USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=14 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 692 HIS : no HD1:sc= -2.96! C(o=-3.5!,f=-4.8!) USER MOD Set 1.2: A 696 HIS : no HD1:sc= -0.568 K(o=-3.5,f=-4) USER MOD Set 2.1: A 644 CYS SG : rot -57:sc= -1.11 USER MOD Set 2.2: A 648 THR OG1 : rot 62:sc= 0.477 USER MOD Single : A 629 HIS : no HD1:sc= -0.0377 X(o=-0.038,f=0) USER MOD Single : A 641 THR OG1 : rot 65:sc= 0.353! USER MOD Single : A 646 MET CE :methyl 141:sc= -1.01 (180deg=-3.75!) USER MOD Single : A 653 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 661 SER OG : rot 180:sc= 0 USER MOD Single : A 662 THR OG1 : rot 180:sc= 0 USER MOD Single : A 666 GLN : amide:sc= -0.997! K(o=-1!,f=0) USER MOD Single : A 671 GLN : amide:sc= 0.833 K(o=0.83,f=-1.3!) USER MOD Single : A 677 MET CE :methyl -107:sc= -0.0462 (180deg=-2.51!) USER MOD Single : A 684 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 685 SER OG : rot 180:sc= 0 USER MOD Single : A 686 CYS SG : rot -152:sc= -0.715! USER MOD Single : A 691 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 718 THR OG1 : rot 140:sc= -3 USER MOD Single : A 720 GLN : amide:sc= -0.114 K(o=-0.11,f=-0.89) USER MOD Single : A 722 SER OG : rot -150:sc= 0 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 732 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 736 THR OG1 : rot 76:sc= 1.08 USER MOD Single : A 737 THR OG1 : rot 87:sc= 1.23 USER MOD Single : A 739 GLN : amide:sc= -1.69 X(o=-1.7,f=-2!) USER MOD ----------------------------------------------------------------- ATOM 13 N GLY A 628 -8.589 7.108 9.059 1.00 0.00 N ATOM 14 CA GLY A 628 -8.195 6.012 8.182 1.00 0.00 C ATOM 15 C GLY A 628 -7.536 6.538 6.912 1.00 0.00 C ATOM 16 O GLY A 628 -8.162 6.595 5.854 1.00 0.00 O ATOM 0 HA2 GLY A 628 -7.505 5.351 8.707 1.00 0.00 H new ATOM 0 HA3 GLY A 628 -9.070 5.417 7.922 1.00 0.00 H new ATOM 20 N HIS A 629 -6.268 6.922 7.023 1.00 0.00 N ATOM 21 CA HIS A 629 -5.538 7.439 5.873 1.00 0.00 C ATOM 22 C HIS A 629 -4.861 6.300 5.118 1.00 0.00 C ATOM 23 O HIS A 629 -4.190 5.458 5.715 1.00 0.00 O ATOM 24 CB HIS A 629 -4.480 8.446 6.331 1.00 0.00 C ATOM 25 CG HIS A 629 -5.153 9.678 6.872 1.00 0.00 C ATOM 26 ND1 HIS A 629 -4.469 10.630 7.611 1.00 0.00 N ATOM 27 CD2 HIS A 629 -6.447 10.128 6.787 1.00 0.00 C ATOM 28 CE1 HIS A 629 -5.346 11.596 7.939 1.00 0.00 C ATOM 29 NE2 HIS A 629 -6.566 11.340 7.462 1.00 0.00 N ATOM 0 H HIS A 629 -5.730 6.885 7.889 1.00 0.00 H new ATOM 0 HA HIS A 629 -6.247 7.935 5.210 1.00 0.00 H new ATOM 0 HB2 HIS A 629 -3.847 7.999 7.098 1.00 0.00 H new ATOM 0 HB3 HIS A 629 -3.831 8.711 5.496 1.00 0.00 H new ATOM 0 HD2 HIS A 629 -7.250 9.620 6.275 1.00 0.00 H new ATOM 0 HE1 HIS A 629 -5.094 12.472 8.518 1.00 0.00 H new ATOM 0 HE2 HIS A 629 -7.405 11.910 7.569 1.00 0.00 H new ATOM 38 N ILE A 630 -5.042 6.281 3.802 1.00 0.00 N ATOM 39 CA ILE A 630 -4.445 5.242 2.973 1.00 0.00 C ATOM 40 C ILE A 630 -3.411 5.841 2.029 1.00 0.00 C ATOM 41 O ILE A 630 -3.615 6.927 1.486 1.00 0.00 O ATOM 42 CB ILE A 630 -5.524 4.543 2.144 1.00 0.00 C ATOM 43 CG1 ILE A 630 -6.613 3.994 3.070 1.00 0.00 C ATOM 44 CG2 ILE A 630 -4.896 3.393 1.354 1.00 0.00 C ATOM 45 CD1 ILE A 630 -7.696 3.307 2.234 1.00 0.00 C ATOM 0 H ILE A 630 -5.594 6.969 3.289 1.00 0.00 H new ATOM 0 HA ILE A 630 -3.961 4.521 3.631 1.00 0.00 H new ATOM 0 HB ILE A 630 -5.968 5.259 1.453 1.00 0.00 H new ATOM 0 HG12 ILE A 630 -6.181 3.286 3.777 1.00 0.00 H new ATOM 0 HG13 ILE A 630 -7.049 4.803 3.655 1.00 0.00 H new ATOM 0 HG21 ILE A 630 -5.665 2.895 0.763 1.00 0.00 H new ATOM 0 HG22 ILE A 630 -4.126 3.786 0.690 1.00 0.00 H new ATOM 0 HG23 ILE A 630 -4.449 2.678 2.045 1.00 0.00 H new ATOM 0 HD11 ILE A 630 -8.471 2.916 2.893 1.00 0.00 H new ATOM 0 HD12 ILE A 630 -8.135 4.028 1.545 1.00 0.00 H new ATOM 0 HD13 ILE A 630 -7.254 2.487 1.668 1.00 0.00 H new ATOM 57 N LEU A 631 -2.310 5.126 1.819 1.00 0.00 N ATOM 58 CA LEU A 631 -1.275 5.616 0.914 1.00 0.00 C ATOM 59 C LEU A 631 -1.336 4.867 -0.409 1.00 0.00 C ATOM 60 O LEU A 631 -1.406 3.638 -0.437 1.00 0.00 O ATOM 61 CB LEU A 631 0.110 5.447 1.541 1.00 0.00 C ATOM 62 CG LEU A 631 0.202 6.295 2.809 1.00 0.00 C ATOM 63 CD1 LEU A 631 1.600 6.162 3.413 1.00 0.00 C ATOM 64 CD2 LEU A 631 -0.054 7.761 2.458 1.00 0.00 C ATOM 0 H LEU A 631 -2.113 4.224 2.253 1.00 0.00 H new ATOM 0 HA LEU A 631 -1.451 6.676 0.733 1.00 0.00 H new ATOM 0 HB2 LEU A 631 0.288 4.398 1.778 1.00 0.00 H new ATOM 0 HB3 LEU A 631 0.881 5.749 0.832 1.00 0.00 H new ATOM 0 HG LEU A 631 -0.542 5.952 3.528 1.00 0.00 H new ATOM 0 HD11 LEU A 631 1.665 6.767 4.317 1.00 0.00 H new ATOM 0 HD12 LEU A 631 1.792 5.118 3.661 1.00 0.00 H new ATOM 0 HD13 LEU A 631 2.342 6.506 2.692 1.00 0.00 H new ATOM 0 HD21 LEU A 631 0.011 8.368 3.361 1.00 0.00 H new ATOM 0 HD22 LEU A 631 0.693 8.099 1.739 1.00 0.00 H new ATOM 0 HD23 LEU A 631 -1.048 7.863 2.023 1.00 0.00 H new ATOM 76 N LEU A 632 -1.319 5.617 -1.506 1.00 0.00 N ATOM 77 CA LEU A 632 -1.382 5.014 -2.828 1.00 0.00 C ATOM 78 C LEU A 632 -0.199 5.448 -3.683 1.00 0.00 C ATOM 79 O LEU A 632 -0.044 6.628 -3.998 1.00 0.00 O ATOM 80 CB LEU A 632 -2.684 5.426 -3.519 1.00 0.00 C ATOM 81 CG LEU A 632 -2.814 4.694 -4.855 1.00 0.00 C ATOM 82 CD1 LEU A 632 -3.413 3.306 -4.621 1.00 0.00 C ATOM 83 CD2 LEU A 632 -3.728 5.493 -5.786 1.00 0.00 C ATOM 0 H LEU A 632 -1.263 6.635 -1.504 1.00 0.00 H new ATOM 0 HA LEU A 632 -1.348 3.931 -2.712 1.00 0.00 H new ATOM 0 HB2 LEU A 632 -3.536 5.191 -2.881 1.00 0.00 H new ATOM 0 HB3 LEU A 632 -2.695 6.504 -3.682 1.00 0.00 H new ATOM 0 HG LEU A 632 -1.829 4.592 -5.311 1.00 0.00 H new ATOM 0 HD11 LEU A 632 -3.506 2.784 -5.574 1.00 0.00 H new ATOM 0 HD12 LEU A 632 -2.763 2.736 -3.957 1.00 0.00 H new ATOM 0 HD13 LEU A 632 -4.398 3.407 -4.165 1.00 0.00 H new ATOM 0 HD21 LEU A 632 -3.822 4.972 -6.739 1.00 0.00 H new ATOM 0 HD22 LEU A 632 -4.713 5.595 -5.330 1.00 0.00 H new ATOM 0 HD23 LEU A 632 -3.302 6.482 -5.953 1.00 0.00 H new ATOM 95 N LEU A 633 0.620 4.480 -4.072 1.00 0.00 N ATOM 96 CA LEU A 633 1.775 4.759 -4.912 1.00 0.00 C ATOM 97 C LEU A 633 1.620 4.034 -6.241 1.00 0.00 C ATOM 98 O LEU A 633 1.509 2.809 -6.276 1.00 0.00 O ATOM 99 CB LEU A 633 3.056 4.301 -4.212 1.00 0.00 C ATOM 100 CG LEU A 633 4.272 4.771 -5.011 1.00 0.00 C ATOM 101 CD1 LEU A 633 5.423 5.084 -4.054 1.00 0.00 C ATOM 102 CD2 LEU A 633 4.701 3.663 -5.976 1.00 0.00 C ATOM 0 H LEU A 633 0.506 3.498 -3.820 1.00 0.00 H new ATOM 0 HA LEU A 633 1.840 5.832 -5.091 1.00 0.00 H new ATOM 0 HB2 LEU A 633 3.094 4.705 -3.200 1.00 0.00 H new ATOM 0 HB3 LEU A 633 3.065 3.215 -4.122 1.00 0.00 H new ATOM 0 HG LEU A 633 4.014 5.668 -5.573 1.00 0.00 H new ATOM 0 HD11 LEU A 633 6.289 5.419 -4.624 1.00 0.00 H new ATOM 0 HD12 LEU A 633 5.118 5.869 -3.363 1.00 0.00 H new ATOM 0 HD13 LEU A 633 5.683 4.187 -3.492 1.00 0.00 H new ATOM 0 HD21 LEU A 633 5.568 3.994 -6.548 1.00 0.00 H new ATOM 0 HD22 LEU A 633 4.960 2.768 -5.410 1.00 0.00 H new ATOM 0 HD23 LEU A 633 3.881 3.437 -6.658 1.00 0.00 H new ATOM 114 N GLU A 634 1.600 4.789 -7.332 1.00 0.00 N ATOM 115 CA GLU A 634 1.442 4.182 -8.649 1.00 0.00 C ATOM 116 C GLU A 634 1.959 5.104 -9.746 1.00 0.00 C ATOM 117 O GLU A 634 2.255 6.274 -9.506 1.00 0.00 O ATOM 118 CB GLU A 634 -0.036 3.875 -8.922 1.00 0.00 C ATOM 119 CG GLU A 634 -0.575 2.892 -7.879 1.00 0.00 C ATOM 120 CD GLU A 634 -1.984 2.449 -8.261 1.00 0.00 C ATOM 121 OE1 GLU A 634 -2.541 3.036 -9.174 1.00 0.00 O ATOM 122 OE2 GLU A 634 -2.484 1.528 -7.636 1.00 0.00 O ATOM 0 H GLU A 634 1.689 5.805 -7.334 1.00 0.00 H new ATOM 0 HA GLU A 634 2.022 3.259 -8.654 1.00 0.00 H new ATOM 0 HB2 GLU A 634 -0.617 4.797 -8.897 1.00 0.00 H new ATOM 0 HB3 GLU A 634 -0.149 3.454 -9.921 1.00 0.00 H new ATOM 0 HG2 GLU A 634 0.082 2.025 -7.810 1.00 0.00 H new ATOM 0 HG3 GLU A 634 -0.586 3.362 -6.896 1.00 0.00 H new ATOM 129 N GLU A 635 2.044 4.563 -10.955 1.00 0.00 N ATOM 130 CA GLU A 635 2.503 5.333 -12.103 1.00 0.00 C ATOM 131 C GLU A 635 1.333 5.579 -13.046 1.00 0.00 C ATOM 132 O GLU A 635 0.336 4.859 -13.006 1.00 0.00 O ATOM 133 CB GLU A 635 3.608 4.574 -12.842 1.00 0.00 C ATOM 134 CG GLU A 635 4.809 4.383 -11.914 1.00 0.00 C ATOM 135 CD GLU A 635 5.940 3.686 -12.664 1.00 0.00 C ATOM 136 OE1 GLU A 635 5.694 3.216 -13.763 1.00 0.00 O ATOM 137 OE2 GLU A 635 7.035 3.633 -12.129 1.00 0.00 O ATOM 0 H GLU A 635 1.801 3.595 -11.165 1.00 0.00 H new ATOM 0 HA GLU A 635 2.902 6.286 -11.756 1.00 0.00 H new ATOM 0 HB2 GLU A 635 3.237 3.605 -13.176 1.00 0.00 H new ATOM 0 HB3 GLU A 635 3.908 5.125 -13.733 1.00 0.00 H new ATOM 0 HG2 GLU A 635 5.149 5.349 -11.542 1.00 0.00 H new ATOM 0 HG3 GLU A 635 4.518 3.792 -11.046 1.00 0.00 H new ATOM 144 N GLU A 636 1.448 6.598 -13.886 1.00 0.00 N ATOM 145 CA GLU A 636 0.374 6.914 -14.816 1.00 0.00 C ATOM 146 C GLU A 636 -0.889 7.285 -14.045 1.00 0.00 C ATOM 147 O GLU A 636 -1.329 6.546 -13.164 1.00 0.00 O ATOM 148 CB GLU A 636 0.093 5.705 -15.711 1.00 0.00 C ATOM 149 CG GLU A 636 -0.910 6.093 -16.798 1.00 0.00 C ATOM 150 CD GLU A 636 -1.282 4.865 -17.622 1.00 0.00 C ATOM 151 OE1 GLU A 636 -0.803 3.791 -17.296 1.00 0.00 O ATOM 152 OE2 GLU A 636 -2.040 5.016 -18.565 1.00 0.00 O ATOM 0 H GLU A 636 2.261 7.211 -13.943 1.00 0.00 H new ATOM 0 HA GLU A 636 0.677 7.759 -15.435 1.00 0.00 H new ATOM 0 HB2 GLU A 636 1.019 5.353 -16.166 1.00 0.00 H new ATOM 0 HB3 GLU A 636 -0.302 4.882 -15.115 1.00 0.00 H new ATOM 0 HG2 GLU A 636 -1.804 6.522 -16.344 1.00 0.00 H new ATOM 0 HG3 GLU A 636 -0.481 6.859 -17.444 1.00 0.00 H new ATOM 159 N ASP A 637 -1.463 8.436 -14.376 1.00 0.00 N ATOM 160 CA ASP A 637 -2.671 8.897 -13.701 1.00 0.00 C ATOM 161 C ASP A 637 -3.828 7.926 -13.916 1.00 0.00 C ATOM 162 O ASP A 637 -4.712 7.807 -13.068 1.00 0.00 O ATOM 163 CB ASP A 637 -3.059 10.289 -14.207 1.00 0.00 C ATOM 164 CG ASP A 637 -3.399 10.240 -15.694 1.00 0.00 C ATOM 165 OD1 ASP A 637 -3.575 9.149 -16.209 1.00 0.00 O ATOM 166 OD2 ASP A 637 -3.475 11.298 -16.297 1.00 0.00 O ATOM 0 H ASP A 637 -1.115 9.063 -15.102 1.00 0.00 H new ATOM 0 HA ASP A 637 -2.461 8.947 -12.633 1.00 0.00 H new ATOM 0 HB2 ASP A 637 -3.915 10.662 -13.644 1.00 0.00 H new ATOM 0 HB3 ASP A 637 -2.238 10.986 -14.038 1.00 0.00 H new ATOM 171 N GLU A 638 -3.827 7.242 -15.055 1.00 0.00 N ATOM 172 CA GLU A 638 -4.894 6.298 -15.362 1.00 0.00 C ATOM 173 C GLU A 638 -4.914 5.149 -14.360 1.00 0.00 C ATOM 174 O GLU A 638 -5.980 4.719 -13.921 1.00 0.00 O ATOM 175 CB GLU A 638 -4.704 5.742 -16.773 1.00 0.00 C ATOM 176 CG GLU A 638 -5.864 4.806 -17.111 1.00 0.00 C ATOM 177 CD GLU A 638 -7.161 5.601 -17.223 1.00 0.00 C ATOM 178 OE1 GLU A 638 -7.083 6.789 -17.490 1.00 0.00 O ATOM 179 OE2 GLU A 638 -8.212 5.012 -17.038 1.00 0.00 O ATOM 0 H GLU A 638 -3.108 7.322 -15.774 1.00 0.00 H new ATOM 0 HA GLU A 638 -5.845 6.827 -15.300 1.00 0.00 H new ATOM 0 HB2 GLU A 638 -4.659 6.558 -17.494 1.00 0.00 H new ATOM 0 HB3 GLU A 638 -3.758 5.205 -16.840 1.00 0.00 H new ATOM 0 HG2 GLU A 638 -5.663 4.289 -18.049 1.00 0.00 H new ATOM 0 HG3 GLU A 638 -5.962 4.042 -16.340 1.00 0.00 H new ATOM 186 N ALA A 639 -3.736 4.657 -13.995 1.00 0.00 N ATOM 187 CA ALA A 639 -3.651 3.561 -13.037 1.00 0.00 C ATOM 188 C ALA A 639 -3.997 4.055 -11.637 1.00 0.00 C ATOM 189 O ALA A 639 -4.760 3.416 -10.910 1.00 0.00 O ATOM 190 CB ALA A 639 -2.240 2.969 -13.041 1.00 0.00 C ATOM 0 H ALA A 639 -2.838 4.994 -14.342 1.00 0.00 H new ATOM 0 HA ALA A 639 -4.364 2.789 -13.327 1.00 0.00 H new ATOM 0 HB1 ALA A 639 -2.187 2.151 -12.322 1.00 0.00 H new ATOM 0 HB2 ALA A 639 -2.006 2.593 -14.037 1.00 0.00 H new ATOM 0 HB3 ALA A 639 -1.521 3.741 -12.767 1.00 0.00 H new ATOM 196 N ALA A 640 -3.429 5.197 -11.267 1.00 0.00 N ATOM 197 CA ALA A 640 -3.677 5.775 -9.952 1.00 0.00 C ATOM 198 C ALA A 640 -5.110 6.289 -9.840 1.00 0.00 C ATOM 199 O ALA A 640 -5.758 6.124 -8.806 1.00 0.00 O ATOM 200 CB ALA A 640 -2.703 6.927 -9.700 1.00 0.00 C ATOM 0 H ALA A 640 -2.797 5.739 -11.856 1.00 0.00 H new ATOM 0 HA ALA A 640 -3.529 4.995 -9.205 1.00 0.00 H new ATOM 0 HB1 ALA A 640 -2.893 7.355 -8.716 1.00 0.00 H new ATOM 0 HB2 ALA A 640 -1.680 6.554 -9.742 1.00 0.00 H new ATOM 0 HB3 ALA A 640 -2.841 7.694 -10.462 1.00 0.00 H new ATOM 206 N THR A 641 -5.598 6.921 -10.903 1.00 0.00 N ATOM 207 CA THR A 641 -6.953 7.463 -10.897 1.00 