.881 -8.577 -13.298 1.00 0.00 H new ATOM 0 HE3 LYS A 727 -11.091 -10.006 -14.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 727 -12.077 -10.766 -12.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 727 -10.485 -11.161 -11.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 727 -11.201 -9.738 -11.381 1.00 0.00 H new ATOM 1562 N PRO A 728 -8.384 -7.274 -9.019 1.00 0.00 N ATOM 1563 CA PRO A 728 -9.227 -6.494 -8.075 1.00 0.00 C ATOM 1564 C PRO A 728 -10.712 -6.628 -8.391 1.00 0.00 C ATOM 1565 O PRO A 728 -11.112 -6.681 -9.555 1.00 0.00 O ATOM 1566 CB PRO A 728 -8.746 -5.052 -8.238 1.00 0.00 C ATOM 1567 CG PRO A 728 -8.081 -4.989 -9.571 1.00 0.00 C ATOM 1568 CD PRO A 728 -7.600 -6.403 -9.906 1.00 0.00 C ATOM 0 HA PRO A 728 -9.127 -6.851 -7.050 1.00 0.00 H new ATOM 0 HB2 PRO A 728 -9.581 -4.354 -8.185 1.00 0.00 H new ATOM 0 HB3 PRO A 728 -8.052 -4.780 -7.443 1.00 0.00 H new ATOM 0 HG2 PRO A 728 -8.775 -4.629 -10.330 1.00 0.00 H new ATOM 0 HG3 PRO A 728 -7.243 -4.293 -9.550 1.00 0.00 H new ATOM 0 HD2 PRO A 728 -7.774 -6.644 -10.955 1.00 0.00 H new ATOM 0 HD3 PRO A 728 -6.530 -6.512 -9.727 1.00 0.00 H new ATOM 1576 N LEU A 729 -11.516 -6.690 -7.341 1.00 0.00 N ATOM 1577 CA LEU A 729 -12.955 -6.830 -7.487 1.00 0.00 C ATOM 1578 C LEU A 729 -13.610 -6.782 -6.113 1.00 0.00 C ATOM 1579 O LEU A 729 -13.093 -7.354 -5.153 1.00 0.00 O ATOM 1580 CB LEU A 729 -13.280 -8.155 -8.176 1.00 0.00 C ATOM 1581 CG LEU A 729 -14.771 -8.206 -8.502 1.00 0.00 C ATOM 1582 CD1 LEU A 729 -15.066 -7.289 -9.690 1.00 0.00 C ATOM 1583 CD2 LEU A 729 -15.169 -9.641 -8.850 1.00 0.00 C ATOM 0 H LEU A 729 -11.194 -6.645 -6.374 1.00 0.00 H new ATOM 0 HA LEU A 729 -13.339 -6.013 -8.097 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -12.693 -8.256 -9.089 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -13.009 -8.990 -7.529 1.00 0.00 H new ATOM 0 HG LEU A 729 -15.344 -7.872 -7.637 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -16.130 -7.326 -9.922 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -14.784 -6.266 -9.439 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -14.494 -7.621 -10.556 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -16.233 -9.677 -9.083 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -14.597 -9.978 -9.715 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -14.961 -10.292 -8.001 1.00 0.00 H new ATOM 1595 N ASP A 730 -14.736 -6.088 -6.019 1.00 0.00 N ATOM 1596 CA ASP A 730 -15.439 -5.966 -4.747 1.00 0.00 C ATOM 1597 C ASP A 730 -14.529 -5.352 -3.681 1.00 0.00 C ATOM 1598 O ASP A 730 -14.051 -6.051 -2.787 1.00 0.00 O ATOM 1599 CB ASP A 730 -15.918 -7.341 -4.274 1.00 0.00 C ATOM 1600 CG ASP A 730 -17.337 -7.601 -4.769 1.00 0.00 C