USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 694 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 688 ASN : amide:sc= -13.6! C(o=-13!,f=-17!) USER MOD Set 1.2: A 692 SER OG : rot 144:sc= 0.885 USER MOD Single : A 650 CYS SG : rot 16:sc= 0.275 USER MOD Single : A 656 GLN : amide:sc= -0.521 X(o=-0.52,f=-0.038) USER MOD Single : A 657 MET CE :methyl -164:sc= -2.93! (180deg=-3.41!) USER MOD Single : A 664 SER OG : rot -34:sc= -1.37! USER MOD Single : A 666 TYR OH : rot 180:sc= 0 USER MOD Single : A 667 LYS NZ :NH3+ -162:sc= -0.103 (180deg=-0.578) USER MOD Single : A 668 SER OG : rot 180:sc= -0.0885! USER MOD Single : A 672 THR OG1 : rot 180:sc= 0 USER MOD Single : A 673 SER OG : rot 180:sc= 0 USER MOD Single : A 674 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 676 LYS NZ :NH3+ -138:sc= 0.952 (180deg=-1.12) USER MOD Single : A 679 SER OG : rot 180:sc= 0 USER MOD Single : A 682 SER OG : rot 180:sc= 0 USER MOD Single : A 686 LYS NZ :NH3+ -161:sc= -0.0114 (180deg=-0.396) USER MOD Single : A 687 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 ASN : amide:sc= -5.93! C(o=-5.9!,f=-14!) USER MOD Single : A 696 SER OG : rot 120:sc= -2.69! USER MOD Single : A 702 GLN : amide:sc= -11! C(o=-11!,f=-21!) USER MOD Single : A 711 THR OG1 : rot 180:sc= -2.81! USER MOD Single : A 714 HIS : no HD1:sc= -0.836 X(o=-0.84,f=-1.2) USER MOD Single : A 715 SER OG : rot 180:sc= 0 USER MOD Single : A 717 ASN : amide:sc= -6.84! C(o=-6.8!,f=-3.3!) USER MOD Single : A 720 TYR OH : rot 180:sc= 0 USER MOD Single : A 722 MET CE :methyl -97:sc= -6.23! (180deg=-7.27!) USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 HIS : no HE2:sc= -22.4! C(o=-22!,f=-27!) USER MOD Single : A 733 GLN : amide:sc= -3.31! C(o=-3.3!,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 649 -19.426 3.701 -7.035 1.00 0.00 N ATOM 33 CA ASP A 649 -18.218 4.468 -7.462 1.00 0.00 C ATOM 34 C ASP A 649 -16.956 3.777 -6.959 1.00 0.00 C ATOM 35 O ASP A 649 -17.001 2.955 -6.064 1.00 0.00 O ATOM 36 CB ASP A 649 -18.365 5.860 -6.843 1.00 0.00 C ATOM 37 CG ASP A 649 -19.469 6.622 -7.577 1.00 0.00 C ATOM 38 OD1 ASP A 649 -19.593 6.429 -8.775 1.00 0.00 O ATOM 39 OD2 ASP A 649 -20.162 7.393 -6.934 1.00 0.00 O ATOM 0 HA ASP A 649 -18.136 4.529 -8.547 1.00 0.00 H new ATOM 0 HB2 ASP A 649 -18.607 5.776 -5.783 1.00 0.00 H new ATOM 0 HB3 ASP A 649 -17.423 6.404 -6.913 1.00 0.00 H new ATOM 44 N CYS A 650 -15.830 4.089 -7.535 1.00 0.00 N ATOM 45 CA CYS A 650 -14.574 3.424 -7.091 1.00 0.00 C ATOM 46 C CYS A 650 -13.455 4.438 -6.886 1.00 0.00 C ATOM 47 O CYS A 650 -13.445 5.504 -7.472 1.00 0.00 O ATOM 48 CB CYS A 650 -14.199 2.491 -8.239 1.00 0.00 C ATOM 49 SG CYS A 650 -13.769 3.481 -9.692 1.00 0.00 S ATOM 0 H CYS A 650 -15.724 4.769 -8.287 1.00 0.00 H new ATOM 0 HA CYS A 650 -14.715 2.906 -6.143 1.00 0.00 H new ATOM 0 HB2 CYS A 650 -13.358 1.861 -7.951 1.00 0.00 H new ATOM 0 HB3 CYS A 650 -15.031 1.826 -8.470 1.00 0.00 H new ATOM 0 HG CYS A 650 -13.558 4.712 -9.331 1.00 0.00 H new ATOM 55 N ARG A 651 -12.500 4.090 -6.079 1.00 0.00 N ATOM 56 CA ARG A 651 -11.349 4.998 -5.840 1.00 0.00 C ATOM 57 C ARG A 651 -10.074 4.255 -6.215 1.00 0.00 C ATOM 58 O ARG A 651 -10.051 3.042 -6.273 1.00 0.00 O ATOM 59 CB ARG A 651 -11.359 5.297 -4.345 1.00 0.00 C ATOM 60 CG ARG A 651 -12.731 5.811 -3.922 1.00 0.00 C ATOM 61 CD ARG A 651 -12.628 6.428 -2.529 1.00 0.00 C ATOM 62 NE ARG A 651 -13.976 6.248 -1.951 1.00 0.00 N ATOM 63 CZ ARG A 651 -14.200 5.247 -1.158 1.00 0.00 C ATOM 64 NH1 ARG A 651 -13.631 4.097 -1.386 1.00 0.00 N ATOM 65 NH2 ARG A 651 -14.974 5.406 -0.124 1.00 0.00 N ATOM 0 H ARG A 651 -12.466 3.207 -5.569 1.00 0.00 H new ATOM 0 HA ARG A 651 -11.406 5.917 -6.423 1.00 0.00 H new ATOM 0 HB2 ARG A 651 -11.111 4.396 -3.784 1.00 0.00 H new ATOM 0 HB3 ARG A 651 -10.596 6.039 -4.110 1.00 0.00 H new ATOM 0 HG2 ARG A 651 -13.091 6.552 -4.636 1.00 0.00 H new ATOM 0 HG3 ARG A 651 -13.453 4.995 -3.919 1.00 0.00 H new ATOM 0 HD2 ARG A 651 -11.867 5.929 -1.928 1.00 0.00 H new ATOM 0 HD3 ARG A 651 -12.354 7.482 -2.580 1.00 0.00 H new ATOM 0 HE ARG A 651 -14.723 6.905 -2.174 1.00 0.00 H new ATOM 0 HH11 ARG A 651 -13.010 3.985 -2.188 1.00 0.00 H new ATOM 0 HH12 ARG A 651 -13.806 3.309 -0.763 1.00 0.00 H new ATOM 0 HH21 ARG A 651 -15.401 6.314 0.059 1.00 0.00 H new ATOM 0 HH22 ARG A 651 -15.154 4.622 0.504 1.00 0.00 H new ATOM 79 N ILE A 652 -9.019 4.948 -6.483 1.00 0.00 N ATOM 80 CA ILE A 652 -7.773 4.241 -6.863 1.00 0.00 C ATOM 81 C ILE A 652 -6.696 4.444 -5.790 1.00 0.00 C ATOM 82 O ILE A 652 -6.702 5.408 -5.050 1.00 0.00 O ATOM 83 CB ILE A 652 -7.406 4.842 -8.213 1.00 0.00 C ATOM 84 CG1 ILE A 652 -7.093 6.327 -8.026 1.00 0.00 C ATOM 85 CG2 ILE A 652 -8.607 4.671 -9.164 1.00 0.00 C ATOM 86 CD1 ILE A 652 -6.181 6.810 -9.153 1.00 0.00 C ATOM 0 H ILE A 652 -8.960 5.966 -6.457 1.00 0.00 H new ATOM 0 HA ILE A 652 -7.883 3.159 -6.938 1.00 0.00 H new ATOM 0 HB ILE A 652 -6.532 4.343 -8.633 1.00 0.00 H new ATOM 0 HG12 ILE A 652 -8.017 6.905 -8.021 1.00 0.00 H new ATOM 0 HG13 ILE A 652 -6.611 6.488 -7.062 1.00 0.00 H new ATOM 0 HG21 ILE A 652 -8.363 5.096 -10.138 1.00 0.00 H new ATOM 0 HG22 ILE A 652 -8.833 3.611 -9.277 1.00 0.00 H new ATOM 0 HG23 ILE A 652 -9.475 5.185 -8.751 1.00 0.00 H new ATOM 0 HD11 ILE A 652 -5.961 7.869 -9.015 1.00 0.00 H new ATOM 0 HD12 ILE A 652 -5.251 6.241 -9.138 1.00 0.00 H new ATOM 0 HD13 ILE A 652 -6.679 6.665 -10.112 1.00 0.00 H new ATOM 98 N ILE A 653 -5.801 3.505 -5.674 1.00 0.00 N ATOM 99 CA ILE A 653 -4.737 3.576 -4.619 1.00 0.00 C ATOM 100 C ILE A 653 -3.346 3.443 -5.234 1.00 0.00 C ATOM 101 O ILE A 653 -3.151 2.812 -6.257 1.00 0.00 O ATOM 102 CB ILE A 653 -5.036 2.411 -3.636 1.00 0.00 C ATOM 103 CG1 ILE A 653 -3.766 1.575 -3.357 1.00 0.00 C ATOM 104 CG2 ILE A 653 -6.129 1.506 -4.211 1.00 0.00 C ATOM 105 CD1 ILE A 653 -4.130 0.318 -2.564 1.00 0.00 C ATOM 0 H ILE A 653 -5.756 2.678 -6.270 1.00 0.00 H new ATOM 0 HA ILE A 653 -4.747 4.537 -4.105 1.00 0.00 H new ATOM 0 HB ILE A 653 -5.377 2.845 -2.696 1.00 0.00 H new ATOM 0 HG12 ILE A 653 -3.290 1.297 -4.297 1.00 0.00 H new ATOM 0 HG13 ILE A 653 -3.044 2.171 -2.799 1.00 0.00 H new ATOM 0 HG21 ILE A 653 -6.331 0.692 -3.515 1.00 0.00 H new ATOM 0 HG22 ILE A 653 -7.039 2.087 -4.365 1.00 0.00 H new ATOM 0 HG23 ILE A 653 -5.796 1.094 -5.164 1.00 0.00 H new ATOM 0 HD11 ILE A 653 -3.229 -0.265 -2.372 1.00 0.00 H new ATOM 0 HD12 ILE A 653 -4.585 0.605 -1.616 1.00 0.00 H new ATOM 0 HD13 ILE A 653 -4.835 -0.283 -3.138 1.00 0.00 H new ATOM 117 N ARG A 654 -2.385 4.058 -4.614 1.00 0.00 N ATOM 118 CA ARG A 654 -1.001 4.007 -5.136 1.00 0.00 C ATOM 119 C ARG A 654 0.012 4.022 -4.002 1.00 0.00 C ATOM 120 O ARG A 654 -0.096 4.790 -3.070 1.00 0.00 O ATOM 121 CB ARG A 654 -0.884 5.266 -5.962 1.00 0.00 C ATOM 122 CG ARG A 654 0.563 5.444 -6.399 1.00 0.00 C ATOM 123 CD ARG A 654 0.598 6.245 -7.694 1.00 0.00 C ATOM 124 NE ARG A 654 0.741 5.216 -8.755 