0.00 C ATOM 208 C THR A 641 -7.986 6.355 -10.729 1.00 0.00 C ATOM 209 O THR A 641 -8.913 6.478 -9.929 1.00 0.00 O ATOM 210 CB THR A 641 -7.223 8.218 -12.200 1.00 0.00 C ATOM 211 OG1 THR A 641 -6.246 9.235 -12.367 1.00 0.00 O ATOM 212 CG2 THR A 641 -8.614 8.848 -12.148 1.00 0.00 C ATOM 0 H THR A 641 -5.082 7.070 -11.771 1.00 0.00 H new ATOM 0 HA THR A 641 -7.037 8.148 -10.053 1.00 0.00 H new ATOM 0 HB THR A 641 -7.173 7.524 -13.039 1.00 0.00 H new ATOM 0 HG1 THR A 641 -5.364 8.825 -12.488 1.00 0.00 H new ATOM 0 HG21 THR A 641 -8.805 9.386 -13.077 1.00 0.00 H new ATOM 0 HG22 THR A 641 -9.363 8.066 -12.021 1.00 0.00 H new ATOM 0 HG23 THR A 641 -8.668 9.542 -11.309 1.00 0.00 H new ATOM 220 N VAL A 642 -7.826 5.272 -11.484 1.00 0.00 N ATOM 221 CA VAL A 642 -8.762 4.158 -11.395 1.00 0.00 C ATOM 222 C VAL A 642 -8.837 3.644 -9.962 1.00 0.00 C ATOM 223 O VAL A 642 -9.920 3.527 -9.389 1.00 0.00 O ATOM 224 CB VAL A 642 -8.320 3.024 -12.323 1.00 0.00 C ATOM 225 CG1 VAL A 642 -9.281 1.840 -12.180 1.00 0.00 C ATOM 226 CG2 VAL A 642 -8.333 3.515 -13.771 1.00 0.00 C ATOM 0 H VAL A 642 -7.068 5.143 -12.155 1.00 0.00 H new ATOM 0 HA VAL A 642 -9.748 4.509 -11.700 1.00 0.00 H new ATOM 0 HB VAL A 642 -7.312 2.709 -12.053 1.00 0.00 H new ATOM 0 HG11 VAL A 642 -8.965 1.033 -12.841 1.00 0.00 H new ATOM 0 HG12 VAL A 642 -9.273 1.488 -11.149 1.00 0.00 H new ATOM 0 HG13 VAL A 642 -10.289 2.155 -12.448 1.00 0.00 H new ATOM 0 HG21 VAL A 642 -8.018 2.707 -14.432 1.00 0.00 H new ATOM 0 HG22 VAL A 642 -9.341 3.831 -14.039 1.00 0.00 H new ATOM 0 HG23 VAL A 642 -7.649 4.357 -13.876 1.00 0.00 H new ATOM 236 N VAL A 643 -7.676 3.339 -9.390 1.00 0.00 N ATOM 237 CA VAL A 643 -7.617 2.840 -8.022 1.00 0.00 C ATOM 238 C VAL A 643 -8.200 3.859 -7.048 1.00 0.00 C ATOM 239 O VAL A 643 -8.925 3.502 -6.121 1.00 0.00 O ATOM 240 CB VAL A 643 -6.170 2.533 -7.637 1.00 0.00 C ATOM 241 CG1 VAL A 643 -6.115 2.092 -6.173 1.00 0.00 C ATOM 242 CG2 VAL A 643 -5.635 1.410 -8.529 1.00 0.00 C ATOM 0 H VAL A 643 -6.770 3.428 -9.850 1.00 0.00 H new ATOM 0 HA VAL A 643 -8.209 1.926 -7.967 1.00 0.00 H new ATOM 0 HB VAL A 643 -5.559 3.426 -7.770 1.00 0.00 H new ATOM 0 HG11 VAL A 643 -5.083 1.873 -5.898 1.00 0.00 H new ATOM 0 HG12 VAL A 643 -6.498 2.891 -5.538 1.00 0.00 H new ATOM 0 HG13 VAL A 643 -6.724 1.198 -6.039 1.00 0.00 H new ATOM 0 HG21 VAL A 643 -4.603 1.189 -8.256 1.00 0.00 H new ATOM 0 HG22 VAL A 643 -6.245 0.517 -8.395 1.00 0.00 H new ATOM 0 HG23 VAL A 643 -5.676 1.723 -9.572 1.00 0.00 H new ATOM 252 N CYS A 644 -7.871 5.130 -7.261 1.00 0.00 N ATOM 253 CA CYS A 644 -8.363 6.190 -6.390 1.00 0.00 C ATOM 254 C CYS A 644 -9.886 6.213 -6.374 1.00 0.00 C ATOM 255 O CYS A 644 -10.501 6.373 -5.320 1.00 0.00 O ATOM 256 CB CYS A 644 -7.837 7.545 -6.863 1.00 0.00 C ATOM 257 SG CYS A 644 -7.519 8.603 -5.429 1.00 0.00 S ATOM 0 H CYS A 644 -7.271 5.448 -8.022 1.00 0.00 H new ATOM 0 HA CYS A 644 -8.004 5.994 -5.380 1.00 0.00 H new ATOM 0 HB2 CYS A 644 -6.922 7.411 -7.439 1.00 0.00 H new ATOM 0 HB3 CYS A 644 -8.563 8.018 -7.524 1.00 0.00 H new ATOM 0 HG CYS A 644 -8.607 8.723 -4.728 1.00 0.00 H new ATOM 263 N GLU A 645 -10.493 6.053 -7.545 1.00 0.00 N ATOM 264 CA GLU A 645 -11.946 6.059 -7.636 1.00 0.00 C ATOM 265 C GLU A 645 -12.528 4.905 -6.828 1.00 0.00 C ATOM 266 O GLU A 645 -13.553 5.057 -6.164 1.00 0.00 O ATOM 267 CB GLU A 645 -12.386 5.935 -9.095 1.00 0.00 C ATOM 268 CG GLU A 645 -13.907 6.085 -9.182 1.00 0.00 C ATOM 269 CD GLU A 645 -14.379 5.816 -10.607 1.00 0.00 C ATOM 270 OE1 GLU A 645 -13.937 6.520 -11.499 1.00 0.00 O ATOM 271 OE2 GLU A 645 -15.175 4.909 -10.784 1.00 0.00 O ATOM 0 H GLU A 645 -10.008 5.919 -8.432 1.00 0.00 H new ATOM 0 HA GLU A 645 -12.314 7.002 -7.231 1.00 0.00 H new ATOM 0 HB2 GLU A 645 -11.899 6.700 -9.699 1.00 0.00 H new ATOM 0 HB3 GLU A 645 -12.081 4.969 -9.497 1.00 0.00 H new ATOM 0 HG2 GLU A 645 -14.389 5.390 -8.494 1.00 0.00 H new ATOM 0 HG3 GLU A 645 -14.199 7.090 -8.877 1.00 0.00 H new ATOM 278 N MET A 646 -11.865 3.753 -6.883 1.00 0.00 N ATOM 279 CA MET A 646 -12.332 2.588 -6.142 1.00 0.00 C ATOM 280 C MET A 646 -12.206 2.835 -4.644 1.00 0.00 C ATOM 281 O MET A 646 -13.155 2.635 -3.885 1.00 0.00 O ATOM 282 CB MET A 646 -11.497 1.360 -6.513 1.00 0.00 C ATOM 283 CG MET A 646 -11.698 1.019 -7.990 1.00 0.00 C ATOM 284 SD MET A 646 -10.824 -0.521 -8.367 1.00 0.00 S ATOM 285 CE MET A 646 -10.951 -0.424 -10.168 1.00 0.00 C ATOM 0 H MET A 646 -11.014 3.603 -7.425 1.00 0.00 H new ATOM 0 HA MET A 646 -13.377 2.413 -6.398 1.00 0.00 H new ATOM 0 HB2 MET A 646 -10.443 1.554 -6.316 1.00 0.00 H new ATOM 0 HB3 MET A 646 -11.787 0.512 -5.893 1.00 0.00 H new ATOM 0 HG2 MET A 646 -12.760 0.912 -8.210 1.00 0.00 H new ATOM 0 HG3 MET A 646 -11.322 1.828 -8.617 1.00 0.00 H new ATOM 0 HE1 MET A 646 -10.021 -0.772 -10.618 1.00 0.00 H new ATOM 0 HE2 MET A 646 -11.775 -1.050 -10.509 1.00 0.00 H new ATOM 0 HE3 MET A 646 -11.133 0.609 -10.465 1.00 0.00 H new ATOM 295 N LEU A 647 -11.023 3.278 -4.229 1.00 0.00 N ATOM 296 CA LEU A 647 -10.777 3.555 -2.822 1.00 0.00 C ATOM 297 C LEU A 647 -11.575 4.774 -2.376 1.00 0.00 C ATOM 298 O LEU A 647 -12.226 4.754 -1.332 1.00 0.00 O ATOM 299 CB LEU A 647 -9.284 3.801 -2.600 1.00 0.00 C ATOM 300 CG LEU A 647 -8.489 2.593 -3.099 1.00 0.00 C ATOM 301 CD1 LEU A 647 -7.000 2.819 -2.838 1.00 0.00 C ATOM 302 CD2 LEU A 647 -8.950 1.338 -2.355 1.00 0.00 C ATOM 0 H LEU A 647 -10.227 3.451 -4.843 1.00 0.00 H new ATOM 0 HA LEU A 647 -11.093 2.695 -2.231 1.00 0.00 H new ATOM 0 HB2 LEU A 647 -8.970 4.701 -3.129 1.00 0.00 H new ATOM 0 HB3 LEU A 647 -9.085 3.969 -1.541 1.00 0.00 H new ATOM 0 HG LEU A 647 -8.656 2.465 -4.169 1.00 0.00 H new ATOM 0 HD11 LEU A 647 -6.434 1.958 -3.194 1.00 0.00 H new ATOM 0 HD12 LEU A 647 -6.670 3.714 -3.366 1.00 0.00 H new ATOM 0 HD13 LEU A 647 -6.833 2.946 -1.768 1.00 0.00 H new ATOM 0 HD21 LEU A 647 -8.384 0.476 -2.710 1.00 0.00 H new ATOM 0 HD22 LEU A 647 -8.783 1.467 -1.286 1.00 0.00 H new ATOM 0 HD23 LEU A 647 -10.012 1.175 -2.539 1.00 0.00 H new ATOM 314 N THR A 648 -11.535 5.830 -3.184 1.00 0.00 N ATOM 315 CA THR A 648 -12.275 7.044 -2.867 1.00 0.00 C ATOM 316 C THR A 648 -13.751 6.717 -2.683 1.00 0.00 C ATOM 317 O THR A 648 -14.405 7.221 -1.770 1.00 0.00 O ATOM 318 CB THR A 648 -12.107 8.071 -3.989 1.00 0.00 C ATOM 319 OG1 THR A 648 -10.724 8.323 -4.194 1.00 0.00 O ATOM 320 CG2 THR A 648 -12.813 9.372 -3.604 1.00 0.00 C ATOM 0 H THR A 648 -11.004 5.869 -4.054 1.00 0.00 H new ATOM 0 HA THR A 648 -11.883 7.465 -1.941 1.00 0.00 H new ATOM 0 HB THR A 648 -12.546 7.681 -4.907 1.00 0.00 H new ATOM 0 HG1 THR A 648 -10.279 7.497 -4.477 1.00 0.00 H new ATOM 0 HG21 THR A 648 -12.692 10.102 -4.404 1.00 0.00 H new ATOM 0 HG22 THR A 648 -13.874 9.178 -3.447 1.00 0.00 H new ATOM 0 HG23 THR A 648 -12.377 9.765 -2.686 1.00 0.00 H new ATOM 328 N ALA A 649 -14.263 5.863 -3.562 1.00 0.00 N ATOM 329 CA ALA A 649 -15.660 5.456 -3.503 1.00 0.00 C ATOM 330 C ALA A 649 -15.916 4.588 -2.275 1.00 0.00 C ATOM 331 O ALA A 649 -17.044 4.506 -1.786 1.00 0.00 O ATOM 332 CB ALA A 649 -16.030 4.678 -4.767 1.00 0.00 C ATOM 0 H ALA A 649 -13.731 5.440 -4.323 1.00 0.00 H new ATOM 0 HA ALA A 649 -16.277 6.352 -3.434 1.00 0.00 H new ATOM 0 HB1 ALA A 649 -17.076 4.377 -4.716 1.00 0.00 H new ATOM 0 HB2 ALA A 649 -15.877 5.310 -5.641 1.00 0.00 H new ATOM 0 HB3 ALA A 649 -15.401 3.791 -4.846 1.00 0.00 H new ATOM 338 N ALA A 650 -14.866 3.932 -1.788 1.00 0.00 N ATOM 339 CA ALA A 650 -14.997 3.063 -0.622 1.00 0.00 C ATOM 340 C ALA A 650 -15.204 3.884 0.649 1.00 0.00 C ATOM 341 O ALA A 650 -15.461 3.331 1.719 1.00 0.00 O ATOM 342 CB ALA A 650 -13.744 2.196 -0.475 1.00 0.00 C ATOM 0 H ALA A 650 -13.925 3.984 -2.177 1.00 0.00 H new ATOM 0 HA ALA A 650 -15.868 2.424 -0.768 1.00 0.00 H new ATOM 0 HB1 ALA A 650 -13.849 1.550 0.397 1.00 0.00 H new ATOM 0 HB2 ALA A 650 -13.619 1.583 -1.368 1.00 0.00 H new ATOM 0 HB3 ALA A 650 -12.871 2.837 -0.349 1.00 0.00 H new ATOM 348 N GLY A 651 -15.104 5.203 0.525 1.00 0.00 N ATOM 349 CA GLY A 651 -15.297 6.086 1.671 1.00 0.00 C ATOM 350 C GLY A 651 -13.969 6.477 2.314 1.00 0.00 C ATOM 351 O GLY A 651 -13.917 7.393 3.135 1.00 0.00 O ATOM 0 H GLY A 651 -14.892 5.682 -0.350 1.00 0.00 H new ATOM 0 HA2 GLY A 651 -15.825 6.985 1.353 1.00 0.00 H new ATOM 0 HA3 GLY A 651 -15.927 5.591 2.410 1.00 0.00 H new ATOM 355 N PHE A 652 -12.898 5.786 1.940 1.00 0.00 N ATOM 356 CA PHE A 652 -11.583 6.089 2.498 1.00 0.00 C ATOM 357 C PHE A 652 -10.805 7.018 1.573 1.00 0.00 C ATOM 358 O PHE A 652 -10.875 6.896 0.350 1.00 0.00 O ATOM 359 CB PHE A 652 -10.781 4.805 2.717 1.00 0.00 C ATOM 360 CG PHE A 652 -11.440 3.965 3.785 1.00 0.00 C ATOM 361 CD1 PHE A 652 -11.346 4.343 5.130 1.00 0.00 C ATOM 362 CD2 PHE A 652 -12.144 2.808 3.431 1.00 0.00 C ATOM 363 CE1 PHE A 652 -11.954 3.563 6.120 1.00 0.00 C ATOM 364 CE2 PHE A 652 -12.751 2.028 4.422 1.00 0.00 C ATOM 365 CZ PHE A 652 -12.657 2.406 5.766 1.00 0.00 C ATOM 0 H PHE A 652 -12.911 5.023 1.263 1.00 0.00 H new ATOM 0 HA PHE A 652 -11.735 6.585 3.457 1.00 0.00 H new ATOM 0 HB2 PHE A 652 -10.718 4.242 1.786 1.00 0.00 H new ATOM 0 HB3 PHE A 652 -9.760 5.049 3.012 1.00 0.00 H new ATOM 0 HD1 PHE A 652 -10.804 5.236 5.403 1.00 0.00 H new ATOM 0 HD2 PHE A 652 -12.219 2.517 2.394 1.00 0.00 H new ATOM 0 HE1 PHE A 652 -11.881 3.854 7.157 1.00 0.00 H new ATOM 0 HE2 PHE A 652 -13.292 1.134 4.149 1.00 0.00 H new ATOM 0 HZ PHE A 652 -13.127 1.805 6.530 1.00 0.00 H new ATOM 375 N LYS A 653 -10.059 7.944 2.167 1.00 0.00 N ATOM 376 CA LYS A 653 -9.263 8.888 1.391 1.00 0.00 C ATOM 377 C LYS A 653 -7.849 8.350 1.198 1.00 0.00 C ATOM 378 O LYS A 653 -7.230 7.855 2.140 1.00 0.00 O ATOM 379 CB LYS A 653 -9.208 10.235 2.114 1.00 0.00 C ATOM 380 CG LYS A 653 -8.583 11.285 1.195 1.00 0.00 C ATOM 381 CD LYS A 653 -8.480 12.616 1.942 1.00 0.00 C ATOM 382 CE LYS A 653 -8.003 13.706 0.981 1.00 0.00 C ATOM 383 NZ LYS A 653 -7.245 14.739 1.741 1.00 0.00 N ATOM 0 H LYS A 653 -9.989 8.061 3.178 1.00 0.00 H new ATOM 0 HA LYS A 653 -9.727 9.021 0.414 1.00 0.00 H new ATOM 0 HB2 LYS A 653 -10.212 10.544 2.406 1.00 0.00 H new ATOM 0 HB3 LYS A 653 -8.624 10.144 3.030 1.00 0.00 H new ATOM 0 HG2 LYS A 653 -7.594 10.959 0.872 1.00 0.00 H new ATOM 0 HG3 LYS A 653 -9.189 11.405 0.297 1.00 0.00 H new ATOM 0 HD2 LYS A 653 -9.449 12.885 2.362 1.00 0.00 H new ATOM 0 HD3 LYS A 653 -7.786 12.524 2.777 1.00 0.00 H new ATOM 0 HE2 LYS A 653 -7.371 13.272 0.206 1.00 0.00 H new ATOM 0 HE3 LYS A 653 -8.856 14.162 0.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 653 -6.920 15.481 1.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 653 -7.862 15.160 2.