USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=16 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 Set 1.1: A 732 GLN : amide:sc= -8.51! C(o=-7.2!,f=-4.8!) USER MOD Set 1.2: A 736 THR OG1 : rot 81:sc= 1.28 USER MOD Single : A 629 HIS : no HD1:sc= -0.0157 X(o=-0.016,f=0) USER MOD Single : A 641 THR OG1 : rot 65:sc= -1.95! USER MOD Single : A 644 CYS SG : rot 82:sc= 1.11 USER MOD Single : A 646 MET CE :methyl -145:sc= -0.613 (180deg=-1.47) USER MOD Single : A 648 THR OG1 : rot 54:sc= 0.156 USER MOD Single : A 653 LYS NZ :NH3+ -160:sc= -0.0651 (180deg=-0.617) USER MOD Single : A 661 SER OG : rot 180:sc= -0.0735 USER MOD Single : A 662 THR OG1 : rot -168:sc= -1.03 USER MOD Single : A 666 GLN : amide:sc= -1.17! K(o=-1.2!,f=0) USER MOD Single : A 671 GLN : amide:sc= -0.161 X(o=-0.16,f=-0.19) USER MOD Single : A 677 MET CE :methyl -167:sc= -3.09 (180deg=-3.99!) USER MOD Single : A 684 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 685 SER OG : rot 83:sc= 0.315 USER MOD Single : A 686 CYS SG : rot 180:sc= -2.66 USER MOD Single : A 691 GLN : amide:sc= -0.294 X(o=-0.29,f=-0.61) USER MOD Single : A 692 HIS : no HD1:sc= -2.37 K(o=-2.4,f=-5.5!) USER MOD Single : A 696 HIS : no HE2:sc= -8.32! C(o=-8.3!,f=-16!) USER MOD Single : A 718 THR OG1 : rot 80:sc= 1.17 USER MOD Single : A 720 GLN : amide:sc= -3.77 K(o=-3.8,f=-0.49) USER MOD Single : A 722 SER OG : rot -130:sc= 0.672 USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 737 THR OG1 : rot 180:sc= 0 USER MOD Single : A 739 GLN : amide:sc= -0.284 X(o=-0.28,f=-0.31) USER MOD ----------------------------------------------------------------- ATOM 13 N GLY A 628 -8.252 5.336 9.548 1.00 0.00 N ATOM 14 CA GLY A 628 -6.815 5.171 9.339 1.00 0.00 C ATOM 15 C GLY A 628 -6.374 5.781 8.011 1.00 0.00 C ATOM 16 O GLY A 628 -7.177 5.943 7.092 1.00 0.00 O ATOM 0 HA2 GLY A 628 -6.270 5.642 10.157 1.00 0.00 H new ATOM 0 HA3 GLY A 628 -6.562 4.111 9.356 1.00 0.00 H new ATOM 20 N HIS A 629 -5.091 6.119 7.916 1.00 0.00 N ATOM 21 CA HIS A 629 -4.558 6.710 6.695 1.00 0.00 C ATOM 22 C HIS A 629 -3.966 5.633 5.791 1.00 0.00 C ATOM 23 O HIS A 629 -3.250 4.744 6.253 1.00 0.00 O ATOM 24 CB HIS A 629 -3.481 7.741 7.037 1.00 0.00 C ATOM 25 CG HIS A 629 -4.104 8.892 7.776 1.00 0.00 C ATOM 26 ND1 HIS A 629 -3.588 9.371 8.970 1.00 0.00 N ATOM 27 CD2 HIS A 629 -5.202 9.668 7.502 1.00 0.00 C ATOM 28 CE1 HIS A 629 -4.369 10.392 9.367 1.00 0.00 C ATOM 29 NE2 HIS A 629 -5.368 10.615 8.508 1.00 0.00 N ATOM 0 H HIS A 629 -4.408 5.995 8.663 1.00 0.00 H new ATOM 0 HA HIS A 629 -5.375 7.202 6.168 1.00 0.00 H new ATOM 0 HB2 HIS A 629 -2.704 7.281 7.647 1.00 0.00 H new ATOM 0 HB3 HIS A 629 -3.001 8.097 6.125 1.00 0.00 H new ATOM 0 HD2 HIS A 629 -5.840 9.560 6.637 1.00 0.00 H new ATOM 0 HE1 HIS A 629 -4.208 10.962 10.270 1.00 0.00 H new ATOM 0 HE2 HIS A 629 -6.096 11.326 8.575 1.00 0.00 H new ATOM 38 N ILE A 630 -4.272 5.720 4.500 1.00 0.00 N ATOM 39 CA ILE A 630 -3.770 4.749 3.532 1.00 0.00 C ATOM 40 C ILE A 630 -2.847 5.430 2.527 1.00 0.00 C ATOM 41 O ILE A 630 -3.157 6.510 2.025 1.00 0.00 O ATOM 42 CB ILE A 630 -4.944 4.113 2.784 1.00 0.00 C ATOM 43 CG1 ILE A 630 -5.936 3.534 3.793 1.00 0.00 C ATOM 44 CG2 ILE A 630 -4.429 2.992 1.878 1.00 0.00 C ATOM 45 CD1 ILE A 630 -7.220 3.129 3.066 1.00 0.00 C ATOM 0 H ILE A 630 -4.863 6.449 4.101 1.00 0.00 H new ATOM 0 HA ILE A 630 -3.212 3.981 4.067 1.00 0.00 H new ATOM 0 HB ILE A 630 -5.439 4.871 2.177 1.00 0.00 H new ATOM 0 HG12 ILE A 630 -5.500 2.669 4.294 1.00 0.00 H new ATOM 0 HG13 ILE A 630 -6.159 4.271 4.565 1.00 0.00 H new ATOM 0 HG21 ILE A 630 -5.266 2.540 1.346 1.00 0.00 H new ATOM 0 HG22 ILE A 630 -3.721 3.402 1.158 1.00 0.00 H new ATOM 0 HG23 ILE A 630 -3.932 2.234 2.484 1.00 0.00 H new ATOM 0 HD11 ILE A 630 -7.929 2.716 3.783 1.00 0.00 H new ATOM 0 HD12 ILE A 630 -7.658 4.004 2.586 1.00 0.00 H new ATOM 0 HD13 ILE A 630 -6.989 2.378 2.310 1.00 0.00 H new ATOM 57 N LEU A 631 -1.718 4.796 2.229 1.00 0.00 N ATOM 58 CA LEU A 631 -0.778 5.370 1.269 1.00 0.00 C ATOM 59 C LEU A 631 -0.738 4.545 -0.011 1.00 0.00 C ATOM 60 O LEU A 631 -0.584 3.324 0.030 1.00 0.00 O ATOM 61 CB LEU A 631 0.631 5.439 1.859 1.00 0.00 C ATOM 62 CG LEU A 631 1.553 6.159 0.866 1.00 0.00 C ATOM 63 CD1 LEU A 631 1.310 7.669 0.945 1.00 0.00 C ATOM 64 CD2 LEU A 631 3.018 5.870 1.198 1.00 0.00 C ATOM 0 H LEU A 631 -1.434 3.902 2.629 1.00 0.00 H new ATOM 0 HA LEU A 631 -1.123 6.378 1.039 1.00 0.00 H new ATOM 0 HB2 LEU A 631 0.615 5.970 2.811 1.00 0.00 H new ATOM 0 HB3 LEU A 631 1.005 4.435 2.060 1.00 0.00 H new ATOM 0 HG LEU A 631 1.335 5.799 -0.140 1.00 0.00 H new ATOM 0 HD11 LEU A 631 1.965 8.180 0.240 1.00 0.00 H new ATOM 0 HD12 LEU A 631 0.271 7.884 0.696 1.00 0.00 H new ATOM 0 HD13 LEU A 631 1.521 8.019 1.955 1.00 0.00 H new ATOM 0 HD21 LEU A 631 3.661 6.387 0.486 1.00 0.00 H new ATOM 0 HD22 LEU A 631 3.238 6.220 2.206 1.00 0.00 H new ATOM 0 HD23 LEU A 631 3.200 4.797 1.139 1.00 0.00 H new ATOM 76 N LEU A 632 -0.865 5.224 -1.148 1.00 0.00 N ATOM 77 CA LEU A 632 -0.831 4.547 -2.438 1.00 0.00 C ATOM 78 C LEU A 632 0.373 5.002 -3.256 1.00 0.00 C ATOM 79 O LEU A 632 0.562 6.195 -3.492 1.00 0.00 O ATOM 80 CB LEU A 632 -2.111 4.837 -3.219 1.00 0.00 C ATOM 81 CG LEU A 632 -2.109 4.022 -4.512 1.00 0.00 C ATOM 82 CD1 LEU A 632 -2.445 2.565 -4.193 1.00 0.00 C ATOM 83 CD2 LEU A 632 -3.153 4.589 -5.476 1.00 0.00 C ATOM 0 H LEU A 632 -0.991 6.235 -1.201 1.00 0.00 H new ATOM 0 HA LEU A 632 -0.750 3.475 -2.255 1.00 0.00 H new ATOM 0 HB2 LEU A 632 -2.983 4.583 -2.617 1.00 0.00 H new ATOM 0 HB3 LEU A 632 -2.179 5.901 -3.446 1.00 0.00 H new ATOM 0 HG LEU A 632 -1.124 4.076 -4.975 1.00 0.00 H new ATOM 0 HD11 LEU A 632 -2.444 1.981 -5.114 1.00 0.00 H new ATOM 0 HD12 LEU A 632 -1.700 2.162 -3.507 1.00 0.00 H new ATOM 0 HD13 LEU A 632 -3.431 2.512 -3.731 1.00 0.00 H new ATOM 0 HD21 LEU A 632 -3.151 4.007 -6.398 1.00 0.00 H new ATOM 0 HD22 LEU A 632 -4.140 4.536 -5.016 1.00 0.00 H new ATOM 0 HD23 LEU A 632 -2.913 5.628 -5.702 1.00 0.00 H new ATOM 95 N LEU A 633 1.177 4.044 -3.700 1.00 0.00 N ATOM 96 CA LEU A 633 2.348 4.357 -4.507 1.00 0.00 C ATOM 97 C LEU A 633 2.216 3.705 -5.879 1.00 0.00 C ATOM 98 O LEU A 633 2.234 2.479 -5.994 1.00 0.00 O ATOM 99 CB LEU A 633 3.609 3.844 -3.812 1.00 0.00 C ATOM 100 CG LEU A 633 4.837 4.267 -4.612 1.00 0.00 C ATOM 101 CD1 LEU A 633 5.168 5.726 -4.303 1.00 0.00 C ATOM 102 CD2 LEU A 633 6.023 3.379 -4.230 1.00 0.00 C ATOM 0 H LEU A 633 1.041 3.050 -3.516 1.00 0.00 H new ATOM 0 HA LEU A 633 2.421 5.438 -4.628 1.00 0.00 H new ATOM 0 HB2 LEU A 633 3.667 4.242 -2.799 1.00 0.00 H new ATOM 0 HB3 LEU A 633 3.574 2.758 -3.726 1.00 0.00 H new ATOM 0 HG LEU A 633 4.633 4.161 -5.677 1.00 0.00 H new ATOM 0 HD11 LEU A 633 6.045 6.029 -4.874 1.00 0.00 H new ATOM 0 HD12 LEU A 633 4.322 6.357 -4.576 1.00 0.00 H new ATOM 0 HD13 LEU A 633 5.373 5.835 -3.238 1.00 0.00 H new ATOM 0 HD21 LEU A 633 6.902 3.680 -4.801 1.00 0.00 H new ATOM 0 HD22 LEU A 633 6.229 3.485 -3.165 1.00 0.00 H new ATOM 0 HD23 LEU A 633 5.785 2.339 -4.452 1.00 0.00 H new ATOM 114 N GLU A 634 2.074 4.524 -6.916 1.00 0.00 N ATOM 115 CA GLU A 634 1.930 3.997 -8.268 1.00 0.00 C ATOM 116 C GLU A 634 2.265 5.067 -9.303 1.00 0.00 C ATOM 117 O GLU A 634 2.317 6.255 -8.986 1.00 0.00 O ATOM 118 CB GLU A 634 0.492 3.506 -8.478 1.00 0.00 C ATOM 119 CG GLU A 634 0.387 2.726 -9.794 1.00 0.00 C ATOM 120 CD GLU A 634 -1.042 2.234 -9.996 1.00 0.00 C ATOM 121 OE1 GLU A 634 -1.870 2.518 -9.147 1.00 0.00 O ATOM 122 OE2 GLU A 634 -1.288 1.580 -10.997 1.00 0.00 O ATOM 0 H GLU A 634 2.056 5.542 -6.849 1.00 0.00 H new ATOM 0 HA GLU A 634 2.623 3.165 -8.393 1.00 0.00 H new ATOM 0 HB2 GLU A 634 0.191 2.871 -7.645 1.00 0.00 H new ATOM 0 HB3 GLU A 634 -0.191 4.355 -8.494 1.00 0.00 H new ATOM 0 HG2 GLU A 634 0.683 3.362 -10.628 1.00 0.00 H new ATOM 0 HG3 GLU A 634 1.073 1.879 -9.780 1.00 0.00 H new ATOM 129 N GLU A 635 2.472 4.636 -10.541 1.00 0.00 N ATOM 130 CA GLU A 635 2.779 5.558 -11.627 1.00 0.00 C ATOM 131 C GLU A 635 1.556 5.700 -12.527 1.00 0.00 C ATOM 132 O GLU A 635 0.601 4.936 -12.404 1.00 0.00 O ATOM 133 CB GLU A 635 3.960 5.032 -12.447 1.00 0.00 C ATOM 134 CG GLU A 635 5.176 4.846 -11.535 1.00 0.00 C ATOM 135 CD GLU A 635 5.565 6.175 -10.895 1.00 0.00 C ATOM 136 OE1 GLU A 635 5.278 7.203 -11.487 1.00 0.00 O ATOM 137 OE2 GLU A 635 6.140 6.145 -9.819 1.00 0.00 O ATOM 0 H GLU A 635 2.433 3.655 -10.818 1.00 0.00 H new ATOM 0 HA GLU A 635 3.044 6.529 -11.209 1.00 0.00 H new ATOM 0 HB2 GLU A 635 3.696 4.084 -12.916 1.00 0.00 H new ATOM 0 HB3 GLU A 635 4.198 5.730 -13.250 1.00 0.00 H new ATOM 0 HG2 GLU A 635 4.949 4.114 -10.760 1.00 0.00 H new ATOM 0 HG3 GLU A 635 6.014 4.452 -12.110 1.00 0.00 H new ATOM 144 N GLU A 636 1.583 6.681 -13.421 1.00 0.00 N ATOM 145 CA GLU A 636 0.460 6.908 -14.326 1.00 0.00 C ATOM 146 C GLU A 636 -0.760 7.393 -13.551 1.00 0.00 C ATOM 147 O GLU A 636 -1.362 6.643 -12.783 1.00 0.00 O ATOM 148 CB GLU A 636 0.109 5.617 -15.072 1.00 0.00 C ATOM 149 CG GLU A 636 -0.938 5.915 -16.147 1.00 0.00 C ATOM 150 CD GLU A 636 -0.300 6.673 -17.305 1.00 0.00 C ATOM 151 OE1 GLU A 636 0.903 6.557 -17.475 1.00 0.00 O ATOM 152 OE2 GLU A 636 -1.024 7.359 -18.007 1.00 0.00 O ATOM 0 H GLU A 636 2.363 7.328 -13.540 1.00 0.00 H new ATOM 0 HA GLU A 636 0.752 7.672 -15.046 1.00 0.00 H new ATOM 0 HB2 GLU A 636 1.004 5.194 -15.529 1.00 0.00 H new ATOM 0 HB3 GLU A 636 -0.274 4.874 -14.373 1.00 0.00 H new ATOM 0 HG2 GLU A 636 -1.374 4.984 -16.508 1.00 0.00 H new ATOM 0 HG3 GLU A 636 -1.750 6.504 -15.721 1.00 0.00 H new ATOM 159 N ASP A 637 -1.118 8.654 -13.759 1.00 0.00 N ATOM 160 CA ASP A 637 -2.265 9.240 -13.079 1.00 0.00 C ATOM 161 C ASP A 637 -3.538 8.442 -13.351 1.00 0.00 C ATOM 162 O ASP A 637 -4.396 8.319 -12.480 1.00 0.00 O ATOM 163 CB ASP A 637 -2.467 10.680 -13.551 1.00 0.00 C ATOM 164 CG ASP A 637 -3.605 11.332 -12.773 1.00 0.00 C ATOM 165 OD1 ASP A 637 -4.125 10.692 -11.873 1.00 0.00 O ATOM 166 OD2 ASP A 637 -3.941 12.461 -13.089 1.00 0.00 O ATOM 0 H ASP A 637 -0.631 9.289 -14.392 1.00 0.00 H new ATOM 0 HA ASP A 637 -2.065 9.221 -12.008 1.00 0.00 H new ATOM 0 HB2 ASP A 637 -1.548 11.249 -13.411 1.00 0.00 H new ATOM 0 HB3 ASP A 637 -2.691 10.693 -14.618 1.00 0.00 H new ATOM 171 N GLU A 638 -3.667 7.916 -14.564 1.00 0.00 N ATOM 172 CA GLU A 638 -4.862 7.159 -14.924 1.00 0.00 C ATOM 173 C GLU A 638 -5.008 5.910 -14.063 1.00 0.00 C ATOM 174 O GLU A 638 -6.107 5.583 -13.618 1.00 0.00 O ATOM 175 CB GLU A 638 -4.803 6.753 -16.398 1.00 0.00 C ATOM 176 CG GLU A 638 -6.132 6.113 -16.804 1.00 0.00 C ATOM 177 CD GLU A 638 -6.052 5.603 -18.238 1.00 0.00 C ATOM 178 OE1 GLU A 638 -4.967 5.629 -18.796 1.00 0.00 O ATOM 179 OE2 GLU A 638 -7.076 5.187 -18.757 1.00 0.00 O ATOM 0 H GLU A 638 -2.971 7.997 -15.305 1.00 0.00 H new ATOM 0 HA GLU A 638 -5.726 7.801 -14.752 1.00 0.00 H new ATOM 0 HB2 GLU A 638 -4.603 7.626 -17.019 1.00 0.00 H new ATOM 0 HB3 GLU A 638 -3.985 6.052 -16.561 1.00 0.00 H new ATOM 0 HG2 GLU A 638 -6.369 5.290 -16.130 1.00 0.00 H new ATOM 0 HG3 GLU A 638 -6.938 6.841 -16.713 1.00 0.00 H new ATOM 186 N ALA A 639 -3.904 5.212 -13.828 1.00 0.00 N ATOM 187 CA ALA A 639 -3.952 4.005 -13.014 1.00 0.00 C ATOM 188 C ALA A 639 -4.164 4.357 -11.547 1.00 0.00 C ATOM 189 O ALA A 639 -4.995 3.755 -10.866 1.00 0.00 O ATOM 190 CB ALA A 639 -2.655 3.213 -13.169 1.00 0.00 C ATOM 0 H ALA A 639 -2.979 5.455 -14.183 1.00 0.00 H new ATOM 0 HA ALA A 639 -4.789 3.395 -13.355 1.00 0.00 H new ATOM 0 HB1 ALA A 639 -2.703 2.313 -12.556 1.00 0.00 H new ATOM 0 HB2 ALA A 639 -2.522 2.933 -14.214 1.00 0.00 H new ATOM 0 HB3 ALA A 639 -1.813 3.827 -12.848 1.00 0.00 H new ATOM 196 N ALA A 640 -3.410 5.339 -11.068 1.00 0.00 N ATOM 197 CA ALA A 640 -3.525 5.766 -9.681 1.00 0.00 C ATOM 198 C ALA A 640 -4.899 6.371 -9.419 1.00 0.00 C ATOM 199 O ALA A 640 -5.469 6.195 -8.342 1.00 0.00 O ATOM 200 CB ALA A 640 -2.442 6.797 -9.361 1.00 0.00 C ATOM 0 H ALA A 640 -2.718 5.851 -11.615 1.00 0.00 H new ATOM 0 HA ALA A 640 -3.397 4.894 -9.040 1.00 0.00 H new ATOM 0 HB1 ALA A 640 -2.535 7.111 -8.321 1.00 0.00 H new ATOM 0 HB2 ALA A 640 -1.459 6.353 -9.520 1.00 0.00 H new ATOM 0 HB3 ALA A 640 -2.559 7.662 -10.014 1.00 0.00 H new ATOM 206 N THR A 641 -5.427 7.086 -10.408 1.00 0.00 N