1.00 0.00 N ATOM 125 CZ ARG A 654 -0.314 4.790 -9.389 1.00 0.00 C ATOM 126 NH1 ARG A 654 -1.170 3.999 -8.796 1.00 0.00 N ATOM 127 NH2 ARG A 654 -0.515 5.158 -10.619 1.00 0.00 N ATOM 0 H ARG A 654 -2.502 4.600 -3.758 1.00 0.00 H new ATOM 0 HA ARG A 654 -0.803 3.099 -5.706 1.00 0.00 H new ATOM 0 HB2 ARG A 654 -1.535 5.205 -6.834 1.00 0.00 H new ATOM 0 HB3 ARG A 654 -1.210 6.129 -5.381 1.00 0.00 H new ATOM 0 HG2 ARG A 654 1.129 5.959 -5.623 1.00 0.00 H new ATOM 0 HG3 ARG A 654 1.034 4.472 -6.545 1.00 0.00 H new ATOM 0 HD2 ARG A 654 -0.313 6.829 -7.826 1.00 0.00 H new ATOM 0 HD3 ARG A 654 1.431 6.947 -7.705 1.00 0.00 H new ATOM 0 HE ARG A 654 1.662 4.844 -8.986 1.00 0.00 H new ATOM 0 HH11 ARG A 654 -1.014 3.711 -7.830 1.00 0.00 H new ATOM 0 HH12 ARG A 654 -1.994 3.670 -9.300 1.00 0.00 H new ATOM 0 HH21 ARG A 654 0.151 5.776 -11.082 1.00 0.00 H new ATOM 0 HH22 ARG A 654 -1.339 4.828 -11.122 1.00 0.00 H new ATOM 141 N VAL A 655 1.001 3.185 -4.082 1.00 0.00 N ATOM 142 CA VAL A 655 2.035 3.147 -3.010 1.00 0.00 C ATOM 143 C VAL A 655 3.422 3.010 -3.637 1.00 0.00 C ATOM 144 O VAL A 655 3.559 2.872 -4.834 1.00 0.00 O ATOM 145 CB VAL A 655 1.728 1.910 -2.167 1.00 0.00 C ATOM 146 CG1 VAL A 655 2.530 1.963 -0.872 1.00 0.00 C ATOM 147 CG2 VAL A 655 0.230 1.826 -1.840 1.00 0.00 C ATOM 0 H VAL A 655 1.142 2.522 -4.844 1.00 0.00 H new ATOM 0 HA VAL A 655 2.022 4.056 -2.409 1.00 0.00 H new ATOM 0 HB VAL A 655 2.006 1.025 -2.740 1.00 0.00 H new ATOM 0 HG11 VAL A 655 2.310 1.080 -0.272 1.00 0.00 H new ATOM 0 HG12 VAL A 655 3.595 1.988 -1.104 1.00 0.00 H new ATOM 0 HG13 VAL A 655 2.259 2.859 -0.313 1.00 0.00 H new ATOM 0 HG21 VAL A 655 0.038 0.937 -1.239 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -0.071 2.713 -1.282 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -0.342 1.769 -2.766 1.00 0.00 H new ATOM 157 N GLN A 656 4.451 3.045 -2.844 1.00 0.00 N ATOM 158 CA GLN A 656 5.814 2.912 -3.419 1.00 0.00 C ATOM 159 C GLN A 656 6.725 2.077 -2.504 1.00 0.00 C ATOM 160 O GLN A 656 7.288 2.584 -1.553 1.00 0.00 O ATOM 161 CB GLN A 656 6.313 4.358 -3.544 1.00 0.00 C ATOM 162 CG GLN A 656 5.649 5.028 -4.755 1.00 0.00 C ATOM 163 CD GLN A 656 5.835 6.547 -4.669 1.00 0.00 C ATOM 164 OE1 GLN A 656 6.231 7.176 -5.631 1.00 0.00 O ATOM 165 NE2 GLN A 656 5.547 7.168 -3.554 1.00 