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 653 -6.423 14.298 2.201 1.00 0.00 H new ATOM 397 N VAL A 654 -7.344 8.438 -0.030 1.00 0.00 N ATOM 398 CA VAL A 654 -6.005 7.941 -0.326 1.00 0.00 C ATOM 399 C VAL A 654 -5.128 9.042 -0.912 1.00 0.00 C ATOM 400 O VAL A 654 -5.622 9.985 -1.531 1.00 0.00 O ATOM 401 CB VAL A 654 -6.091 6.784 -1.322 1.00 0.00 C ATOM 402 CG1 VAL A 654 -7.169 5.797 -0.871 1.00 0.00 C ATOM 403 CG2 VAL A 654 -6.445 7.330 -2.707 1.00 0.00 C ATOM 0 H VAL A 654 -7.835 8.844 -0.827 1.00 0.00 H new ATOM 0 HA VAL A 654 -5.558 7.598 0.607 1.00 0.00 H new ATOM 0 HB VAL A 654 -5.130 6.272 -1.367 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -7.229 4.973 -1.582 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -6.916 5.407 0.115 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -8.132 6.306 -0.824 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -6.507 6.506 -3.418 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -7.406 7.843 -2.661 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -5.675 8.031 -3.030 1.00 0.00 H new ATOM 413 N ILE A 655 -3.820 8.904 -0.720 1.00 0.00 N ATOM 414 CA ILE A 655 -2.867 9.879 -1.238 1.00 0.00 C ATOM 415 C ILE A 655 -2.084 9.268 -2.396 1.00 0.00 C ATOM 416 O ILE A 655 -1.648 8.119 -2.322 1.00 0.00 O ATOM 417 CB ILE A 655 -1.905 10.309 -0.129 1.00 0.00 C ATOM 418 CG1 ILE A 655 -2.707 10.845 1.060 1.00 0.00 C ATOM 419 CG2 ILE A 655 -0.981 11.409 -0.655 1.00 0.00 C ATOM 420 CD1 ILE A 655 -1.765 11.096 2.239 1.00 0.00 C ATOM 0 H ILE A 655 -3.397 8.128 -0.211 1.00 0.00 H new ATOM 0 HA ILE A 655 -3.410 10.754 -1.595 1.00 0.00 H new ATOM 0 HB ILE A 655 -1.309 9.453 0.188 1.00 0.00 H new ATOM 0 HG12 ILE A 655 -3.214 11.769 0.783 1.00 0.00 H new ATOM 0 HG13 ILE A 655 -3.479 10.130 1.344 1.00 0.00 H new ATOM 0 HG21 ILE A 655 -0.295 11.716 0.134 1.00 0.00 H new ATOM 0 HG22 ILE A 655 -0.411 11.031 -1.504 1.00 0.00 H new ATOM 0 HG23 ILE A 655 -1.577 12.265 -0.971 1.00 0.00 H new ATOM 0 HD11 ILE A 655 -2.336 11.478 3.086 1.00 0.00 H new ATOM 0 HD12 ILE A 655 -1.278 10.162 2.521 1.00 0.00 H new ATOM 0 HD13 ILE A 655 -1.009 11.827 1.952 1.00 0.00 H new ATOM 432 N TRP A 656 -1.922 10.031 -3.473 1.00 0.00 N ATOM 433 CA TRP A 656 -1.205 9.532 -4.643 1.00 0.00 C ATOM 434 C TRP A 656 0.275 9.898 -4.582 1.00 0.00 C ATOM 435 O TRP A 656 0.633 11.066 -4.432 1.00 0.00 O ATOM 436 CB TRP A 656 -1.825 10.112 -5.917 1.00 0.00 C ATOM 437 CG TRP A 656 -1.029 9.686 -7.112 1.00 0.00 C ATOM 438 CD1 TRP A 656 -0.350 8.520 -7.226 1.00 0.00 C ATOM 439 CD2 TRP A 656 -0.827 10.399 -8.367 1.00 0.00 C ATOM 440 NE1 TRP A 656 0.259 8.476 -8.468 1.00 0.00 N ATOM 441 CE2 TRP A 656 -0.006 9.611 -9.208 1.00 0.00 C ATOM 442 CE3 TRP A 656 -1.270 11.643 -8.851 1.00 0.00 C ATOM 443 CZ2 TRP A 656 0.360 10.041 -10.485 1.00 0.00 C ATOM 444 CZ3 TRP A 656 -0.904 12.079 -10.135 1.00 0.00 C ATOM 445 CH2 TRP A 656 -0.090 11.280 -10.950 1.00 0.00 C ATOM 0 H TRP A 656 -2.272 10.985 -3.561 1.00 0.00 H new ATOM 0 HA TRP A 656 -1.289 8.445 -4.653 1.00 0.00 H new ATOM 0 HB2 TRP A 656 -2.856 9.773 -6.017 1.00 0.00 H new ATOM 0 HB3 TRP A 656 -1.851 11.200 -5.856 1.00 0.00 H new ATOM 0 HD1 TRP A 656 -0.293 7.750 -6.471 1.00 0.00 H new ATOM 0 HE1 TRP A 656 0.833 7.700 -8.797 1.00 0.00 H new ATOM 0 HE3 TRP A 656 -1.896 12.267 -8.231 1.00 0.00 H new ATOM 0 HZ2 TRP A 656 0.986 9.421 -11.109 1.00 0.00 H new ATOM 0 HZ3 TRP A 656 -1.252 13.035 -10.497 1.00 0.00 H new ATOM 0 HH2 TRP A 656 0.189 11.621 -11.936 1.00 0.00 H new ATOM 456 N LEU A 657 1.128 8.885 -4.710 1.00 0.00 N ATOM 457 CA LEU A 657 2.571 9.097 -4.680 1.00 0.00 C ATOM 458 C LEU A 657 3.195 8.745 -6.026 1.00 0.00 C ATOM 459 O LEU A 657 2.777 7.789 -6.685 1.00 0.00 O ATOM 460 CB LEU A 657 3.212 8.240 -3.585 1.00 0.00 C ATOM 461 CG LEU A 657 3.092 8.948 -2.236 1.00 0.00 C ATOM 462 CD1 LEU A 657 4.043 10.148 -2.204 1.00 0.00 C ATOM 463 CD2 LEU A 657 1.653 9.429 -2.035 1.00 0.00 C ATOM 0 H LEU A 657 0.846 7.913 -4.835 1.00 0.00 H new ATOM 0 HA LEU A 657 2.753 10.151 -4.468 1.00 0.00 H new ATOM 0 HB2 LEU A 657 2.724 7.267 -3.540 1.00 0.00 H new ATOM 0 HB3 LEU A 657 4.261 8.060 -3.819 1.00 0.00 H new ATOM 0 HG LEU A 657 3.355 8.254 -1.437 1.00 0.00 H new ATOM 0 HD11 LEU A 657 3.958 10.654 -1.242 1.00 0.00 H new ATOM 0 HD12 LEU A 657 5.068 9.804 -2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 657 3.781 10.841 -3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 657 1.569 9.934 -1.073 1.00 0.00 H new ATOM 0 HD22 LEU A 657 1.386 10.122 -2.833 1.00 0.00 H new ATOM 0 HD23 LEU A 657 0.977 8.574 -2.056 1.00 0.00 H new ATOM 475 N VAL A 658 4.203 9.517 -6.421 1.00 0.00 N ATOM 476 CA VAL A 658 4.888 9.274 -7.683 1.00 0.00 C ATOM 477 C VAL A 658 6.174 8.491 -7.441 1.00 0.00 C ATOM 478 O VAL A 658 6.716 7.875 -8.357 1.00 0.00 O ATOM 479 CB VAL A 658 5.219 10.605 -8.362 1.00 0.00 C ATOM 480 CG1 VAL A 658 6.053 10.344 -9.618 1.00 0.00 C ATOM 481 CG2 VAL A 658 3.922 11.321 -8.750 1.00 0.00 C ATOM 0 H VAL A 658 4.561 10.310 -5.889 1.00 0.00 H new ATOM 0 HA VAL A 658 4.232 8.692 -8.330 1.00 0.00 H new ATOM 0 HB VAL A 658 5.785 11.231 -7.673 1.00 0.00 H new ATOM 0 HG11 VAL A 658 6.289 11.292 -10.102 1.00 0.00 H new ATOM 0 HG12 VAL A 658 6.978 9.838 -9.342 1.00 0.00 H new ATOM 0 HG13 VAL A 658 5.487 9.716 -10.306 1.00 0.00 H new ATOM 0 HG21 VAL A 658 4.160 12.269 -9.233 1.00 0.00 H new ATOM 0 HG22 VAL A 658 3.353 10.696 -9.438 1.00 0.00 H new ATOM 0 HG23 VAL A 658 3.329 11.509 -7.855 1.00 0.00 H new ATOM 491 N ASP A 659 6.646 8.512 -6.195 1.00 0.00 N ATOM 492 CA ASP A 659 7.867 7.797 -5.827 1.00 0.00 C ATOM 493 C ASP A 659 7.783 7.304 -4.384 1.00 0.00 C ATOM 494 O ASP A 659 7.123 7.918 -3.545 1.00 0.00 O ATOM 495 CB ASP A 659 9.085 8.714 -5.974 1.00 0.00 C ATOM 496 CG ASP A 659 9.384 8.976 -7.447 1.00 0.00 C ATOM 497 OD1 ASP A 659 8.862 8.253 -8.277 1.00 0.00 O ATOM 498 OD2 ASP A 659 10.134 9.897 -7.722 1.00 0.00 O ATOM 0 H ASP A 659 6.203 9.015 -5.426 1.00 0.00 H new ATOM 0 HA ASP A 659 7.973 6.942 -6.495 1.00 0.00 H new ATOM 0 HB2 ASP A 659 8.901 9.658 -5.461 1.00 0.00 H new ATOM 0 HB3 ASP A 659 9.952 8.256 -5.497 1.00 0.00 H new ATOM 503 N GLY A 660 8.453 6.190 -4.106 1.00 0.00 N ATOM 504 CA GLY A 660 8.447 5.615 -2.765 1.00 0.00 C ATOM 505 C GLY A 660 9.135 6.529 -1.754 1.00 0.00 C ATOM 506 O GLY A 660 8.682 6.659 -0.616 1.00 0.00 O ATOM 0 H GLY A 660 9.005 5.669 -4.788 1.00 0.00 H new ATOM 0 HA2 GLY A 660 7.419 5.435 -2.451 1.00 0.00 H new ATOM 0 HA3 GLY A 660 8.949 4.648 -2.782 1.00 0.00 H new ATOM 510 N SER A 661 10.235 7.151 -2.168 1.00 0.00 N ATOM 511 CA SER A 661 10.978 8.037 -1.275 1.00 0.00 C ATOM 512 C SER A 661 10.087 9.166 -0.768 1.00 0.00 C ATOM 513 O SER A 661 10.151 9.541 0.402 1.00 0.00 O ATOM 514 CB SER A 661 12.182 8.628 -2.010 1.00 0.00 C ATOM 515 OG SER A 661 13.008 9.318 -1.081 1.00 0.00 O ATOM 0 H SER A 661 10.629 7.061 -3.105 1.00 0.00 H new ATOM 0 HA SER A 661 11.321 7.452 -0.422 1.00 0.00 H new ATOM 0 HB2 SER A 661 12.749 7.836 -2.499 1.00 0.00 H new ATOM 0 HB3 SER A 661 11.847 9.309 -2.792 1.00 0.00 H new ATOM 0 HG SER A 661 13.781 9.697 -1.549 1.00 0.00 H new ATOM 521 N THR A 662 9.256 9.701 -1.653 1.00 0.00 N ATOM 522 CA THR A 662 8.357 10.784 -1.279 1.00 0.00 C ATOM 523 C THR A 662 7.345 10.304 -0.245 1.00 0.00 C ATOM 524 O THR A 662 6.996 11.032 0.684 1.00 0.00 O ATOM 525 CB THR A 662 7.620 11.300 -2.517 1.00 0.00 C ATOM 526 OG1 THR A 662 8.566 11.635 -3.522 1.00 0.00 O ATOM 527 CG2 THR A 662 6.802 12.539 -2.148 1.00 0.00 C ATOM 0 H THR A 662 9.186 9.406 -2.627 1.00 0.00 H new ATOM 0 HA THR A 662 8.948 11.591 -0.846 1.00 0.00 H new ATOM 0 HB THR A 662 6.950 10.526 -2.891 1.00 0.00 H new ATOM 0 HG1 THR A 662 8.096 11.964 -4.317 1.00 0.00 H new ATOM 0 HG21 THR A 662 6.278 12.905 -3.031 1.00 0.00 H new ATOM 0 HG22 THR A 662 6.077 12.280 -1.377 1.00 0.00 H new ATOM 0 HG23 THR A 662 7.468 13.316 -1.773 1.00 0.00 H new ATOM 535 N ALA A 663 6.873 9.075 -0.423 1.00 0.00 N ATOM 536 CA ALA A 663 5.892 8.498 0.491 1.00 0.00 C ATOM 537 C ALA A 663 6.461 8.343 1.895 1.00 0.00 C ATOM 538 O ALA A 663 5.811 8.692 2.873 1.00 0.00 O ATOM 539 CB ALA A 663 5.439 7.132 -0.027 1.00 0.00 C ATOM 0 H ALA A 663 7.152 8.461 -1.188 1.00 0.00 H new ATOM 0 HA ALA A 663 5.042 9.178 0.540 1.00 0.00 H new ATOM 0 HB1 ALA A 663 4.707 6.707 0.660 1.00 0.00 H new ATOM 0 HB2 ALA A 663 4.988 7.248 -1.012 1.00 0.00 H new ATOM 0 HB3 ALA A 663 6.299 6.466 -0.098 1.00 0.00 H new ATOM 545 N LEU A 664 7.670 7.810 1.992 1.00 0.00 N ATOM 546 CA LEU A 664 8.297 7.611 3.295 1.00 0.00 C ATOM 547 C LEU A 664 8.447 8.935 4.042 1.00 0.00 C ATOM 548 O LEU A 664 8.198 9.010 5.247 1.00 0.00 O ATOM 549 CB LEU A 664 9.667 6.957 3.120 1.00 0.00 C ATOM 550 CG LEU A 664 9.494 5.598 2.439 1.00 0.00 C ATOM 551 CD1 LEU A 664 10.848 4.889 2.358 1.00 0.00 C ATOM 552 CD2 LEU A 664 8.521 4.742 3.253 1.00 0.00 C ATOM 0 H LEU A 664 8.233 7.510 1.196 1.00 0.00 H new ATOM 0 HA LEU A 664 7.654 6.957 3.884 1.00 0.00 H new ATOM 0 HB2 LEU A 664 10.315 7.597 2.521 1.00 0.00 H new ATOM 0 HB3 LEU A 664 10.150 6.832 4.089 1.00 0.00 H new ATOM 0 HG LEU A 664 9.100 5.744 1.433 1.00 0.00 H new ATOM 0 HD11 LEU A 664 10.723 3.921 1.873 1.00 0.00 H new ATOM 0 HD12 LEU A 664 11.543 5.498 1.780 1.00 0.00 H new ATOM 0 HD13 LEU A 664 11.243 4.743 3.363 1.00 0.00 H new ATOM 0 HD21 LEU A 664 8.396 3.773 2.769 1.00 0.00 H new ATOM 0 HD22 LEU A 664 8.917 4.597 4.258 1.00 0.00 H new ATOM 0 HD23 LEU A 664 7.556 5.245 3.312 1.00 0.00 H new ATOM 564 N ASP A 665 8.853 9.978 3.323 1.00 0.00 N ATOM 565 CA ASP A 665 9.030 11.291 3.937 1.00 0.00 C ATOM 566 C ASP A 665 7.705 11.820 4.476 1.00 0.00 C ATOM 567 O ASP A 665 7.655 12.411 5.554 1.00 0.00 O ATOM 568 CB ASP A 665 9.598 12.275 2.913 1.00 0.00 C ATOM 569 CG ASP A 665 11.032 11.893 2.565 1.00 0.00 C ATOM 570 OD1 ASP A 665 11.590 11.067 3.269 1.00 0.00 O ATOM 571 OD2 ASP A 665 11.551 12.434 1.603 1.00 0.00 O ATOM 0 H ASP A 665 9.064 9.941 2.326 1.00 0.00 H new ATOM 0 HA ASP A 665 9.728 11.188 4.768 1.00 0.00 H new ATOM 0 HB2 ASP A 665 8.983 12.272 2.013 1.00 0.00 H new ATOM 0 HB3 ASP A 665 9.570 13.288 3.315 1.00 0.00 H new ATOM 576 N GLN A 666 6.634 11.603 3.720 1.00 0.00 N ATOM 577 CA GLN A 666 5.313 12.062 4.134 1.00 0.00 C ATOM 578 C GLN A 666 4.658 11.047 5.065 1.00 0.00 C ATOM 579 O GLN A 666 4.046 11.408 6.068 1.00 0.00 O ATOM 580 CB GLN A 666 4.423 12.262 2.905 1.00 0.00 C ATOM 581 CG GLN A 666 4.997 13.371 2.022 1.00 0.00 C ATOM 582 CD GLN A 666 4.060 13.634 0.847 1.00 0.00 C ATOM 583 OE1 GLN A 666 4.312 14.527 0.038 1.00 0.00 O ATOM 584 NE2 GLN A 666 2.990 12.901 0.701 1.00 0.00 N ATOM 0 H GLN A 666 6.654 11.116 2.824 1.00 0.00 H new ATOM 0 HA GLN A 666 5.430 13.007 4.664 1.00 0.00 H new ATOM 0 HB2 GLN A 666 4.355 11.333 2.339 1.00 0.00 H new ATOM 0 HB3 GLN A 666 3.411 12.520 3.216 1.00 0.00 H new ATOM 0 HG2 GLN A 666 5.128 14.282 2.606 1.00 0.00 H new ATOM 0 HG3 GLN A 666 5.982 13.083 1.656 1.00 0.00 H new ATOM 0 HE21 GLN A 666 2.783 12.162 1.372 1.00 0.00 H new ATOM 0 HE22 GLN A 666 2.361 13.068 -0.084 1.00 0.00 H new ATOM 593 N LEU A 667 4.788 9.776 4.705 1.00 0.00 N ATOM 594 CA LEU A 667 4.199 8.689 5.481 1.00 0.00 C ATOM 595 C LEU A 667 4.442 8.851 6.975 1.00 0.00 C ATOM 596 O LEU A 667 3.533 8.651 7.781 1.00 0.00 O ATOM 597 CB LEU A 667 4.782 7.351 5.032 1.00 0.00 C ATOM 598 CG LEU A 667 4.089 6.229 5.802 1.00 0.00 C ATOM 599 CD1 LEU A 667 4.245 4.915 5.034 1.00 0.00 C ATOM 600 CD2 LEU A 667 4.714 6.083 7.197 1.00 0.00 C ATOM 0 H LEU A 667 5.299 9.471 3.876 1.00 0.00 H new ATOM 0 HA LEU A 667 3.124 8.718 5.304 1.00 0.00 H new ATOM 0 HB2 LEU A 667 4.638 7.218 3.960 1.00 0.00 H new ATOM 0 HB3 LEU A 667 5.856 7.327 5.215 1.00 0.00 H new ATOM 0 HG LEU A 667 3.031 6.470 5.909 1.00 0.00 H new ATOM 0 HD11 LEU A 667 3.751 4.113 5.582 1.00 0.00 H new ATOM 0 HD12 LEU A 667 3.791 5.014 4.048 1.00 0.00 H new ATOM 0 HD13 LEU A 667 5.304 4.681 4.924 1.00 0.00 H new ATOM 0 HD21 LEU A 667 4.213 5.280 7.738 1.00 0.00 H new ATOM 0 HD22 LEU A 667 5.774 5.847 7.098 1.00 0.00 H new ATOM 0 HD23 LEU A 667 4.600 7.017 7.746 1.00 0.00 H new ATOM 612 N ASP A 668 5.665 9.197 7.348 1.00 0.00 N ATOM 613 CA ASP A 668 5.989 9.355 8.759 1.00 0.00 C ATOM 614 C ASP A 668 5.094 10.410 9.399 1.00 0.00 C ATOM 615 O ASP A 668 4.720 10.296 10.566 1.00 0.00 O ATOM 616 CB ASP A 668 7.457 9.754 8.919 1.00 0.00 C ATOM 617 CG ASP A 668 8.358 8.592 8.515 1.00 0.00 C ATOM 618 OD1 ASP A 668 7.837 7.505 8.322 1.00 0.00 O ATOM 619 OD2 ASP A 668 9.553 8.805 8.402 1.00 0.00 O ATOM 0 H ASP A 668 6.438 9.371 6.706 1.00 0.00 H new ATOM 0 HA ASP A 668 5.820 8.402 9.260 1.00 0.00 H new ATOM 0 HB2 ASP A 668 7.675 10.626 8.302 1.00 0.00 H new ATOM 0 HB3 ASP A 668 7.655 10.037 9.953 1.00 0.00 H new ATOM 624 N LEU A 669 4.760 11.438 8.631 1.00 0.00 N ATOM 625 CA LEU A 669 3.913 12.511 9.136 1.00 0.00 C ATOM 626 C LEU A 669 2.441 12.093 9.206 1.00 0.00 C ATOM 627 O LEU A 669 1.732 12.473 10.137 1.00 0.00 O ATOM 628 CB LEU A 669 4.047 13.740 8.237 1.00 0.00 C ATOM 629 CG LEU A 669 5.509 14.184 8.195 1.00 0.00 C ATOM 630 CD1 LEU A 669 5.626 15.484 7.397 1.00 0.00 C ATOM 631 CD2 LEU A 669 6.011 14.415 9.622 1.00 0.00 C ATOM 0 H LEU A 669 5.060 11.552 7.663 1.00 0.00 H new ATOM 0 HA LEU A 669 4.245 12.744 10.148 1.00 0.00 H new ATOM 0 HB2 LEU A 669 3.697 13.508 7.231 1.00 0.00 H new ATOM 0 HB3 LEU A 669 3.421 14.549 8.613 1.00 0.00 H new ATOM 0 HG LEU A 669 6.110 13.410 7.717 1.00 0.00 H new ATOM 0 HD11 LEU A 669 6.669 15.800 7.367 1.00 0.00 H new ATOM 0 HD12 LEU A 669 5.267 15.321 6.381 1.00 0.00 H new ATOM 0 HD13 LEU A 669 5.025 16.259 7.874 1.00 0.00 H new ATOM 0 HD21 LEU A 669 7.054 14.732 9.594 1.00 0.00 H new ATOM 0 HD22 LEU A 669 5.409 15.189 10.099 1.00 0.00 H new ATOM 0 HD23 LEU A 669 5.928 13.489 10.191 1.00 0.00 H new ATOM 643 N LEU A 670 1.974 11.332 8.215 1.00 0.00 N ATOM 644 CA LEU A 670 0.571 10.913 8.198 1.00 0.00 C ATOM 