ATOM 207 CA THR A 641 -6.736 7.710 -10.264 1.00 0.00 C ATOM 208 C THR A 641 -7.820 6.651 -10.083 1.00 0.00 C ATOM 209 O THR A 641 -8.667 6.765 -9.199 1.00 0.00 O ATOM 210 CB THR A 641 -7.050 8.563 -11.496 1.00 0.00 C ATOM 211 OG1 THR A 641 -6.026 9.531 -11.675 1.00 0.00 O ATOM 212 CG2 THR A 641 -8.389 9.272 -11.302 1.00 0.00 C ATOM 0 H THR A 641 -4.974 7.246 -11.308 1.00 0.00 H new ATOM 0 HA THR A 641 -6.717 8.347 -9.379 1.00 0.00 H new ATOM 0 HB THR A 641 -7.104 7.921 -12.375 1.00 0.00 H new ATOM 0 HG1 THR A 641 -5.182 9.079 -11.884 1.00 0.00 H new ATOM 0 HG21 THR A 641 -8.610 9.878 -12.180 1.00 0.00 H new ATOM 0 HG22 THR A 641 -9.177 8.531 -11.165 1.00 0.00 H new ATOM 0 HG23 THR A 641 -8.337 9.913 -10.422 1.00 0.00 H new ATOM 220 N VAL A 642 -7.786 5.617 -10.918 1.00 0.00 N ATOM 221 CA VAL A 642 -8.778 4.551 -10.825 1.00 0.00 C ATOM 222 C VAL A 642 -8.810 3.973 -9.416 1.00 0.00 C ATOM 223 O VAL A 642 -9.875 3.844 -8.811 1.00 0.00 O ATOM 224 CB VAL A 642 -8.451 3.438 -11.824 1.00 0.00 C ATOM 225 CG1 VAL A 642 -9.289 2.198 -11.502 1.00 0.00 C ATOM 226 CG2 VAL A 642 -8.778 3.911 -13.243 1.00 0.00 C ATOM 0 H VAL A 642 -7.093 5.495 -11.657 1.00 0.00 H new ATOM 0 HA VAL A 642 -9.756 4.972 -11.059 1.00 0.00 H new ATOM 0 HB VAL A 642 -7.391 3.192 -11.755 1.00 0.00 H new ATOM 0 HG11 VAL A 642 -9.056 1.406 -12.214 1.00 0.00 H new ATOM 0 HG12 VAL A 642 -9.061 1.857 -10.492 1.00 0.00 H new ATOM 0 HG13 VAL A 642 -10.348 2.447 -11.571 1.00 0.00 H new ATOM 0 HG21 VAL A 642 -8.545 3.118 -13.954 1.00 0.00 H new ATOM 0 HG22 VAL A 642 -9.838 4.158 -13.309 1.00 0.00 H new ATOM 0 HG23 VAL A 642 -8.185 4.795 -13.478 1.00 0.00 H new ATOM 236 N VAL A 643 -7.638 3.624 -8.902 1.00 0.00 N ATOM 237 CA VAL A 643 -7.544 3.057 -7.565 1.00 0.00 C ATOM 238 C VAL A 643 -8.110 4.020 -6.525 1.00 0.00 C ATOM 239 O VAL A 643 -8.833 3.615 -5.613 1.00 0.00 O ATOM 240 CB VAL A 643 -6.084 2.741 -7.233 1.00 0.00 C ATOM 241 CG1 VAL A 643 -5.985 2.226 -5.795 1.00 0.00 C ATOM 242 CG2 VAL A 643 -5.565 1.670 -8.196 1.00 0.00 C ATOM 0 H VAL A 643 -6.746 3.723 -9.387 1.00 0.00 H new ATOM 0 HA VAL A 643 -8.130 2.138 -7.542 1.00 0.00 H new ATOM 0 HB VAL A 643 -5.484 3.645 -7.335 1.00 0.00 H new ATOM 0 HG11 VAL A 643 -4.945 2.001 -5.560 1.00 0.00 H new ATOM 0 HG12 VAL A 643 -6.356 2.988 -5.109 1.00 0.00 H new ATOM 0 HG13 VAL A 643 -6.584 1.321 -5.690 1.00 0.00 H new ATOM 0 HG21 VAL A 643 -4.525 1.443 -7.962 1.00 0.00 H new ATOM 0 HG22 VAL A 643 -6.166 0.766 -8.093 1.00 0.00 H new ATOM 0 HG23 VAL A 643 -5.634 2.037 -9.220 1.00 0.00 H new ATOM 252 N CYS A 644 -7.764 5.295 -6.664 1.00 0.00 N ATOM 253 CA CYS A 644 -8.223 6.316 -5.727 1.00 0.00 C ATOM 254 C CYS A 644 -9.732 6.538 -5.824 1.00 0.00 C ATOM 255 O CYS A 644 -10.394 6.770 -4.813 1.00 0.00 O ATOM 256 CB CYS A 644 -7.496 7.633 -6.004 1.00 0.00 C ATOM 257 SG CYS A 644 -5.721 7.411 -5.729 1.00 0.00 S ATOM 0 H CYS A 644 -7.169 5.646 -7.414 1.00 0.00 H new ATOM 0 HA CYS A 644 -7.998 5.967 -4.719 1.00 0.00 H new ATOM 0 HB2 CYS A 644 -7.679 7.953 -7.030 1.00 0.00 H new ATOM 0 HB3 CYS A 644 -7.881 8.417 -5.352 1.00 0.00 H new ATOM 0 HG CYS A 644 -5.181 6.879 -6.785 1.00 0.00 H new ATOM 263 N GLU A 645 -10.272 6.480 -7.037 1.00 0.00 N ATOM 264 CA GLU A 645 -11.702 6.696 -7.225 1.00 0.00 C ATOM 265 C GLU A 645 -12.523 5.640 -6.496 1.00 0.00 C ATOM 266 O GLU A 645 -13.559 5.952 -5.908 1.00 0.00 O ATOM 267 CB GLU A 645 -12.049 6.678 -8.714 1.00 0.00 C ATOM 268 CG GLU A 645 -11.522 7.954 -9.375 1.00 0.00 C ATOM 269 CD GLU A 645 -12.176 9.177 -8.741 1.00 0.00 C ATOM 270 OE1 GLU A 645 -13.216 9.016 -8.123 1.00 0.00 O ATOM 271 OE2 GLU A 645 -11.628 10.258 -8.883 1.00 0.00 O ATOM 0 H GLU A 645 -9.751 6.288 -7.892 1.00 0.00 H new ATOM 0 HA GLU A 645 -11.948 7.672 -6.806 1.00 0.00 H new ATOM 0 HB2 GLU A 645 -11.611 5.801 -9.190 1.00 0.00 H new ATOM 0 HB3 GLU A 645 -13.129 6.606 -8.846 1.00 0.00 H new ATOM 0 HG2 GLU A 645 -10.439 8.011 -9.263 1.00 0.00 H new ATOM 0 HG3 GLU A 645 -11.731 7.933 -10.445 1.00 0.00 H new ATOM 278 N MET A 646 -12.065 4.394 -6.523 1.00 0.00 N ATOM 279 CA MET A 646 -12.797 3.335 -5.840 1.00 0.00 C ATOM 280 C MET A 646 -12.775 3.578 -4.334 1.00 0.00 C ATOM 281 O MET A 646 -13.813 3.553 -3.669 1.00 0.00 O ATOM 282 CB MET A 646 -12.177 1.967 -6.148 1.00 0.00 C ATOM 283 CG MET A 646 -12.367 1.630 -7.630 1.00 0.00 C ATOM 284 SD MET A 646 -11.973 -0.117 -7.910 1.00 0.00 S ATOM 285 CE MET A 646 -10.288 -0.085 -7.256 1.00 0.00 C ATOM 0 H MET A 646 -11.212 4.097 -6.997 1.00 0.00 H new ATOM 0 HA MET A 646 -13.827 3.342 -6.195 1.00 0.00 H new ATOM 0 HB2 MET A 646 -11.115 1.975 -5.901 1.00 0.00 H new ATOM 0 HB3 MET A 646 -12.642 1.200 -5.529 1.00 0.00 H new ATOM 0 HG2 MET A 646 -13.394 1.835 -7.931 1.00 0.00 H new ATOM 0 HG3 MET A 646 -11.723 2.261 -8.243 1.00 0.00 H new ATOM 0 HE1 MET A 646 -9.661 -0.766 -7.832 1.00 0.00 H new ATOM 0 HE2 MET A 646 -9.888 0.926 -7.330 1.00 0.00 H new ATOM 0 HE3 MET A 646 -10.297 -0.396 -6.211 1.00 0.00 H new ATOM 295 N LEU A 647 -11.580 3.824 -3.805 1.00 0.00 N ATOM 296 CA LEU A 647 -11.425 4.080 -2.379 1.00 0.00 C ATOM 297 C LEU A 647 -12.012 5.439 -2.009 1.00 0.00 C ATOM 298 O LEU A 647 -12.707 5.572 -1.000 1.00 0.00 O ATOM 299 CB LEU A 647 -9.946 4.047 -2.014 1.00 0.00 C ATOM 300 CG LEU A 647 -9.350 2.704 -2.438 1.00 0.00 C ATOM 301 CD1 LEU A 647 -7.917 2.587 -1.916 1.00 0.00 C ATOM 302 CD2 LEU A 647 -10.196 1.569 -1.860 1.00 0.00 C ATOM 0 H LEU A 647 -10.711 3.851 -4.339 1.00 0.00 H new ATOM 0 HA LEU A 647 -11.959 3.308 -1.826 1.00 0.00 H new ATOM 0 HB2 LEU A 647 -9.420 4.864 -2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 647 -9.821 4.190 -0.941 1.00 0.00 H new ATOM 0 HG LEU A 647 -9.343 2.639 -3.526 1.00 0.00 H new ATOM 0 HD11 LEU A 647 -7.496 1.629 -2.220 1.00 0.00 H new ATOM 0 HD12 LEU A 647 -7.313 3.396 -2.327 1.00 0.00 H new ATOM 0 HD13 LEU A 647 -7.920 2.653 -0.828 1.00 0.00 H new ATOM 0 HD21 LEU A 647 -9.773 0.610 -2.161 1.00 0.00 H new ATOM 0 HD22 LEU A 647 -10.202 1.637 -0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 647 -11.217 1.649 -2.234 1.00 0.00 H new ATOM 314 N THR A 648 -11.733 6.446 -2.835 1.00 0.00 N ATOM 315 CA THR A 648 -12.246 7.788 -2.586 1.00 0.00 C ATOM 316 C THR A 648 -13.763 7.750 -2.467 1.00 0.00 C ATOM 317 O THR A 648 -14.346 8.394 -1.595 1.00 0.00 O ATOM 318 CB THR A 648 -11.851 8.726 -3.729 1.00 0.00 C ATOM 319 OG1 THR A 648 -10.436 8.753 -3.851 1.00 0.00 O ATOM 320 CG2 THR A 648 -12.369 10.137 -3.442 1.00 0.00 C ATOM 0 H THR A 648 -11.160 6.358 -3.674 1.00 0.00 H new ATOM 0 HA THR A 648 -11.817 8.157 -1.654 1.00 0.00 H new ATOM 0 HB THR A 648 -12.289 8.366 -4.660 1.00 0.00 H new ATOM 0 HG1 THR A 648 -10.098 7.837 -3.938 1.00 0.00 H new ATOM 0 HG21 THR A 648 -12.086 10.802 -4.258 1.00 0.00 H new ATOM 0 HG22 THR A 648 -13.455 10.115 -3.353 1.00 0.00 H new ATOM 0 HG23 THR A 648 -11.936 10.501 -2.510 1.00 0.00 H new ATOM 328 N ALA A 649 -14.391 6.984 -3.352 1.00 0.00 N ATOM 329 CA ALA A 649 -15.841 6.856 -3.345 1.00 0.00 C ATOM 330 C ALA A 649 -16.310 6.178 -2.063 1.00 0.00 C ATOM 331 O ALA A 649 -17.388 6.478 -1.549 1.00 0.00 O ATOM 332 CB ALA A 649 -16.298 6.038 -4.555 1.00 0.00 C ATOM 0 H ALA A 649 -13.921 6.445 -4.079 1.00 0.00 H new ATOM 0 HA ALA A 649 -16.277 7.854 -3.396 1.00 0.00 H new ATOM 0 HB1 ALA A 649 -17.384 5.946 -4.543 1.00 0.00 H new ATOM 0 HB2 ALA A 649 -15.986 6.539 -5.472 1.00 0.00 H new ATOM 0 HB3 ALA A 649 -15.850 5.045 -4.513 1.00 0.00 H new ATOM 338 N ALA A 650 -15.499 5.253 -1.558 1.00 0.00 N ATOM 339 CA ALA A 650 -15.850 4.527 -0.340 1.00 0.00 C ATOM 340 C ALA A 650 -15.645 5.392 0.905 1.00 0.00 C ATOM 341 O ALA A 650 -15.986 4.981 2.014 1.00 0.00 O ATOM 342 CB ALA A 650 -14.994 3.265 -0.225 1.00 0.00 C ATOM 0 H ALA A 650 -14.603 4.990 -1.968 1.00 0.00 H new ATOM 0 HA ALA A 650 -16.905 4.259 -0.402 1.00 0.00 H new ATOM 0 HB1 ALA A 650 -15.259 2.727 0.685 1.00 0.00 H new ATOM 0 HB2 ALA A 650 -15.171 2.625 -1.090 1.00 0.00 H new ATOM 0 HB3 ALA A 650 -13.940 3.542 -0.188 1.00 0.00 H new ATOM 348 N GLY A 651 -15.091 6.587 0.720 1.00 0.00 N ATOM 349 CA GLY A 651 -14.854 7.490 1.846 1.00 0.00 C ATOM 350 C GLY A 651 -13.515 7.191 2.524 1.00 0.00 C ATOM 351 O GLY A 651 -13.257 7.651 3.637 1.00 0.00 O ATOM 0 H GLY A 651 -14.800 6.951 -0.187 1.00 0.00 H new ATOM 0 HA2 GLY A 651 -14.865 8.522 1.496 1.00 0.00 H new ATOM 0 HA3 GLY A 651 -15.662 7.391 2.571 1.00 0.00 H new ATOM 355 N PHE A 652 -12.670 6.422 1.845 1.00 0.00 N ATOM 356 CA PHE A 652 -11.358 6.066 2.382 1.00 0.00 C ATOM 357 C PHE A 652 -10.307 7.083 1.937 1.00 0.00 C ATOM 358 O PHE A 652 -10.358 7.584 0.813 1.00 0.00 O ATOM 359 CB PHE A 652 -10.958 4.670 1.890 1.00 0.00 C ATOM 360 CG PHE A 652 -11.778 3.616 2.603 1.00 0.00 C ATOM 361 CD1 PHE A 652 -13.170 3.603 2.466 1.00 0.00 C ATOM 362 CD2 PHE A 652 -11.144 2.649 3.395 1.00 0.00 C ATOM 363 CE1 PHE A 652 -13.930 2.626 3.121 1.00 0.00 C ATOM 364 CE2 PHE A 652 -11.904 1.672 4.050 1.00 0.00 C ATOM 365 CZ PHE A 652 -13.298 1.661 3.913 1.00 0.00 C ATOM 0 H PHE A 652 -12.868 6.033 0.923 1.00 0.00 H new ATOM 0 HA PHE A 652 -11.414 6.068 3.471 1.00 0.00 H new ATOM 0 HB2 PHE A 652 -11.113 4.596 0.814 1.00 0.00 H new ATOM 0 HB3 PHE A 652 -9.897 4.501 2.072 1.00 0.00 H new ATOM 0 HD1 PHE A 652 -13.659 4.347 1.855 1.00 0.00 H new ATOM 0 HD2 PHE A 652 -10.069 2.657 3.500 1.00 0.00 H new ATOM 0 HE1 PHE A 652 -15.005 2.617 3.015 1.00 0.00 H new ATOM 0 HE2 PHE A 652 -11.415 0.927 4.661 1.00 0.00 H new ATOM 0 HZ PHE A 652 -13.885 0.908 4.418 1.00 0.00 H new ATOM 375 N LYS A 653 -9.354 7.380 2.818 1.00 0.00 N ATOM 376 CA LYS A 653 -8.300 8.336 2.489 1.00 0.00 C ATOM 377 C LYS A 653 -7.097 7.625 1.889 1.00 0.00 C ATOM 378 O LYS A 653 -6.424 6.846 2.563 1.00 0.00 O ATOM 379 CB LYS A 653 -7.842 9.087 3.741 1.00 0.00 C ATOM 380 CG LYS A 653 -8.927 10.057 4.204 1.00 0.00 C ATOM 381 CD LYS A 653 -8.392 10.857 5.393 1.00 0.00 C ATOM 382 CE LYS A 653 -9.495 11.742 5.975 1.00 0.00 C ATOM 383 NZ LYS A 653 -10.223 12.437 4.874 1.00 0.00 N ATOM 0 H LYS A 653 -9.290 6.978 3.753 1.00 0.00 H new ATOM 0 HA LYS A 653 -8.711 9.040 1.765 1.00 0.00 H new ATOM 0 HB2 LYS A 653 -7.616 8.377 4.537 1.00 0.00 H new ATOM 0 HB3 LYS A 653 -6.923 9.633 3.530 1.00 0.00 H new ATOM 0 HG2 LYS A 653 -9.206 10.728 3.392 1.00 0.00 H new ATOM 0 HG3 LYS A 653 -9.826 9.511 4.489 1.00 0.00 H new ATOM 0 HD2 LYS A 653 -8.019 10.177 6.159 1.00 0.00 H new ATOM 0 HD3 LYS A 653 -7.551 11.473 5.077 1.00 0.00 H new ATOM 0 HE2 LYS A 653 -10.190 11.136 6.557 1.00 0.00 H new ATOM 0 HE3 LYS A 653 -9.063 12.475 6.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 653 -10.721 13.266 5.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 653 -9.544 12.744 4.