ATOM 1601 OD1 ASP A 730 -17.533 -7.601 -5.973 1.00 0.00 O ATOM 1602 OD2 ASP A 730 -18.207 -7.795 -3.936 1.00 0.00 O ATOM 0 H ASP A 730 -15.180 -5.605 -6.800 1.00 0.00 H new ATOM 0 HA ASP A 730 -16.299 -5.313 -4.897 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -15.247 -8.116 -4.645 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -15.890 -7.390 -3.185 1.00 0.00 H new ATOM 1607 N PRO A 731 -14.280 -4.069 -3.759 1.00 0.00 N ATOM 1608 CA PRO A 731 -13.409 -3.359 -2.774 1.00 0.00 C ATOM 1609 C PRO A 731 -13.815 -3.670 -1.334 1.00 0.00 C ATOM 1610 O PRO A 731 -13.158 -3.244 -0.381 1.00 0.00 O ATOM 1611 CB PRO A 731 -13.626 -1.877 -3.093 1.00 0.00 C ATOM 1612 CG PRO A 731 -14.087 -1.832 -4.513 1.00 0.00 C ATOM 1613 CD PRO A 731 -14.800 -3.158 -4.791 1.00 0.00 C ATOM 0 HA PRO A 731 -12.365 -3.664 -2.853 1.00 0.00 H new ATOM 0 HB2 PRO A 731 -14.368 -1.438 -2.426 1.00 0.00 H new ATOM 0 HB3 PRO A 731 -12.705 -1.309 -2.962 1.00 0.00 H new ATOM 0 HG2 PRO A 731 -14.761 -0.990 -4.674 1.00 0.00 H new ATOM 0 HG3 PRO A 731 -13.243 -1.698 -5.189 1.00 0.00 H new ATOM 0 HD2 PRO A 731 -15.882 -3.051 -4.719 1.00 0.00 H new ATOM 0 HD3 PRO A 731 -14.582 -3.525 -5.794 1.00 0.00 H new ATOM 1621 N GLN A 732 -14.910 -4.409 -1.194 1.00 0.00 N ATOM 1622 CA GLN A 732 -15.427 -4.770 0.120 1.00 0.00 C ATOM 1623 C GLN A 732 -14.511 -5.767 0.818 1.00 0.00 C ATOM 1624 O GLN A 732 -14.416 -5.773 2.045 1.00 0.00 O ATOM 1625 CB GLN A 732 -16.826 -5.360 -0.037 1.00 0.00 C ATOM 1626 CG GLN A 732 -17.761 -4.274 -0.570 1.00 0.00 C ATOM 1627 CD GLN A 732 -19.158 -4.838 -0.801 1.00 0.00 C ATOM 1628 OE1 GLN A 732 -19.311 -5.999 -1.180 1.00 0.00 O ATOM 1629 NE2 GLN A 732 -20.196 -4.078 -0.587 1.00 0.00 N ATOM 0 H GLN A 732 -15.457 -4.770 -1.976 1.00 0.00 H new ATOM 0 HA GLN A 732 -15.472 -3.873 0.738 1.00 0.00 H new ATOM 0 HB2 GLN A 732 -16.803 -6.208 -0.721 1.00 0.00 H new ATOM 0 HB3 GLN A 732 -17.188 -5.733 0.921 1.00 0.00 H new ATOM 0 HG2 GLN A 732 -17.809 -3.447 0.139 1.00 0.00 H new ATOM 0 HG3 GLN A 732 -17.366 -3.872 -1.503 1.00 0.00 H new ATOM 0 HE21 GLN A 732 -20.068 -3.116 -0.273 1.00 0.00 H new ATOM 0 HE22 GLN A 732 -21.136 -4.446 -0.734 1.00 0.00 H new ATOM 1638 N LEU A 733 -13.829 -6.597 0.041 1.00 0.00 N ATOM 1639 CA LEU A 733 -12.916 -7.575 0.619 1.00 0.00 C ATOM 1640 C LEU A 733 -11.738 -6.856 1.272 1.00 0.00 C ATOM 1641 O LEU A 733 -11.360 -7.168 2.402 1.00 0.00 O ATOM 1642 CB LEU A 733 -12.415 -8.523 -0.473 1.00 0.00 C ATOM 1643 CG LEU A 733 -11.437 -9.541 0.123 1.00 0.00 C ATOM 1644 CD1 LEU A 733 -12.204 -10.573 0.953 1.00 0.00 C ATOM 1645 CD2 LEU A 733 -10.691 -10.255 -1.008 1.00 0.00 C ATOM 0 H LEU A 733 -13.888 -6.614 -0.977 1.00 0.00 H new ATOM 0 HA LEU A 733 -13.441 -8.156 1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -13.258 -9.041 -0.931 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -11.924 -7.954 -1.262 1.00 0.00 H new ATOM 0 HG LEU A 733 -10.724 -9.021 0.762 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -11.504 -11.294 1.374 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -12.735 -10.069 1.760 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -12.920 -11.092 0.316 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -9.995 -10.979 -0.584 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -11.407 -10.771 -1.647 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -10.139 -9.524 -1.598 1.00 0.00 H new ATOM 1657 N LEU A 734 -11.180 -5.871 0.568 1.00 0.00 N ATOM 1658 CA LEU A 734 -10.067 -5.097 1.110 1.00 0.00 C ATOM 1659 C LEU A 734 -10.477 -4.462 2.429 1.00 0.00 C ATOM 1660 O LEU A 734 -9.705 -4.434 3.387 1.00 0.00 O ATOM 1661 CB LEU A 734 -9.650 -3.998 0.125 1.00 0.00 C ATOM 1662 CG LEU A 734 -8.528 -3.146 0.734 1.00 0.00 C ATOM 1663 CD1 LEU A 734 -7.213 -3.924 0.714 1.00 0.00 C ATOM 1664 CD2 LEU A 734 -8.370 -1.858 -0.077 1.00 0.00 C ATOM 0 H LEU A 734 -11.477 -5.594 -0.368 1.00 0.00 H new ATOM 0 HA LEU A 734 -9.223 -5.768 1.272 1.00 0.00 H new ATOM 0 HB2 LEU A 734 -9.312 -4.445 -0.810 1.00 0.00 H new ATOM 0 HB3 LEU A 734 -10.507 -3.368 -0.114 1.00 0.00 H new ATOM 0 HG LEU A 734 -8.783 -2.902 1.765 1.00 0.00 H new ATOM 0 HD11 LEU A 734 -6.422 -3.312 1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 734 -7.323 -4.840 1.294 1.00 0.00 H new ATOM 0 HD13 LEU A 734 -6.955 -4.175 -0.315 1.00 0.00 H new ATOM 0 HD21 LEU A 734 -7.573 -1.252 0.354 1.00 0.00 H new ATOM 0 HD22 LEU A 734 -8.119 -2.106 -1.108 1.00 0.00 H new ATOM 0 HD23 LEU A 734 -9.305 -1.298 -0.055 1.00 0.00 H new ATOM 1676 N LEU A 735 -11.701 -3.947 2.465 1.00 0.00 N ATOM 1677 CA LEU A 735 -12.208 -3.311 3.670 1.00 0.00 C ATOM 1678 C LEU A 735 -12.273 -4.318 4.808 1.00 0.00 C ATOM 1679 O LEU A 735 -11.939 -3.999 5.949 1.00 0.00 O ATOM 1680 CB LEU A 735 -13.600 -2.738 3.414 1.00 0.00 C ATOM 1681 CG LEU A 735 -14.085 -2.001 4.661 1.00 0.00 C ATOM 1682 CD1 LEU A 735 -13.288 -0.706 4.829 1.00 0.00 C ATOM 1683 CD2 LEU A 735 -15.571 -1.674 4.506 1.00 0.00 C ATOM 0 H LEU A 735 -12.353 -3.958 1.681 1.00 0.00 H new ATOM 0 HA LEU A 735 -11.532 -2.502 3.947 1.00 0.00 H new ATOM 0 HB2 LEU A 735 -13.574 -2.057 2.563 1.00 0.00 H new ATOM 0 HB3 LEU A 735 -14.294 -3.539 3.159 1.00 0.00 H new ATOM 0 HG LEU A 735 -13.940 -2.629 5.540 1.00 0.00 H new ATOM 0 HD11 LEU A 735 -13.633 -0.179 5.719 1.00 0.00 H new ATOM 0 HD12 LEU A 735 -12.229 -0.942 4.935 1.00 0.00 H new ATOM 0 HD13 LEU A 735 -13.433 -0.073 3.953 1.00 0.00 H new ATOM 