645 C LEU A 670 0.312 9.767 9.173 1.00 0.00 C ATOM 646 O LEU A 670 -0.711 9.747 9.858 1.00 0.00 O ATOM 647 CB LEU A 670 0.149 10.471 6.791 1.00 0.00 C ATOM 648 CG LEU A 670 1.132 10.989 5.735 1.00 0.00 C ATOM 649 CD1 LEU A 670 0.577 10.681 4.344 1.00 0.00 C ATOM 650 CD2 LEU A 670 1.317 12.507 5.864 1.00 0.00 C ATOM 0 H LEU A 670 2.532 10.999 7.429 1.00 0.00 H new ATOM 0 HA LEU A 670 -0.018 11.777 8.505 1.00 0.00 H new ATOM 0 HB2 LEU A 670 0.102 9.383 6.747 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -0.853 10.843 6.574 1.00 0.00 H new ATOM 0 HG LEU A 670 2.094 10.499 5.884 1.00 0.00 H new ATOM 0 HD11 LEU A 670 1.270 11.046 3.587 1.00 0.00 H new ATOM 0 HD12 LEU A 670 0.452 9.604 4.232 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -0.388 11.173 4.220 1.00 0.00 H new ATOM 0 HD21 LEU A 670 2.018 12.854 5.105 1.00 0.00 H new ATOM 0 HD22 LEU A 670 0.357 13.004 5.725 1.00 0.00 H new ATOM 0 HD23 LEU A 670 1.707 12.743 6.854 1.00 0.00 H new ATOM 662 N GLN A 671 1.228 8.806 9.220 1.00 0.00 N ATOM 663 CA GLN A 671 1.060 7.657 10.104 1.00 0.00 C ATOM 664 C GLN A 671 -0.234 6.921 9.760 1.00 0.00 C ATOM 665 O GLN A 671 -1.154 6.840 10.573 1.00 0.00 O ATOM 666 CB GLN A 671 1.018 8.118 11.562 1.00 0.00 C ATOM 667 CG GLN A 671 2.262 8.953 11.869 1.00 0.00 C ATOM 668 CD GLN A 671 3.271 8.117 12.650 1.00 0.00 C ATOM 669 OE1 GLN A 671 2.886 7.292 13.478 1.00 0.00 O ATOM 670 NE2 GLN A 671 4.548 8.283 12.434 1.00 0.00 N ATOM 0 H GLN A 671 2.084 8.798 8.665 1.00 0.00 H new ATOM 0 HA GLN A 671 1.905 6.982 9.968 1.00 0.00 H new ATOM 0 HB2 GLN A 671 0.118 8.706 11.743 1.00 0.00 H new ATOM 0 HB3 GLN A 671 0.973 7.255 12.226 1.00 0.00 H new ATOM 0 HG2 GLN A 671 2.711 9.307 10.941 1.00 0.00 H new ATOM 0 HG3 GLN A 671 1.985 9.836 12.445 1.00 0.00 H new ATOM 0 HE21 GLN A 671 4.864 8.967 11.747 1.00 0.00 H new ATOM 0 HE22 GLN A 671 5.229 7.728 12.952 1.00 0.00 H new ATOM 679 N PRO A 672 -0.310 6.400 8.566 1.00 0.00 N ATOM 680 CA PRO A 672 -1.504 5.662 8.069 1.00 0.00 C ATOM 681 C PRO A 672 -1.549 4.217 8.566 1.00 0.00 C ATOM 682 O PRO A 672 -0.563 3.697 9.087 1.00 0.00 O ATOM 683 CB PRO A 672 -1.356 5.719 6.551 1.00 0.00 C ATOM 684 CG PRO A 672 0.105 5.890 6.285 1.00 0.00 C ATOM 685 CD PRO A 672 0.750 6.460 7.553 1.00 0.00 C ATOM 0 HA PRO A 672 -2.434 6.103 8.428 1.00 0.00 H new ATOM 0 HB2 PRO A 672 -1.733 4.807 6.088 1.00 0.00 H new ATOM 0 HB3 PRO A 672 -1.928 6.548 6.134 1.00 0.00 H new ATOM 0 HG2 PRO A 672 0.559 4.935 6.022 1.00 0.00 H new ATOM 0 HG3 PRO A 672 0.263 6.562 5.441 1.00 0.00 H new ATOM 0 HD2 PRO A 672 1.619 5.875 7.853 1.00 0.00 H new ATOM 0 HD3 PRO A 672 1.093 7.483 7.398 1.00 0.00 H new ATOM 693 N ILE A 673 -2.710 3.585 8.417 1.00 0.00 N ATOM 694 CA ILE A 673 -2.889 2.208 8.869 1.00 0.00 C ATOM 695 C ILE A 673 -2.657 1.197 7.744 1.00 0.00 C ATOM 696 O ILE A 673 -2.416 0.019 8.010 1.00 0.00 O ATOM 697 CB ILE A 673 -4.300 2.034 9.430 1.00 0.00 C ATOM 698 CG1 ILE A 673 -4.466 2.918 10.670 1.00 0.00 C ATOM 699 CG2 ILE A 673 -4.526 0.571 9.810 1.00 0.00 C ATOM 700 CD1 ILE A 673 -5.925 2.888 11.131 1.00 0.00 C ATOM 0 H ILE A 673 -3.537 4.001 7.989 1.00 0.00 H new ATOM 0 HA ILE A 673 -2.147 2.015 9.644 1.00 0.00 H new ATOM 0 HB ILE A 673 -5.029 2.325 8.674 1.00 0.00 H new ATOM 0 HG12 ILE A 673 -3.814 2.566 11.470 1.00 0.00 H new ATOM 0 HG13 ILE A 673 -4.167 3.941 10.442 1.00 0.00 H new ATOM 0 HG21 ILE A 673 -5.533 0.450 10.210 1.00 0.00 H new ATOM 0 HG22 ILE A 673 -4.409 -0.057 8.927 1.00 0.00 H new ATOM 0 HG23 ILE A 673 -3.798 0.275 10.565 1.00 0.00 H new ATOM 0 HD11 ILE A 673 -6.041 3.518 12.013 1.00 0.00 H new ATOM 0 HD12 ILE A 673 -6.567 3.261 10.333 1.00 0.00 H new ATOM 0 HD13 ILE A 673 -6.208 1.864 11.376 1.00 0.00 H new ATOM 712 N VAL A 674 -2.733 1.645 6.494 1.00 0.00 N ATOM 713 CA VAL A 674 -2.529 0.734 5.369 1.00 0.00 C ATOM 714 C VAL A 674 -1.740 1.405 4.248 1.00 0.00 C ATOM 715 O VAL A 674 -1.920 2.594 3.960 1.00 0.00 O ATOM 716 CB VAL A 674 -3.878 0.259 4.833 1.00 0.00 C ATOM 717 CG1 VAL A 674 -4.653 1.454 4.283 1.00 0.00 C ATOM 718 CG2 VAL A 674 -3.649 -0.760 3.714 1.00 0.00 C ATOM 0 H VAL A 674 -2.930 2.612 6.236 1.00 0.00 H new ATOM 0 HA VAL A 674 -1.954 -0.120 5.728 1.00 0.00 H new ATOM 0 HB VAL A 674 -4.448 -0.206 5.637 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -5.616 1.118 3.900 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -4.813 2.181 5.079 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -4.084 1.917 3.477 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -4.610 -1.101 3.330 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -3.081 -0.295 2.909 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -3.093 -1.612 4.106 1.00 0.00 H new ATOM 728 N ILE A 675 -0.858 0.630 3.619 1.00 0.00 N ATOM 729 CA ILE A 675 -0.036 1.152 2.536 1.00 0.00 C ATOM 730 C ILE A 675 -0.285 0.388 1.239 1.00 0.00 C ATOM 731 O ILE A 675 -0.122 -0.831 1.185 1.00 0.00 O ATOM 732 CB ILE A 675 1.443 1.016 2.902 1.00 0.00 C ATOM 733 CG1 ILE A 675 1.653 1.421 4.362 1.00 0.00 C ATOM 734 CG2 ILE A 675 2.274 1.931 2.001 1.00 0.00 C ATOM 735 CD1 ILE A 675 1.136 2.841 4.580 1.00 0.00 C ATOM 0 H ILE A 675 -0.697 -0.353 3.840 1.00 0.00 H new ATOM 0 HA ILE A 675 -0.300 2.199 2.389 1.00 0.00 H new ATOM 0 HB ILE A 675 1.754 -0.020 2.765 1.00 0.00 H new ATOM 0 HG12 ILE A 675 1.130 0.728 5.021 1.00 0.00 H new ATOM 0 HG13 ILE A 675 2.711 1.366 4.616 1.00 0.00 H new ATOM 0 HG21 ILE A 675 3.329 1.836 2.260 1.00 0.00 H new ATOM 0 HG22 ILE A 675 2.129 1.645 0.959 1.00 0.00 H new ATOM 0 HG23 ILE A 675 1.958 2.965 2.141 1.00 0.00 H new ATOM 0 HD11 ILE A 675 1.287 3.127 5.621 1.00 0.00 H new ATOM 0 HD12 ILE A 675 1.679 3.529 3.932 1.00 0.00 H new ATOM 0 HD13 ILE A 675 0.073 2.882 4.343 1.00 0.00 H new ATOM 747 N LEU A 676 -0.642 1.117 0.189 1.00 0.00 N ATOM 748 CA LEU A 676 -0.867 0.502 -1.113 1.00 0.00 C ATOM 749 C LEU A 676 0.293 0.867 -2.030 1.00 0.00 C ATOM 750 O LEU A 676 0.628 2.043 -2.172 1.00 0.00 O ATOM 751 CB LEU A 676 -2.184 0.997 -1.712 1.00 0.00 C ATOM 752 CG LEU A 676 -3.308 0.773 -0.705 1.00 0.00 C ATOM 753 CD1 LEU A 676 -4.598 1.407 -1.227 1.00 0.00 C ATOM 754 CD2 LEU A 676 -3.527 -0.728 -0.506 1.00 0.00 C ATOM 0 H LEU A 676 -0.781 2.127 0.212 1.00 0.00 H new ATOM 0 HA LEU A 676 -0.927 -0.581 -1.003 1.00 0.00 H new ATOM 0 HB2 LEU A 676 -2.109 2.055 -1.962 1.00 0.00 H new ATOM 0 HB3 LEU A 676 -2.399 0.465 -2.639 1.00 0.00 H new ATOM 0 HG LEU A 676 -3.035 1.231 0.246 1.00 0.00 H new ATOM 0 HD11 LEU A 676 -5.400 1.246 -0.507 1.00 0.00 H new ATOM 0 HD12 LEU A 676 -4.446 2.477 -1.368 1.00 0.00 H new ATOM 0 HD13 LEU A 676 -4.869 0.950 -2.179 1.00 0.00 H new ATOM 0 HD21 LEU A 676 -4.330 -0.886 0.214 1.00 0.00 H new ATOM 0 HD22 LEU A 676 -3.797 -1.186 -1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 676 -2.610 -1.183 -0.132 1.00 0.00 H new ATOM 766 N MET A 677 0.922 -0.132 -2.632 1.00 0.00 N ATOM 767 CA MET A 677 2.063 0.144 -3.504 1.00 0.00 C ATOM 768 C MET A 677 2.088 -0.761 -4.732 1.00 0.00 C ATOM 769 O MET A 677 1.909 -1.975 -4.632 1.00 0.00 O ATOM 770 CB MET A 677 3.363 -0.049 -2.722 1.00 0.00 C ATOM 771 CG MET A 677 3.222 -1.252 -1.788 1.00 0.00 C ATOM 772 SD MET A 677 2.902 -0.677 -0.103 1.00 0.00 S ATOM 773 CE MET A 677 4.627 -0.409 0.375 1.00 0.00 C ATOM 0 H MET A 677 0.674 -1.117 -2.540 1.00 0.00 H new ATOM 0 HA MET A 677 1.965 1.174 -3.847 1.00 0.00 H new ATOM 0 HB2 MET A 677 4.194 -0.205 -3.410 1.00 0.00 H new ATOM 0 HB3 MET A 677 3.590 0.848 -2.146 1.00 0.00 H new ATOM 0 HG2 MET A 677 2.408 -1.893 -2.125 1.00 0.00 H new ATOM 0 HG3 MET A 677 4.131 -1.852 -1.812 1.00 0.00 H new ATOM 0 HE1 MET A 677 4.938 -1.190 1.069 1.00 0.00 H new ATOM 0 HE2 MET A 677 5.259 -0.439 -0.512 1.00 0.00 H new ATOM 0 HE3 MET A 677 4.724 0.564 0.857 1.00 0.00 H new ATOM 783 N ALA A 678 2.347 -0.153 -5.886 1.00 0.00 N ATOM 784 CA ALA A 678 2.441 -0.896 -7.137 1.00 0.00 C ATOM 785 C ALA A 678 3.678 -1.787 -7.113 1.00 0.00 C ATOM 786 O ALA A 678 4.656 -1.474 -6.433 1.00 0.00 O ATOM 787 CB ALA A 678 2.528 0.075 -8.316 1.00 0.00 C ATOM 0 H ALA A 678 2.495 0.852 -5.980 1.00 0.00 H new ATOM 0 HA ALA A 678 1.552 -1.516 -7.251 1.00 0.00 H new ATOM 0 HB1 ALA A 678 2.598 -0.488 -9.247 1.00 0.00 H new ATOM 0 HB2 ALA A 678 1.637 0.702 -8.337 1.00 0.00 H new ATOM 0 HB3 ALA A 678 3.411 0.704 -8.205 1.00 0.00 H new ATOM 793 N TRP A 679 3.646 -2.896 -7.848 1.00 0.00 N ATOM 794 CA TRP A 679 4.796 -3.793 -7.869 1.00 0.00 C ATOM 795 C TRP A 679 5.296 -4.063 -9.291 1.00 0.00 C ATOM 796 O TRP A 679 5.525 -5.214 -9.662 1.00 0.00 O ATOM 797 CB TRP A 679 4.429 -5.120 -7.204 1.00 0.00 C ATOM 798 CG TRP A 679 5.603 -6.044 -7.263 1.00 0.00 C ATOM 799 CD1 TRP A 679 5.674 -7.166 -8.016 1.00 0.00 C ATOM 800 CD2 TRP A 679 6.873 -5.946 -6.555 1.00 0.00 C ATOM 801 NE1 TRP A 679 6.906 -7.761 -7.817 1.00 0.00 N ATOM 802 CE2 TRP A 679 7.682 -7.047 -6.925 1.00 0.00 C ATOM 803 CE3 TRP A 679 7.397 -5.017 -5.639 1.00 0.00 C ATOM 804 CZ2 TRP A 679 8.964 -7.221 -6.403 1.00 0.00 C ATOM 805 CZ3 TRP A 679 8.688 -5.189 -5.111 1.00 0.00 C ATOM 806 CH2 TRP A 679 9.470 -6.288 -5.493 1.00 0.00 C ATOM 0 H TRP A 679 2.857 -3.190 -8.423 1.00 0.00 H new ATOM 0 HA TRP A 679 5.600 -3.302 -7.320 1.00 0.00 H new ATOM 0 HB2 TRP A 679 4.136 -4.952 -6.168 1.00 0.00 H new ATOM 0 HB3 TRP A 679 3.573 -5.568 -7.709 1.00 0.00 H new ATOM 0 HD1 TRP A 679 4.895 -7.536 -8.666 1.00 0.00 H new ATOM 0 HE1 TRP A 679 7.205 -8.623 -8.273 1.00 0.00 H new ATOM 0 HE3 TRP A 679 6.804 -4.166 -5.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 679 9.561 -8.070 -6.700 1.00 0.00 H new ATOM 0 HZ3 TRP A 679 9.080 -4.470 -4.407 1.00 0.00 H new ATOM 0 HH2 TRP A 679 10.462 -6.414 -5.085 1.00 0.00 H new ATOM 817 N PRO A 680 5.503 -3.035 -10.079 1.00 0.00 N ATOM 818 CA PRO A 680 6.026 -3.181 -11.466 1.00 0.00 C ATOM 819 C PRO A 680 7.555 -3.271 -11.478 1.00 0.00 C ATOM 820 O PRO A 680 8.228 -2.501 -10.794 1.00 0.00 O ATOM 821 CB PRO A 680 5.555 -1.899 -12.148 1.00 0.00 C ATOM 822 CG PRO A 680 5.516 -0.874 -11.061 1.00 0.00 C ATOM 823 CD PRO A 680 5.251 -1.622 -9.749 1.00 0.00 C ATOM 0 HA PRO A 680 5.676 -4.089 -11.958 1.00 0.00 H new ATOM 0 HB2 PRO A 680 6.237 -1.603 -12.945 1.00 0.00 H new ATOM 0 HB3 PRO A 680 4.573 -2.031 -12.601 1.00 0.00 H new ATOM 0 HG2 PRO A 680 6.459 -0.329 -11.011 1.00 0.00 H new ATOM 0 HG3 PRO A 680 4.733 -0.140 -11.251 1.00 0.00 H new ATOM 0 HD2 PRO A 680 5.910 -1.276 -8.953 1.00 0.00 H new ATOM 0 HD3 PRO A 680 4.228 -1.470 -9.404 1.00 0.00 H new ATOM 831 N PRO A 681 8.114 -4.186 -12.230 1.00 0.00 N ATOM 832 CA PRO A 681 9.592 -4.351 -12.302 1.00 0.00 C ATOM 833 C PRO A 681 10.334 -3.044 -12.598 1.00 0.00 C ATOM 834 O PRO A 681 11.320 -2.731 -11.930 1.00 0.00 O ATOM 835 CB PRO A 681 9.826 -5.354 -13.428 1.00 0.00 C ATOM 836 CG PRO A 681 8.504 -5.983 -13.745 1.00 0.00 C ATOM 837 CD PRO A 681 7.402 -5.156 -13.074 1.00 0.00 C ATOM 0 HA PRO A 681 9.979 -4.685 -11.339 1.00 0.00 H new ATOM 0 HB2 PRO A 681 10.236 -4.856 -14.307 1.00 0.00 H new ATOM 0 HB3 PRO A 681 10.549 -6.111 -13.124 1.00 0.00 H new ATOM 0 HG2 PRO A 681 8.349 -6.017 -14.823 1.00 0.00 H new ATOM 0 HG3 PRO A 681 8.478 -7.012 -13.386 1.00 0.00 H new ATOM 0 HD2 PRO A 681 6.780 -4.653 -13.814 1.00 0.00 H new ATOM 0 HD3 PRO A 681 6.742 -5.787 -12.479 1.00 0.00 H new ATOM 845 N PRO A 682 9.904 -2.279 -13.575 1.00 0.00 N ATOM 846 CA PRO A 682 10.583 -0.999 -13.924 1.00 0.00 C ATOM 847 C PRO A 682 10.454 0.016 -12.798 1.00 0.00 C ATOM 848 O PRO A 682 10.430 1.225 -13.034 1.00 0.00 O ATOM 849 CB PRO A 682 9.864 -0.518 -15.187 1.00 0.00 C ATOM 850 CG PRO A 682 8.539 -1.200 -15.173 1.00 0.00 C ATOM 851 CD PRO A 682 8.739 -2.528 -14.444 1.00 0.00 C ATOM 0 HA PRO A 682 11.654 -1.129 -14.082 1.00 0.00 H new ATOM 0 HB2 PRO A 682 9.748 0.566 -15.184 1.00 0.00 H new ATOM 0 HB3 PRO A 682 10.429 -0.776 -16.083 1.00 0.00 H new ATOM 0 HG2 PRO A 682 7.794 -0.588 -14.665 1.00 0.00 H new ATOM 0 HG3 PRO A 682 8.178 -1.366 -16.188 1.00 0.00 H new ATOM 0 HD2 PRO A 682 7.858 -2.803 -13.864 1.00 0.00 H new ATOM 0 HD3 PRO A 682 8.928 -3.343 -15.142 1.00 0.00 H new ATOM 859 N ASP A 683 10.364 -0.489 -11.573 1.00 0.00 N ATOM 860 CA ASP A 683 10.229 0.384 -10.411 1.00 0.00 C ATOM 861 C ASP A 683 10.830 -0.263 -9.167 1.00 0.00 C ATOM 862 O ASP A 683 10.109 -0.675 -8.257 1.00 0.00 O ATOM 863 CB ASP A 683 8.752 0.681 -10.159 1.00 0.00 C ATOM 864 CG ASP A 683 8.611 1.781 -9.112 1.00 0.00 C ATOM 865 OD1 ASP A 683 8.820 2.932 -9.459 1.00 0.00 O ATOM 866 OD2 ASP A 683 8.298 1.455 -7.978 1.00 0.00 O ATOM 0 H ASP A 683 10.382 -1.486 -11.359 1.00 0.00 H new ATOM 0 HA ASP A 683 10.766 1.310 -10.617 1.00 0.00 H new ATOM 0 HB2 ASP A 683 8.271 0.988 -11.088 1.00 0.00 H new ATOM 0 HB3 ASP A 683 8.244 -0.222 -9.820 1.00 0.00 H new ATOM 871 N GLN A 684 12.155 -0.334 -9.132 1.00 0.00 N ATOM 872 CA GLN A 684 12.858 -0.914 -7.992 1.00 0.00 C ATOM 873 C GLN A 684 12.605 -0.091 -6.732 1.00 0.00 C ATOM 874 O GLN A 684 13.130 -0.400 -5.662 1.00 0.00 O ATOM 875 CB GLN A 684 14.359 -0.963 -8.274 1.00 0.00 C ATOM 876 CG GLN A 684 14.890 0.463 -8.387 1.00 0.00 C ATOM 877 CD GLN A 684 16.394 0.446 -8.631 1.00 0.00 C ATOM 878 OE1 GLN A 684 16.965 -0.603 -8.930 1.00 0.00 O ATOM 879 NE2 GLN A 684 17.075 1.554 -8.520 1.00 0.00 N ATOM 0 H GLN A 684 12.764 0.002 -9.878 1.00 0.00 H new ATOM 0 HA GLN A 684 12.484 -1.926 -7.835 1.00 0.00 H new ATOM 0 HB2 GLN A 684 14.875 -1.495 -7.475 1.00 0.00 H new ATOM 0 HB3 GLN A 684 14.551 -1.511 -9.197 1.00 0.00 H new ATOM 0 HG2 GLN A 684 14.388 0.982 -9.203 1.00 0.00 H new ATOM 0 HG3 GLN A 684 14.669 1.015 -7.474 1.00 0.00 H new ATOM 0 HE21 GLN A 684 16.600 2.422 -8.272 1.00 0.00 H new ATOM 0 HE22 GLN A 684 18.082 1.552 -8.681 1.00 0.00 H new ATOM 888 N SER A 685 11.815 0.968 -6.871 1.00 0.00 N ATOM 889 CA SER A 685 11.517 1.845 -5.742 1.00 0.00 C ATOM 890 C SER A 685 10.800 1.089 -4.627 1.00 0.00 C ATOM 891 O SER A 685 10.988 1.386 -3.447 1.00 0.00 O ATOM 892 CB SER A 685 10.647 3.012 -6.207 1.00 0.00 C ATOM 893 OG SER A 685 11.287 3.672 -7.293 1.00 0.00 O ATOM 0 H SER A 685 11.371 1.240 -7.748 1.00 0.00 H new ATOM 0 HA SER A 685 12.462 2.221 -5.350 1.00 0.00 H new ATOM 0 HB2 SER A 685 9.666 2.649 -6.514 1.00 0.00 H new ATOM 0 HB3 SER A 685 10.486 3.710 -5.386 1.00 0.00 H new ATOM 0 HG SER A 685 10.731 4.420 -7.595 1.00 0.00 H new ATOM 899 N CYS A 686 9.979 0.114 -5.000 1.00 0.00 N ATOM 900 CA CYS A 686 9.245 -0.667 -4.009 1.00 0.00 C ATOM 901 C CYS A 686 10.215 -1.359 -3.054 1.00 0.00 C ATOM 902 O CYS A 686 9.880 -1.634 -1.901 1.00 0.00 O ATOM 903 CB CYS A 686 8.371 -1.711 -4.705 1.00 0.00 C ATOM 904 SG CYS A 686 7.068 -0.876 -5.644 1.00 0.00 S ATOM 0 H CYS A 686 9.805 -0.153 -5.969 1.00 0.00 H new ATOM 0 HA CYS A 686 8.608 0.008 -3.437 1.00 0.00 H new ATOM 0 HB2 CYS A 686 8.978 -2.324 -5.371 1.00 0.00 H new ATOM 0 HB3 CYS A 686 7.930 -2.382 -3.968 1.00 0.00 H new ATOM 0 HG CYS A 686 6.029 -1.653 -5.730 1.00 0.00 H new ATOM 910 N LEU A 687 11.420 -1.633 -3.542 1.00 0.00 N ATOM 911 CA LEU A 687 12.432 -2.289 -2.724 1.00 0.00 C ATOM 912 C LEU A 687 12.832 -1.393 -1.558 1.00 0.00 C ATOM 913 O LEU A 687 13.147 -1.875 -0.470 1.00 0.00 O ATOM 914 CB LEU A 687 13.669 -2.600 -3.570 1.00 0.00 C ATOM 915 CG LEU A 687 13.275 -3.489 -4.750 1.00 0.00 C ATOM 916 CD1 LEU A 687 14.515 -3.793 -5.593 1.00 0.00 C ATOM 917 CD2 LEU A 687 12.687 -4.800 -4.225 1.00 0.00 C ATOM 0 H LEU A 687 11.718 -1.413 -4.492 1.00 0.00 H new ATOM 0 HA LEU A 687 12.014 -3.218 -2.336 1.00 0.00 H new ATOM 0 HB2 LEU A 687 14.116 -1.674 -3.933 1.00 0.00 H new ATOM 0 HB3 LEU A 687 14.422 -3.100 -2.961 1.00 0.00 H new ATOM 0 HG LEU A 687 12.534 -2.975 -5.361 1.00 0.00 H new ATOM 0 HD11 LEU A 687 14.236 -4.427 -6.435 1.00 0.00 H new ATOM 0 HD12 LEU A 687 14.939 -2.861 -5.966 1.00 0.00 H new ATOM 0 HD13 LEU A 687 15.254 -4.309 -4.980 1.00 0.00 H new ATOM 0 HD21 LEU A 687 12.406 -5.435 -5.065 1.00 0.00 H new ATOM 0 HD22 LEU A 687 13.430 -5.314 -3.615 1.00 0.00 H new ATOM 0 HD23 LEU A 687 11.806 -4.587 -3.620 1.00 0.00 H new ATOM 929 N LEU A 688 12.815 -0.085 -1.793 1.00 0.00 N ATOM 930 CA LEU A 688 13.177 0.867 -0.752 1.00 0.00 C ATOM 931 C LEU A 688 12.136 0.854 0.362 1.00 0.00 C ATOM 932 O LEU A 688 12.475 0.941 1.542 1.00 0.00 O ATOM 933 CB LEU A 688 13.274 2.275 -1.343 1.00 0.00 C ATOM 934 CG LEU A 688 14.276 2.280 -2.500 1.00 0.00 C ATOM 935 CD1 LEU A 688 14.446 3.709 -3.020 1.00 0.00 C ATOM 936 CD2 LEU A 688 15.626 1.754 -2.008 1.00 0.00 C ATOM 0 H LEU A 688 12.557 0.336 -2.686 1.00 0.00 H new ATOM 0 HA LEU A 688 14.144 0.580 -0.339 1.00 0.00 H new ATOM 0 HB2 LEU A 688 12.295 2.600 -1.695 1.00 0.00 H new ATOM 0 HB3 LEU A 688 13.587 2.982 -0.575 1.00 0.00 H new ATOM 0 HG LEU A 688 13.907 1.641 -3.303 1.00 0.00 H new ATOM 0 HD11 LEU A 688 15.159 3.714 -3.844 1.00 0.00 H new ATOM 0 HD12 LEU A 688 13.485 4.086 -3.370 1.00 0.00 H new ATOM 0 HD13 LEU A 688 14.815 4.347 -2.217 1.00 0.00 H new ATOM 0 HD21 LEU A 688 16.340 1.757 -2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 688 15.995 2.393 -1.206 1.00 0.00 H new ATOM 0 HD23 LEU A 688 15.506 0.737 -1.636 1.00 0.00 H new ATOM 948 N LEU A 689 10.867 0.738 -0.020 1.00 0.00 N ATOM 949 CA LEU A 689 9.789 0.707 0.961 1.00 0.00 C ATOM 950 C LEU A 689 9.960 -0.481 1.902 1.00 0.00 C ATOM 951 O LEU A 689 9.769 -0.359 3.112 1.00 0.00 O ATOM 952 CB LEU A 689 8.437 0.609 0.251 1.00 0.00 C ATOM 953 CG LEU A 689 8.268 1.802 -0.690 1.00 0.00 C ATOM 954 CD1 LEU A 689 6.876 1.760 -1.324 1.00 0.00 C ATOM 955 CD2 LEU A 689 8.427 3.102 0.101 1.00 0.00 C ATOM 0 H LEU A 689 10.563 0.665 -0.991 1.00 0.00 H new ATOM 0 HA LEU A 689 9.825 1.628 1.543 1.00 0.00 H new ATOM 0 HB2 LEU A 689 8.376 -0.323 -0.311 1.00 0.00 H new ATOM 0 HB3 LEU A 689 7.630 0.593 0.983 1.00 0.00 H new ATOM 0 HG LEU A 689 9.025 1.756 -1.472 1.00 0.00 H new ATOM 0 HD11 LEU A 689 6.756 2.611 -1.995 1.00 0.00 H new ATOM 0 HD12 LEU A 689 6.761 0.834 -1.888 1.00 0.00 H new ATOM 0 HD13 LEU A 689 6.118 1.805 -0.542 1.00 0.00 H new ATOM 0 HD21 LEU A 689 8.307 3.953 -0.569 1.00 0.00 H new ATOM 0 HD22 LEU A 689 7.670 3.147 0.884 1.00 0.00 H new ATOM 0 HD23 LEU A 689 9.418 3.134 0.553 1.00 0.00 H new ATOM 967 N LEU A 690 10.322 -1.630 1.338 1.00 0.00 N ATOM 968 CA LEU A 690 10.516 -2.835 2.139 1.00 0.00 C ATOM 969 C LEU A 690 11.615 -2.627 3.176 1.00 0.00 C ATOM 970 O LEU A 690 11.469 -3.014 4.335 1.00 0.00 O ATOM 971 CB LEU A 690 10.889 -4.011 1.234 1.00 0.00 C ATOM 972 CG LEU A 690 9.753 -4.281 0.248 1.00 0.00 C ATOM 973 CD1 LEU A 690 10.129 -5.462 -0.649 1.00 0.00 C ATOM 974 CD2 LEU A 690 8.478 -4.621 1.023 1.00 0.00 C ATOM 0 H LEU A 690 10.486 -1.752 0.339 1.00 0.00 H new ATOM 0 HA LEU A 690 9.581 -3.052 2.656 1.00 0.00 H new ATOM 0 HB2 LEU A 690 11.809 -3.789 0.693 1.00 0.00 H new ATOM 0 HB3 LEU A 690 11.080 -4.899 1.836 1.00 0.00 H new ATOM 0 HG LEU A 690 9.584 -3.395 -0.365 1.00 0.00 H new ATOM 0 HD11 LEU A 690 9.320 -5.656 -1.353 1.00 0.00 H new ATOM 0 HD12 LEU A 690 11.040 -5.226 -1.199 1.00 0.00 H new ATOM 0 HD13 LEU A 690 10.296 -6.347 -0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 690 7.666 -4.814 0.322 1.00 0.00 H new ATOM 0 HD22 LEU A 690 8.649 -5.508 1.633 1.00 0.00 H new ATOM 0 HD23 LEU A 690 8.209 -3.784 1.667 1.00 0.00 H new ATOM 986 N GLN A 691 12.716 -2.017 2.750 1.00 0.00 N ATOM 987 CA GLN A 691 13.835 -1.768 3.651 1.00 0.00 C ATOM 988 C GLN A 691 13.418 -0.852 4.796 1.00 0.00 C ATOM 989 O GLN A 691 13.835 -1.044 5.938 1.00 0.00 O ATOM 990 CB GLN A 691 14.993 -1.133 2.881 1.00 0.00 C ATOM 991 CG GLN A 691 15.534 -2.133 1.858 1.00 0.00 C ATOM 992 CD GLN A 691 16.626 -1.480 1.019 1.00 0.00 C ATOM 993 OE1 GLN A 691 16.727 -0.254 0.975 1.00 0.00 O ATOM 994 NE2 GLN A 691 17.457 -2.230 0.348 1.00 0.00 N ATOM 0 H GLN A 691 12.857 -1.688 1.795 1.00 0.00 H new ATOM 0 HA GLN A 691 14.155 -2.722 4.069 1.00 0.00 H new ATOM 0 HB2 GLN A 691 14.655 -0.227 2.377 1.00 0.00 H new ATOM 0 HB3 GLN A 691 15.784 -0.838 3.571 1.00 0.00 H new ATOM 0 HG2 GLN A 691 15.932 -3.010 2.369 1.00 0.00 H new ATOM 0 HG3 GLN A 691 14.726 -2.479 1.213 1.00 0.00 H new ATOM 0 HE21 GLN A 691 17.372 -3.246 0.386 1.00 0.00 H new ATOM 0 HE22 GLN A 691 18.192 -1.800 -0.214 1.00 0.00 H new ATOM 1003 N HIS A 692 12.591 0.141 4.486 1.00 0.00 N ATOM 1004 CA HIS A 692 12.128 1.073 5.507 1.00 0.00 C ATOM 1005 C HIS A 692 11.443 0.312 6.635 1.00 0.00 C ATOM 1006 O HIS A 692 11.759 0.503 7.809 1.00 0.00 O ATOM 1007 CB HIS A 692 11.151 2.075 4.890 1.00 0.00 C ATOM 1008 CG HIS A 692 10.830 3.152 5.890 1.00 0.00 C ATOM 1009 ND1 HIS A 692 9.542 3.633 6.069 1.00 0.00 N ATOM 1010 CD2 HIS A 692 11.618 3.856 6.766 1.00 0.00 C ATOM 1011 CE1 HIS A 692 9.593 4.585 7.019 1.00 0.00 C ATOM 1012 NE2 HIS A 692 10.835 4.760 7.478 1.00 0.00 N ATOM 0 H HIS A 692 12.232 0.320 3.548 1.00 0.00 H new ATOM 0 HA HIS A 692 12.985 1.611 5.911 1.00 0.00 H new ATOM 0 HB2 HIS A 692 11.586 2.516 3.993 1.00 0.00 H new ATOM 0 HB3 HIS A 692 10.237 1.565 4.584 1.00 0.00 H new ATOM 0 HD2 HIS A 692 12.684 3.728 6.885 1.00 0.00 H new ATOM 0 HE1 HIS A 692 8.734 5.140 7.368 1.00 0.00 H new ATOM 0 HE2 HIS A 692 11.143 5.415 8.196 1.00 0.00 H new ATOM 1021 N LEU A 693 10.512 -0.561 6.266 1.00 0.00 N ATOM 1022 CA LEU A 693 9.795 -1.360 7.249 1.00 0.00 C ATOM 1023 C LEU A 693 10.786 -2.128 8.121 1.00 0.00 C ATOM 1024 O LEU A 693 10.631 -2.208 9.339 1.00 0.00 O ATOM 1025 CB LEU A 693 8.868 -2.345 6.532 1.00 0.00 C ATOM 1026 CG LEU A 693 7.963 -1.580 5.564 1.00 0.00 C ATOM 1027 CD1 LEU A 693 7.014 -2.556 4.865 1.00 0.00 C ATOM 1028 CD2 LEU A 693 7.144 -0.546 6.340 1.00 0.00 C ATOM 0 H LEU A 693 10.238 -0.732 5.298 1.00 0.00 H new ATOM 0 HA LEU A 693 9.202 -0.700 7.882 1.00 0.00 H new ATOM 0 HB2 LEU A 693 9.456 -3.085 5.989 1.00 0.00 H new ATOM 0 HB3 LEU A 693 8.264 -2.888 7.259 1.00 0.00 H new ATOM 0 HG LEU A 693 8.578 -1.076 4.819 1.00 0.00 H new ATOM 0 HD11 LEU A 693 6.371 -2.008 4.176 1.00 0.00 H new ATOM 0 HD12 LEU A 693 7.594 -3.294 4.311 1.00 0.00 H new ATOM 0 HD13 LEU A 693 6.400 -3.063 5.610 1.00 0.00 H new ATOM 0 HD21 LEU A 693 6.499 -0.001 5.651 1.00 0.00 H new ATOM 0 HD22 LEU A 693 6.532 -1.052 7.086 1.00 0.00 H new ATOM 0 HD23 LEU A 693 7.817 0.153 6.837 1.00 0.00 H new ATOM 1040 N ARG A 694 11.805 -2.689 7.476 1.00 0.00 N ATOM 1041 CA ARG A 694 12.833 -3.452 8.178 1.00 0.00 C ATOM 1042 C ARG A 694 13.676 -2.548 9.072 1.00 0.00 C ATOM 1043 O ARG A 694 14.155 -2.969 10.124 1.00 0.00 O ATOM 1044 CB ARG A 694 13.743 -4.143 7.162 1.00 0.00 C ATOM 1045 CG ARG A 694 12.935 -5.164 6.359 1.00 0.00 C ATOM 1046 CD ARG A 694 13.848 -5.843 5.336 1.00 0.00 C ATOM 1047 NE ARG A 694 14.829 -6.684 6.012 1.00 0.00 N ATOM 1048 CZ ARG A 694 15.851 -7.213 5.348 1.00 0.00 C ATOM 1049 NH1 ARG A 694 15.998 -6.971 4.074 1.00 0.00 N ATOM 1050 NH2 ARG A 694 16.710 -7.973 5.971 1.00 0.00 N ATOM 0 H ARG A 694 11.941 -2.629 6.467 1.00 0.00 H new ATOM 0 HA ARG A 694 12.337 -4.194 8.804 1.00 0.00 H new ATOM 0 HB2 ARG A 694 14.183 -3.405 6.492 1.00 0.00 H new ATOM 0 HB3 ARG A 694 14.567 -4.639 7.675 1.00 0.00 H new ATOM 0 HG2 ARG A 694 12.502 -5.908 7.027 1.00 0.00 H new ATOM 0 HG3 ARG A 694 12.106 -4.670 5.852 1.00 0.00 H new ATOM 0 HD2 ARG A 694 13.252 -6.446 4.651 1.00 0.00 H new ATOM 0 HD3 ARG A 694 14.357 -5.089 4.736 1.00 0.00 H new ATOM 0 HE ARG A 694 14.729 -6.869 7.010 1.00 0.00 H new ATOM 0 HH11 ARG A 694 15.328 -6.375 3.587 1.00 0.00 H new ATOM 0 HH12 ARG A 694 16.783 -7.377 3.565 1.00 0.00 H new ATOM 0 HH21 ARG A 694 16.596 -8.161 6.967 1.00 0.00 H new ATOM 0 HH22 ARG A 694 17.495 -8.379 5.462 1.00 0.00 H new ATOM 1064 N GLU A 695 13.871 -1.311 8.633 1.00 0.00 N ATOM 1065 CA GLU A 695 14.680 -0.361 9.387 1.00 0.00 C ATOM 1066 C GLU A 695 14.029 -0.008 10.722 1.00 0.00 C ATOM 1067 O GLU A 695 14.722 0.267 11.701 1.00 0.00 O ATOM 1068 CB GLU A 695 14.878 0.913 8.564 1.00 0.00 C ATOM 1069 CG GLU A 695 15.830 1.858 9.299 1.00 0.00 C ATOM 1070 CD GLU A 695 15.955 3.171 8.533 1.00 0.00 C ATOM 1071 OE1 GLU A 695 15.321 3.292 7.497 1.00 0.00 O ATOM 1072 OE2 GLU A 695 16.682 4.035 8.993 1.00 0.00 O ATOM 0 H GLU A 695 13.483 -0.943 7.764 1.00 0.00 H new ATOM 0 HA GLU A 695 15.644 -0.828 9.591 1.00 0.00 H new ATOM 0 HB2 GLU A 695 15.282 0.665 7.583 1.00 0.00 H new ATOM 0 HB3 GLU A 695 13.919 1.404 8.399 1.00 0.00 H new ATOM 0 HG2 GLU A 695 15.460 2.049 10.307 1.00 0.00 H new ATOM 0 HG3 GLU A 695 16.810 1.393 9.402 1.00 0.00 H new ATOM 1079 N HIS A 696 12.701 -0.002 10.760 1.00 0.00 N ATOM 1080 CA HIS A 696 11.997 0.338 11.992 1.00 0.00 C ATOM 1081 C HIS A 696 10.994 -0.745 12.384 1.00 0.00 C ATOM 1082 O HIS