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 653 -10.913 11.785 4.448 1.00 0.00 H new ATOM 397 N VAL A 654 -6.825 7.910 0.625 1.00 0.00 N ATOM 398 CA VAL A 654 -5.690 7.307 -0.056 1.00 0.00 C ATOM 399 C VAL A 654 -4.844 8.385 -0.717 1.00 0.00 C ATOM 400 O VAL A 654 -5.373 9.285 -1.371 1.00 0.00 O ATOM 401 CB VAL A 654 -6.170 6.315 -1.111 1.00 0.00 C ATOM 402 CG1 VAL A 654 -4.960 5.668 -1.783 1.00 0.00 C ATOM 403 CG2 VAL A 654 -7.015 5.231 -0.443 1.00 0.00 C ATOM 0 H VAL A 654 -7.372 8.552 0.052 1.00 0.00 H new ATOM 0 HA VAL A 654 -5.086 6.777 0.681 1.00 0.00 H new ATOM 0 HB VAL A 654 -6.769 6.837 -1.857 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -5.299 4.958 -2.538 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -4.352 6.438 -2.257 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -4.365 5.145 -1.035 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -7.358 4.522 -1.196 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -6.414 4.708 0.301 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -7.876 5.689 0.043 1.00 0.00 H new ATOM 413 N ILE A 655 -3.533 8.298 -0.548 1.00 0.00 N ATOM 414 CA ILE A 655 -2.647 9.285 -1.146 1.00 0.00 C ATOM 415 C ILE A 655 -1.800 8.645 -2.241 1.00 0.00 C ATOM 416 O ILE A 655 -1.114 7.651 -2.008 1.00 0.00 O ATOM 417 CB ILE A 655 -1.749 9.894 -0.070 1.00 0.00 C ATOM 418 CG1 ILE A 655 -2.628 10.414 1.072 1.00 0.00 C ATOM 419 CG2 ILE A 655 -0.955 11.055 -0.672 1.00 0.00 C ATOM 420 CD1 ILE A 655 -1.753 10.976 2.193 1.00 0.00 C ATOM 0 H ILE A 655 -3.065 7.567 -0.011 1.00 0.00 H new ATOM 0 HA ILE A 655 -3.250 10.075 -1.594 1.00 0.00 H new ATOM 0 HB ILE A 655 -1.058 9.141 0.309 1.00 0.00 H new ATOM 0 HG12 ILE A 655 -3.300 11.188 0.701 1.00 0.00 H new ATOM 0 HG13 ILE A 655 -3.253 9.608 1.457 1.00 0.00 H new ATOM 0 HG21 ILE A 655 -0.313 11.492 0.093 1.00 0.00 H new ATOM 0 HG22 ILE A 655 -0.341 10.688 -1.495 1.00 0.00 H new ATOM 0 HG23 ILE A 655 -1.644 11.813 -1.044 1.00 0.00 H new ATOM 0 HD11 ILE A 655 -2.387 11.343 3.000 1.00 0.00 H new ATOM 0 HD12 ILE A 655 -1.100 10.191 2.573 1.00 0.00 H new ATOM 0 HD13 ILE A 655 -1.148 11.796 1.806 1.00 0.00 H new ATOM 432 N TRP A 656 -1.859 9.220 -3.439 1.00 0.00 N ATOM 433 CA TRP A 656 -1.099 8.694 -4.566 1.00 0.00 C ATOM 434 C TRP A 656 0.236 9.417 -4.702 1.00 0.00 C ATOM 435 O TRP A 656 0.278 10.633 -4.896 1.00 0.00 O ATOM 436 CB TRP A 656 -1.902 8.861 -5.856 1.00 0.00 C ATOM 437 CG TRP A 656 -1.029 8.535 -7.022 1.00 0.00 C ATOM 438 CD1 TRP A 656 -0.298 7.404 -7.152 1.00 0.00 C ATOM 439 CD2 TRP A 656 -0.776 9.329 -8.216 1.00 0.00 C ATOM 440 NE1 TRP A 656 0.388 7.453 -8.352 1.00 0.00 N ATOM 441 CE2 TRP A 656 0.126 8.620 -9.045 1.00 0.00 C ATOM 442 CE3 TRP A 656 -1.239 10.583 -8.658 1.00 0.00 C ATOM 443 CZ2 TRP A 656 0.556 9.139 -10.266 1.00 0.00 C ATOM 444 CZ3 TRP A 656 -0.808 11.107 -9.887 1.00 0.00 C ATOM 445 CH2 TRP A 656 0.089 10.386 -10.689 1.00 0.00 C ATOM 0 H TRP A 656 -2.421 10.044 -3.652 1.00 0.00 H new ATOM 0 HA TRP A 656 -0.908 7.636 -4.387 1.00 0.00 H new ATOM 0 HB2 TRP A 656 -2.773 8.206 -5.844 1.00 0.00 H new ATOM 0 HB3 TRP A 656 -2.273 9.883 -5.938 1.00 0.00 H new ATOM 0 HD1 TRP A 656 -0.257 6.596 -6.437 1.00 0.00 H new ATOM 0 HE1 TRP A 656 1.011 6.718 -8.685 1.00 0.00 H new ATOM 0 HE3 TRP A 656 -1.930 11.145 -8.048 1.00 0.00 H new ATOM 0 HZ2 TRP A 656 1.246 8.580 -10.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 656 -1.169 12.070 -10.217 1.00 0.00 H new ATOM 0 HH2 TRP A 656 0.418 10.795 -11.633 1.00 0.00 H new ATOM 456 N LEU A 657 1.322 8.660 -4.603 1.00 0.00 N ATOM 457 CA LEU A 657 2.656 9.237 -4.721 1.00 0.00 C ATOM 458 C LEU A 657 3.415 8.623 -5.892 1.00 0.00 C ATOM 459 O LEU A 657 3.210 7.459 -6.242 1.00 0.00 O ATOM 460 CB LEU A 657 3.445 9.026 -3.428 1.00 0.00 C ATOM 461 CG LEU A 657 2.685 9.652 -2.258 1.00 0.00 C ATOM 462 CD1 LEU A 657 3.545 9.579 -0.996 1.00 0.00 C ATOM 463 CD2 LEU A 657 2.371 11.119 -2.575 1.00 0.00 C ATOM 0 H LEU A 657 1.307 7.653 -4.443 1.00 0.00 H new ATOM 0 HA LEU A 657 2.543 10.306 -4.902 1.00 0.00 H new ATOM 0 HB2 LEU A 657 3.594 7.961 -3.250 1.00 0.00 H new ATOM 0 HB3 LEU A 657 4.434 9.476 -3.515 1.00 0.00 H new ATOM 0 HG LEU A 657 1.754 9.108 -2.099 1.00 0.00 H new ATOM 0 HD11 LEU A 657 3.004 10.025 -0.161 1.00 0.00 H new ATOM 0 HD12 LEU A 657 3.769 8.537 -0.768 1.00 0.00 H new ATOM 0 HD13 LEU A 657 4.476 10.123 -1.158 1.00 0.00 H new ATOM 0 HD21 LEU A 657 1.829 11.564 -1.740 1.00 0.00 H new ATOM 0 HD22 LEU A 657 3.301 11.664 -2.735 1.00 0.00 H new ATOM 0 HD23 LEU A 657 1.759 11.174 -3.475 1.00 0.00 H new ATOM 475 N VAL A 658 4.293 9.419 -6.490 1.00 0.00 N ATOM 476 CA VAL A 658 5.090 8.961 -7.620 1.00 0.00 C ATOM 477 C VAL A 658 6.566 8.890 -7.243 1.00 0.00 C ATOM 478 O VAL A 658 7.428 8.700 -8.099 1.00 0.00 O ATOM 479 CB VAL A 658 4.902 9.909 -8.806 1.00 0.00 C ATOM 480 CG1 VAL A 658 3.439 9.881 -9.259 1.00 0.00 C ATOM 481 CG2 VAL A 658 5.273 11.334 -8.381 1.00 0.00 C ATOM 0 H VAL A 658 4.471 10.384 -6.211 1.00 0.00 H new ATOM 0 HA VAL A 658 4.755 7.962 -7.899 1.00 0.00 H new ATOM 0 HB VAL A 658 5.543 9.592 -9.628 1.00 0.00 H new ATOM 0 HG11 VAL A 658 3.307 10.557 -10.104 1.00 0.00 H new ATOM 0 HG12 VAL A 658 3.170 8.868 -9.559 1.00 0.00 H new ATOM 0 HG13 VAL A 658 2.797 10.198 -8.437 1.00 0.00 H new ATOM 0 HG21 VAL A 658 5.140 12.012 -9.224 1.00 0.00 H new ATOM 0 HG22 VAL A 658 4.630 11.648 -7.559 1.00 0.00 H new ATOM 0 HG23 VAL A 658 6.314 11.358 -8.057 1.00 0.00 H new ATOM 491 N ASP A 659 6.847 9.038 -5.952 1.00 0.00 N ATOM 492 CA ASP A 659 8.221 8.985 -5.462 1.00 0.00 C ATOM 493 C ASP A 659 8.253 8.445 -4.036 1.00 0.00 C ATOM 494 O ASP A 659 7.637 9.013 -3.136 1.00 0.00 O ATOM 495 CB ASP A 659 8.845 10.383 -5.487 1.00 0.00 C ATOM 496 CG ASP A 659 9.010 10.864 -6.924 1.00 0.00 C ATOM 497 OD1 ASP A 659 9.172 10.026 -7.796 1.00 0.00 O ATOM 498 OD2 ASP A 659 8.973 12.066 -7.132 1.00 0.00 O ATOM 0 H ASP A 659 6.145 9.195 -5.229 1.00 0.00 H new ATOM 0 HA ASP A 659 8.792 8.322 -6.112 1.00 0.00 H new ATOM 0 HB2 ASP A 659 8.215 11.079 -4.933 1.00 0.00 H new ATOM 0 HB3 ASP A 659 9.814 10.365 -4.989 1.00 0.00 H new ATOM 503 N GLY A 660 8.970 7.342 -3.837 1.00 0.00 N ATOM 504 CA GLY A 660 9.069 6.733 -2.514 1.00 0.00 C ATOM 505 C GLY A 660 9.700 7.688 -1.504 1.00 0.00 C ATOM 506 O GLY A 660 9.243 7.787 -0.366 1.00 0.00 O ATOM 0 H GLY A 660 9.487 6.855 -4.569 1.00 0.00 H new ATOM 0 HA2 GLY A 660 8.076 6.443 -2.171 1.00 0.00 H new ATOM 0 HA3 GLY A 660 9.664 5.822 -2.575 1.00 0.00 H new ATOM 510 N SER A 661 10.751 8.389 -1.922 1.00 0.00 N ATOM 511 CA SER A 661 11.427 9.325 -1.028 1.00 0.00 C ATOM 512 C SER A 661 10.451 10.386 -0.542 1.00 0.00 C ATOM 513 O SER A 661 10.491 10.804 0.616 1.00 0.00 O ATOM 514 CB SER A 661 12.587 10.000 -1.761 1.00 0.00 C ATOM 515 OG SER A 661 12.069 10.888 -2.745 1.00 0.00 O ATOM 0 H SER A 661 11.148 8.329 -2.860 1.00 0.00 H new ATOM 0 HA SER A 661 11.811 8.772 -0.171 1.00 0.00 H new ATOM 0 HB2 SER A 661 13.210 10.547 -1.053 1.00 0.00 H new ATOM 0 HB3 SER A 661 13.222 9.249 -2.231 1.00 0.00 H new ATOM 0 HG SER A 661 12.810 11.323 -3.215 1.00 0.00 H new ATOM 521 N THR A 662 9.563 10.807 -1.434 1.00 0.00 N ATOM 522 CA THR A 662 8.566 11.811 -1.090 1.00 0.00 C ATOM 523 C THR A 662 7.610 11.261 -0.040 1.00 0.00 C ATOM 524 O THR A 662 7.208 11.966 0.885 1.00 0.00 O ATOM 525 CB THR A 662 7.784 12.209 -2.341 1.00 0.00 C ATOM 526 OG1 THR A 662 8.697 12.580 -3.365 1.00 0.00 O ATOM 527 CG2 THR A 662 6.865 13.389 -2.023 1.00 0.00 C ATOM 0 H THR A 662 9.513 10.471 -2.396 1.00 0.00 H new ATOM 0 HA THR A 662 9.071 12.688 -0.685 1.00 0.00 H new ATOM 0 HB THR A 662 7.180 11.366 -2.675 1.00 0.00 H new ATOM 0 HG1 THR A 662 8.210 13.013 -4.097 1.00 0.00 H new ATOM 0 HG21 THR A 662 6.310 13.669 -2.918 1.00 0.00 H new ATOM 0 HG22 THR A 662 6.166 13.104 -1.237 1.00 0.00 H new ATOM 0 HG23 THR A 662 7.463 14.236 -1.687 1.00 0.00 H new ATOM 535 N ALA A 663 7.253 9.992 -0.197 1.00 0.00 N ATOM 536 CA ALA A 663 6.345 9.335 0.732 1.00 0.00 C ATOM 537 C ALA A 663 6.961 9.231 2.125 1.00 0.00 C ATOM 538 O ALA A 663 6.284 9.441 3.129 1.00 0.00 O ATOM 539 CB ALA A 663 6.005 7.936 0.216 1.00 0.00 C ATOM 0 H ALA A 663 7.579 9.398 -0.959 1.00 0.00 H new ATOM 0 HA ALA A 663 5.437 9.934 0.803 1.00 0.00 H new ATOM 0 HB1 ALA A 663 5.325 7.446 0.913 1.00 0.00 H new ATOM 0 HB2 ALA A 663 5.528 8.014 -0.761 1.00 0.00 H new ATOM 0 HB3 ALA A 663 6.919 7.349 0.128 1.00 0.00 H new ATOM 545 N LEU A 664 8.245 8.894 2.182 1.00 0.00 N ATOM 546 CA LEU A 664 8.933 8.755 3.465 1.00 0.00 C ATOM 547 C LEU A 664 8.892 10.055 4.264 1.00 0.00 C ATOM 548 O LEU A 664 8.614 10.049 5.463 1.00 0.00 O ATOM 549 CB LEU A 664 10.393 8.359 3.238 1.00 0.00 C ATOM 550 CG LEU A 664 10.460 7.010 2.524 1.00 0.00 C ATOM 551 CD1 LEU A 664 11.924 6.630 2.297 1.00 0.00 C ATOM 552 CD2 LEU A 664 9.784 5.945 3.390 1.00 0.00 C ATOM 0 H LEU A 664 8.828 8.713 1.365 1.00 0.00 H new ATOM 0 HA LEU A 664 8.418 7.979 4.031 1.00 0.00 H new ATOM 0 HB2 LEU A 664 10.897 9.121 2.643 1.00 0.00 H new ATOM 0 HB3 LEU A 664 10.916 8.302 4.193 1.00 0.00 H new ATOM 0 HG LEU A 664 9.948 7.077 1.564 1.00 0.00 H new ATOM 0 HD11 LEU A 664 11.975 5.668 1.788 1.00 0.00 H new ATOM 0 HD12 LEU A 664 12.407 7.391 1.684 1.00 0.00 H new ATOM 0 HD13 LEU A 664 12.435 6.560 3.257 1.00 0.00 H new ATOM 0 HD21 LEU A 664 9.830 4.981 2.883 1.00 0.00 H new ATOM 0 HD22 LEU A 664 10.298 5.876 4.349 1.00 0.00 H new ATOM 0 HD23 LEU A 664 8.742 6.218 3.556 1.00 0.00 H new ATOM 564 N ASP A 665 9.185 11.164 3.597 1.00 0.00 N ATOM 565 CA ASP A 665 9.195 12.461 4.264 1.00 0.00 C ATOM 566 C ASP A 665 7.817 12.803 4.814 1.00 0.00 C ATOM 567 O ASP A 665 7.695 13.345 5.913 1.00 0.00 O ATOM 568 CB ASP A 665 9.637 13.549 3.286 1.00 0.00 C ATOM 569 CG ASP A 665 11.114 13.375 2.954 1.00 0.00 C ATOM 570 OD1 ASP A 665 11.717 12.460 3.489 1.00 0.00 O ATOM 571 OD2 ASP A 665 11.621 14.158 2.167 1.00 0.00 O ATOM 0 H ASP A 665 9.417 11.193 2.604 1.00 0.00 H new ATOM 0 HA ASP A 665 9.898 12.408 5.095 1.00 0.00 H new ATOM 0 HB2 ASP A 665 9.041 13.496 2.375 1.00 0.00 H new ATOM 0 HB3 ASP A 665 9.466 14.534 3.721 1.00 0.00 H new ATOM 576 N GLN A 666 6.784 12.494 4.043 1.00 0.00 N ATOM 577 CA GLN A 666 5.420 12.786 4.464 1.00 0.00 C ATOM 578 C GLN A 666 4.828 11.638 5.274 1.00 0.00 C ATOM 579 O GLN A 666 4.347 11.835 6.390 1.00 0.00 O ATOM 580 CB GLN A 666 4.545 13.052 3.239 1.00 0.00 C ATOM 581 CG GLN A 666 5.007 14.341 2.552 1.00 0.00 C ATOM 582 CD GLN A 666 4.072 14.684 1.399 1.00 0.00 C ATOM 583 OE1 GLN A 666 4.310 15.647 0.669 1.00 0.00 O ATOM 584 NE2 GLN A 666 3.009 13.957 1.197 1.00 0.00 N ATOM 0 H GLN A 666 6.862 12.045 3.130 1.00 0.00 H new ATOM 0 HA GLN A 666 5.448 13.671 5.099 1.00 0.00 H new ATOM 0 HB2 GLN A 666 4.608 12.214 2.545 1.00 0.00 H new ATOM 0 HB3 GLN A 666 3.500 13.140 3.537 1.00 0.00 H new ATOM 0 HG2 GLN A 666 5.025 15.159 3.272 1.00 0.00 H new ATOM 0 HG3 GLN A 666 6.025 14.220 2.181 1.00 0.00 H new ATOM 0 HE21 GLN A 666 2.814 13.160 1.803 1.00 0.00 H new ATOM 0 HE22 GLN A 666 2.373 14.185 0.433 1.00 0.00 H new ATOM 593 N LEU A 667 4.851 10.448 4.692 1.00 0.00 N ATOM 594 CA LEU A 667 4.297 9.265 5.343 1.00 0.00 C ATOM 595 C LEU A 667 4.772 9.116 6.782 1.00 0.00 C ATOM 596 O LEU A 667 4.027 8.635 7.635 1.00 0.00 O ATOM 597 CB LEU A 667 4.667 8.004 4.566 1.00 0.00 C ATOM 598 CG LEU A 667 3.968 6.812 5.222 1.00 0.00 C ATOM 599 CD1 LEU A 667 3.672 5.743 4.172 1.00 0.00 C ATOM 600 CD2 LEU A 667 4.867 6.211 6.310 1.00 0.00 C ATOM 0 H LEU A 667 5.248 10.274 3.769 1.00 0.00 H new ATOM 0 HA LEU A 667 3.215 9.396 5.355 1.00 0.00 H new ATOM 0 HB2 LEU A 667 4.361 8.097 3.524 1.00 0.00 H new ATOM 0 HB3 LEU A 667 5.747 7.859 4.569 1.00 0.00 H new ATOM 0 HG LEU A 667 3.035 7.155 5.669 1.00 0.00 H new ATOM 0 HD11 LEU A 667 3.174 4.896 4.645 1.00 0.00 H new ATOM 0 HD12 LEU A 667 3.025 6.160 3.401 1.00 0.00 H new ATOM 0 HD13 LEU A 667 4.606 5.409 3.720 1.00 0.00 H new ATOM 0 HD21 LEU A 667 4.362 5.363 6.772 1.00 0.00 H new ATOM 0 HD22 LEU A 667 5.804 5.876 5.864 1.00 0.00 H new ATOM 0 HD23 LEU A 667 5.075 6.966 7.068 1.00 0.00 H new ATOM 612 N ASP A 668 6.013 9.497 7.053 1.00 0.00 N ATOM 613 CA ASP A 668 6.544 9.353 8.403 1.00 0.00 C ATOM 614 C ASP A 668 5.616 10.023 9.407 1.00 0.00 C ATOM 615 O ASP A 668 5.366 9.490 10.488 1.00 0.00 O ATOM 616 CB ASP A 668 7.936 9.982 8.490 1.00 0.00 C ATOM 617 CG ASP A 668 8.573 9.659 9.837 1.00 0.00 C ATOM 618 OD1 ASP A 668 7.898 9.065 10.662 1.00 0.00 O ATOM 619 OD2 ASP A 668 9.727 10.007 10.024 1.00 0.00 O ATOM 0 H ASP A 668 6.659 9.899 6.374 1.00 0.00 H new ATOM 0 HA ASP A 668 6.615 8.291 8.638 1.00 0.00 H new ATOM 0 HB2 ASP A 668 8.564 9.607 7.682 1.00 0.00 H new ATOM 0 HB3 ASP A 668 7.864 11.062 8.362 1.00 0.00 H new ATOM 624 N LEU A 669 5.097 11.184 9.039 1.00 0.00 N ATOM 625 CA LEU A 669 4.184 11.908 9.913 1.00 0.00 C ATOM 626 C LEU A 669 2.777 11.317 9.834 1.00 0.00 C ATOM 627 O LEU A 669 1.983 11.461 10.763 1.00 0.00 O ATOM 628 CB LEU A 669 4.144 13.386 9.521 1.00 0.00 C ATOM 629 CG LEU A 669 5.543 13.991 9.648 1.00 0.00 C ATOM 630 CD1 LEU A 669 5.464 15.497 9.397 1.00 0.00 C ATOM 631 CD2 LEU A 669 6.086 13.740 11.059 1.00 0.00 C ATOM 0 H LEU A 669 5.289 11.643 8.149 1.00 0.00 H new ATOM 0 HA LEU A 669 4.545 11.815 10.937 1.00 0.00 H new ATOM 0 HB2 LEU A 669 3.783 13.491 8.498 1.00 0.00 H new ATOM 0 HB3 LEU A 669 3.445 13.923 10.162 1.00 0.00 H new ATOM 0 HG LEU A 669 6.207 13.529 8.917 1.00 0.00 H new ATOM 0 HD11 LEU A 669 6.459 15.933 9.486 1.00 0.00 H new ATOM 0 HD12 LEU A 669 5.077 15.679 8.395 1.00 0.00 H new ATOM 0 HD13 LEU A 669 4.800 15.954 10.131 1.00 0.00 H new ATOM 0 HD21 LEU A 669 7.083 14.172 11.147 1.00 0.00 H new ATOM 0 HD22 LEU A 669 5.424 14.202 11.791 1.00 0.00 H new ATOM 0 HD23 LEU A 669 6.138 12.667 11.243 1.00 0.00 H new ATOM 643 N LEU A 670 2.469 10.670 8.711 1.00 