0 HD21 LEU A 735 -15.922 -1.148 5.394 1.00 0.00 H new ATOM 0 HD22 LEU A 735 -15.715 -1.043 3.629 1.00 0.00 H new ATOM 0 HD23 LEU A 735 -16.136 -2.598 4.385 1.00 0.00 H new ATOM 1695 N THR A 736 -12.696 -5.537 4.488 1.00 0.00 N ATOM 1696 CA THR A 736 -12.788 -6.585 5.492 1.00 0.00 C ATOM 1697 C THR A 736 -11.420 -6.838 6.120 1.00 0.00 C ATOM 1698 O THR A 736 -11.311 -7.027 7.331 1.00 0.00 O ATOM 1699 CB THR A 736 -13.315 -7.873 4.856 1.00 0.00 C ATOM 1700 OG1 THR A 736 -14.594 -7.626 4.286 1.00 0.00 O ATOM 1701 CG2 THR A 736 -13.425 -8.966 5.921 1.00 0.00 C ATOM 0 H THR A 736 -12.978 -5.820 3.549 1.00 0.00 H new ATOM 0 HA THR A 736 -13.478 -6.263 6.272 1.00 0.00 H new ATOM 0 HB THR A 736 -12.628 -8.203 4.077 1.00 0.00 H new ATOM 0 HG1 THR A 736 -14.496 -7.051 3.499 1.00 0.00 H new ATOM 0 HG21 THR A 736 -13.801 -9.882 5.465 1.00 0.00 H new ATOM 0 HG22 THR A 736 -12.442 -9.153 6.354 1.00 0.00 H new ATOM 0 HG23 THR A 736 -14.111 -8.643 6.704 1.00 0.00 H new ATOM 1709 N THR A 737 -10.376 -6.831 5.295 1.00 0.00 N ATOM 1710 CA THR A 737 -9.031 -7.056 5.805 1.00 0.00 C ATOM 1711 C THR A 737 -8.663 -5.972 6.813 1.00 0.00 C ATOM 1712 O THR A 737 -8.069 -6.255 7.854 1.00 0.00 O ATOM 1713 CB THR A 737 -8.012 -7.046 4.662 1.00 0.00 C ATOM 1714 OG1 THR A 737 -8.431 -7.937 3.636 1.00 0.00 O ATOM 1715 CG2 THR A 737 -6.650 -7.488 5.199 1.00 0.00 C ATOM 0 H THR A 737 -10.435 -6.675 4.289 1.00 0.00 H new ATOM 0 HA THR A 737 -9.012 -8.031 6.292 1.00 0.00 H new ATOM 0 HB THR A 737 -7.936 -6.039 4.251 1.00 0.00 H new ATOM 0 HG1 THR A 737 -7.777 -7.926 2.906 1.00 0.00 H new ATOM 0 HG21 THR A 737 -5.920 -7.483 4.389 1.00 0.00 H new ATOM 0 HG22 THR A 737 -6.328 -6.802 5.982 1.00 0.00 H new ATOM 0 HG23 THR A 737 -6.730 -8.495 5.609 1.00 0.00 H new ATOM 1723 N LEU A 738 -9.019 -4.729 6.502 1.00 0.00 N ATOM 1724 CA LEU A 738 -8.715 -3.619 7.398 1.00 0.00 C ATOM 1725 C LEU A 738 -9.445 -3.794 8.728 1.00 0.00 C ATOM 1726 O LEU A 738 -8.872 -3.590 9.797 1.00 0.00 O ATOM 1727 CB LEU A 738 -9.150 -2.294 6.763 1.00 0.00 C ATOM 1728 CG LEU A 738 -8.453 -2.096 5.413 1.00 0.00 C ATOM 1729 CD1 LEU A 738 -8.924 -0.781 4.789 1.00 0.00 C ATOM 1730 CD2 LEU A 738 -6.940 -2.040 5.623 1.00 0.00 C ATOM 0 H LEU A 738 -9.512 -4.467 5.648 1.00 0.00 H new ATOM 0 HA LEU A 738 -7.639 -3.607 7.573 1.00 0.00 H new ATOM 0 HB2 LEU A 738 -10.231 -2.286 6.626 1.00 0.00 H new ATOM 0 HB3 LEU A 738 -8.907 -1.467 7.430 1.00 0.00 H new ATOM 0 HG LEU A 738 -8.699 -2.927 4.752 1.00 0.00 H new ATOM 0 HD11 LEU A 738 -8.430 -0.637 3.828 1.00 0.00 H new ATOM 0 HD12 LEU A 738 -10.003 -0.815 4.641 1.00 0.00 H new ATOM 0 HD13 LEU A 738 -8.675 0.047 5.453 1.00 0.00 H new ATOM 0 HD21 LEU A 738 -6.444 -1.899 4.662 1.00 0.00 