A 696 11.084 -1.316 13.469 1.00 0.00 O ATOM 1083 CB HIS A 696 11.275 1.675 11.817 1.00 0.00 C ATOM 1084 CG HIS A 696 12.253 2.699 11.311 1.00 0.00 C ATOM 1085 ND1 HIS A 696 13.229 3.253 12.124 1.00 0.00 N ATOM 1086 CD2 HIS A 696 12.426 3.269 10.074 1.00 0.00 C ATOM 1087 CE1 HIS A 696 13.941 4.114 11.373 1.00 0.00 C ATOM 1088 NE2 HIS A 696 13.493 4.161 10.115 1.00 0.00 N ATOM 0 H HIS A 696 12.099 -0.224 9.967 1.00 0.00 H new ATOM 0 HA HIS A 696 12.733 0.415 12.792 1.00 0.00 H new ATOM 0 HB2 HIS A 696 10.447 1.567 11.116 1.00 0.00 H new ATOM 0 HB3 HIS A 696 10.848 1.999 12.766 1.00 0.00 H new ATOM 0 HD2 HIS A 696 11.825 3.057 9.202 1.00 0.00 H new ATOM 0 HE1 HIS A 696 14.773 4.696 11.742 1.00 0.00 H new ATOM 0 HE2 HIS A 696 13.855 4.729 9.349 1.00 0.00 H new ATOM 1168 N PRO A 702 4.397 -3.942 12.762 1.00 0.00 N ATOM 1169 CA PRO A 702 4.355 -3.759 11.284 1.00 0.00 C ATOM 1170 C PRO A 702 2.950 -3.428 10.773 1.00 0.00 C ATOM 1171 O PRO A 702 1.983 -4.110 11.113 1.00 0.00 O ATOM 1172 CB PRO A 702 4.819 -5.109 10.736 1.00 0.00 C ATOM 1173 CG PRO A 702 5.644 -5.721 11.818 1.00 0.00 C ATOM 1174 CD PRO A 702 5.124 -5.162 13.143 1.00 0.00 C ATOM 0 HA PRO A 702 4.976 -2.922 10.966 1.00 0.00 H new ATOM 0 HB2 PRO A 702 3.969 -5.743 10.486 1.00 0.00 H new ATOM 0 HB3 PRO A 702 5.402 -4.982 9.824 1.00 0.00 H new ATOM 0 HG2 PRO A 702 5.562 -6.808 11.799 1.00 0.00 H new ATOM 0 HG3 PRO A 702 6.698 -5.479 11.684 1.00 0.00 H new ATOM 0 HD2 PRO A 702 4.470 -5.874 13.646 1.00 0.00 H new ATOM 0 HD3 PRO A 702 5.941 -4.940 13.829 1.00 0.00 H new ATOM 1182 N PRO A 703 2.823 -2.406 9.962 1.00 0.00 N ATOM 1183 CA PRO A 703 1.510 -1.990 9.390 1.00 0.00 C ATOM 1184 C PRO A 703 1.051 -2.933 8.279 1.00 0.00 C ATOM 1185 O PRO A 703 1.833 -3.741 7.779 1.00 0.00 O ATOM 1186 CB PRO A 703 1.778 -0.587 8.845 1.00 0.00 C ATOM 1187 CG PRO A 703 3.240 -0.546 8.547 1.00 0.00 C ATOM 1188 CD PRO A 703 3.918 -1.535 9.499 1.00 0.00 C ATOM 0 HA PRO A 703 0.711 -2.013 10.131 1.00 0.00 H new ATOM 0 HB2 PRO A 703 1.189 -0.396 7.948 1.00 0.00 H new ATOM 0 HB3 PRO A 703 1.505 0.176 9.574 1.00 0.00 H new ATOM 0 HG2 PRO A 703 3.430 -0.818 7.509 1.00 0.00 H new ATOM 0 HG3 PRO A 703 3.635 0.460 8.690 1.00 0.00 H new ATOM 0 HD2 PRO A 703 4.694 -2.108 8.991 1.00 0.00 H new ATOM 0 HD3 PRO A 703 4.396 -1.020 10.332 1.00 0.00 H new ATOM 1196 N LEU A 704 -0.218 -2.826 7.895 1.00 0.00 N ATOM 1197 CA LEU A 704 -0.756 -3.680 6.841 1.00 0.00 C ATOM 1198 C LEU A 704 -0.293 -3.171 5.478 1.00 0.00 C ATOM 1199 O LEU A 704 -0.481 -1.999 5.150 1.00 0.00 O ATOM 1200 CB LEU A 704 -2.288 -3.683 6.906 1.00 0.00 C ATOM 1201 CG LEU A 704 -2.843 -4.873 6.117 1.00 0.00 C ATOM 1202 CD1 LEU A 704 -4.189 -5.294 6.709 1.00 0.00 C ATOM 1203 CD2 LEU A 704 -3.039 -4.472 4.653 1.00 0.00 C ATOM 0 H LEU A 704 -0.886 -2.165 8.292 1.00 0.00 H new ATOM 0 HA LEU A 704 -0.393 -4.698 6.983 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -2.616 -3.739 7.944 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -2.679 -2.751 6.498 1.00 0.00 H new ATOM 0 HG LEU A 704 -2.140 -5.704 6.176 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -4.584 -6.141 6.148 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -4.054 -5.581 7.752 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -4.889 -4.461 6.650 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -3.434 -5.320 4.093 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -3.741 -3.640 4.594 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -2.082 -4.170 4.227 1.00 0.00 H new ATOM 1215 N VAL A 705 0.326 -4.050 4.693 1.00 0.00 N ATOM 1216 CA VAL A 705 0.824 -3.658 3.377 1.00 0.00 C ATOM 1217 C VAL A 705 0.230 -4.524 2.267 1.00 0.00 C ATOM 1218 O VAL A 705 0.205 -5.753 2.362 1.00 0.00 O ATOM 1219 CB VAL A 705 2.349 -3.768 3.350 1.00 0.00 C ATOM 1220 CG1 VAL A 705 2.870 -3.320 1.985 1.00 0.00 C ATOM 1221 CG2 VAL A 705 2.942 -2.872 4.440 1.00 0.00 C ATOM 0 H VAL A 705 0.493 -5.025 4.941 1.00 0.00 H new ATOM 0 HA VAL A 705 0.520 -2.627 3.199 1.00 0.00 H new ATOM 0 HB VAL A 705 2.642 -4.803 3.528 1.00 0.00 H new ATOM 0 HG11 VAL A 705 3.957 -3.399 1.967 1.00 0.00 H new ATOM 0 HG12 VAL A 705 2.447 -3.956 1.207 1.00 0.00 H new ATOM 0 HG13 VAL A 705 2.578 -2.285 1.806 1.00 0.00 H new ATOM 0 HG21 VAL A 705 4.029 -2.949 4.423 1.00 0.00 H new ATOM 0 HG22 VAL A 705 2.648 -1.838 4.260 1.00 0.00 H new ATOM 0 HG23 VAL A 705 2.571 -3.190 5.414 1.00 0.00 H new ATOM 1231 N LEU A 706 -0.235 -3.863 1.209 1.00 0.00 N ATOM 1232 CA LEU A 706 -0.818 -4.558 0.064 1.00 0.00 C ATOM 1233 C LEU A 706 -0.010 -4.283 -1.203 1.00 0.00 C ATOM 1234 O LEU A 706 0.366 -3.141 -1.474 1.00 0.00 O ATOM 1235 CB LEU A 706 -2.263 -4.098 -0.146 1.00 0.00 C ATOM 1236 CG LEU A 706 -3.150 -4.658 0.966 1.00 0.00 C ATOM 1237 CD1 LEU A 706 -4.382 -3.768 1.133 1.00 0.00 C ATOM 1238 CD2 LEU A 706 -3.599 -6.071 0.587 1.00 0.00 C ATOM 0 H LEU A 706 -0.219 -2.847 1.121 1.00 0.00 H new ATOM 0 HA LEU A 706 -0.800 -5.628 0.269 1.00 0.00 H new ATOM 0 HB2 LEU A 706 -2.311 -3.009 -0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 706 -2.625 -4.436 -1.117 1.00 0.00 H new ATOM 0 HG LEU A 706 -2.590 -4.685 1.901 1.00 0.00 H new ATOM 0 HD11 LEU A 706 -5.015 -4.167 1.926 1.00 0.00 H new ATOM 0 HD12 LEU A 706 -4.068 -2.757 1.394 1.00 0.00 H new ATOM 0 HD13 LEU A 706 -4.943 -3.744 0.199 1.00 0.00 H new ATOM 0 HD21 LEU A 706 -4.232 -6.476 1.377 1.00 0.00 H new ATOM 0 HD22 LEU A 706 -4.161 -6.036 -0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 706 -2.724 -6.709 0.460 1.00 0.00 H new ATOM 1250 N PHE A 707 0.241 -5.332 -1.983 1.00 0.00 N ATOM 1251 CA PHE A 707 0.994 -5.183 -3.227 1.00 0.00 C ATOM 1252 C PHE A 707 0.073 -5.334 -4.433 1.00 0.00 C ATOM 1253 O PHE A 707 -0.570 -6.369 -4.608 1.00 0.00 O ATOM 1254 CB PHE A 707 2.094 -6.243 -3.311 1.00 0.00 C ATOM 1255 CG PHE A 707 3.367 -5.728 -2.685 1.00 0.00 C ATOM 1256 CD1 PHE A 707 3.326 -5.042 -1.466 1.00 0.00 C ATOM 1257 CD2 PHE A 707 4.592 -5.943 -3.327 1.00 0.00 C ATOM 1258 CE1 PHE A 707 4.513 -4.571 -0.890 1.00 0.00 C ATOM 1259 CE2 PHE A 707 5.777 -5.473 -2.751 1.00 0.00 C ATOM 1260 CZ PHE A 707 5.738 -4.787 -1.532 1.00 0.00 C ATOM 0 H PHE A 707 -0.062 -6.285 -1.779 1.00 0.00 H new ATOM 0 HA PHE A 707 1.439 -4.188 -3.233 1.00 0.00 H new ATOM 0 HB2 PHE A 707 1.772 -7.152 -2.802 1.00 0.00 H new ATOM 0 HB3 PHE A 707 2.274 -6.508 -4.353 1.00 0.00 H new ATOM 0 HD1 PHE A 707 2.381 -4.876 -0.970 1.00 0.00 H new ATOM 0 HD2 PHE A 707 4.622 -6.472 -4.268 1.00 0.00 H new ATOM 0 HE1 PHE A 707 4.483 -4.041 0.050 1.00 0.00 H new ATOM 0 HE2 PHE A 707 6.722 -5.640 -3.247 1.00 0.00 H new ATOM 0 HZ PHE A 707 6.653 -4.424 -1.087 1.00 0.00 H new ATOM 1270 N LEU A 708 0.021 -4.304 -5.271 1.00 0.00 N ATOM 1271 CA LEU A 708 -0.817 -4.351 -6.462 1.00 0.00 C ATOM 1272 C LEU A 708 0.025 -4.708 -7.684 1.00 0.00 C ATOM 1273 O LEU A 708 1.108 -4.157 -7.882 1.00 0.00 O ATOM 1274 CB LEU A 708 -1.496 -2.996 -6.678 1.00 0.00 C ATOM 1275 CG LEU A 708 -2.237 -2.589 -5.402 1.00 0.00 C ATOM 1276 CD1 LEU A 708 -3.038 -1.312 -5.661 1.00 0.00 C ATOM 1277 CD2 LEU A 708 -3.188 -3.712 -4.983 1.00 0.00 C ATOM 0 H LEU A 708 0.543 -3.436 -5.149 1.00 0.00 H new ATOM 0 HA LEU A 708 -1.581 -5.116 -6.323 1.00 0.00 H new ATOM 0 HB2 LEU A 708 -0.753 -2.242 -6.936 1.00 0.00 H new ATOM 0 HB3 LEU A 708 -2.194 -3.056 -7.513 1.00 0.00 H new ATOM 0 HG LEU A 708 -1.515 -2.409 -4.606 1.00 0.00 H new ATOM 0 HD11 LEU A 708 -3.565 -1.023 -4.752 1.00 0.00 H new ATOM 0 HD12 LEU A 708 -2.360 -0.511 -5.958 1.00 0.00 H new ATOM 0 HD13 LEU A 708 -3.760 -1.491 -6.458 1.00 0.00 H new ATOM 0 HD21 LEU A 708 -3.716 -3.422 -4.074 1.00 0.00 H new ATOM 0 HD22 LEU A 708 -3.910 -3.894 -5.779 1.00 0.00 H new ATOM 0 HD23 LEU A 708 -2.617 -4.622 -4.796 1.00 0.00 H new ATOM 1289 N GLY A 709 -0.475 -5.627 -8.505 1.00 0.00 N ATOM 1290 CA GLY A 709 0.254 -6.033 -9.701 1.00 0.00 C ATOM 1291 C GLY A 709 0.275 -7.551 -9.852 1.00 0.00 C ATOM 1292 O GLY A 709 -0.735 -8.221 -9.639 1.00 0.00 O ATOM 0 H GLY A 709 -1.369 -6.098 -8.367 1.00 0.00 H new ATOM 0 HA2 GLY A 709 -0.208 -5.585 -10.580 1.00 0.00 H new ATOM 0 HA3 GLY A 709 1.276 -5.657 -9.651 1.00 0.00 H new ATOM 1296 N GLU A 710 1.433 -8.082 -10.234 1.00 0.00 N ATOM 1297 CA GLU A 710 1.582 -9.521 -10.427 1.00 0.00 C ATOM 1298 C GLU A 710 2.108 -10.193 -9.158 1.00 0.00 C ATOM 1299 O GLU A 710 2.284 -9.541 -8.129 1.00 0.00 O ATOM 1300 CB GLU A 710 2.530 -9.786 -11.594 1.00 0.00 C ATOM 1301 CG GLU A 710 2.642 -8.520 -12.439 1.00 0.00 C ATOM 1302 CD GLU A 710 1.251 -7.968 -12.733 1.00 0.00 C ATOM 1303 OE1 GLU A 710 0.316 -8.751 -12.748 1.00 0.00 O ATOM 1304 OE2 GLU A 710 1.141 -6.770 -12.935 1.00 0.00 O ATOM 0 H GLU A 710 2.278 -7.540 -10.415 1.00 0.00 H new ATOM 0 HA GLU A 710 0.603 -9.944 -10.651 1.00 0.00 H new ATOM 0 HB2 GLU A 710 3.512 -10.079 -11.223 1.00 0.00 H new ATOM 0 HB3 GLU A 710 2.159 -10.612 -12.201 1.00 0.00 H new ATOM 0 HG2 GLU A 710 3.236 -7.772 -11.913 1.00 0.00 H new ATOM 0 HG3 GLU A 710 3.160 -8.740 -13.372 1.00 0.00 H new ATOM 1311 N PRO A 711 2.347 -11.479 -9.213 1.00 0.00 N ATOM 1312 CA PRO A 711 2.849 -12.258 -8.041 1.00 0.00 C ATOM 1313 C PRO A 711 4.215 -11.771 -7.563 1.00 0.00 C ATOM 1314 O PRO A 711 4.963 -11.143 -8.311 1.00 0.00 O ATOM 1315 CB PRO A 711 2.933 -13.704 -8.549 1.00 0.00 C ATOM 1316 CG PRO A 711 2.143 -13.743 -9.817 1.00 0.00 C ATOM 1317 CD PRO A 711 2.169 -12.331 -10.394 1.00 0.00 C ATOM 0 HA PRO A 711 2.190 -12.149 -7.179 1.00 0.00 H new ATOM 0 HB2 PRO A 711 3.968 -13.996 -8.725 1.00 0.00 H new ATOM 0 HB3 PRO A 711 2.527 -14.400 -7.815 1.00 0.00 H new ATOM 0 HG2 PRO A 711 2.574 -14.456 -10.520 1.00 0.00 H new ATOM 0 HG3 PRO A 711 1.119 -14.064 -9.625 1.00 0.00 H new ATOM 0 HD2 PRO A 711 2.984 -12.204 -11.107 1.00 0.00 H new ATOM 0 HD3 PRO A 711 1.245 -12.097 -10.922 1.00 0.00 H new ATOM 1325 N PRO A 712 4.534 -12.045 -6.328 1.00 0.00 N ATOM 1326 CA PRO A 712 5.826 -11.626 -5.705 1.00 0.00 C ATOM 1327 C PRO A 712 7.038 -12.303 -6.344 1.00 0.00 C ATOM 1328 O PRO A 712 6.969 -13.458 -6.766 1.00 0.00 O ATOM 1329 CB PRO A 712 5.683 -12.041 -4.238 1.00 0.00 C ATOM 1330 CG PRO A 712 4.621 -13.089 -4.215 1.00 0.00 C ATOM 1331 CD PRO A 712 3.689 -12.794 -5.388 1.00 0.00 C ATOM 0 HA PRO A 712 6.003 -10.559 -5.837 1.00 0.00 H new ATOM 0 HB2 PRO A 712 6.624 -12.429 -3.848 1.00 0.00 H new ATOM 0 HB3 PRO A 712 5.406 -11.190 -3.616 1.00 0.00 H new ATOM 0 HG2 PRO A 712 5.057 -14.084 -4.307 1.00 0.00 H new ATOM 0 HG3 PRO A 712 4.075 -13.066 -3.272 1.00 0.00 H new ATOM 0 HD2 PRO A 712 3.308 -13.711 -5.837 1.00 0.00 H new ATOM 0 HD3 PRO A 712 2.824 -12.209 -5.074 1.00 0.00 H new ATOM 1339 N VAL A 713 8.148 -11.572 -6.402 1.00 0.00 N ATOM 1340 CA VAL A 713 9.379 -12.102 -6.980 1.00 0.00 C ATOM 1341 C VAL A 713 10.156 -12.911 -5.946 1.00 0.00 C ATOM 1342 O VAL A 713 11.060 -13.672 -6.291 1.00 0.00 O ATOM 1343 CB VAL A 713 10.250 -10.955 -7.497 1.00 0.00 C ATOM 1344 CG1 VAL A 713 11.634 -11.489 -7.872 1.00 0.00 C ATOM 1345 CG2 VAL A 713 9.594 -10.335 -8.733 1.00 0.00 C ATOM 0 H VAL A 713 8.220 -10.615 -6.057 1.00 0.00 H new ATOM 0 HA VAL A 713 9.114 -12.758 -7.809 1.00 0.00 H new ATOM 0 HB VAL A 713 10.352 -10.199 -6.718 1.00 0.00 H new ATOM 0 HG11 VAL A 713 12.252 -10.670 -8.240 1.00 0.00 H new ATOM 0 HG12 VAL A 713 12.103 -11.932 -6.994 1.00 0.00 H new ATOM 0 HG13 VAL A 713 11.533 -12.246 -8.650 1.00 0.00 H new ATOM 0 HG21 VAL A 713 10.213 -9.518 -9.102 1.00 0.00 H new ATOM 0 HG22 VAL A 713 9.492 -11.093 -9.510 1.00 0.00 H new ATOM 0 HG23 VAL A 713 8.608 -9.952 -8.468 1.00 0.00 H new ATOM 1355 N ASP A 714 9.800 -12.743 -4.676 1.00 0.00 N ATOM 1356 CA ASP A 714 10.475 -13.465 -3.603 1.00 0.00 C ATOM 1357 C ASP A 714 9.626 -13.449 -2.335 1.00 0.00 C ATOM 1358 O ASP A 714 8.861 -12.514 -2.098 1.00 0.00 O ATOM 1359 CB ASP A 714 11.838 -12.828 -3.317 1.00 0.00 C ATOM 1360 CG ASP A 714 11.934 -11.469 -4.001 1.00 0.00 C ATOM 1361 OD1 ASP A 714 11.164 -10.593 -3.643 1.00 0.00 O ATOM 1362 OD2 ASP A 714 12.776 -11.323 -4.871 1.00 0.00 O ATOM 0 H ASP A 714 9.055 -12.119 -4.367 1.00 0.00 H new ATOM 0 HA ASP A 714 10.620 -14.498 -3.919 1.00 0.00 H new ATOM 0 HB2 ASP A 714 11.976 -12.713 -2.242 1.00 0.00 H new ATOM 0 HB3 ASP A 714 12.635 -13.480 -3.673 1.00 0.00 H new ATOM 1367 N PRO A 715 9.744 -14.470 -1.532 1.00 0.00 N ATOM 1368 CA PRO A 715 8.969 -14.597 -0.261 1.00 0.00 C ATOM 1369 C PRO A 715 9.318 -13.515 0.760 1.00 0.00 C ATOM 1370 O PRO A 715 8.647 -13.384 1.784 1.00 0.00 O ATOM 1371 CB PRO A 715 9.351 -15.983 0.270 1.00 0.00 C ATOM 1372 CG PRO A 715 10.639 -16.332 -0.399 1.00 0.00 C ATOM 1373 CD PRO A 715 10.632 -15.620 -1.749 1.00 0.00 C ATOM 0 HA PRO A 715 7.900 -14.478 -0.437 1.00 0.00 H new ATOM 0 HB2 PRO A 715 9.464 -15.969 1.354 1.00 0.00 H new ATOM 0 HB3 PRO A 715 8.579 -16.717 0.039 1.00 0.00 H new ATOM 0 HG2 PRO A 715 11.489 -16.012 0.204 1.00 0.00 H new ATOM 0 HG3 PRO A 715 10.729 -17.410 -0.529 1.00 0.00 H new ATOM 0 HD2 PRO A 715 11.634 -15.303 -2.040 1.00 0.00 H new ATOM 0 HD3 PRO A 715 10.260 -16.269 -2.542 1.00 0.00 H new ATOM 1381 N LEU A 716 10.370 -12.749 0.489 1.00 0.00 N ATOM 1382 CA LEU A 716 10.781 -11.699 1.415 1.00 0.00 C ATOM 1383 C LEU A 716 9.772 -10.558 1.420 1.00 0.00 C ATOM 1384 O LEU A 716 9.448 -10.010 2.474 1.00 0.00 O ATOM 1385 CB LEU A 716 12.159 -11.162 1.025 1.00 0.00 C ATOM 1386 CG LEU A 716 13.162 -12.314 0.962 1.00 0.00 C ATOM 1387 CD1 LEU A 716 14.563 -11.754 0.710 1.00 0.00 C ATOM 1388 CD2 LEU A 716 13.147 -13.073 2.289 1.00 0.00 C ATOM 0 H LEU A 716 10.945 -12.832 -0.349 1.00 0.00 H new ATOM 0 HA LEU A 716 10.830 -12.129 2.416 1.00 0.00 H new ATOM 0 HB2 LEU A 716 12.105 -10.661 0.058 1.00 0.00 H new ATOM 0 HB3 LEU A 716 12.489 -10.419 1.751 1.00 0.00 H new ATOM 0 HG LEU A 716 12.890 -12.992 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 716 15.280 -12.574 0.665 1.00 0.00 H new ATOM 0 HD12 LEU A 716 14.573 -11.211 -0.235 1.00 0.00 H new ATOM 0 HD13 LEU A 716 14.836 -11.078 1.520 1.00 0.00 H new ATOM 0 HD21 LEU A 716 13.862 -13.895 2.246 1.00 0.00 H new ATOM 0 HD22 LEU A 716 13.421 -12.396 3.098 1.00 0.00 H new ATOM 0 HD23 LEU A 716 12.148 -13.470 2.470 1.00 0.00 H new ATOM 1400 N LEU A 717 9.262 -10.214 0.246 1.00 0.00 N ATOM 1401 CA LEU A 717 8.277 -9.149 0.156 1.00 0.00 C ATOM 1402 C LEU A 717 6.913 -9.703 0.533 1.00 0.00 C ATOM 1403 O LEU A 717 6.119 -9.037 1.197 1.00 0.00 O ATOM 1404 CB LEU A 717 8.241 -8.572 -1.262 1.00 0.00 C ATOM 1405 CG LEU A 717 7.434 -9.496 -2.176 1.00 0.00 C ATOM 1406 CD1 LEU A 717 5.937 -9.211 -2.014 1.00 0.00 C ATOM 1407 CD2 LEU A 717 7.845 -9.248 -3.629 1.00 0.00 C ATOM 0 H LEU A 717 9.509 -10.649 -0.643 1.00 0.00 H new ATOM 0 HA LEU A 717 8.548 -8.347 0.842 1.00 0.00 H new ATOM 0 HB2 LEU A 717 7.795 -7.578 -1.249 1.00 0.00 H new ATOM 0 HB3 LEU A 717 9.255 -8.461 -1.645 1.00 0.00 H new ATOM 0 HG LEU A 717 7.631 -10.534 -1.907 1.00 0.00 H new ATOM 0 HD11 LEU A 717 5.368 -9.872 -2.668 1.00 0.00 H new ATOM 0 HD12 LEU A 717 5.644 -9.384 -0.979 1.00 0.00 H new ATOM 0 HD13 LEU A 717 5.733 -8.174 -2.281 1.00 0.00 H new ATOM 0 HD21 LEU A 717 7.273 -9.904 -4.286 1.00 0.00 H new ATOM 0 HD22 LEU A 717 7.646 -8.209 -3.891 1.00 0.00 H new ATOM 0 HD23 LEU A 717 8.909 -9.455 -3.747 1.00 0.00 H new ATOM 1419 N THR A 718 6.661 -10.942 0.125 1.00 0.00 N ATOM 1420 CA THR A 718 5.403 -11.594 0.448 1.00 0.00 C ATOM 1421 C THR A 718 5.290 -11.768 1.958 1.00 0.00 C ATOM 1422 O THR A 718 4.224 -11.561 2.538 1.00 0.00 O ATOM 1423 CB THR A 718 5.324 -12.960 -0.239 1.00 0.00 C ATOM 1424 OG1 THR A 718 5.574 -12.804 -1.628 1.00 0.00 O ATOM 1425 CG2 THR A 718 3.931 -13.557 -0.038 1.00 0.00 C ATOM 0 H THR A 718 7.307 -11.509 -0.425 1.00 0.00 H new ATOM 0 HA THR A 718 4.580 -10.974 0.092 1.00 0.00 H new ATOM 0 HB THR A 718 6.069 -13.627 0.195 1.00 0.00 H new ATOM 0 HG1 THR A 718 6.131 -13.545 -1.945 1.00 0.00 H new ATOM 0 HG21 THR A 718 3.878 -14.529 -0.528 1.00 0.00 H new ATOM 0 HG22 THR A 718 3.737 -13.677 1.028 1.00 0.00 H new ATOM 0 HG23 THR A 718 3.184 -12.891 -0.470 1.00 0.00 H new ATOM 1433 N ALA A 719 6.403 -12.140 2.594 1.00 0.00 N ATOM 1434 CA ALA A 719 6.411 -12.323 4.040 1.00 0.00 C ATOM 1435 C ALA A 719 6.168 -10.990 4.735 1.00 0.00 C ATOM 1436 O ALA A 719 5.461 -10.918 5.739 1.00 0.00 O ATOM 1437 CB ALA A 719 7.753 -12.899 4.493 1.00 0.00 C ATOM 0 H ALA A 719 7.297 -12.317 2.135 1.00 0.00 H new ATOM 0 HA ALA A 719 5.616 -13.019 4.307 1.00 0.00 H new ATOM 0 HB1 ALA A 719 7.746 -13.031 5.575 1.00 0.00 H new ATOM 0 HB2 ALA A 719 7.916 -13.863 4.011 1.00 0.00 H new ATOM 0 HB3 ALA A 719 8.555 -12.214 4.216 1.00 0.00 H new ATOM 1443 N GLN A 720 6.759 -9.935 4.184 1.00 0.00 N ATOM 1444 CA GLN A 720 6.603 -8.601 4.747 1.00 0.00 C ATOM 1445 C GLN A 720 5.214 -8.054 4.439 1.00 0.00 C ATOM 1446 O GLN A 720 4.602 -7.379 5.267 1.00 0.00 O ATOM 1447 CB GLN A 720 7.660 -7.664 4.161 1.00 0.00 C ATOM 1448 CG GLN A 720 7.611 -6.320 4.889 1.00 0.00 C ATOM 1449 CD GLN A 720 8.181 -6.469 6.296 1.00 0.00 C ATOM 1450 OE1 GLN A 720 9.192 -7.143 6.488 1.00 0.00 O ATOM 1451 NE2 GLN A 720 7.590 -5.875 7.297 1.00 0.00 N ATOM 0 H GLN A 720 7.348 -9.978 3.352 1.00 0.00 H new ATOM 0 HA GLN A 720 6.729 -8.663 5.828 1.00 0.00 H new ATOM 0 HB2 GLN A 720 8.650 -8.108 4.261 1.00 0.00 H new ATOM 0 HB3 GLN A 720 7.482 -7.519 3.095 1.00 0.00 H new ATOM 0 HG2 GLN A 720 8.181 -5.575 4.334 1.00 0.00 H new ATOM 0 HG3 GLN A 720 6.583 -5.962 4.940 1.00 0.00 H new ATOM 0 HE21 GLN A 720 6.752 -5.317 7.136 1.00 0.00 H new ATOM 0 HE22 GLN A 720 7.966 -5.969 8.240 1.00 0.00 H new ATOM 1460 N ALA A 721 4.723 -8.350 3.241 1.00 0.00 N ATOM 1461 CA ALA A 721 3.406 -7.882 2.831 1.00 0.00 C ATOM 1462 C ALA A 721 2.312 -8.637 3.578 1.00 0.00 C ATOM 1463 O ALA A 721 2.447 -9.828 3.859 1.00 0.00 O ATOM 1464 CB ALA A 721 3.228 -8.077 1.325 1.00 0.00 C ATOM 0 H ALA A 721 5.213 -8.908 2.542 1.00 0.00 H new ATOM 0 HA ALA A 721 3.327 -6.822 3.071 1.00 0.00 H new ATOM 0 HB1 ALA A 721 2.241 -7.725 1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 721 3.992 -7.511 0.792 1.00 0.00 H new ATOM 0 HB3 ALA A 721 3.325 -9.135 1.081 1.00 0.00 H new ATOM 1470 N SER A 722 1.230 -7.936 3.894 1.00 0.00 N ATOM 1471 CA SER A 722 0.114 -8.547 4.606 1.00 0.00 C ATOM 1472 C SER A 722 -0.838 -9.225 3.628 1.00 0.00 C ATOM 1473 O SER A 722 -1.585 -10.131 3.999 1.00 0.00 O ATOM 1474 CB SER A 722 -0.639 -7.481 5.399 1.00 0.00 C ATOM 1475 OG SER A 722 0.047 -7.227 6.617 1.00 0.00 O ATOM 0 H SER A 722 1.101 -6.949 3.670 1.00 0.00 H new ATOM 0 HA SER A 722 0.508 -9.299 5.289 1.00 0.00 H new ATOM 0 HB2 SER A 722 -0.717 -6.564 4.814 1.00 0.00 H new ATOM 0 HB3 SER A 722 -1.656 -7.815 5.604 1.00 0.00 H new ATOM 0 HG SER A 722 -0.596 -6.955 7.304 1.00 0.00 H new ATOM 1481 N ALA A 723 -0.808 -8.779 2.376 1.00 0.00 N ATOM 1482 CA ALA A 723 -1.676 -9.350 1.352 1.00 0.00 C ATOM 1483 C ALA A 723 -1.282 -8.832 -0.027 1.00 0.00 C ATOM 1484 O ALA A 723 -0.553 -7.847 -0.145 1.00 0.00 O ATOM 1485 CB ALA A 723 -3.134 -8.991 1.642 1.00 0.00 C ATOM 0 H ALA A 723 -0.198 -8.030 2.048 1.00 0.00 H new ATOM 0 HA ALA A 723 -1.564 -10.434 1.366 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -3.775 -9.421 0.872 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -3.420 -9.388 2.616 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -3.248 -7.907 1.645 1.00 0.00 H new ATOM 1491 N ILE A 724 -1.759 -9.507 -1.069 1.00 0.00 N ATOM 1492 CA ILE A 724 -1.433 -9.103 -2.432 1.00 0.00 C ATOM 1493 C ILE A 724 -2.650 -9.230 -3.344 1.00 0.00 C ATOM 1494 O ILE A 724 -3.291 -10.280 -3.395 1.00 0.00 O ATOM 1495 CB ILE A 724 -0.307 -9.985 -2.973 1.00 0.00 C ATOM 1496 CG1 ILE A 724 0.861 -9.989 -1.984 1.00 0.00 C ATOM 1497 CG2 ILE A 724 0.169 -9.437 -4.320 1.00 0.00 C ATOM 1498 CD1 ILE A 724 2.006 -10.832 -2.548 1.00 0.00 C ATOM 0 H ILE A 724 -2.364 -10.325 -0.998 1.00 0.00 H new ATOM 0 HA ILE A 724 -1.116 -8.060 -2.413 1.00 0.00 H new ATOM 0 HB ILE A 724 -0.676 -11.002 -3.104 1.00 0.00 H new ATOM 0 HG12 ILE A 724 1.201 -8.969 -1.803 1.00 0.00 H new ATOM 0 HG13 ILE A 724 0.537 -10.392 -1.024 1.00 0.00 H new ATOM 0 HG21 ILE A 724 0.972 -10.066 -4.705 1.00 0.00 H new ATOM 0 HG22 ILE A 724 -0.661 -9.435 -5.026 1.00 0.00 H new ATOM 0 HG23 ILE A 724 0.536 -8.419 -4.189 1.00 0.00 H new ATOM 0 HD11 ILE A 724 2.837 -10.834 -1.843 1.00 0.00 H new ATOM 0 HD12 ILE A 724 1.662 -11.854 -2.706 1.00 0.00 H new ATOM 0 HD13 ILE A 724 2.336 -10.409 -3.497 1.00 0.00 H new ATOM 1510 N LEU A 725 -2.957 -8.160 -4.072 1.00 0.00 N ATOM 1511 CA LEU A 725 -4.092 -8.174 -4.988 1.00 0.00 C ATOM 1512 C LEU A 725 -3.601 -8.235 -6.432 1.00 0.00 C ATOM 1513 O LEU A 725 -2.798 -7.406 -6.859 1.00 0.00 O ATOM 1514 CB LEU A 725 -4.946 -6.921 -4.789 1.00 0.00 C ATOM 1515 CG LEU A 725 -5.361 -6.813 -3.320 1.00 0.00 C ATOM 1516 CD1 LEU A 725 -6.365 -5.671 -3.154 1.00 0.00 C ATOM 1517 CD2 LEU A 725 -6.005 -8.127 -2.872 1.00 0.00 C ATOM 0 H LEU A 725 -2.441 -7.281 -4.046 1.00 0.00 H new ATOM 0 HA LEU A 725 -4.697 -9.056 -4.778 1.00 0.00 H new ATOM 0 HB2 LEU A 725 -4.385 -6.035 -5.085 1.00 0.00 H new ATOM 0 HB3 LEU A 725 -5.830 -6.966 -5.425 1.00 0.00 H new ATOM 0 HG LEU A 725 -4.480 -6.613 -2.710 1.00 0.00 H new ATOM 0 HD11 LEU A 725 -6.660 -5.595 -2.107 1.00 0.00 H new ATOM 0 HD12 LEU A 725 -5.906 -4.734 -3.471 1.00 0.00 H new ATOM 0 HD13 LEU A 725 -7.245 -5.869 -3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -6.300 -8.049 -1.826 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -6.885 -8.328 -3.483 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -5.289 -8.941 -2.988 1.00 0.00 H new ATOM 1529 N SER A 726 -4.082 -9.226 -7.176 1.00 0.00 N ATOM 1530 CA SER A 726 -3.676 -9.388 -8.568 1.00 0.00 C ATOM 1531 C SER A 726 -4.288 -8.308 -9.456 1.00 0.00 C ATOM 1532 O SER A 726 -3.699 -7.245 -9.653 1.00 0.00 O ATOM 1533 CB SER A 726 -4.099 -10.768 -9.074 1.00 0.00 C ATOM 1534 OG SER A 726 -3.464 -11.772 -8.293 1.00 0.00 O ATOM 0 H SER A 726 -4.747 -9.923 -6.842 1.00 0.00 H new ATOM 0 HA SER A 726 -2.591 -9.293 -8.615 1.00 0.00 H new ATOM 0 HB2 SER A 726 -5.182 -10.874 -9.012 1.00 0.00 H new ATOM 0 HB3 SER A 726 -3.827 -10.882 -10.123 1.00 0.00 H new ATOM 0 HG SER A 726 -3.735 -12.657 -8.615 1.00 0.00 H new ATOM 1540 N LYS A 727 -5.463 -8.598 -10.008 1.00 0.00 N ATOM 1541 CA LYS A 727 -6.134 -7.652 -10.895 1.00 0.00 C ATOM 1542 C LYS A 727 -7.603 -7.438 -10.513 1.00 0.00 C ATOM 1543 O LYS A 727 -8.140 -6.348 -10.711 1.00 0.00 O ATOM 1544 CB LYS A 727 -6.058 -8.160 -12.337 1.00 0.00 C ATOM 1545 CG LYS A 727 -6.836 -7.217 -13.256 1.00 0.00 C ATOM 1546 CD LYS A 727 -6.230 -7.261 -14.661 1.00 0.00 C ATOM 1547 CE LYS A 727 -7.207 -6.642 -15.662 1.00 0.00 C ATOM 1548 NZ LYS A 727 -6.443 -6.048 -16.795 1.00 0.00 N ATOM 0 H LYS A 727 -5.967 -9.472 -9.859 1.00 0.00 H new ATOM 0 HA LYS A 727 -5.622 -6.695 -10.798 1.00 0.00 H new ATOM 0 HB2 LYS A 727 -5.018 -8.220 -12.658 1.00 0.00 H new ATOM 0 HB3 LYS A 727 -6.470 -9.167 -12.400 1.00 0.00 H new ATOM 0 HG2 LYS A 727 -7.885 -7.510 -13.291 1.00 0.00 H new ATOM 0 HG3 LYS A 727 -6.802 -6.200 -12.865 1.00 0.00 H new ATOM 0 HD2 LYS A 727 -5.285 -6.718 -14.677 1.00 0.00 H new ATOM 0 HD3 LYS A 727 -6.011 -8.291 -14.941 1.00 0.00 H new ATOM 0 HE2 LYS A 727 -7.896 -7.401 -16.032 1.00 0.00 H new ATOM 0 HE3 LYS A 727 -7.809 -5.876 -15.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 727 -7.105 -5.626 -17.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 727 -5.803 -5.312 -16.