0.00 N ATOM 644 CA LEU A 670 1.143 10.086 8.517 1.00 0.00 C ATOM 645 C LEU A 670 0.933 8.857 9.391 1.00 0.00 C ATOM 646 O LEU A 670 -0.178 8.608 9.862 1.00 0.00 O ATOM 647 CB LEU A 670 0.953 9.688 7.050 1.00 0.00 C ATOM 648 CG LEU A 670 1.223 10.894 6.157 1.00 0.00 C ATOM 649 CD1 LEU A 670 0.831 10.565 4.716 1.00 0.00 C ATOM 650 CD2 LEU A 670 0.404 12.088 6.655 1.00 0.00 C ATOM 0 H LEU A 670 3.111 10.538 7.930 1.00 0.00 H new ATOM 0 HA LEU A 670 0.412 10.843 8.801 1.00 0.00 H new ATOM 0 HB2 LEU A 670 1.629 8.873 6.793 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -0.061 9.323 6.890 1.00 0.00 H new ATOM 0 HG LEU A 670 2.284 11.142 6.191 1.00 0.00 H new ATOM 0 HD11 LEU A 670 1.025 11.429 4.080 1.00 0.00 H new ATOM 0 HD12 LEU A 670 1.417 9.716 4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -0.229 10.315 4.675 1.00 0.00 H new ATOM 0 HD21 LEU A 670 0.595 12.952 6.018 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -0.657 11.841 6.622 1.00 0.00 H new ATOM 0 HD23 LEU A 670 0.690 12.323 7.680 1.00 0.00 H new ATOM 662 N GLN A 671 1.988 8.076 9.591 1.00 0.00 N ATOM 663 CA GLN A 671 1.868 6.867 10.395 1.00 0.00 C ATOM 664 C GLN A 671 0.633 6.084 9.953 1.00 0.00 C ATOM 665 O GLN A 671 -0.320 5.927 10.716 1.00 0.00 O ATOM 666 CB GLN A 671 1.747 7.233 11.877 1.00 0.00 C ATOM 667 CG GLN A 671 3.113 7.670 12.411 1.00 0.00 C ATOM 668 CD GLN A 671 4.052 6.470 12.491 1.00 0.00 C ATOM 669 OE1 GLN A 671 3.766 5.504 13.198 1.00 0.00 O ATOM 670 NE2 GLN A 671 5.160 6.475 11.802 1.00 0.00 N ATOM 0 H GLN A 671 2.920 8.253 9.215 1.00 0.00 H new ATOM 0 HA GLN A 671 2.757 6.252 10.255 1.00 0.00 H new ATOM 0 HB2 GLN A 671 1.021 8.036 12.006 1.00 0.00 H new ATOM 0 HB3 GLN A 671 1.380 6.378 12.444 1.00 0.00 H new ATOM 0 HG2 GLN A 671 3.540 8.433 11.760 1.00 0.00 H new ATOM 0 HG3 GLN A 671 3.000 8.120 13.397 1.00 0.00 H new ATOM 0 HE21 GLN A 671 5.393 7.278 11.217 1.00 0.00 H new ATOM 0 HE22 GLN A 671 5.793 5.676 11.848 1.00 0.00 H new ATOM 679 N PRO A 672 0.629 5.615 8.729 1.00 0.00 N ATOM 680 CA PRO A 672 -0.516 4.855 8.150 1.00 0.00 C ATOM 681 C PRO A 672 -0.633 3.441 8.711 1.00 0.00 C ATOM 682 O PRO A 672 0.330 2.885 9.241 1.00 0.00 O ATOM 683 CB PRO A 672 -0.229 4.809 6.641 1.00 0.00 C ATOM 684 CG PRO A 672 1.032 5.584 6.410 1.00 0.00 C ATOM 685 CD PRO A 672 1.721 5.753 7.762 1.00 0.00 C ATOM 0 HA PRO A 672 -1.463 5.337 8.394 1.00 0.00 H new ATOM 0 HB2 PRO A 672 -0.116 3.779 6.301 1.00 0.00 H new ATOM 0 HB3 PRO A 672 -1.056 5.242 6.078 1.00 0.00 H new ATOM 0 HG2 PRO A 672 1.683 5.058 5.711 1.00 0.00 H new ATOM 0 HG3 PRO A 672 0.810 6.556 5.969 1.00 0.00 H new ATOM 0 HD2 PRO A 672 2.490 4.997 7.916 1.00 0.00 H new ATOM 0 HD3 PRO A 672 2.208 6.725 7.844 1.00 0.00 H new ATOM 693 N ILE A 673 -1.823 2.864 8.572 1.00 0.00 N ATOM 694 CA ILE A 673 -2.072 1.509 9.047 1.00 0.00 C ATOM 695 C ILE A 673 -1.868 0.511 7.909 1.00 0.00 C ATOM 696 O ILE A 673 -1.605 -0.667 8.144 1.00 0.00 O ATOM 697 CB ILE A 673 -3.502 1.393 9.583 1.00 0.00 C ATOM 698 CG1 ILE A 673 -3.679 2.333 10.779 1.00 0.00 C ATOM 699 CG2 ILE A 673 -3.770 -0.049 10.020 1.00 0.00 C ATOM 700 CD1 ILE A 673 -5.130 2.280 11.264 1.00 0.00 C ATOM 0 H ILE A 673 -2.628 3.313 8.135 1.00 0.00 H new ATOM 0 HA ILE A 673 -1.371 1.285 9.851 1.00 0.00 H new ATOM 0 HB ILE A 673 -4.206 1.670 8.798 1.00 0.00 H new ATOM 0 HG12 ILE A 673 -3.005 2.043 11.585 1.00 0.00 H new ATOM 0 HG13 ILE A 673 -3.417 3.352 10.495 1.00 0.00 H new ATOM 0 HG21 ILE A 673 -4.788 -0.130 10.401 1.00 0.00 H new ATOM 0 HG22 ILE A 673 -3.648 -0.716 9.167 1.00 0.00 H new ATOM 0 HG23 ILE A 673 -3.066 -0.329 10.803 1.00 0.00 H new ATOM 0 HD11 ILE A 673 -5.254 2.950 12.115 1.00 0.00 H new ATOM 0 HD12 ILE A 673 -5.795 2.591 10.458 1.00 0.00 H new ATOM 0 HD13 ILE A 673 -5.376 1.262 11.565 1.00 0.00 H new ATOM 712 N VAL A 674 -1.988 0.994 6.674 1.00 0.00 N ATOM 713 CA VAL A 674 -1.807 0.136 5.508 1.00 0.00 C ATOM 714 C VAL A 674 -1.170 0.905 4.352 1.00 0.00 C ATOM 715 O VAL A 674 -1.493 2.071 4.108 1.00 0.00 O ATOM 716 CB VAL A 674 -3.154 -0.434 5.064 1.00 0.00 C ATOM 717 CG1 VAL A 674 -4.092 0.709 4.675 1.00 0.00 C ATOM 718 CG2 VAL A 674 -2.939 -1.348 3.859 1.00 0.00 C ATOM 0 H VAL A 674 -2.208 1.966 6.457 1.00 0.00 H new ATOM 0 HA VAL A 674 -1.140 -0.679 5.789 1.00 0.00 H new ATOM 0 HB VAL A 674 -3.598 -1.001 5.882 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -5.052 0.300 4.359 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -4.242 1.365 5.533 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -3.652 1.278 3.856 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -3.897 -1.758 3.538 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -2.497 -0.776 3.043 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -2.270 -2.163 4.135 1.00 0.00 H new ATOM 728 N ILE A 675 -0.272 0.239 3.635 1.00 0.00 N ATOM 729 CA ILE A 675 0.398 0.862 2.500 1.00 0.00 C ATOM 730 C ILE A 675 0.196 0.023 1.245 1.00 0.00 C ATOM 731 O ILE A 675 0.604 -1.137 1.191 1.00 0.00 O ATOM 732 CB ILE A 675 1.893 1.001 2.793 1.00 0.00 C ATOM 733 CG1 ILE A 675 2.080 1.837 4.059 1.00 0.00 C ATOM 734 CG2 ILE A 675 2.592 1.696 1.621 1.00 0.00 C ATOM 735 CD1 ILE A 675 3.546 1.790 4.493 1.00 0.00 C ATOM 0 H ILE A 675 0.007 -0.725 3.817 1.00 0.00 H new ATOM 0 HA ILE A 675 -0.031 1.851 2.337 1.00 0.00 H new ATOM 0 HB ILE A 675 2.327 0.011 2.933 1.00 0.00 H new ATOM 0 HG12 ILE A 675 1.778 2.868 3.874 1.00 0.00 H new ATOM 0 HG13 ILE A 675 1.442 1.456 4.856 1.00 0.00 H new ATOM 0 HG21 ILE A 675 3.656 1.791 1.837 1.00 0.00 H new ATOM 0 HG22 ILE A 675 2.457 1.105 0.715 1.00 0.00 H new ATOM 0 HG23 ILE A 675 2.161 2.687 1.476 1.00 0.00 H new ATOM 0 HD11 ILE A 675 3.678 2.387 5.396 1.00 0.00 H new ATOM 0 HD12 ILE A 675 3.833 0.758 4.695 1.00 0.00 H new ATOM 0 HD13 ILE A 675 4.174 2.192 3.698 1.00 0.00 H new ATOM 747 N LEU A 676 -0.432 0.620 0.238 1.00 0.00 N ATOM 748 CA LEU A 676 -0.682 -0.079 -1.018 1.00 0.00 C ATOM 749 C LEU A 676 0.262 0.424 -2.101 1.00 0.00 C ATOM 750 O LEU A 676 0.406 1.629 -2.295 1.00 0.00 O ATOM 751 CB LEU A 676 -2.127 0.152 -1.457 1.00 0.00 C ATOM 752 CG LEU A 676 -3.066 -0.258 -0.326 1.00 0.00 C ATOM 753 CD1 LEU A 676 -4.514 0.030 -0.727 1.00 0.00 C ATOM 754 CD2 LEU A 676 -2.906 -1.752 -0.051 1.00 0.00 C ATOM 0 H LEU A 676 -0.775 1.580 0.266 1.00 0.00 H new ATOM 0 HA LEU A 676 -0.511 -1.145 -0.865 1.00 0.00 H new ATOM 0 HB2 LEU A 676 -2.280 1.201 -1.710 1.00 0.00 H new ATOM 0 HB3 LEU A 676 -2.344 -0.427 -2.354 1.00 0.00 H new ATOM 0 HG LEU A 676 -2.819 0.310 0.571 1.00 0.00 H new ATOM 0 HD11 LEU A 676 -5.181 -0.264 0.083 1.00 0.00 H new ATOM 0 HD12 LEU A 676 -4.632 1.095 -0.925 1.00 0.00 H new ATOM 0 HD13 LEU A 676 -4.762 -0.536 -1.625 1.00 0.00 H new ATOM 0 HD21 LEU A 676 -3.576 -2.047 0.757 1.00 0.00 H new ATOM 0 HD22 LEU A 676 -3.152 -2.316 -0.951 1.00 0.00 H new ATOM 0 HD23 LEU A 676 -1.876 -1.961 0.238 1.00 0.00 H new ATOM 766 N MET A 677 0.901 -0.498 -2.811 1.00 0.00 N ATOM 767 CA MET A 677 1.820 -0.095 -3.871 1.00 0.00 C ATOM 768 C MET A 677 1.807 -1.073 -5.040 1.00 0.00 C ATOM 769 O MET A 677 1.793 -2.290 -4.855 1.00 0.00 O ATOM 770 CB MET A 677 3.239 0.018 -3.321 1.00 0.00 C ATOM 771 CG MET A 677 3.635 -1.293 -2.642 1.00 0.00 C ATOM 772 SD MET A 677 5.096 -1.016 -1.612 1.00 0.00 S ATOM 773 CE MET A 677 5.985 0.058 -2.767 1.00 0.00 C ATOM 0 H MET A 677 0.805 -1.505 -2.679 1.00 0.00 H new ATOM 0 HA MET A 677 1.485 0.875 -4.238 1.00 0.00 H new ATOM 0 HB2 MET A 677 3.935 0.245 -4.128 1.00 0.00 H new ATOM 0 HB3 MET A 677 3.298 0.840 -2.608 1.00 0.00 H new ATOM 0 HG2 MET A 677 2.811 -1.663 -2.032 1.00 0.00 H new ATOM 0 HG3 MET A 677 3.844 -2.056 -3.392 1.00 0.00 H new ATOM 0 HE1 MET A 677 7.019 0.169 -2.439 1.00 0.00 H new ATOM 0 HE2 MET A 677 5.966 -0.384 -3.763 1.00 0.00 H new ATOM 0 HE3 MET A 677 5.506 1.037 -2.795 1.00 0.00 H new ATOM 783 N ALA A 678 1.830 -0.518 -6.247 1.00 0.00 N ATOM 784 CA ALA A 678 1.843 -1.324 -7.463 1.00 0.00 C ATOM 785 C ALA A 678 3.179 -2.049 -7.609 1.00 0.00 C ATOM 786 O ALA A 678 4.216 -1.545 -7.178 1.00 0.00 O ATOM 787 CB ALA A 678 1.616 -0.425 -8.680 1.00 0.00 C ATOM 0 H ALA A 678 1.840 0.489 -6.410 1.00 0.00 H new ATOM 0 HA ALA A 678 1.045 -2.064 -7.399 1.00 0.00 H new ATOM 0 HB1 ALA A 678 1.626 -1.030 -9.586 1.00 0.00 H new ATOM 0 HB2 ALA A 678 0.652 0.075 -8.588 1.00 0.00 H new ATOM 0 HB3 ALA A 678 2.408 0.322 -8.733 1.00 0.00 H new ATOM 793 N TRP A 679 3.154 -3.224 -8.228 1.00 0.00 N ATOM 794 CA TRP A 679 4.379 -3.987 -8.434 1.00 0.00 C ATOM 795 C TRP A 679 4.761 -4.021 -9.915 1.00 0.00 C ATOM 796 O TRP A 679 5.944 -4.024 -10.255 1.00 0.00 O ATOM 797 CB TRP A 679 4.218 -5.416 -7.912 1.00 0.00 C ATOM 798 CG TRP A 679 5.573 -6.004 -7.674 1.00 0.00 C ATOM 799 CD1 TRP A 679 6.084 -7.078 -8.322 1.00 0.00 C ATOM 800 CD2 TRP A 679 6.598 -5.567 -6.734 1.00 0.00 C ATOM 801 NE1 TRP A 679 7.357 -7.325 -7.840 1.00 0.00 N ATOM 802 CE2 TRP A 679 7.719 -6.420 -6.860 1.00 0.00 C ATOM 803 CE3 TRP A 679 6.664 -4.519 -5.796 1.00 0.00 C ATOM 804 CZ2 TRP A 679 8.861 -6.246 -6.077 1.00 0.00 C ATOM 805 CZ3 TRP A 679 7.812 -4.340 -5.008 1.00 0.00 C ATOM 806 CH2 TRP A 679 8.910 -5.200 -5.150 1.00 0.00 C ATOM 0 H TRP A 679 2.309 -3.665 -8.592 1.00 0.00 H new ATOM 0 HA TRP A 679 5.175 -3.492 -7.878 1.00 0.00 H new ATOM 0 HB2 TRP A 679 3.640 -5.416 -6.988 1.00 0.00 H new ATOM 0 HB3 TRP A 679 3.667 -6.020 -8.633 1.00 0.00 H new ATOM 0 HD1 TRP A 679 5.580 -7.648 -9.089 1.00 0.00 H new ATOM 0 HE1 TRP A 679 7.956 -8.083 -8.168 1.00 0.00 H new ATOM 0 HE3 TRP A 679 5.825 -3.848 -5.682 1.00 0.00 H new ATOM 0 HZ2 TRP A 679 9.702 -6.915 -6.186 1.00 0.00 H new ATOM 0 HZ3 TRP A 679 7.849 -3.535 -4.289 1.00 0.00 H new ATOM 0 HH2 TRP A 679 9.792 -5.055 -4.544 1.00 0.00 H new ATOM 817 N PRO A 680 3.794 -4.051 -10.797 1.00 0.00 N ATOM 818 CA PRO A 680 4.057 -4.092 -12.265 1.00 0.00 C ATOM 819 C PRO A 680 5.003 -2.977 -12.730 1.00 0.00 C ATOM 820 O PRO A 680 5.890 -3.220 -13.548 1.00 0.00 O ATOM 821 CB PRO A 680 2.671 -3.970 -12.910 1.00 0.00 C ATOM 822 CG PRO A 680 1.693 -4.352 -11.844 1.00 0.00 C ATOM 823 CD PRO A 680 2.353 -4.059 -10.496 1.00 0.00 C ATOM 0 HA PRO A 680 4.568 -5.011 -12.552 1.00 0.00 H new ATOM 0 HB2 PRO A 680 2.491 -2.954 -13.261 1.00 0.00 H new ATOM 0 HB3 PRO A 680 2.583 -4.627 -13.776 1.00 0.00 H new ATOM 0 HG2 PRO A 680 0.768 -3.785 -11.950 1.00 0.00 H new ATOM 0 HG3 PRO A 680 1.431 -5.407 -11.923 1.00 0.00 H new ATOM 0 HD2 PRO A 680 2.025 -3.102 -10.091 1.00 0.00 H new ATOM 0 HD3 PRO A 680 2.104 -4.820 -9.756 1.00 0.00 H new ATOM 831 N PRO A 681 4.849 -1.773 -12.228 1.00 0.00 N ATOM 832 CA PRO A 681 5.733 -0.632 -12.614 1.00 0.00 C ATOM 833 C PRO A 681 7.206 -0.908 -12.289 1.00 0.00 C ATOM 834 O PRO A 681 7.526 -1.373 -11.194 1.00 0.00 O ATOM 835 CB PRO A 681 5.220 0.550 -11.781 1.00 0.00 C ATOM 836 CG PRO A 681 3.860 0.164 -11.305 1.00 0.00 C ATOM 837 CD PRO A 681 3.823 -1.362 -11.256 1.00 0.00 C ATOM 0 HA PRO A 681 5.696 -0.448 -13.688 1.00 0.00 H new ATOM 0 HB2 PRO A 681 5.884 0.751 -10.940 1.00 0.00 H new ATOM 0 HB3 PRO A 681 5.179 1.460 -12.380 1.00 0.00 H new ATOM 0 HG2 PRO A 681 3.661 0.587 -10.320 1.00 0.00 H new ATOM 0 HG3 PRO A 681 3.092 0.547 -11.977 1.00 0.00 H new ATOM 0 HD2 PRO A 681 4.047 -1.735 -10.257 1.00 0.00 H new ATOM 0 HD3 PRO A 681 2.840 -1.747 -11.527 1.00 0.00 H new ATOM 845 N PRO A 682 8.100 -0.621 -13.208 1.00 0.00 N ATOM 846 CA PRO A 682 9.564 -0.834 -13.009 1.00 0.00 C ATOM 847 C PRO A 682 10.226 0.324 -12.260 1.00 0.00 C ATOM 848 O PRO A 682 11.384 0.654 -12.518 1.00 0.00 O ATOM 849 CB PRO A 682 10.091 -0.913 -14.440 1.00 0.00 C ATOM 850 CG PRO A 682 9.203 0.001 -15.214 1.00 0.00 C ATOM 851 CD PRO A 682 7.824 -0.070 -14.550 1.00 0.00 C ATOM 0 HA PRO A 682 9.775 -1.716 -12.405 1.00 0.00 H new ATOM 0 HB2 PRO A 682 11.133 -0.598 -14.498 1.00 0.00 H new ATOM 0 HB3 PRO A 682 10.045 -1.932 -14.825 1.00 0.00 H new ATOM 0 HG2 PRO A 682 9.588 1.020 -15.200 1.00 0.00 H new ATOM 0 HG3 PRO A 682 9.147 -0.305 -16.259 1.00 0.00 H new ATOM 0 HD2 PRO A 682 7.359 0.914 -14.489 1.00 0.00 H new ATOM 0 HD3 PRO A 682 7.143 -0.710 -15.112 1.00 0.00 H new ATOM 859 N ASP A 683 9.491 0.944 -11.341 1.00 0.00 N ATOM 860 CA ASP A 683 10.039 2.065 -10.584 1.00 0.00 C ATOM 861 C ASP A 683 10.899 1.570 -9.426 1.00 0.00 C ATOM 