H new ATOM 0 HD22 LEU A 738 -6.695 -1.208 6.283 1.00 0.00 H new ATOM 0 HD23 LEU A 738 -6.600 -2.973 6.073 1.00 0.00 H new ATOM 1742 N GLN A 739 -10.716 -4.168 8.646 1.00 0.00 N ATOM 1743 CA GLN A 739 -11.534 -4.365 9.839 1.00 0.00 C ATOM 1744 C GLN A 739 -11.031 -5.538 10.677 1.00 0.00 C ATOM 1745 O GLN A 739 -11.125 -5.521 11.904 1.00 0.00 O ATOM 1746 CB GLN A 739 -12.985 -4.616 9.429 1.00 0.00 C ATOM 1747 CG GLN A 739 -13.518 -3.397 8.671 1.00 0.00 C ATOM 1748 CD GLN A 739 -13.576 -2.193 9.602 1.00 0.00 C ATOM 1749 OE1 GLN A 739 -14.058 -2.305 10.731 1.00 0.00 O ATOM 1750 NE2 GLN A 739 -13.117 -1.042 9.197 1.00 0.00 N ATOM 0 H GLN A 739 -11.204 -4.341 7.767 1.00 0.00 H new ATOM 0 HA GLN A 739 -11.467 -3.462 10.446 1.00 0.00 H new ATOM 0 HB2 GLN A 739 -13.048 -5.505 8.801 1.00 0.00 H new ATOM 0 HB3 GLN A 739 -13.596 -4.805 10.311 1.00 0.00 H new ATOM 0 HG2 GLN A 739 -12.875 -3.178 7.819 1.00 0.00 H new ATOM 0 HG3 GLN A 739 -14.511 -3.610 8.275 1.00 0.00 H new ATOM 0 HE21 GLN A 739 -12.719 -0.952 8.262 1.00 0.00 H new ATOM 0 HE22 GLN A 739 -13.156 -0.231 9.815 1.00 0.00 H new ATOM 1759 N GLY A 740 -10.516 -6.561 10.008 1.00 0.00 N ATOM 1760 CA GLY A 740 -10.023 -7.746 10.701 1.00 0.00 C ATOM 1761 C GLY A 740 -8.909 -7.406 11.691 1.00 0.00 C ATOM 1762 O GLY A 740 -8.323 -8.303 12.297 1.00 0.00 O ATOM 0 H GLY A 740 -10.429 -6.596 8.992 1.00 0.00 H new ATOM 0 HA2 GLY A 740 -10.846 -8.225 11.231 1.00 0.00 H new ATOM 0 HA3 GLY A 740 -9.653 -8.466 9.971 1.00 0.00 H new ATOM 1766 N LEU A 741 -8.620 -6.118 11.856 1.00 0.00 N ATOM 1767 CA LEU A 741 -7.574 -5.700 12.788 1.00 0.00 C ATOM 1768 C LEU A 741 -8.119 -5.663 14.213 1.00 0.00 C ATOM 1769 O LEU A 741 -7.384 -5.881 15.175 1.00 0.00 O ATOM 1770 CB LEU A 741 -7.025 -4.322 12.405 1.00 0.00 C ATOM 1771 CG LEU A 741 -5.849 -3.973 13.326 1.00 0.00 C ATOM 1772 CD1 LEU A 741 -4.637 -4.833 12.961 1.00 0.00 C ATOM 1773 CD2 LEU A 741 -5.489 -2.494 13.165 1.00 0.00 C ATOM 0 H LEU A 741 -9.087 -5.355 11.365 1.00 0.00 H new ATOM 0 HA LEU A 741 -6.762 -6.425 12.735 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -6.700 -4.323 11.365 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -7.807 -3.568 12.493 1.00 0.00 H new ATOM 0 HG LEU A 741 -6.134 -4.167 14.360 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -3.803 -4.583 13.617 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -4.889 -5.887 13.080 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -4.354 -4.643 11.926 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -4.653 -2.249 13.821 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -5.208 -2.299 12.130 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -6.349 -1.879 13.429 1.00 0.00 H new