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 727 -5.887 -6.790 -17.266 1.00 0.00 H new ATOM 1562 N PRO A 728 -8.267 -8.441 -9.991 1.00 0.00 N ATOM 1563 CA PRO A 728 -9.707 -8.330 -9.605 1.00 0.00 C ATOM 1564 C PRO A 728 -9.961 -7.151 -8.669 1.00 0.00 C ATOM 1565 O PRO A 728 -9.077 -6.744 -7.915 1.00 0.00 O ATOM 1566 CB PRO A 728 -10.009 -9.662 -8.913 1.00 0.00 C ATOM 1567 CG PRO A 728 -8.984 -10.613 -9.432 1.00 0.00 C ATOM 1568 CD PRO A 728 -7.734 -9.781 -9.706 1.00 0.00 C ATOM 0 HA PRO A 728 -10.348 -8.146 -10.467 1.00 0.00 H new ATOM 0 HB2 PRO A 728 -9.944 -9.566 -7.829 1.00 0.00 H new ATOM 0 HB3 PRO A 728 -11.017 -10.006 -9.143 1.00 0.00 H new ATOM 0 HG2 PRO A 728 -8.778 -11.398 -8.705 1.00 0.00 H new ATOM 0 HG3 PRO A 728 -9.332 -11.104 -10.341 1.00 0.00 H new ATOM 0 HD2 PRO A 728 -7.063 -9.771 -8.847 1.00 0.00 H new ATOM 0 HD3 PRO A 728 -7.167 -10.175 -10.550 1.00 0.00 H new ATOM 1576 N LEU A 729 -11.170 -6.602 -8.733 1.00 0.00 N ATOM 1577 CA LEU A 729 -11.525 -5.462 -7.897 1.00 0.00 C ATOM 1578 C LEU A 729 -11.341 -5.799 -6.420 1.00 0.00 C ATOM 1579 O LEU A 729 -10.685 -5.064 -5.682 1.00 0.00 O ATOM 1580 CB LEU A 729 -12.984 -5.077 -8.153 1.00 0.00 C ATOM 1581 CG LEU A 729 -13.190 -4.809 -9.645 1.00 0.00 C ATOM 1582 CD1 LEU A 729 -14.649 -4.426 -9.900 1.00 0.00 C ATOM 1583 CD2 LEU A 729 -12.279 -3.664 -10.090 1.00 0.00 C ATOM 0 H LEU A 729 -11.915 -6.925 -9.350 1.00 0.00 H new ATOM 0 HA LEU A 729 -10.871 -4.627 -8.149 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -13.645 -5.878 -7.822 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -13.243 -4.190 -7.575 1.00 0.00 H new ATOM 0 HG LEU A 729 -12.946 -5.709 -10.210 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -14.795 -4.235 -10.963 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -15.300 -5.242 -9.585 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -14.894 -3.528 -9.333 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -12.426 -3.474 -11.153 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -12.521 -2.765 -9.523 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -11.239 -3.936 -9.911 1.00 0.00 H new ATOM 1595 N ASP A 730 -11.918 -6.919 -5.998 1.00 0.00 N ATOM 1596 CA ASP A 730 -11.804 -7.352 -4.610 1.00 0.00 C ATOM 1597 C ASP A 730 -11.932 -6.166 -3.655 1.00 0.00 C ATOM 1598 O ASP A 730 -11.037 -5.911 -2.849 1.00 0.00 O ATOM 1599 CB ASP A 730 -10.457 -8.043 -4.389 1.00 0.00 C ATOM 1600 CG ASP A 730 -10.377 -9.309 -5.236 1.00 0.00 C ATOM 1601 OD1 ASP A 730 -11.420 -9.867 -5.531 1.00 0.00 O ATOM 1602 OD2 ASP A 730 -9.273 -9.701 -5.577 1.00 0.00 O ATOM 0 H ASP A 730 -12.466 -7.540 -6.593 1.00 0.00 H new ATOM 0 HA ASP A 730 -12.614 -8.052 -4.405 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -9.644 -7.367 -4.653 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -10.335 -8.292 -3.335 1.00 0.00 H new ATOM 1607 N PRO A 731 -13.019 -5.443 -3.727 1.00 0.00 N ATOM 1608 CA PRO A 731 -13.257 -4.266 -2.850 1.00 0.00 C ATOM 1609 C PRO A 731 -13.802 -4.671 -1.483 1.00 0.00 C ATOM 1610 O PRO A 731 -13.577 -3.985 -0.482 1.00 0.00 O ATOM 1611 CB PRO A 731 -14.282 -3.449 -3.633 1.00 0.00 C ATOM 1612 CG PRO A 731 -15.044 -4.442 -4.453 1.00 0.00 C ATOM 1613 CD PRO A 731 -14.140 -5.666 -4.650 1.00 0.00 C ATOM 0 HA PRO A 731 -12.342 -3.716 -2.632 1.00 0.00 H new ATOM 0 HB2 PRO A 731 -14.945 -2.904 -2.961 1.00 0.00 H new ATOM 0 HB3 PRO A 731 -13.793 -2.710 -4.267 1.00 0.00 H new ATOM 0 HG2 PRO A 731 -15.969 -4.725 -3.951 1.00 0.00 H new ATOM 0 HG3 PRO A 731 -15.323 -4.012 -5.415 1.00 0.00 H new ATOM 0 HD2 PRO A 731 -14.668 -6.591 -4.419 1.00 0.00 H new ATOM 0 HD3 PRO A 731 -13.796 -5.745 -5.681 1.00 0.00 H new ATOM 1621 N GLN A 732 -14.507 -5.798 -1.443 1.00 0.00 N ATOM 1622 CA GLN A 732 -15.066 -6.285 -0.190 1.00 0.00 C ATOM 1623 C GLN A 732 -13.956 -6.847 0.682 1.00 0.00 C ATOM 1624 O GLN A 732 -13.961 -6.678 1.902 1.00 0.00 O ATOM 1625 CB GLN A 732 -16.103 -7.375 -0.460 1.00 0.00 C ATOM 1626 CG GLN A 732 -15.393 -8.624 -0.975 1.00 0.00 C ATOM 1627 CD GLN A 732 -16.416 -9.669 -1.407 1.00 0.00 C ATOM 1628 OE1 GLN A 732 -17.420 -9.336 -2.036 1.00 0.00 O ATOM 1629 NE2 GLN A 732 -16.219 -10.923 -1.102 1.00 0.00 N ATOM 0 H GLN A 732 -14.702 -6.384 -2.255 1.00 0.00 H new ATOM 0 HA GLN A 732 -15.550 -5.455 0.324 1.00 0.00 H new ATOM 0 HB2 GLN A 732 -16.653 -7.605 0.452 1.00 0.00 H new ATOM 0 HB3 GLN A 732 -16.831 -7.028 -1.193 1.00 0.00 H new ATOM 0 HG2 GLN A 732 -14.749 -8.365 -1.816 1.00 0.00 H new ATOM 0 HG3 GLN A 732 -14.750 -9.034 -0.196 1.00 0.00 H new ATOM 0 HE21 GLN A 732 -15.386 -11.196 -0.581 1.00 0.00 H new ATOM 0 HE22 GLN A 732 -16.898 -11.629 -1.385 1.00 0.00 H new ATOM 1638 N LEU A 733 -12.995 -7.504 0.044 1.00 0.00 N ATOM 1639 CA LEU A 733 -11.870 -8.071 0.768 1.00 0.00 C ATOM 1640 C LEU A 733 -11.011 -6.955 1.345 1.00 0.00 C ATOM 1641 O LEU A 733 -10.540 -7.042 2.478 1.00 0.00 O ATOM 1642 CB LEU A 733 -11.025 -8.940 -0.165 1.00 0.00 C ATOM 1643 CG LEU A 733 -9.869 -9.555 0.623 1.00 0.00 C ATOM 1644 CD1 LEU A 733 -10.421 -10.557 1.638 1.00 0.00 C ATOM 1645 CD2 LEU A 733 -8.923 -10.275 -0.340 1.00 0.00 C ATOM 0 H LEU A 733 -12.974 -7.655 -0.965 1.00 0.00 H new ATOM 0 HA LEU A 733 -12.252 -8.690 1.580 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -11.640 -9.726 -0.604 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -10.639 -8.340 -0.989 1.00 0.00 H new ATOM 0 HG LEU A 733 -9.326 -8.768 1.147 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -9.597 -10.996 2.201 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -11.097 -10.046 2.324 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -10.963 -11.344 1.114 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -8.098 -10.714 0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -9.466 -11.062 -0.863 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -8.530 -9.562 -1.065 1.00 0.00 H new ATOM 1657 N LEU A 734 -10.821 -5.899 0.558 1.00 0.00 N ATOM 1658 CA LEU A 734 -10.026 -4.767 1.007 1.00 0.00 C ATOM 1659 C LEU A 734 -10.583 -4.229 2.320 1.00 0.00 C ATOM 1660 O LEU A 734 -9.839 -3.996 3.272 1.00 0.00 O ATOM 1661 CB LEU A 734 -10.040 -3.662 -0.052 1.00 0.00 C ATOM 1662 CG LEU A 734 -9.094 -2.538 0.372 1.00 0.00 C ATOM 1663 CD1 LEU A 734 -7.646 -3.011 0.230 1.00 0.00 C ATOM 1664 CD2 LEU A 734 -9.320 -1.317 -0.523 1.00 0.00 C ATOM 0 H LEU A 734 -11.203 -5.806 -0.383 1.00 0.00 H new ATOM 0 HA LEU A 734 -8.999 -5.098 1.162 1.00 0.00 H new ATOM 0 HB2 LEU A 734 -9.734 -4.065 -1.017 1.00 0.00 H new ATOM 0 HB3 LEU A 734 -11.051 -3.274 -0.175 1.00 0.00 H new ATOM 0 HG LEU A 734 -9.290 -2.270 1.410 1.00 0.00 H new ATOM 0 HD11 LEU A 734 -6.971 -2.211 0.532 1.00 0.00 H new ATOM 0 HD12 LEU A 734 -7.484 -3.882 0.865 1.00 0.00 H new ATOM 0 HD13 LEU A 734 -7.451 -3.278 -0.809 1.00 0.00 H new ATOM 0 HD21 LEU A 734 -8.646 -0.515 -0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 734 -9.123 -1.585 -1.561 1.00 0.00 H new ATOM 0 HD23 LEU A 734 -10.352 -0.980 -0.425 1.00 0.00 H new ATOM 1676 N LEU A 735 -11.901 -4.045 2.368 1.00 0.00 N ATOM 1677 CA LEU A 735 -12.543 -3.546 3.580 1.00 0.00 C ATOM 1678 C LEU A 735 -12.375 -4.548 4.718 1.00 0.00 C ATOM 1679 O LEU A 735 -12.052 -4.177 5.846 1.00 0.00 O ATOM 1680 CB LEU A 735 -14.031 -3.305 3.320 1.00 0.00 C ATOM 1681 CG LEU A 735 -14.653 -2.584 4.519 1.00 0.00 C ATOM 1682 CD1 LEU A 735 -15.784 -1.674 4.035 1.00 0.00 C ATOM 1683 CD2 LEU A 735 -15.218 -3.614 5.501 1.00 0.00 C ATOM 0 H LEU A 735 -12.537 -4.231 1.593 1.00 0.00 H new ATOM 0 HA LEU A 735 -12.070 -2.606 3.864 1.00 0.00 H new ATOM 0 HB2 LEU A 735 -14.161 -2.708 2.417 1.00 0.00 H new ATOM 0 HB3 LEU A 735 -14.539 -4.254 3.150 1.00 0.00 H new ATOM 0 HG LEU A 735 -13.889 -1.987 5.017 1.00 0.00 H new ATOM 0 HD11 LEU A 735 -16.228 -1.160 4.888 1.00 0.00 H new ATOM 0 HD12 LEU A 735 -15.386 -0.939 3.336 1.00 0.00 H new ATOM 0 HD13 LEU A 735 -16.545 -2.274 3.536 1.00 0.00 H new ATOM 0 HD21 LEU A 735 -15.660 -3.099 6.354 1.00 0.00 H new ATOM 0 HD22 LEU A 735 -15.981 -4.212 5.002 1.00 0.00 H new ATOM 0 HD23 LEU A 735 -14.415 -4.265 5.847 1.00 0.00 H new ATOM 1695 N THR A 736 -12.590 -5.822 4.406 1.00 0.00 N ATOM 1696 CA THR A 736 -12.453 -6.880 5.399 1.00 0.00 C ATOM 1697 C THR A 736 -11.027 -6.931 5.935 1.00 0.00 C ATOM 1698 O THR A 736 -10.806 -7.175 7.121 1.00 0.00 O ATOM 1699 CB THR A 736 -12.813 -8.230 4.775 1.00 0.00 C ATOM 1700 OG1 THR A 736 -14.137 -8.174 4.261 1.00 0.00 O ATOM 1701 CG2 THR A 736 -12.720 -9.329 5.835 1.00 0.00 C ATOM 0 H THR A 736 -12.859 -6.145 3.477 1.00 0.00 H new ATOM 0 HA THR A 736 -13.132 -6.667 6.225 1.00 0.00 H new ATOM 0 HB THR A 736 -12.117 -8.452 3.966 1.00 0.00 H new ATOM 0 HG1 THR A 736 -14.140 -7.671 3.420 1.00 0.00 H new ATOM 0 HG21 THR A 736 -12.977 -10.289 5.387 1.00 0.00 H new ATOM 0 HG22 THR A 736 -11.704 -9.372 6.227 1.00 0.00 H new ATOM 0 HG23 THR A 736 -13.413 -9.110 6.647 1.00 0.00 H new ATOM 1709 N THR A 737 -10.063 -6.711 5.046 1.00 0.00 N ATOM 1710 CA THR A 737 -8.657 -6.745 5.429 1.00 0.00 C ATOM 1711 C THR A 737 -8.346 -5.685 6.483 1.00 0.00 C ATOM 1712 O THR A 737 -7.626 -5.951 7.445 1.00 0.00 O ATOM 1713 CB THR A 737 -7.779 -6.512 4.198 1.00 0.00 C ATOM 1714 OG1 THR A 737 -8.126 -7.450 3.188 1.00 0.00 O ATOM 1715 CG2 THR A 737 -6.309 -6.688 4.578 1.00 0.00 C ATOM 0 H THR A 737 -10.229 -6.508 4.060 1.00 0.00 H new ATOM 0 HA THR A 737 -8.446 -7.726 5.854 1.00 0.00 H new ATOM 0 HB THR A 737 -7.936 -5.500 3.824 1.00 0.00 H new ATOM 0 HG1 THR A 737 -8.863 -7.093 2.650 1.00 0.00 H new ATOM 0 HG21 THR A 737 -5.684 -6.522 3.701 1.00 0.00 H new ATOM 0 HG22 THR A 737 -6.045 -5.969 5.353 1.00 0.00 H new ATOM 0 HG23 THR A 737 -6.148 -7.699 4.952 1.00 0.00 H new ATOM 1723 N LEU A 738 -8.890 -4.486 6.301 1.00 0.00 N ATOM 1724 CA LEU A 738 -8.652 -3.407 7.253 1.00 0.00 C ATOM 1725 C LEU A 738 -9.229 -3.766 8.618 1.00 0.00 C ATOM 1726 O LEU A 738 -8.632 -3.472 9.654 1.00 0.00 O ATOM 1727 CB LEU A 738 -9.293 -2.110 6.753 1.00 0.00 C ATOM 1728 CG LEU A 738 -8.679 -1.713 5.408 1.00 0.00 C ATOM 1729 CD1 LEU A 738 -9.193 -0.331 5.003 1.00 0.00 C ATOM 1730 CD2 LEU A 738 -7.155 -1.671 5.537 1.00 0.00 C ATOM 0 H LEU A 738 -9.491 -4.239 5.514 1.00 0.00 H new ATOM 0 HA LEU A 738 -7.576 -3.264 7.347 1.00 0.00 H new ATOM 0 HB2 LEU A 738 -10.370 -2.243 6.647 1.00 0.00 H new ATOM 0 HB3 LEU A 738 -9.141 -1.314 7.482 1.00 0.00 H new ATOM 0 HG LEU A 738 -8.960 -2.443 4.649 1.00 0.00 H new ATOM 0 HD11 LEU A 738 -8.757 -0.047 4.045 1.00 0.00 H new ATOM 0 HD12 LEU A 738 -10.279 -0.359 4.913 1.00 0.00 H new ATOM 0 HD13 LEU A 738 -8.910 0.399 5.761 1.00 0.00 H new ATOM 0 HD21 LEU A 738 -6.716 -1.388 4.580 1.00 0.00 H new ATOM 0 HD22 LEU A 738 -6.874 -0.940 6.295 1.00 0.00 H new ATOM 0 HD23 LEU A 738 -6.787 -2.655 5.828 1.00 0.00 H new ATOM 1742 N GLN A 739 -10.394 -4.406 8.608 1.00 0.00 N ATOM 1743 CA GLN A 739 -11.050 -4.807 9.847 1.00 0.00 C ATOM 1744 C GLN A 739 -10.214 -5.841 10.597 1.00 0.00 C ATOM 1745 O GLN A 739 -10.197 -5.864 11.827 1.00 0.00 O ATOM 1746 CB GLN A 739 -12.428 -5.392 9.535 1.00 0.00 C ATOM 1747 CG GLN A 739 -13.326 -4.300 8.954 1.00 0.00 C ATOM 1748 CD GLN A 739 -14.678 -4.890 8.568 1.00 0.00 C ATOM 1749 OE1 GLN A 739 -14.794 -6.099 8.369 1.00 0.00 O ATOM 1750 NE2 GLN A 739 -15.713 -4.104 8.450 1.00 0.00 N ATOM 0 H GLN A 739 -10.901 -4.657 7.759 1.00 0.00 H new ATOM 0 HA GLN A 739 -11.158 -3.925 10.479 1.00 0.00 H new ATOM 0 HB2 GLN A 739 -12.333 -6.215 8.827 1.00 0.00 H new ATOM 0 HB3 GLN A 739 -12.875 -5.801 10.441 1.00 0.00 H new ATOM 0 HG2 GLN A 739 -13.463 -3.503 9.685 1.00 0.00 H new ATOM 0 HG3 GLN A 739 -12.851 -3.854 8.080 1.00 0.00 H new ATOM 0 HE21 GLN A 739 -15.614 -3.102 8.615 1.00 0.00 H new ATOM 0 HE22 GLN A 739 -16.621 -4.491 8.192 1.00 0.00 H new ATOM 1759 N GLY A 740 -9.532 -6.700 9.847 1.00 0.00 N ATOM 1760 CA GLY A 740 -8.706 -7.741 10.450 1.00 0.00 C ATOM 1761 C GLY A 740 -7.601 -7.143 11.314 1.00 0.00 C ATOM 1762 O GLY A 740 -6.783 -7.869 11.880 1.00 0.00 O ATOM 0 H GLY A 740 -9.534 -6.697 8.827 1.00 0.00 H new ATOM 0 HA2 GLY A 740 -9.330 -8.397 11.057 1.00 0.00 H new ATOM 0 HA3 GLY A 740 -8.264 -8.357 9.666 1.00 0.00 H new ATOM 1766 N LEU A 741 -7.579 -5.819 11.413 1.00 0.00 N ATOM 1767 CA LEU A 741 -6.565 -5.142 12.214 1.00 0.00 C ATOM 1768 C LEU A 741 -6.969 -5.121 13.686 1.00 0.00 C ATOM 1769 O LEU A 741 -6.142 -4.872 14.563 1.00 0.00 O ATOM 1770 CB LEU A 741 -6.374 -3.711 11.706 1.00 0.00 C ATOM 1771 CG LEU A 741 -5.296 -3.007 12.533 1.00 0.00 C ATOM 1772 CD1 LEU A 741 -3.961 -3.732 12.360 1.00 0.00 C ATOM 1773 CD2 LEU A 741 -5.152 -1.562 12.051 1.00 0.00 C ATOM 0 H LEU A 741 -8.245 -5.197 10.954 1.00 0.00 H new ATOM 0 HA LEU A 741 -5.626 -5.687 12.120 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -6.088 -3.724 10.654 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -7.314 -3.163 11.774 1.00 0.00 H new ATOM 0 HG LEU A 741 -5.581 -3.018 13.585 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -3.195 -3.229 12.950 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -4.061 -4.763 12.698 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -3.675 -3.721 11.308 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -4.385 -1.057 12.638 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -4.866 -1.556 10.999 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -6.102 -1.042 12.172 1.00 0.00 H new