862 O ASP A 683 10.398 0.989 -8.464 1.00 0.00 O ATOM 863 CB ASP A 683 8.907 2.944 -10.047 1.00 0.00 C ATOM 864 CG ASP A 683 9.489 4.152 -9.321 1.00 0.00 C ATOM 865 OD1 ASP A 683 10.676 4.135 -9.043 1.00 0.00 O ATOM 866 OD2 ASP A 683 8.739 5.076 -9.051 1.00 0.00 O ATOM 0 H ASP A 683 8.530 0.695 -11.105 1.00 0.00 H new ATOM 0 HA ASP A 683 10.665 2.653 -11.255 1.00 0.00 H new ATOM 0 HB2 ASP A 683 8.270 3.274 -10.868 1.00 0.00 H new ATOM 0 HB3 ASP A 683 8.279 2.368 -9.368 1.00 0.00 H new ATOM 871 N GLN A 684 12.200 1.814 -9.536 1.00 0.00 N ATOM 872 CA GLN A 684 13.147 1.403 -8.507 1.00 0.00 C ATOM 873 C GLN A 684 12.823 2.075 -7.178 1.00 0.00 C ATOM 874 O GLN A 684 13.180 1.571 -6.114 1.00 0.00 O ATOM 875 CB GLN A 684 14.568 1.775 -8.933 1.00 0.00 C ATOM 876 CG GLN A 684 14.925 1.032 -10.220 1.00 0.00 C ATOM 877 CD GLN A 684 16.338 1.399 -10.657 1.00 0.00 C ATOM 878 OE1 GLN A 684 17.269 1.357 -9.852 1.00 0.00 O ATOM 879 NE2 GLN A 684 16.553 1.764 -11.891 1.00 0.00 N ATOM 0 H GLN A 684 12.623 2.295 -10.329 1.00 0.00 H new ATOM 0 HA GLN A 684 13.072 0.323 -8.381 1.00 0.00 H new ATOM 0 HB2 GLN A 684 14.642 2.851 -9.089 1.00 0.00 H new ATOM 0 HB3 GLN A 684 15.275 1.518 -8.144 1.00 0.00 H new ATOM 0 HG2 GLN A 684 14.852 -0.044 -10.061 1.00 0.00 H new ATOM 0 HG3 GLN A 684 14.214 1.287 -11.006 1.00 0.00 H new ATOM 0 HE21 GLN A 684 15.779 1.798 -12.555 1.00 0.00 H new ATOM 0 HE22 GLN A 684 17.495 2.016 -12.192 1.00 0.00 H new ATOM 888 N SER A 685 12.160 3.225 -7.247 1.00 0.00 N ATOM 889 CA SER A 685 11.814 3.965 -6.039 1.00 0.00 C ATOM 890 C SER A 685 10.932 3.126 -5.126 1.00 0.00 C ATOM 891 O SER A 685 11.061 3.184 -3.907 1.00 0.00 O ATOM 892 CB SER A 685 11.083 5.256 -6.405 1.00 0.00 C ATOM 893 OG SER A 685 11.896 6.024 -7.281 1.00 0.00 O ATOM 0 H SER A 685 11.854 3.661 -8.117 1.00 0.00 H new ATOM 0 HA SER A 685 12.738 4.206 -5.513 1.00 0.00 H new ATOM 0 HB2 SER A 685 10.131 5.025 -6.883 1.00 0.00 H new ATOM 0 HB3 SER A 685 10.858 5.828 -5.505 1.00 0.00 H new ATOM 0 HG SER A 685 11.788 5.697 -8.199 1.00 0.00 H new ATOM 899 N CYS A 686 10.043 2.335 -5.711 1.00 0.00 N ATOM 900 CA CYS A 686 9.168 1.492 -4.910 1.00 0.00 C ATOM 901 C CYS A 686 10.008 0.537 -4.074 1.00 0.00 C ATOM 902 O CYS A 686 9.656 0.213 -2.942 1.00 0.00 O ATOM 903 CB CYS A 686 8.220 0.697 -5.811 1.00 0.00 C ATOM 904 SG CYS A 686 7.146 1.842 -6.711 1.00 0.00 S ATOM 0 H CYS A 686 9.910 2.260 -6.719 1.00 0.00 H new ATOM 0 HA CYS A 686 8.573 2.125 -4.252 1.00 0.00 H new ATOM 0 HB2 CYS A 686 8.791 0.089 -6.513 1.00 0.00 H new ATOM 0 HB3 CYS A 686 7.620 0.012 -5.212 1.00 0.00 H new ATOM 0 HG CYS A 686 6.341 1.169 -7.479 1.00 0.00 H new ATOM 910 N LEU A 687 11.128 0.104 -4.640 1.00 0.00 N ATOM 911 CA LEU A 687 12.023 -0.807 -3.941 1.00 0.00 C ATOM 912 C LEU A 687 12.630 -0.125 -2.724 1.00 0.00 C ATOM 913 O LEU A 687 12.859 -0.760 -1.692 1.00 0.00 O ATOM 914 CB LEU A 687 13.141 -1.258 -4.884 1.00 0.00 C ATOM 915 CG LEU A 687 12.532 -1.927 -6.117 1.00 0.00 C ATOM 916 CD1 LEU A 687 13.652 -2.475 -7.006 1.00 0.00 C ATOM 917 CD2 LEU A 687 11.623 -3.075 -5.671 1.00 0.00 C ATOM 0 H LEU A 687 11.436 0.368 -5.576 1.00 0.00 H new ATOM 0 HA LEU A 687 11.450 -1.674 -3.611 1.00 0.00 H new ATOM 0 HB2 LEU A 687 13.746 -0.402 -5.183 1.00 0.00 H new ATOM 0 HB3 LEU A 687 13.805 -1.954 -4.371 1.00 0.00 H new ATOM 0 HG LEU A 687 11.949 -1.198 -6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 687 13.218 -2.952 -7.885 1.00 0.00 H new ATOM 0 HD12 LEU A 687 14.301 -1.657 -7.320 1.00 0.00 H new ATOM 0 HD13 LEU A 687 14.235 -3.207 -6.447 1.00 0.00 H new ATOM 0 HD21 LEU A 687 11.187 -3.555 -6.547 1.00 0.00 H new ATOM 0 HD22 LEU A 687 12.207 -3.805 -5.111 1.00 0.00 H new ATOM 0 HD23 LEU A 687 10.827 -2.684 -5.037 1.00 0.00 H new ATOM 929 N LEU A 688 12.889 1.171 -2.846 1.00 0.00 N ATOM 930 CA LEU A 688 13.469 1.921 -1.746 1.00 0.00 C ATOM 931 C LEU A 688 12.449 2.087 -0.625 1.00 0.00 C ATOM 932 O LEU A 688 12.803 2.054 0.553 1.00 0.00 O ATOM 933 CB LEU A 688 13.961 3.287 -2.242 1.00 0.00 C ATOM 934 CG LEU A 688 12.944 4.378 -1.901 1.00 0.00 C ATOM 935 CD1 LEU A 688 13.051 4.736 -0.417 1.00 0.00 C ATOM 936 CD2 LEU A 688 13.235 5.618 -2.750 1.00 0.00 C ATOM 0 H LEU A 688 12.708 1.718 -3.688 1.00 0.00 H new ATOM 0 HA LEU A 688 14.323 1.370 -1.352 1.00 0.00 H new ATOM 0 HB2 LEU A 688 14.922 3.522 -1.785 1.00 0.00 H new ATOM 0 HB3 LEU A 688 14.120 3.254 -3.320 1.00 0.00 H new ATOM 0 HG LEU A 688 11.937 4.018 -2.110 1.00 0.00 H new ATOM 0 HD11 LEU A 688 12.326 5.513 -0.177 1.00 0.00 H new ATOM 0 HD12 LEU A 688 12.848 3.851 0.186 1.00 0.00 H new ATOM 0 HD13 LEU A 688 14.056 5.099 -0.202 1.00 0.00 H new ATOM 0 HD21 LEU A 688 12.514 6.400 -2.512 1.00 0.00 H new ATOM 0 HD22 LEU A 688 14.242 5.977 -2.537 1.00 0.00 H new ATOM 0 HD23 LEU A 688 13.157 5.362 -3.807 1.00 0.00 H new ATOM 948 N LEU A 689 11.181 2.250 -0.993 1.00 0.00 N ATOM 949 CA LEU A 689 10.136 2.402 0.008 1.00 0.00 C ATOM 950 C LEU A 689 10.086 1.159 0.893 1.00 0.00 C ATOM 951 O LEU A 689 9.984 1.261 2.113 1.00 0.00 O ATOM 952 CB LEU A 689 8.775 2.613 -0.665 1.00 0.00 C ATOM 953 CG LEU A 689 7.738 2.998 0.396 1.00 0.00 C ATOM 954 CD1 LEU A 689 7.666 4.523 0.518 1.00 0.00 C ATOM 955 CD2 LEU A 689 6.364 2.455 -0.002 1.00 0.00 C ATOM 0 H LEU A 689 10.858 2.280 -1.960 1.00 0.00 H new ATOM 0 HA LEU A 689 10.362 3.275 0.620 1.00 0.00 H new ATOM 0 HB2 LEU A 689 8.847 3.396 -1.420 1.00 0.00 H new ATOM 0 HB3 LEU A 689 8.466 1.703 -1.179 1.00 0.00 H new ATOM 0 HG LEU A 689 8.033 2.570 1.354 1.00 0.00 H new ATOM 0 HD11 LEU A 689 6.928 4.793 1.273 1.00 0.00 H new ATOM 0 HD12 LEU A 689 8.642 4.911 0.809 1.00 0.00 H new ATOM 0 HD13 LEU A 689 7.377 4.952 -0.442 1.00 0.00 H new ATOM 0 HD21 LEU A 689 5.630 2.731 0.755 1.00 0.00 H new ATOM 0 HD22 LEU A 689 6.070 2.877 -0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 689 6.411 1.369 -0.082 1.00 0.00 H new ATOM 967 N LEU A 690 10.171 -0.017 0.269 1.00 0.00 N ATOM 968 CA LEU A 690 10.144 -1.270 1.020 1.00 0.00 C ATOM 969 C LEU A 690 11.329 -1.356 1.975 1.00 0.00 C ATOM 970 O LEU A 690 11.197 -1.847 3.097 1.00 0.00 O ATOM 971 CB LEU A 690 10.173 -2.471 0.069 1.00 0.00 C ATOM 972 CG LEU A 690 8.777 -2.705 -0.516 1.00 0.00 C ATOM 973 CD1 LEU A 690 8.523 -1.716 -1.648 1.00 0.00 C ATOM 974 CD2 LEU A 690 8.687 -4.132 -1.062 1.00 0.00 C ATOM 0 H LEU A 690 10.258 -0.127 -0.741 1.00 0.00 H new ATOM 0 HA LEU A 690 9.219 -1.290 1.597 1.00 0.00 H new ATOM 0 HB2 LEU A 690 10.888 -2.293 -0.734 1.00 0.00 H new ATOM 0 HB3 LEU A 690 10.507 -3.361 0.603 1.00 0.00 H new ATOM 0 HG LEU A 690 8.030 -2.563 0.265 1.00 0.00 H new ATOM 0 HD11 LEU A 690 7.529 -1.885 -2.062 1.00 0.00 H new ATOM 0 HD12 LEU A 690 8.588 -0.698 -1.263 1.00 0.00 H new ATOM 0 HD13 LEU A 690 9.270 -1.857 -2.429 1.00 0.00 H new ATOM 0 HD21 LEU A 690 7.694 -4.300 -1.479 1.00 0.00 H new ATOM 0 HD22 LEU A 690 9.436 -4.271 -1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 690 8.867 -4.842 -0.255 1.00 0.00 H new ATOM 986 N GLN A 691 12.489 -0.888 1.524 1.00 0.00 N ATOM 987 CA GLN A 691 13.685 -0.937 2.358 1.00 0.00 C ATOM 988 C GLN A 691 13.491 -0.146 3.648 1.00 0.00 C ATOM 989 O GLN A 691 13.900 -0.592 4.719 1.00 0.00 O ATOM 990 CB GLN A 691 14.887 -0.372 1.597 1.00 0.00 C ATOM 991 CG GLN A 691 15.244 -1.298 0.433 1.00 0.00 C ATOM 992 CD GLN A 691 15.644 -2.672 0.963 1.00 0.00 C ATOM 993 OE1 GLN A 691 16.422 -2.770 1.913 1.00 0.00 O ATOM 994 NE2 GLN A 691 15.157 -3.744 0.402 1.00 0.00 N ATOM 0 H GLN A 691 12.626 -0.477 0.601 1.00 0.00 H new ATOM 0 HA GLN A 691 13.868 -1.981 2.611 1.00 0.00 H new ATOM 0 HB2 GLN A 691 14.656 0.625 1.223 1.00 0.00 H new ATOM 0 HB3 GLN A 691 15.740 -0.271 2.268 1.00 0.00 H new ATOM 0 HG2 GLN A 691 14.393 -1.393 -0.241 1.00 0.00 H new ATOM 0 HG3 GLN A 691 16.063 -0.870 -0.145 1.00 0.00 H new ATOM 0 HE21 GLN A 691 14.513 -3.660 -0.384 1.00 0.00 H new ATOM 0 HE22 GLN A 691 15.420 -4.666 0.750 1.00 0.00 H new ATOM 1003 N HIS A 692 12.872 1.028 3.550 1.00 0.00 N ATOM 1004 CA HIS A 692 12.650 1.846 4.738 1.00 0.00 C ATOM 1005 C HIS A 692 11.768 1.107 5.741 1.00 0.00 C ATOM 1006 O HIS A 692 12.145 0.925 6.900 1.00 0.00 O ATOM 1007 CB HIS A 692 12.003 3.177 4.359 1.00 0.00 C ATOM 1008 CG HIS A 692 12.131 4.133 5.514 1.00 0.00 C ATOM 1009 ND1 HIS A 692 12.573 5.437 5.351 1.00 0.00 N ATOM 1010 CD2 HIS A 692 11.889 3.984 6.858 1.00 0.00 C ATOM 1011 CE1 HIS A 692 12.584 6.016 6.567 1.00 0.00 C ATOM 1012 NE2 HIS A 692 12.175 5.175 7.520 1.00 0.00 N ATOM 0 H HIS A 692 12.522 1.428 2.679 1.00 0.00 H new ATOM 0 HA HIS A 692 13.618 2.044 5.199 1.00 0.00 H new ATOM 0 HB2 HIS A 692 12.485 3.591 3.473 1.00 0.00 H new ATOM 0 HB3 HIS A 692 10.953 3.027 4.110 1.00 0.00 H new ATOM 0 HD2 HIS A 692 11.531 3.081 7.329 1.00 0.00 H new ATOM 0 HE1 HIS A 692 12.887 7.037 6.749 1.00 0.00 H new ATOM 0 HE2 HIS A 692 12.090 5.364 8.519 1.00 0.00 H new ATOM 1021 N LEU A 693 10.596 0.667 5.284 1.00 0.00 N ATOM 1022 CA LEU A 693 9.678 -0.066 6.149 1.00 0.00 C ATOM 1023 C LEU A 693 10.381 -1.271 6.757 1.00 0.00 C ATOM 1024 O LEU A 693 10.152 -1.616 7.915 1.00 0.00 O ATOM 1025 CB LEU A 693 8.460 -0.540 5.349 1.00 0.00 C ATOM 1026 CG LEU A 693 7.487 0.622 5.123 1.00 0.00 C ATOM 1027 CD1 LEU A 693 6.653 0.842 6.388 1.00 0.00 C ATOM 1028 CD2 LEU A 693 8.261 1.900 4.790 1.00 0.00 C ATOM 0 H LEU A 693 10.264 0.804 4.329 1.00 0.00 H new ATOM 0 HA LEU A 693 9.348 0.601 6.946 1.00 0.00 H new ATOM 0 HB2 LEU A 693 8.782 -0.946 4.390 1.00 0.00 H new ATOM 0 HB3 LEU A 693 7.957 -1.346 5.883 1.00 0.00 H new ATOM 0 HG LEU A 693 6.829 0.379 4.288 1.00 0.00 H new ATOM 0 HD11 LEU A 693 5.961 1.668 6.228 1.00 0.00 H new ATOM 0 HD12 LEU A 693 6.091 -0.064 6.615 1.00 0.00 H new ATOM 0 HD13 LEU A 693 7.313 1.078 7.223 1.00 0.00 H new ATOM 0 HD21 LEU A 693 7.560 2.719 4.631 1.00 0.00 H new ATOM 0 HD22 LEU A 693 8.927 2.148 5.616 1.00 0.00 H new ATOM 0 HD23 LEU A 693 8.848 1.744 3.885 1.00 0.00 H new ATOM 1040 N ARG A 694 11.234 -1.906 5.960 1.00 0.00 N ATOM 1041 CA ARG A 694 11.967 -3.085 6.407 1.00 0.00 C ATOM 1042 C ARG A 694 12.849 -2.765 7.609 1.00 0.00 C ATOM 1043 O ARG A 694 13.005 -3.590 8.509 1.00 0.00 O ATOM 1044 CB ARG A 694 12.846 -3.610 5.270 1.00 0.00 C ATOM 1045 CG ARG A 694 13.586 -4.867 5.738 1.00 0.00 C ATOM 1046 CD ARG A 694 14.572 -5.318 4.658 1.00 0.00 C ATOM 1047 NE ARG A 694 13.869 -5.594 3.408 1.00 0.00 N ATOM 1048 CZ ARG A 694 13.533 -6.834 3.067 1.00 0.00 C ATOM 1049 NH1 ARG A 694 13.804 -7.830 3.864 1.00 0.00 N ATOM 1050 NH2 ARG A 694 12.928 -7.057 1.931 1.00 0.00 N ATOM 0 H ARG A 694 11.435 -1.624 5.001 1.00 0.00 H new ATOM 0 HA ARG A 694 11.239 -3.841 6.700 1.00 0.00 H new ATOM 0 HB2 ARG A 694 12.233 -3.839 4.398 1.00 0.00 H new ATOM 0 HB3 ARG A 694 13.561 -2.846 4.966 1.00 0.00 H new ATOM 0 HG2 ARG A 694 14.118 -4.663 6.667 1.00 0.00 H new ATOM 0 HG3 ARG A 694 12.872 -5.664 5.948 1.00 0.00 H new ATOM 0 HD2 ARG A 694 15.323 -4.545 4.497 1.00 0.00 H new ATOM 0 HD3 ARG A 694 15.101 -6.212 4.990 1.00 0.00 H new ATOM 0 HE ARG A 694 13.632 -4.822 2.786 1.00 0.00 H new ATOM 0 HH11 ARG A 694 14.275 -7.659 4.752 1.00 0.00 H new ATOM 0 HH12 ARG A 694 13.545 -8.780 3.599 1.00 0.00 H new ATOM 0 HH21 ARG A 694 12.714 -6.280 1.306 1.00 0.00 H new ATOM 0 HH22 ARG A 694 12.670 -8.008 1.669 1.00 0.00 H new ATOM 1064 N GLU A 695 13.433 -1.573 7.611 1.00 0.00 N ATOM 1065 CA GLU A 695 14.309 -1.170 8.704 1.00 0.00 C ATOM 1066 C GLU A 695 13.522 -0.971 9.996 1.00 0.00 C ATOM 1067 O GLU A 695 13.980 -1.355 11.072 1.00 0.00 O ATOM 1068 CB GLU A 695 15.029 0.130 8.342 1.00 0.00 C ATOM 1069 CG GLU A 695 16.062 0.461 9.420 1.00 0.00 C ATOM 1070 CD GLU A 695 16.706 1.810 9.122 1.00 0.00 C ATOM 1071 OE1 GLU A 695 16.343 2.409 8.122 1.00 0.00 O ATOM 1072 OE2 GLU A 695 17.552 2.225 9.896 1.00 0.00 O ATOM 0 H GLU A 695 13.318 -0.875 6.876 1.00 0.00 H new ATOM 0 HA GLU A 695 15.038 -1.965 8.862 1.00 0.00 H new ATOM 0 HB2 GLU A 695 15.519 0.029 7.373 1.00 0.00 H new ATOM 0 HB3 GLU A 695 14.309 0.943 8.252 1.00 0.00 H new ATOM 0 HG2 GLU A 695 15.584 0.484 10.399 1.00 0.00 H new ATOM 0 HG3 GLU A 695 16.825 -0.316 9.456 1.00 0.00 H new ATOM 1079 N HIS A 696 12.341 -0.367 9.892 1.00 0.00 N ATOM 1080 CA HIS A 696 11.524 -0.130 11.080 1.00 0.00 C ATOM 1081 C HIS A 696 10.351 -1.107 11.149 1.00 