0.00 N ATOM 0 H GLN A 656 4.409 3.159 -1.831 1.00 0.00 H new ATOM 0 HA GLN A 656 5.814 2.392 -4.377 1.00 0.00 H new ATOM 0 HB2 GLN A 656 6.081 4.914 -2.635 1.00 0.00 H new ATOM 0 HB3 GLN A 656 7.397 4.371 -3.657 1.00 0.00 H new ATOM 0 HG2 GLN A 656 6.088 4.650 -5.678 1.00 0.00 H new ATOM 0 HG3 GLN A 656 4.587 4.783 -4.782 1.00 0.00 H new ATOM 0 HE21 GLN A 656 5.215 6.640 -2.747 1.00 0.00 H new ATOM 0 HE22 GLN A 656 5.655 8.180 -3.492 1.00 0.00 H new ATOM 174 N MET A 657 6.912 0.806 -2.791 1.00 0.00 N ATOM 175 CA MET A 657 7.835 0.004 -1.929 1.00 0.00 C ATOM 176 C MET A 657 9.260 0.164 -2.488 1.00 0.00 C ATOM 177 O MET A 657 9.649 -0.477 -3.443 1.00 0.00 O ATOM 178 CB MET A 657 7.329 -1.456 -1.952 1.00 0.00 C ATOM 179 CG MET A 657 8.169 -2.304 -0.983 1.00 0.00 C ATOM 180 SD MET A 657 7.807 -1.820 0.726 1.00 0.00 S ATOM 181 CE MET A 657 9.241 -0.745 0.991 1.00 0.00 C ATOM 0 H MET A 657 6.477 0.303 -3.564 1.00 0.00 H new ATOM 0 HA MET A 657 7.855 0.336 -0.891 1.00 0.00 H new ATOM 0 HB2 MET A 657 6.278 -1.492 -1.667 1.00 0.00 H new ATOM 0 HB3 MET A 657 7.399 -1.861 -2.962 1.00 0.00 H new ATOM 0 HG2 MET A 657 7.949 -3.362 -1.126 1.00 0.00 H new ATOM 0 HG3 MET A 657 9.230 -2.168 -1.192 1.00 0.00 H new ATOM 0 HE1 MET A 657 9.370 -0.566 2.059 1.00 0.00 H new ATOM 0 HE2 MET A 657 10.135 -1.226 0.593 1.00 0.00 H new ATOM 0 HE3 MET A 657 9.083 0.205 0.481 1.00 0.00 H new ATOM 191 N GLU A 658 10.014 1.071 -1.910 1.00 0.00 N ATOM 192 CA GLU A 658 11.404 1.372 -2.398 1.00 0.00 C ATOM 193 C GLU A 658 12.462 0.382 -1.885 1.00 0.00 C ATOM 194 O GLU A 658 13.641 0.676 -1.919 1.00 0.00 O ATOM 195 CB GLU A 658 11.708 2.772 -1.842 1.00 0.00 C ATOM 196 CG GLU A 658 10.926 3.840 -2.620 1.00 0.00 C ATOM 197 CD GLU A 658 11.349 5.234 -2.141 1.00 0.00 C ATOM 198 OE1 GLU A 658 12.541 5.452 -1.991 1.00 0.00 O ATOM 199 OE2 GLU A 658 10.475 6.062 -1.935 1.00 0.00 O ATOM 0 H GLU A 658 9.721 1.626 -1.106 1.00 0.00 H new ATOM 0 HA GLU A 658 11.445 1.301 -3.485 1.00 0.00 H new ATOM 0 HB2 GLU A 658 11.443 2.816 -0.786 1.00 0.00 H new ATOM 0 HB3 GLU A 658 12.777 2.973 -1.911 1.00 0.00 H new ATOM 0 HG2 GLU A 658 11.115 3.738 -3.689 1.00 0.00 H new ATOM 0 HG3 GLU A 658 9.855 3.702 -2.471 1.00 0.00 H new ATOM 206 N LEU A 659 12.085 -0.764 -1.390 1.00 0.00 N ATOM 207 CA LEU A 659 13.139 -1.697 -0.867 1.00 0.00 C ATOM 208 C LEU A 659 12.774 -3.162 -1.093 1.00 0.00 C ATOM 209 O LEU A 659 11.636 -3.500 -1.344 1.00 0.00 O ATOM 210 CB LEU A 659 13.209 -1.418 0.625 1.00 0.00 C ATOM 211 CG LEU A 659 14.338 -2.253 1.266 1.00 0.00 C ATOM 212 CD1 LEU A 659 15.665 -2.047 0.519 1.00 0.00 C ATOM 213 CD2 LEU A 659 14.537 -1.811 2.717 1.00 0.00 C ATOM 0 H LEU A 659 11.122 -1.095 -1.323 1.00 0.00 H new ATOM 0 HA LEU A 659 14.086 -1.533 -1.381 1.00 0.00 H new ATOM 0 HB2 LEU A 659 13.388 -0.357 0.797 1.00 0.00 H new ATOM 0 HB3 LEU A 659 12.255 -1.660 1.094 1.00 0.00 H new ATOM 0 HG LEU A 659 14.052 -3.304 1.215 1.00 0.00 H new ATOM 0 HD11 LEU A 659 16.444 -2.646 0.990 1.00 0.00 H new ATOM 0 HD12 LEU A 659 15.549 -2.355 -0.520 1.00 0.00 H new ATOM 0 HD13 LEU A 659 15.944 -0.994 0.557 1.00 0.00 H new ATOM 0 HD21 LEU A 659 15.334 -2.400 3.171 1.00 0.00 H new ATOM 0 HD22 LEU A 659 14.807 -0.755 2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 659 13.612 -1.962 3.274 1.00 0.00 H new ATOM 225 N GLY A 660 13.739 -4.032 -1.001 1.00 0.00 N ATOM 226 CA GLY A 660 13.466 -5.476 -1.202 1.00 0.00 C ATOM 227 C GLY A 660 14.661 -6.104 -1.911 1.00 0.00 C ATOM 228 O GLY A 660 15.578 -5.414 -2.311 1.00 0.00 O ATOM 0 H GLY A 660 14.711 -3.801 -0.794 1.00 0.00 H new ATOM 0 HA2 GLY A 660 13.295 -5.966 -0.243 1.00 0.00 H new ATOM 0 HA3 GLY A 660 12.561 -5.611 -1.795 1.00 0.00 H new ATOM 232 N GLU A 661 14.660 -7.394 -2.109 1.00 0.00 N ATOM 233 CA GLU A 661 15.803 -8.003 -2.831 1.00 0.00 C ATOM 234 C GLU A 661 15.960 -7.211 -4.127 1.00 0.00 C ATOM 235 O GLU A 661 17.053 -6.902 -4.557 1.00 0.00 O ATOM 236 CB GLU A 661 15.418 -9.468 -3.096 1.00 0.00 C ATOM 237 CG GLU A 661 15.412 -10.257 -1.778 1.00 0.00 C ATOM 238 CD GLU A 661 15.152 -11.737 -2.078 1.00 0.00 C ATOM 239 OE1 GLU A 661 14.786 -12.036 -3.203 1.00 0.00 O ATOM 240 OE2 GLU A 661 15.329 -12.545 -1.181 1.00 0.00 O ATOM 0 H GLU A 661 13.930 -8.039 -1.807 1.00 0.00 H new ATOM 0 HA GLU A 661 16.745 -7.979 -2.283 1.00 0.00 H new ATOM 0 HB2 GLU A 661 14.434 -9.515 -3.562 1.00 0.00 H new ATOM 0 HB3 GLU A 661 16.124 -9.917 -3.795 1.00 0.00 H new ATOM 0 HG2 GLU A 661 16.367 -10.140 -1.266 1.00 0.00 H new ATOM 0 HG3 GLU A 661 14.643 -9.868 -1.111 1.00 0.00 H new ATOM 247 N ASP A 662 14.860 -6.827 -4.723 1.00 0.00 N ATOM 