0.00 C ATOM 1082 O HIS A 696 9.423 -0.920 11.934 1.00 0.00 O ATOM 1083 CB HIS A 696 11.019 1.319 11.105 1.00 0.00 C ATOM 1084 CG HIS A 696 9.787 1.470 10.256 1.00 0.00 C ATOM 1085 ND1 HIS A 696 8.700 0.618 10.362 1.00 0.00 N ATOM 1086 CD2 HIS A 696 9.443 2.397 9.303 1.00 0.00 C ATOM 1087 CE1 HIS A 696 7.762 1.046 9.496 1.00 0.00 C ATOM 1088 NE2 HIS A 696 8.165 2.129 8.825 1.00 0.00 N ATOM 0 H HIS A 696 11.934 -0.038 9.016 1.00 0.00 H new ATOM 0 HA HIS A 696 12.151 -0.296 11.956 1.00 0.00 H new ATOM 0 HB2 HIS A 696 10.798 1.614 12.131 1.00 0.00 H new ATOM 0 HB3 HIS A 696 11.800 1.987 10.743 1.00 0.00 H new ATOM 0 HD1 HIS A 696 8.624 -0.187 10.983 1.00 0.00 H new ATOM 0 HD2 HIS A 696 10.071 3.212 8.974 1.00 0.00 H new ATOM 0 HE1 HIS A 696 6.801 0.572 9.360 1.00 0.00 H new ATOM 1168 N PRO A 702 3.441 -2.750 13.594 1.00 0.00 N ATOM 1169 CA PRO A 702 3.981 -2.530 12.225 1.00 0.00 C ATOM 1170 C PRO A 702 2.874 -2.333 11.188 1.00 0.00 C ATOM 1171 O PRO A 702 1.833 -2.986 11.247 1.00 0.00 O ATOM 1172 CB PRO A 702 4.792 -3.798 11.928 1.00 0.00 C ATOM 1173 CG PRO A 702 4.311 -4.827 12.896 1.00 0.00 C ATOM 1174 CD PRO A 702 3.793 -4.073 14.117 1.00 0.00 C ATOM 0 HA PRO A 702 4.581 -1.621 12.173 1.00 0.00 H new ATOM 0 HB2 PRO A 702 4.640 -4.127 10.900 1.00 0.00 H new ATOM 0 HB3 PRO A 702 5.860 -3.616 12.050 1.00 0.00 H new ATOM 0 HG2 PRO A 702 3.522 -5.435 12.454 1.00 0.00 H new ATOM 0 HG3 PRO A 702 5.118 -5.505 13.174 1.00 0.00 H new ATOM 0 HD2 PRO A 702 2.929 -4.571 14.557 1.00 0.00 H new ATOM 0 HD3 PRO A 702 4.552 -4.005 14.896 1.00 0.00 H new ATOM 1182 N PRO A 703 3.083 -1.447 10.249 1.00 0.00 N ATOM 1183 CA PRO A 703 2.086 -1.156 9.179 1.00 0.00 C ATOM 1184 C PRO A 703 1.945 -2.318 8.201 1.00 0.00 C ATOM 1185 O PRO A 703 2.900 -3.056 7.958 1.00 0.00 O ATOM 1186 CB PRO A 703 2.646 0.085 8.482 1.00 0.00 C ATOM 1187 CG PRO A 703 4.113 0.065 8.755 1.00 0.00 C ATOM 1188 CD PRO A 703 4.296 -0.629 10.103 1.00 0.00 C ATOM 0 HA PRO A 703 1.085 -1.001 9.582 1.00 0.00 H new ATOM 0 HB2 PRO A 703 2.445 0.058 7.411 1.00 0.00 H new ATOM 0 HB3 PRO A 703 2.187 0.994 8.870 1.00 0.00 H new ATOM 0 HG2 PRO A 703 4.646 -0.469 7.969 1.00 0.00 H new ATOM 0 HG3 PRO A 703 4.516 1.077 8.782 1.00 0.00 H new ATOM 0 HD2 PRO A 703 5.196 -1.244 10.117 1.00 0.00 H new ATOM 0 HD3 PRO A 703 4.391 0.093 10.914 1.00 0.00 H new ATOM 1196 N LEU A 704 0.750 -2.476 7.644 1.00 0.00 N ATOM 1197 CA LEU A 704 0.500 -3.554 6.694 1.00 0.00 C ATOM 1198 C LEU A 704 1.053 -3.195 5.319 1.00 0.00 C ATOM 1199 O LEU A 704 0.960 -2.049 4.881 1.00 0.00 O ATOM 1200 CB LEU A 704 -1.004 -3.812 6.581 1.00 0.00 C ATOM 1201 CG LEU A 704 -1.593 -4.048 7.972 1.00 0.00 C ATOM 1202 CD1 LEU A 704 -3.059 -4.463 7.839 1.00 0.00 C ATOM 1203 CD2 LEU A 704 -0.812 -5.161 8.677 1.00 0.00 C ATOM 0 H LEU A 704 -0.055 -1.878 7.831 1.00 0.00 H new ATOM 0 HA LEU A 704 1.000 -4.452 7.055 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -1.494 -2.961 6.108 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -1.187 -4.679 5.946 1.00 0.00 H new ATOM 0 HG LEU A 704 -1.524 -3.130 8.556 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -3.481 -4.632 8.830 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -3.617 -3.672 7.337 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -3.126 -5.381 7.255 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -1.232 -5.329 9.669 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -0.881 -6.079 8.094 1.00 0.00 H new ATOM 0 HD23 LEU A 704 0.234 -4.868 8.771 1.00 0.00 H new ATOM 1215 N VAL A 705 1.621 -4.184 4.637 1.00 0.00 N ATOM 1216 CA VAL A 705 2.172 -3.957 3.308 1.00 0.00 C ATOM 1217 C VAL A 705 1.502 -4.877 2.293 1.00 0.00 C ATOM 1218 O VAL A 705 1.467 -6.095 2.472 1.00 0.00 O ATOM 1219 CB VAL A 705 3.683 -4.203 3.315 1.00 0.00 C ATOM 1220 CG1 VAL A 705 4.251 -3.936 1.918 1.00 0.00 C ATOM 1221 CG2 VAL A 705 4.341 -3.257 4.324 1.00 0.00 C ATOM 0 H VAL A 705 1.711 -5.141 4.979 1.00 0.00 H new ATOM 0 HA VAL A 705 1.981 -2.922 3.025 1.00 0.00 H new ATOM 0 HB VAL A 705 3.885 -5.237 3.595 1.00 0.00 H new ATOM 0 HG11 VAL A 705 5.327 -4.111 1.923 1.00 0.00 H new ATOM 0 HG12 VAL A 705 3.778 -4.605 1.199 1.00 0.00 H new ATOM 0 HG13 VAL A 705 4.053 -2.902 1.636 1.00 0.00 H new ATOM 0 HG21 VAL A 705 5.418 -3.427 4.334 1.00 0.00 H new ATOM 0 HG22 VAL A 705 4.139 -2.224 4.039 1.00 0.00 H new ATOM 0 HG23 VAL A 705 3.935 -3.445 5.318 1.00 0.00 H new ATOM 1231 N LEU A 706 0.967 -4.287 1.229 1.00 0.00 N ATOM 1232 CA LEU A 706 0.301 -5.071 0.195 1.00 0.00 C ATOM 1233 C LEU A 706 0.796 -4.680 -1.194 1.00 0.00 C ATOM 1234 O LEU A 706 0.969 -3.497 -1.493 1.00 0.00 O ATOM 1235 CB LEU A 706 -1.211 -4.865 0.276 1.00 0.00 C ATOM 1236 CG LEU A 706 -1.727 -5.370 1.625 1.00 0.00 C ATOM 1237 CD1 LEU A 706 -1.474 -4.309 2.700 1.00 0.00 C ATOM 1238 CD2 LEU A 706 -3.230 -5.643 1.523 1.00 0.00 C ATOM 0 H LEU A 706 0.981 -3.281 1.061 1.00 0.00 H new ATOM 0 HA LEU A 706 0.537 -6.122 0.363 1.00 0.00 H new ATOM 0 HB2 LEU A 706 -1.451 -3.809 0.156 1.00 0.00 H new ATOM 0 HB3 LEU A 706 -1.705 -5.398 -0.536 1.00 0.00 H new ATOM 0 HG LEU A 706 -1.206 -6.289 1.893 1.00 0.00 H new ATOM 0 HD11 LEU A 706 -1.842 -4.669 3.661 1.00 0.00 H new ATOM 0 HD12 LEU A 706 -0.404 -4.112 2.772 1.00 0.00 H new ATOM 0 HD13 LEU A 706 -1.995 -3.390 2.434 1.00 0.00 H new ATOM 0 HD21 LEU A 706 -3.600 -6.003 2.483 1.00 0.00 H new ATOM 0 HD22 LEU A 706 -3.750 -4.723 1.256 1.00 0.00 H new ATOM 0 HD23 LEU A 706 -3.412 -6.398 0.758 1.00 0.00 H new ATOM 1250 N PHE A 707 1.012 -5.683 -2.042 1.00 0.00 N ATOM 1251 CA PHE A 707 1.477 -5.435 -3.403 1.00 0.00 C ATOM 1252 C PHE A 707 0.401 -5.823 -4.415 1.00 0.00 C ATOM 1253 O PHE A 707 -0.149 -6.924 -4.361 1.00 0.00 O ATOM 1254 CB PHE A 707 2.747 -6.250 -3.686 1.00 0.00 C ATOM 1255 CG PHE A 707 3.786 -6.031 -2.605 1.00 0.00 C ATOM 1256 CD1 PHE A 707 3.989 -4.760 -2.049 1.00 0.00 C ATOM 1257 CD2 PHE A 707 4.562 -7.113 -2.170 1.00 0.00 C ATOM 1258 CE1 PHE A 707 4.961 -4.577 -1.060 1.00 0.00 C ATOM 1259 CE2 PHE A 707 5.534 -6.928 -1.179 1.00 0.00 C ATOM 1260 CZ PHE A 707 5.734 -5.660 -0.626 1.00 0.00 C ATOM 0 H PHE A 707 0.874 -6.667 -1.813 1.00 0.00 H new ATOM 0 HA PHE A 707 1.695 -4.371 -3.498 1.00 0.00 H new ATOM 0 HB2 PHE A 707 2.497 -7.309 -3.746 1.00 0.00 H new ATOM 0 HB3 PHE A 707 3.159 -5.964 -4.654 1.00 0.00 H new ATOM 0 HD1 PHE A 707 3.395 -3.923 -2.384 1.00 0.00 H new ATOM 0 HD2 PHE A 707 4.410 -8.092 -2.600 1.00 0.00 H new ATOM 0 HE1 PHE A 707 5.115 -3.598 -0.630 1.00 0.00 H new ATOM 0 HE2 PHE A 707 6.129 -7.764 -0.842 1.00 0.00 H new ATOM 0 HZ PHE A 707 6.485 -5.516 0.136 1.00 0.00 H new ATOM 1270 N LEU A 708 0.115 -4.914 -5.343 1.00 0.00 N ATOM 1271 CA LEU A 708 -0.885 -5.167 -6.375 1.00 0.00 C ATOM 1272 C LEU A 708 -0.219 -5.694 -7.644 1.00 0.00 C ATOM 1273 O LEU A 708 0.921 -5.342 -7.947 1.00 0.00 O ATOM 1274 CB LEU A 708 -1.644 -3.878 -6.700 1.00 0.00 C ATOM 1275 CG LEU A 708 -2.418 -3.408 -5.467 1.00 0.00 C ATOM 1276 CD1 LEU A 708 -1.451 -2.796 -4.451 1.00 0.00 C ATOM 1277 CD2 LEU A 708 -3.452 -2.360 -5.886 1.00 0.00 C ATOM 0 H LEU A 708 0.560 -3.998 -5.401 1.00 0.00 H new ATOM 0 HA LEU A 708 -1.583 -5.915 -6.000 1.00 0.00 H new ATOM 0 HB2 LEU A 708 -0.946 -3.104 -7.019 1.00 0.00 H new ATOM 0 HB3 LEU A 708 -2.331 -4.049 -7.529 1.00 0.00 H new ATOM 0 HG LEU A 708 -2.924 -4.259 -5.012 1.00 0.00 H new ATOM 0 HD11 LEU A 708 -2.007 -2.463 -3.575 1.00 0.00 H new ATOM 0 HD12 LEU A 708 -0.716 -3.544 -4.152 1.00 0.00 H new ATOM 0 HD13 LEU A 708 -0.940 -1.945 -4.902 1.00 0.00 H new ATOM 0 HD21 LEU A 708 -4.005 -2.023 -5.009 1.00 0.00 H new ATOM 0 HD22 LEU A 708 -2.944 -1.510 -6.343 1.00 0.00 H new ATOM 0 HD23 LEU A 708 -4.144 -2.799 -6.605 1.00 0.00 H new ATOM 1289 N GLY A 709 -0.935 -6.535 -8.384 1.00 0.00 N ATOM 1290 CA GLY A 709 -0.398 -7.098 -9.621 1.00 0.00 C ATOM 1291 C GLY A 709 0.079 -8.533 -9.413 1.00 0.00 C ATOM 1292 O GLY A 709 -0.612 -9.340 -8.793 1.00 0.00 O ATOM 0 H GLY A 709 -1.880 -6.840 -8.153 1.00 0.00 H new ATOM 0 HA2 GLY A 709 -1.164 -7.075 -10.396 1.00 0.00 H new ATOM 0 HA3 GLY A 709 0.431 -6.484 -9.973 1.00 0.00 H new ATOM 1296 N GLU A 710 1.263 -8.849 -9.937 1.00 0.00 N ATOM 1297 CA GLU A 710 1.813 -10.194 -9.798 1.00 0.00 C ATOM 1298 C GLU A 710 2.644 -10.296 -8.518 1.00 0.00 C ATOM 1299 O GLU A 710 3.165 -9.293 -8.030 1.00 0.00 O ATOM 1300 CB GLU A 710 2.687 -10.534 -11.010 1.00 0.00 C ATOM 1301 CG GLU A 710 2.078 -9.917 -12.270 1.00 0.00 C ATOM 1302 CD GLU A 710 2.556 -10.671 -13.507 1.00 0.00 C ATOM 1303 OE1 GLU A 710 3.757 -10.829 -13.654 1.00 0.00 O ATOM 1304 OE2 GLU A 710 1.714 -11.077 -14.291 1.00 0.00 O ATOM 0 H GLU A 710 1.853 -8.199 -10.456 1.00 0.00 H new ATOM 0 HA GLU A 710 0.987 -10.903 -9.743 1.00 0.00 H new ATOM 0 HB2 GLU A 710 3.698 -10.156 -10.860 1.00 0.00 H new ATOM 0 HB3 GLU A 710 2.765 -11.615 -11.123 1.00 0.00 H new ATOM 0 HG2 GLU A 710 0.990 -9.951 -12.212 1.00 0.00 H new ATOM 0 HG3 GLU A 710 2.360 -8.867 -12.343 1.00 0.00 H new ATOM 1311 N PRO A 711 2.772 -11.479 -7.967 1.00 0.00 N ATOM 1312 CA PRO A 711 3.553 -11.704 -6.718 1.00 0.00 C ATOM 1313 C PRO A 711 5.057 -11.828 -6.979 1.00 0.00 C ATOM 1314 O PRO A 711 5.475 -12.581 -7.859 1.00 0.00 O ATOM 1315 CB PRO A 711 2.995 -13.026 -6.199 1.00 0.00 C ATOM 1316 CG PRO A 711 2.589 -13.779 -7.423 1.00 0.00 C ATOM 1317 CD PRO A 711 2.183 -12.735 -8.468 1.00 0.00 C ATOM 0 HA PRO A 711 3.457 -10.872 -6.020 1.00 0.00 H new ATOM 0 HB2 PRO A 711 3.745 -13.574 -5.628 1.00 0.00 H new ATOM 0 HB3 PRO A 711 2.146 -12.863 -5.536 1.00 0.00 H new ATOM 0 HG2 PRO A 711 3.411 -14.394 -7.789 1.00 0.00 H new ATOM 0 HG3 PRO A 711 1.760 -14.452 -7.206 1.00 0.00 H new ATOM 0 HD2 PRO A 711 2.567 -12.989 -9.456 1.00 0.00 H new ATOM 0 HD3 PRO A 711 1.099 -12.660 -8.557 1.00 0.00 H new ATOM 1325 N PRO A 712 5.874 -11.127 -6.231 1.00 0.00 N ATOM 1326 CA PRO A 712 7.354 -11.192 -6.398 1.00 0.00 C ATOM 1327 C PRO A 712 7.861 -12.632 -6.370 1.00 0.00 C ATOM 1328 O PRO A 712 7.249 -13.502 -5.750 1.00 0.00 O ATOM 1329 CB PRO A 712 7.914 -10.404 -5.210 1.00 0.00 C ATOM 1330 CG PRO A 712 6.788 -9.582 -4.670 1.00 0.00 C ATOM 1331 CD PRO A 712 5.477 -10.201 -5.158 1.00 0.00 C ATOM 0 HA PRO A 712 7.667 -10.784 -7.359 1.00 0.00 H new ATOM 0 HB2 PRO A 712 8.302 -11.078 -4.446 1.00 0.00 H new ATOM 0 HB3 PRO A 712 8.742 -9.768 -5.523 1.00 0.00 H new ATOM 0 HG2 PRO A 712 6.818 -9.562 -3.581 1.00 0.00 H new ATOM 0 HG3 PRO A 712 6.872 -8.550 -5.010 1.00 0.00 H new ATOM 0 HD2 PRO A 712 4.964 -10.726 -4.352 1.00 0.00 H new ATOM 0 HD3 PRO A 712 4.793 -9.437 -5.528 1.00 0.00 H new ATOM 1339 N VAL A 713 8.978 -12.878 -7.048 1.00 0.00 N ATOM 1340 CA VAL A 713 9.551 -14.217 -7.095 1.00 0.00 C ATOM 1341 C VAL A 713 10.360 -14.507 -5.833 1.00 0.00 C ATOM 1342 O VAL A 713 10.586 -15.666 -5.483 1.00 0.00 O ATOM 1343 CB VAL A 713 10.445 -14.356 -8.328 1.00 0.00 C ATOM 1344 CG1 VAL A 713 11.183 -15.695 -8.277 1.00 0.00 C ATOM 1345 CG2 VAL A 713 9.580 -14.300 -9.591 1.00 0.00 C ATOM 0 H VAL A 713 9.500 -12.173 -7.568 1.00 0.00 H new ATOM 0 HA VAL A 713 8.736 -14.938 -7.154 1.00 0.00 H new ATOM 0 HB VAL A 713 11.170 -13.543 -8.344 1.00 0.00 H new ATOM 0 HG11 VAL A 713 11.820 -15.793 -9.156 1.00 0.00 H new ATOM 0 HG12 VAL A 713 11.797 -15.738 -7.377 1.00 0.00 H new ATOM 0 HG13 VAL A 713 10.459 -16.509 -8.261 1.00 0.00 H new ATOM 0 HG21 VAL A 713 10.215 -14.399 -10.471 1.00 0.00 H new ATOM 0 HG22 VAL A 713 8.856 -15.114 -9.572 1.00 0.00 H new ATOM 0 HG23 VAL A 713 9.053 -13.347 -9.629 1.00 0.00 H new ATOM 1355 N ASP A 714 10.796 -13.450 -5.153 1.00 0.00 N ATOM 1356 CA ASP A 714 11.580 -13.616 -3.933 1.00 0.00 C ATOM 1357 C ASP A 714 10.694 -14.106 -2.783 1.00 0.00 C ATOM 1358 O ASP A 714 9.620 -13.554 -2.543 1.00 0.00 O ATOM 1359 CB ASP A 714 12.228 -12.287 -3.539 1.00 0.00 C ATOM 1360 CG ASP A 714 13.437 -12.012 -4.425 1.00 0.00 C ATOM 1361 OD1 ASP A 714 13.528 -12.624 -5.477 1.00 0.00 O ATOM 1362 OD2 ASP A 714 14.255 -11.191 -4.041 1.00 0.00 O ATOM 0 H ASP A 714 10.623 -12.481 -5.421 1.00 0.00 H new ATOM 0 HA ASP A 714 12.355 -14.358 -4.126 1.00 0.00 H new ATOM 0 HB2 ASP A 714 11.504 -11.478 -3.636 1.00 0.00 H new ATOM 0 HB3 ASP A 714 12.533 -12.318 -2.493 1.00 0.00 H new ATOM 1367 N PRO A 715 11.122 -15.115 -2.064 1.00 0.00 N ATOM 1368 CA PRO A 715 10.345 -15.660 -0.916 1.00 0.00 C ATOM 1369 C PRO A 715 10.410 -14.743 0.301 1.00 0.00 C ATOM 1370 O PRO A 715 9.477 -14.688 1.099 1.00 0.00 O ATOM 1371 CB PRO A 715 11.014 -17.002 -0.623 1.00 0.00 C ATOM 1372 CG PRO A 715 12.413 -16.870 -1.128 1.00 0.00 C ATOM 1373 CD PRO A 715 12.387 -15.842 -2.261 1.00 0.00 C ATOM 0 HA PRO A 715 9.284 -15.754 -1.148 1.00 0.00 H new ATOM 0 HB2 PRO A 715 11.001 -17.222 0.445 1.00 0.00 H new ATOM 0 HB3 PRO A 715 10.492 -17.818 -1.123 1.00 0.00 H new ATOM 0 HG2 PRO A 715 13.082 -16.547 -0.330 1.00 0.00 H new ATOM 0 HG3 PRO A 715 12.785 -17.830 -1.487 1.00 0.00 H new ATOM 0 HD2 PRO A 715 13.244 -15.170 -2.208 1.00 0.00 H new ATOM 0 HD3 PRO A 715 12.420 -16.325 -3.237 1.00 0.00 H new ATOM 1381 N LEU A 716 11.521 -14.027 0.434 1.00 0.00 N ATOM 1382 CA LEU A 716 11.697 -13.116 1.557 1.00 0.00 C ATOM 1383 C LEU A 716 10.876 -11.844 1.362 1.00 0.00 C ATOM 1384 O LEU A 716 10.402 -11.244 2.328 1.00 0.00 O ATOM 1385 CB LEU A 716 13.179 -12.761 1.719 1.00 0.00 C ATOM 1386 CG LEU A 716 13.664 -11.963 0.501 1.00 0.00 C ATOM 1387 CD1 LEU A 716 14.124 -10.575 0.948 1.00 0.00 C ATOM 1388 CD2 LEU A 716 14.835 -12.692 -0.162 1.00 0.00 C ATOM 0 H LEU A 716 12.306 -14.059 -0.216 1.00 0.00 H new ATOM 0 HA LEU A 716 11.346 -13.616 2.460 1.00 0.00 H new ATOM 0 HB2 LEU A 716 13.324 -12.177 2.628 1.00 0.00 H new ATOM 0 HB3 LEU A 716 13.770 -13.671 1.827 1.00 0.00 H new ATOM 0 HG LEU A 716 12.845 -11.866 -0.212 1.00 0.00 H new ATOM 0 HD11 LEU A 716 14.468 -10.009 0.082 1.00 0.00 H new ATOM 0 HD12 LEU A 716 13.292 -10.050 1.417 1.00 0.00 H new ATOM 0 HD13 LEU A 716 14.940 -10.675 1.664 1.00 0.00 H new ATOM 0 HD21 LEU A 716 15.176 -12.122 -1.026 1.00 0.00 H new ATOM 0 HD22 LEU A 716 15.652 -12.792 0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 716 14.512 -13.682 -0.485 1.00 0.00 H new ATOM 1400 N LEU A 717 10.711 -11.434 0.108 1.00 0.00 N ATOM 1401 CA LEU A 717 9.950 -10.229 -0.194 1.00 0.00 C ATOM 1402 C LEU A 717 8.457 -10.511 -0.078 1.00 0.00 C ATOM 1403 O LEU A 717 7.710 -9.718 0.494 1.00 0.00 O ATOM 1404 CB LEU A 717 10.296 -9.743 -1.603 1.00 0.00 C ATOM 1405 CG LEU A 717 9.560 -8.438 -1.904 1.00 0.00 C ATOM 1406 CD1 LEU A 717 10.125 -7.315 -1.031 1.00 0.00 C ATOM 1407 CD2 LEU A 717 9.759 -8.084 -3.380 1.00 0.00 C ATOM 0 H LEU A 717 11.091 -11.914 -0.708 1.00 0.00 H new ATOM 0 HA LEU A 717 10.210 -9.449 0.522 1.00 0.00 H new ATOM 0 HB2 LEU A 717 11.372 -9.591 -1.690 1.00 0.00 H new ATOM 0 HB3 LEU A 717 10.021 -10.502 -2.336 1.00 0.00 H new ATOM 0 HG LEU A 717 8.498 -8.558 -1.691 1.00 0.00 H new ATOM 0 HD11 LEU A 717 9.598 -6.386 -1.248 1.00 0.00 H new ATOM 0 HD12 LEU A 717 9.993 -7.570 0.020 1.00 0.00 H new ATOM 0 HD13 LEU A 717 11.187 -7.188 -1.243 1.00 0.00 H new ATOM 0 HD21 LEU A 717 9.237 -7.154 -3.605 1.00 0.00 H new ATOM 0 HD22 LEU A 717 10.823 -7.962 -3.585 1.00 0.00 H new ATOM 0 HD23 LEU A 717 9.359 -8.884 -4.003 1.00 0.00 H new ATOM 1419 N THR A 718 8.029 -11.655 -0.598 1.00 0.00 N ATOM 1420 CA THR A 718 6.627 -12.031 -0.510 1.00 0.00 C ATOM 1421 C THR A 718 6.246 -12.234 0.952 1.00 0.00 C ATOM 1422 O THR A 718 5.157 -11.854 1.382 1.00 0.00 O ATOM 1423 CB THR A 718 6.372 -13.319 -1.296 1.00 0.00 C ATOM 1424 OG1 THR A 718 6.867 -13.169 -2.619 1.00 0.00 O ATOM 1425 CG2 THR A 718 4.869 -13.599 -1.340 1.00 0.00 C ATOM 0 H THR A 718 8.625 -12.329 -1.079 1.00 0.00 H new ATOM 0 HA THR A 718 6.018 -11.235 -0.938 1.00 0.00 H new ATOM 0 HB THR A 718 6.881 -14.151 -0.810 1.00 0.00 H new ATOM 0 HG1 THR A 718 7.838 -13.298 -2.621 1.00 0.00 H new ATOM 0 HG21 THR A 718 4.686 -14.516 -1.900 1.00 0.00 H new ATOM 0 HG22 THR A 718 4.490 -13.712 -0.324 1.00 0.00 H new ATOM 0 HG23 THR A 718 4.358 -12.769 -1.828 1.00 0.00 H new ATOM 1433 N ALA A 719 7.161 -12.835 1.710 1.00 0.00 N ATOM 1434 CA ALA A 719 6.925 -13.086 3.127 1.00 0.00 C ATOM 1435 C ALA A 719 6.826 -11.773 3.901 1.00 0.00 C ATOM 1436 O ALA A 719 6.105 -11.681 4.894 1.00 0.00 O ATOM 1437 CB ALA A 719 8.061 -13.933 3.705 1.00 0.00 C ATOM 0 H ALA A 719 8.067 -13.155 1.368 1.00 0.00 H new ATOM 0 HA ALA A 719 5.982 -13.623 3.225 1.00 0.00 H new ATOM 0 HB1 ALA A 719 7.876 -14.116 4.764 1.00 0.00 H new ATOM 0 HB2 ALA A 719 8.111 -14.885 3.176 1.00 0.00 H new ATOM 0 HB3 ALA A 719 9.006 -13.403 3.588 1.00 0.00 H new ATOM 1443 N GLN A 720 7.564 -10.765 3.444 1.00 0.00 N ATOM 1444 CA GLN A 720 7.566 -9.464 4.106 1.00 0.00 C ATOM 1445 C GLN A 720 6.240 -8.741 3.887 1.00 0.00 C ATOM 1446 O GLN A 720 5.791 -7.976 4.741 1.00 0.00 O ATOM 1447 CB GLN A 720 8.712 -8.607 3.562 1.00 0.00 C ATOM 1448 CG GLN A 720 8.849 -7.342 4.409 1.00 0.00 C ATOM 1449 CD GLN A 720 9.896 -6.416 3.799 1.00 0.00 C ATOM 1450 OE1 GLN A 720 9.680 -5.856 2.724 1.00 0.00 O ATOM 1451 NE2 GLN A 720 11.026 -6.221 4.423 1.00 0.00 N ATOM 0 H GLN A 720 8.165 -10.823 2.622 1.00 0.00 H new ATOM 0 HA GLN A 720 7.703 -9.624 5.176 1.00 0.00 H new ATOM 0 HB2 GLN A 720 9.644 -9.173 3.580 1.00 0.00 H new ATOM 0 HB3 GLN A 720 8.520 -8.342 2.522 1.00 0.00 H new ATOM 0 HG2 GLN A 720 7.889 -6.829 4.469 1.00 0.00 H new ATOM 0 HG3 GLN A 720 9.134 -7.606 5.428 1.00 0.00 H new ATOM 0 HE21 GLN A 720 11.204 -6.686 5.314 1.00 0.00 H new ATOM 0 HE22 GLN A 720 11.731 -5.604 4.020 1.00 0.00 H new ATOM 1460 N ALA A 721 5.621 -8.987 2.740 1.00 0.00 N ATOM 1461 CA ALA A 721 4.348 -8.353 2.415 1.00 0.00 C ATOM 1462 C ALA A 721 3.226 -8.921 3.281 1.00 0.00 C ATOM 1463 O ALA A 721 3.271 -10.080 3.693 1.00 0.00 O ATOM 1464 CB ALA A 721 4.019 -8.580 0.938 1.00 0.00 C ATOM 0 H ALA A 721 5.977 -9.618 2.022 1.00 0.00 H new ATOM 0 HA ALA A 721 4.434 -7.284 2.611 1.00 0.00 H new ATOM 0 HB1 ALA A 721 3.067 -8.105 0.700 1.00 0.00 H new ATOM 0 HB2 ALA A 721 4.805 -8.147 0.319 1.00 0.00 H new ATOM 0 HB3 ALA A 721 3.950 -9.650 0.741 1.00 0.00 H new ATOM 1470 N SER A 722 2.219 -8.096 3.548 1.00 0.00 N ATOM 1471 CA SER A 722 1.086 -8.526 4.359 1.00 0.00 C ATOM 1472 C SER A 722 0.066 -9.253 3.492 1.00 0.00 C ATOM 1473 O SER A 722 -0.682 -10.103 3.975 1.00 0.00 O ATOM 1474 CB SER A 722 0.431 -7.317 5.025 1.00 0.00 C ATOM 1475 OG SER A 722 1.342 -6.750 5.958 1.00 0.00 O ATOM 0 H SER A 722 2.164 -7.133 3.217 1.00 0.00 H new ATOM 0 HA SER A 722 1.445 -9.207 5.130 1.00 0.00 H new ATOM 0 HB2 SER A 722 0.154 -6.578 4.273 1.00 0.00 H new ATOM 0 HB3 SER A 722 -0.487 -7.617 5.530 1.00 0.00 H new ATOM 0 HG SER A 722 0.891 -6.622 6.819 1.00 0.00 H new ATOM 1481 N ALA A 723 0.047 -8.912 2.207 1.00 0.00 N ATOM 1482 CA ALA A 723 -0.881 -9.539 1.270 1.00 0.00 C ATOM 1483 C ALA A 723 -0.548 -9.128 -0.163 1.00 0.00 C ATOM 1484 O ALA A 723 0.119 -8.121 -0.388 1.00 0.00 O ATOM 1485 CB ALA A 723 -2.317 -9.138 1.608 1.00 0.00 C ATOM 0 H ALA A 723 0.659 -8.210 1.792 1.00 0.00 H new ATOM 0 HA ALA A 723 -0.784 -10.621 1.355 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -3.002 -9.610 0.904 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -2.557 -9.463 2.621 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -2.418 -8.055 1.541 1.00 0.00 H new ATOM 1491 N ILE A 724 -1.007 -9.917 -1.132 1.00 0.00 N ATOM 1492 CA ILE A 724 -0.732 -9.614 -2.534 1.00 0.00 C ATOM 1493 C ILE A 724 -1.935 -9.945 -3.416 1.00 0.00 C ATOM 1494 O ILE A 724 -2.509 -11.029 -3.320 1.00 0.00 O ATOM 1495 CB ILE A 724 0.481 -10.411 -3.015 1.00 0.00 C ATOM 1496 CG1 ILE A 724 1.691 -10.070 -2.140 1.00 0.00 C ATOM 1497 CG2 ILE A 724 0.786 -10.047 -4.471 1.00 0.00 C ATOM 1498 CD1 ILE A 724 2.877 -10.951 -2.535 1.00 0.00 C ATOM 0 H ILE A 724 -1.563 -10.758 -0.976 1.00 0.00 H new ATOM 0 HA ILE A 724 -0.526 -8.546 -2.611 1.00 0.00 H new ATOM 0 HB ILE A 724 0.268 -11.478 -2.945 1.00 0.00 H new ATOM 0 HG12 ILE A 724 1.952 -9.018 -2.257 1.00 0.00 H new ATOM 0 HG13 ILE A 724 1.446 -10.223 -1.089 1.00 0.00 H new ATOM 0 HG21 ILE A 724 1.651 -10.615 -4.815 1.00 0.00 H new ATOM 0 HG22 ILE A 724 -0.076 -10.286 -5.094 1.00 0.00 H new ATOM 0 HG23 ILE A 724 1.001 -8.981 -4.542 1.00 0.00 H new ATOM 0 HD11 ILE A 724 3.736 -10.706 -1.911 1.00 0.00 H new ATOM 0 HD12 ILE A 724 2.614 -11.999 -2.395 1.00 0.00 H new ATOM 0 HD13 ILE A 724 3.127 -10.776 -3.581 1.00 0.00 H new ATOM 1510 N LEU A 725 -2.301 -9.003 -4.280 1.00 0.00 N ATOM 1511 CA LEU A 725 -3.428 -9.201 -5.186 1.00 0.00 C ATOM 1512 C LEU A 725 -2.926 -9.521 -6.591 1.00 0.00 C ATOM 1513 O LEU A 725 -1.866 -9.051 -7.002 1.00 0.00 O ATOM 1514 CB LEU A 725 -4.302 -7.946 -5.228 1.00 0.00 C ATOM 1515 CG LEU A 725 -4.885 -7.681 -3.840 1.00 0.00 C ATOM 1516 CD1 LEU A 725 -3.929 -6.792 -3.043 1.00 0.00 C ATOM 1517 CD2 LEU A 725 -6.240 -6.984 -3.983 1.00 0.00 C ATOM 0 H LEU A 725 -1.837 -8.100 -4.372 1.00 0.00 H new ATOM 0 HA LEU A 725 -4.022 -10.038 -4.819 1.00 0.00 H new ATOM 0 HB2 LEU A 725 -3.712 -7.090 -5.555 1.00 0.00 H new ATOM 0 HB3 LEU A 725 -5.106 -8.074 -5.953 1.00 0.00 H new ATOM 0 HG LEU A 725 -5.018 -8.626 -3.314 1.00 0.00 H new ATOM 0 HD11 LEU A 725 -4.346 -6.604 -2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 725 -2.966 -7.292 -2.942 1.00 0.00 H new ATOM 0 HD13 LEU A 725 -3.792 -5.845 -3.565 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -6.658 -6.794 -2.994 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -6.109 -6.039 -4.509 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -6.920 -7.622 -4.547 1.00 0.00 H new ATOM 1529 N SER A 726 -3.697 -10.323 -7.323 1.00 0.00 N ATOM 1530 CA SER A 726 -3.324 -10.703 -8.683 1.00 0.00 C ATOM 1531 C SER A 726 -4.520 -11.316 -9.401 1.00 0.00 C ATOM 1532 O SER A 726 -4.404 -11.811 -10.522 1.00 0.00 O ATOM 1533 CB SER A 726 -2.171 -11.710 -8.654 1.00 0.00 C ATOM 1534 OG SER A 726 -2.684 -13.007 -8.381 1.00 0.00 O ATOM 0 H SER A 726 -4.579 -10.720 -6.999 1.00 0.00 H new ATOM 0 HA SER A 726 -3.003 -9.809 -9.218 1.00 0.00 H new ATOM 0 HB2 SER A 726 -1.647 -11.708 -9.610 1.00 0.00 H new ATOM 0 HB3 SER A 726 -1.445 -11.426 -7.892 1.00 0.00 H new ATOM 0 HG SER A 726 -1.947 -13.653 -8.364 1.00 0.00 H new ATOM 1540 N LYS A 727 -5.671 -11.268 -8.745 1.00 0.00 N ATOM 1541 CA LYS A 727 -6.896 -11.809 -9.317 1.00 0.00 C ATOM 1542 C LYS A 727 -8.065 -10.878 -9.018 1.00 0.00 C ATOM 1543 O LYS A 727 -8.995 -11.250 -8.301 1.00 0.00 O ATOM 1544 CB LYS A 727 -7.181 -13.188 -8.724 1.00 0.00 C ATOM 1545 CG LYS A 727 -7.864 -14.066 -9.774 1.00 0.00 C ATOM 1546 CD LYS A 727 -6.812 -14.930 -10.475 1.00 0.00 C ATOM 1547 CE LYS A 727 -7.389 -15.492 -11.776 1.00 0.00 C ATOM 1548 NZ LYS A 727 -6.276 -15.812 -12.716 1.00 0.00 N ATOM 0 H LYS A 727 -5.782 -10.860 -7.817 1.00 0.00 H new ATOM 0 HA LYS A 727 -6.772 -11.897 -10.396 1.00 0.00 H new ATOM 0 HB2 LYS A 727 -6.252 -13.653 -8.395 1.00 0.00 H new ATOM 0 HB3 LYS A 727 -7.818 -13.092 -7.845 1.00 0.00 H new ATOM 0 HG2 LYS A 727 -8.615 -14.699 -9.302 1.00 0.00 H new ATOM 0 HG3 LYS A 727 -8.384 -13.444 -10.502 1.00 0.00 H new ATOM 0 HD2 LYS A 727 -5.923 -14.336 -10.687 1.00 0.00 H new ATOM 0 HD3 LYS A 727 -6.503 -15.745 -9.821 1.00 0.00 H new ATOM 0 HE2 LYS A 727 -7.974 -16.388 -11.570 1.00 0.00 H new ATOM 0 HE3 LYS A 727 -8.065 -14.767 -12.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 727 -6.668 -16.194 -13.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 727 -5.736 -14.947 -12.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 727 -5.647 -16.518 -12.282 1.00 0.00 H new ATOM 1562 N PRO A 728 -8.032 -9.679 -9.538 1.00 0.00 N ATOM 1563 CA PRO A 728 -9.111 -8.680 -9.302 1.00 0.00 C ATOM 1564 C PRO A 728 -10.489 -9.204 -9.700 1.00 0.00 C ATOM 1565 O PRO A 728 -10.698 -9.658 -10.826 1.00 0.00 O ATOM 1566 CB PRO A 728 -8.716 -7.468 -10.159 1.00 0.00 C ATOM 1567 CG PRO A 728 -7.589 -7.910 -11.039 1.00 0.00 C ATOM 1568 CD PRO A 728 -6.966 -9.148 -10.398 1.00 0.00 C ATOM 0 HA PRO A 728 -9.197 -8.436 -8.243 1.00 0.00 H new ATOM 0 HB2 PRO A 728 -9.561 -7.125 -10.756 1.00 0.00 H new ATOM 0 HB3 PRO A 728 -8.410 -6.632 -9.529 1.00 0.00 H new ATOM 0 HG2 PRO A 728 -7.952 -8.138 -12.041 1.00 0.00 H new ATOM 0 HG3 PRO A 728 -6.848 -7.117 -11.141 1.00 0.00 H new ATOM 0 HD2 PRO A 728 -6.660 -9.876 -11.150 1.00 0.00 H new ATOM 0 HD3 PRO A 728 -6.077 -8.894 -9.821 1.00 0.00 H new ATOM 1576 N LEU A 729 -11.424 -9.130 -8.760 1.00 0.00 N ATOM 1577 CA LEU A 729 -12.785 -9.589 -8.999 1.00 0.00 C ATOM 1578 C LEU A 729 -13.622 -9.415 -7.734 1.00 0.00 C ATOM 1579 O LEU A 729 -14.851 -9.485 -7.774 1.00 0.00 O ATOM 1580 CB LEU A 729 -12.772 -11.060 -9.447 1.00 0.00 C ATOM 1581 CG LEU A 729 -13.100 -11.987 -8.271 1.00 0.00 C ATOM 1582 CD1 LEU A 729 -14.619 -12.086 -8.092 1.00 0.00 C ATOM 1583 CD2 LEU A 729 -12.531 -13.377 -8.560 1.00 0.00 C ATOM 0 H LEU A 729 -11.263 -8.756 -7.825 1.00 0.00 H new ATOM 0 HA LEU A 729 -13.232 -8.992 -9.793 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -13.498 -11.208 -10.247 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -11.793 -11.313 -9.854 1.00 0.00 H new ATOM 0 HG LEU A 729 -12.659 -11.586 -7.358 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -14.844 -12.746 -7.255 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -15.027 -11.095 -7.893 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -15.067 -12.487 -9.001 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -12.759 -14.044 -7.729 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -12.977 -13.770 -9.474 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -11.450 -13.309 -8.684 1.00 0.00 H new ATOM 1595 N ASP A 730 -12.943 -9.184 -6.609 1.00 0.00 N ATOM 1596 CA ASP A 730 -13.634 -9.002 -5.336 1.00 0.00 C ATOM 1597 C ASP A 730 -12.932 -7.961 -4.465 1.00 0.00 C ATOM 1598 O ASP A 730 -12.271 -8.305 -3.486 1.00 0.00 O ATOM 1599 CB ASP A 730 -13.688 -10.327 -4.576 1.00 0.00 C ATOM 1600 CG ASP A 730 -14.818 -10.290 -3.553 1.00 0.00 C ATOM 1601 OD1 ASP A 730 -15.961 -10.191 -3.967 1.00 0.00 O ATOM 1602 OD2 ASP A 730 -14.523 -10.357 -2.371 1.00 0.00 O ATOM 0 H ASP A 730 -11.926 -9.119 -6.555 1.00 0.00 H new ATOM 0 HA ASP A 730 -14.643 -8.653 -5.555 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -13.843 -11.151 -5.273 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -12.737 -10.508 -4.075 1.00 0.00 H new ATOM 1607 N PRO A 731 -13.082 -6.708 -4.790 1.00 0.00 N ATOM 1608 CA PRO A 731 -12.465 -5.595 -4.010 1.00 0.00 C ATOM 1609 C PRO A 731 -12.889 -5.640 -2.544 1.00 0.00 C ATOM 1610 O PRO A 731 -12.353 -4.916 -1.700 1.00 0.00 O ATOM 1611 CB PRO A 731 -12.997 -4.326 -4.682 1.00 0.00 C ATOM 1612 CG PRO A 731 -13.455 -4.744 -6.041 1.00 0.00 C ATOM 1613 CD PRO A 731 -13.851 -6.216 -5.939 1.00 0.00 C ATOM 0 HA PRO A 731 -11.376 -5.651 -4.009 1.00 0.00 H new ATOM 0 HB2 PRO A 731 -13.818 -3.895 -4.109 1.00 0.00 H new ATOM 0 HB3 PRO A 731 -12.220 -3.564 -4.749 1.00 0.00 H new ATOM 0 HG2 PRO A 731 -14.300 -4.138 -6.368 1.00 0.00 H new ATOM 0 HG3 PRO A 731 -12.662 -4.607 -6.776 1.00 0.00 H new ATOM 0 HD2 PRO A 731 -14.923 -6.332 -5.781 1.00 0.00 H new ATOM 0 HD3 PRO A 731 -13.602 -6.761 -6.850 1.00 0.00 H new ATOM 1621 N GLN A 732 -13.862 -6.496 -2.256 1.00 0.00 N ATOM 1622 CA GLN A 732 -14.371 -6.633 -0.902 1.00 0.00 C ATOM 1623 C GLN A 732 -13.356 -7.355 -0.022 1.00 0.00 C ATOM 1624 O GLN A 732 -13.367 -7.210 1.200 1.00 0.00 O ATOM 1625 CB GLN A 732 -15.722 -7.367 -0.940 1.00 0.00 C ATOM 1626 CG GLN A 732 -15.667 -8.657 -0.124 1.00 0.00 C ATOM 1627 CD GLN A 732 -15.622 -8.336 1.365 1.00 0.00 C ATOM 1628 OE1 GLN A 732 -15.641 -9.244 2.196 1.00 0.00 O ATOM 1629 NE2 GLN A 732 -15.571 -7.093 1.755 1.00 0.00 N ATOM 0 H GLN A 732 -14.312 -7.103 -2.942 1.00 0.00 H new ATOM 0 HA GLN A 732 -14.529 -5.647 -0.465 1.00 0.00 H new ATOM 0 HB2 GLN A 732 -16.504 -6.717 -0.547 1.00 0.00 H new ATOM 0 HB3 GLN A 732 -15.986 -7.596 -1.972 1.00 0.00 H new ATOM 0 HG2 GLN A 732 -16.539 -9.273 -0.345 1.00 0.00 H new ATOM 0 HG3 GLN A 732 -14.788 -9.237 -0.405 1.00 0.00 H new ATOM 0 HE21 GLN A 732 -15.555 -6.342 1.065 1.00 0.00 H new ATOM 0 HE22 GLN A 732 -15.547 -6.871 2.750 1.00 0.00 H new ATOM 1638 N LEU A 733 -12.466 -8.118 -0.649 1.00 0.00 N ATOM 1639 CA LEU A 733 -11.442 -8.829 0.102 1.00 0.00 C ATOM 1640 C LEU A 733 -10.465 -7.828 0.713 1.00 0.00 C ATOM 1641 O LEU A 733 -10.151 -7.899 1.901 1.00 0.00 O ATOM 1642 CB LEU A 733 -10.692 -9.790 -0.824 1.00 0.00 C ATOM 1643 CG LEU A 733 -9.639 -10.567 -0.029 1.00 0.00 C ATOM 1644 CD1 LEU A 733 -10.316 -11.685 0.766 1.00 0.00 C ATOM 1645 CD2 LEU A 733 -8.623 -11.177 -0.998 1.00 0.00 C ATOM 0 H LEU A 733 -12.434 -8.258 -1.659 1.00 0.00 H new ATOM 0 HA LEU A 733 -11.914 -9.401 0.900 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -11.394 -10.483 -1.288 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -10.214 -9.233 -1.630 1.00 0.00 H new ATOM 0 HG LEU A 733 -9.132 -9.891 0.659 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -9.564 -12.236 1.331 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -11.043 -11.253 1.454 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -10.824 -12.363 0.080 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -7.871 -11.731 -0.436 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -9.134 -11.853 -1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -8.139 -10.382 -1.565 1.00 0.00 H new ATOM 1657 N LEU A 734 -10.006 -6.882 -0.104 1.00 0.00 N ATOM 1658 CA LEU A 734 -9.085 -5.851 0.368 1.00 0.00 C ATOM 1659 C LEU A 734 -9.718 -5.037 1.492 1.00 0.00 C ATOM 1660 O LEU A 734 -9.079 -4.753 2.510 1.00 0.00 O ATOM 1661 CB LEU A 734 -8.706 -4.929 -0.790 1.00 0.00 C ATOM 1662 CG LEU A 734 -7.784 -3.820 -0.283 1.00 0.00 C ATOM 1663 CD1 LEU A 734 -6.479 -4.436 0.229 1.00 0.00 C ATOM 1664 CD2 LEU A 734 -7.479 -2.855 -1.433 1.00 0.00 C ATOM 0 H LEU A 734 -10.255 -6.808 -1.090 1.00 0.00 H new ATOM 0 HA LEU A 734 -8.189 -6.336 0.755 1.00 0.00 H new ATOM 0 HB2 LEU A 734 -8.208 -5.499 -1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 734 -9.603 -4.496 -1.232 1.00 0.00 H new ATOM 0 HG LEU A 734 -8.271 -3.280 0.529 1.00 0.00 H new ATOM 0 HD11 LEU A 734 -5.821 -3.646 0.591 1.00 0.00 H new ATOM 0 HD12 LEU A 734 -6.698 -5.127 1.043 1.00 0.00 H new ATOM 0 HD13 LEU A 734 -5.988 -4.974 -0.582 1.00 0.00 H new ATOM 0 HD21 LEU A 734 -6.822 -2.062 -1.078 1.00 0.00 H new ATOM 0 HD22 LEU A 734 -6.989 -3.397 -2.242 1.00 0.00 H new ATOM 0 HD23 LEU A 734 -8.409 -2.419 -1.799 1.00 0.00 H new ATOM 1676 N LEU A 735 -10.983 -4.670 1.307 1.00 0.00 N ATOM 1677 CA LEU A 735 -11.686 -3.896 2.321 1.00 0.00 C ATOM 1678 C LEU A 735 -11.706 -4.675 3.629 1.00 0.00 C ATOM 1679 O LEU A 735 -11.552 -4.106 4.710 1.00 0.00 O ATOM 1680 CB LEU A 735 -13.119 -3.614 1.868 1.00 0.00 C ATOM 1681 CG LEU A 735 -13.793 -2.678 2.871 1.00 0.00 C ATOM 1682 CD1 LEU A 735 -13.219 -1.267 2.719 1.00 0.00 C ATOM 1683 CD2 LEU A 735 -15.301 -2.647 2.609 1.00 0.00 C ATOM 0 H LEU A 735 -11.534 -4.892 0.478 1.00 0.00 H new ATOM 0 HA LEU A 735 -11.169 -2.948 2.468 1.00 0.00 H new ATOM 0 HB2 LEU A 735 -13.116 -3.161 0.876 1.00 0.00 H new ATOM 0 HB3 LEU A 735 -13.678 -4.546 1.791 1.00 0.00 H new ATOM 0 HG LEU A 735 -13.608 -3.038 3.883 1.00 0.00 H new ATOM 0 HD11 LEU A 735 -13.700 -0.600 3.434 1.00 0.00 H new ATOM 0 HD12 LEU A 735 -12.146 -1.289 2.908 1.00 0.00 H new ATOM 0 HD13 LEU A 735 -13.402 -0.907 1.707 1.00 0.00 H new ATOM 0 HD21 LEU A 735 -15.781 -1.979 3.325 1.00 0.00 H new ATOM 0 HD22 LEU A 735 -15.487 -2.288 1.597 1.00 0.00 H new ATOM 0 HD23 LEU A 735 -15.710 -3.651 2.719 1.00 0.00 H new ATOM 1695 N THR A 736 -11.880 -5.988 3.514 1.00 0.00 N ATOM 1696 CA THR A 736 -11.903 -6.855 4.684 1.00 0.00 C ATOM 1697 C THR A 736 -10.582 -6.769 5.438 1.00 0.00 C ATOM 1698 O THR A 736 -10.556 -6.811 6.667 1.00 0.00 O ATOM 1699 CB THR A 736 -12.160 -8.303 4.262 1.00 0.00 C ATOM 1700 OG1 THR A 736 -13.412 -8.385 3.595 1.00 0.00 O ATOM 1701 CG2 THR A 736 -12.175 -9.205 5.496 1.00 0.00 C ATOM 0 H THR A 736 -12.007 -6.472 2.625 1.00 0.00 H new ATOM 0 HA THR A 736 -12.707 -6.524 5.341 1.00 0.00 H new ATOM 0 HB THR A 736 -11.367 -8.630 3.589 1.00 0.00 H new ATOM 0 HG1 THR A 736 -13.305 -8.101 2.663 1.00 0.00 H new ATOM 0 HG21 THR A 736 -12.358 -10.235 5.191 1.00 0.00 H new ATOM 0 HG22 THR A 736 -11.213 -9.143 6.004 1.00 0.00 H new ATOM 0 HG23 THR A 736 -12.965 -8.881 6.174 1.00 0.00 H new ATOM 1709 N THR A 737 -9.484 -6.652 4.696 1.00 0.00 N ATOM 1710 CA THR A 737 -8.172 -6.566 5.320 1.00 0.00 C ATOM 1711 C THR A 737 -8.099 -5.353 6.239 1.00 0.00 C ATOM 1712 O THR A 737 -7.658 -5.459 7.383 1.00 0.00 O ATOM 1713 CB THR A 737 -7.083 -6.457 4.248 1.00 0.00 C ATOM 1714 OG1 THR A 737 -7.187 -7.554 3.351 1.00 0.00 O ATOM 1715 CG2 THR A 737 -5.708 -6.470 4.919 1.00 0.00 C ATOM 0 H THR A 737 -9.478 -6.615 3.677 1.00 0.00 H new ATOM 0 HA THR A 737 -8.012 -7.470 5.908 1.00 0.00 H new ATOM 0 HB THR A 737 -7.208 -5.527 3.694 1.00 0.00 H new ATOM 0 HG1 THR A 737 -6.491 -7.482 2.665 1.00 0.00 H new ATOM 0 HG21 THR A 737 -4.931 -6.393 4.158 1.00 0.00 H new ATOM 0 HG22 THR A 737 -5.630 -5.626 5.605 1.00 0.00 H new ATOM 0 HG23 THR A 737 -5.582 -7.400 5.473 1.00 0.00 H new ATOM 1723 N LEU A 738 -8.539 -4.203 5.739 1.00 0.00 N ATOM 1724 CA LEU A 738 -8.511 -2.988 6.547 1.00 0.00 C ATOM 1725 C LEU A 738 -9.485 -3.102 7.719 1.00 0.00 C ATOM 1726 O LEU A 738 -9.189 -2.661 8.830 1.00 0.00 O ATOM 1727 CB LEU A 738 -8.857 -1.767 5.689 1.00 0.00 C ATOM 1728 CG LEU A 738 -8.512 -0.485 6.463 1.00 0.00 C ATOM 1729 CD1 LEU A 738 -8.207 0.650 5.478 1.00 0.00 C ATOM 1730 CD2 LEU A 738 -9.689 -0.078 7.359 1.00 0.00 C ATOM 0 H LEU A 738 -8.912 -4.086 4.797 1.00 0.00 H new ATOM 0 HA LEU A 738 -7.503 -2.862 6.943 1.00 0.00 H new ATOM 0 HB2 LEU A 738 -8.303 -1.799 4.751 1.00 0.00 H new ATOM 0 HB3 LEU A 738 -9.917 -1.777 5.434 1.00 0.00 H new ATOM 0 HG LEU A 738 -7.636 -0.674 7.084 1.00 0.00 H new ATOM 0 HD11 LEU A 738 -7.963 1.557 6.032 1.00 0.00 H new ATOM 0 HD12 LEU A 738 -7.361 0.370 4.850 1.00 0.00 H new ATOM 0 HD13 LEU A 738 -9.080 0.832 4.851 1.00 0.00 H new ATOM 0 HD21 LEU A 738 -9.434 0.831 7.903 1.00 0.00 H new ATOM 0 HD22 LEU A 738 -10.570 0.102 6.743 1.00 0.00 H new ATOM 0 HD23 LEU A 738 -9.900 -0.878 8.068 1.00 0.00 H new ATOM 1742 N GLN A 739 -10.644 -3.706 7.465 1.00 0.00 N ATOM 1743 CA GLN A 739 -11.655 -3.884 8.505 1.00 0.00 C ATOM 1744 C GLN A 739 -11.144 -4.806 9.610 1.00 0.00 C ATOM 1745 O GLN A 739 -11.558 -4.696 10.764 1.00 0.00 O ATOM 1746 CB GLN A 739 -12.935 -4.465 7.899 1.00 0.00 C ATOM 1747 CG GLN A 739 -13.569 -3.431 6.967 1.00 0.00 C ATOM 1748 CD GLN A 739 -13.990 -2.202 7.768 1.00 0.00 C ATOM 1749 OE1 GLN A 739 -14.746 -2.319 8.733 1.00 0.00 O ATOM 1750 NE2 GLN A 739 -13.542 -1.027 7.425 1.00 0.00 N ATOM 0 H GLN A 739 -10.906 -4.079 6.552 1.00 0.00 H new ATOM 0 HA GLN A 739 -11.871 -2.908 8.940 1.00 0.00 H new ATOM 0 HB2 GLN A 739 -12.708 -5.377 7.348 1.00 0.00 H new ATOM 0 HB3 GLN A 739 -13.635 -4.736 8.690 1.00 0.00 H new ATOM 0 HG2 GLN A 739 -12.860 -3.145 6.190 1.00 0.00 H new ATOM 0 HG3 GLN A 739 -14.435 -3.863 6.465 1.00 0.00 H new ATOM 0 HE21 GLN A 739 -12.916 -0.933 6.625 1.00 0.00 H new ATOM 0 HE22 GLN A 739 -13.817 -0.201 7.956 1.00 0.00 H new ATOM 1759 N GLY A 740 -10.252 -5.721 9.245 1.00 0.00 N ATOM 1760 CA GLY A 740 -9.699 -6.667 10.210 1.00 0.00 C ATOM 1761 C GLY A 740 -9.076 -5.948 11.403 1.00 0.00 C ATOM 1762 O GLY A 740 -8.506 -6.583 12.289 1.00 0.00 O ATOM 0 H GLY A 740 -9.898 -5.828 8.295 1.00 0.00 H new ATOM 0 HA2 GLY A 740 -10.486 -7.336 10.557 1.00 0.00 H new ATOM 0 HA3 GLY A 740 -8.946 -7.287 9.723 1.00 0.00 H new ATOM 1766 N LEU A 741 -9.184 -4.624 11.422 1.00 0.00 N ATOM 1767 CA LEU A 741 -8.622 -3.843 12.518 1.00 0.00 C ATOM 1768 C LEU A 741 -9.534 -3.886 13.741 1.00 0.00 C ATOM 1769 O LEU A 741 -9.064 -3.891 14.877 1.00 0.00 O ATOM 1770 CB LEU A 741 -8.423 -2.393 12.081 1.00 0.00 C ATOM 1771 CG LEU A 741 -7.754 -1.604 13.208 1.00 0.00 C ATOM 1772 CD1 LEU A 741 -6.310 -2.082 13.383 1.00 0.00 C ATOM 1773 CD2 LEU A 741 -7.757 -0.115 12.853 1.00 0.00 C ATOM 0 H LEU A 741 -9.650 -4.074 10.700 1.00 0.00 H new ATOM 0 HA LEU A 741 -7.659 -4.279 12.785 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -7.808 -2.355 11.182 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -9.384 -1.943 11.829 1.00 0.00 H new ATOM 0 HG LEU A 741 -8.302 -1.761 14.137 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -5.835 -1.519 14.186 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -6.306 -3.143 13.632 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -5.760 -1.925 12.455 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -7.281 0.451 13.654 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -7.208 0.039 11.924 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -8.784 0.227 12.728 1.00 0.00 H new