248 CA ASP A 662 14.932 -5.986 -5.949 1.00 0.00 C ATOM 249 C ASP A 662 14.440 -4.571 -5.601 1.00 0.00 C ATOM 250 O ASP A 662 14.797 -3.599 -6.239 1.00 0.00 O ATOM 251 CB ASP A 662 14.010 -6.649 -6.974 1.00 0.00 C ATOM 252 CG ASP A 662 14.572 -8.009 -7.389 1.00 0.00 C ATOM 253 OD1 ASP A 662 15.554 -8.428 -6.800 1.00 0.00 O ATOM 254 OD2 ASP A 662 14.006 -8.612 -8.287 1.00 0.00 O ATOM 0 H ASP A 662 13.917 -7.061 -4.412 1.00 0.00 H new ATOM 0 HA ASP A 662 15.944 -5.904 -6.345 1.00 0.00 H new ATOM 0 HB2 ASP A 662 13.013 -6.773 -6.551 1.00 0.00 H new ATOM 0 HB3 ASP A 662 13.907 -6.008 -7.849 1.00 0.00 H new ATOM 259 N GLY A 663 13.626 -4.455 -4.577 1.00 0.00 N ATOM 260 CA GLY A 663 13.112 -3.116 -4.159 1.00 0.00 C ATOM 261 C GLY A 663 12.343 -2.471 -5.301 1.00 0.00 C ATOM 262 O GLY A 663 12.889 -2.161 -6.337 1.00 0.00 O ATOM 0 H GLY A 663 13.295 -5.237 -4.011 1.00 0.00 H new ATOM 0 HA2 GLY A 663 12.464 -3.222 -3.289 1.00 0.00 H new ATOM 0 HA3 GLY A 663 13.943 -2.476 -3.862 1.00 0.00 H new ATOM 266 N SER A 664 11.078 -2.251 -5.113 1.00 0.00 N ATOM 267 CA SER A 664 10.280 -1.607 -6.186 1.00 0.00 C ATOM 268 C SER A 664 10.294 -0.104 -5.967 1.00 0.00 C ATOM 269 O SER A 664 10.994 0.390 -5.119 1.00 0.00 O ATOM 270 CB SER A 664 8.867 -2.161 -6.040 1.00 0.00 C ATOM 271 OG SER A 664 8.266 -1.631 -4.868 1.00 0.00 O ATOM 0 H SER A 664 10.562 -2.488 -4.266 1.00 0.00 H new ATOM 0 HA SER A 664 10.673 -1.806 -7.183 1.00 0.00 H new ATOM 0 HB2 SER A 664 8.272 -1.901 -6.915 1.00 0.00 H new ATOM 0 HB3 SER A 664 8.896 -3.249 -5.986 1.00 0.00 H new ATOM 0 HG SER A 664 8.949 -1.512 -4.175 1.00 0.00 H new ATOM 277 N VAL A 665 9.539 0.627 -6.721 1.00 0.00 N ATOM 278 CA VAL A 665 9.528 2.099 -6.532 1.00 0.00 C ATOM 279 C VAL A 665 8.095 2.640 -6.642 1.00 0.00 C ATOM 280 O VAL A 665 7.857 3.824 -6.496 1.00 0.00 O ATOM 281 CB VAL A 665 10.431 2.639 -7.645 1.00 0.00 C ATOM 282 CG1 VAL A 665 11.883 2.264 -7.335 1.00 0.00 C ATOM 283 CG2 VAL A 665 10.026 2.009 -8.979 1.00 0.00 C ATOM 0 H VAL A 665 8.929 0.275 -7.459 1.00 0.00 H new ATOM 0 HA VAL A 665 9.885 2.404 -5.548 1.00 0.00 H new ATOM 0 HB VAL A 665 10.330 3.723 -7.706 1.00 0.00 H new ATOM 0 HG11 VAL A 665 12.533 2.645 -8.123 1.00 0.00 H new ATOM 0 HG12 VAL A 665 12.176 2.701 -6.380 1.00 0.00 H new ATOM 0 HG13 VAL A 665 11.975 1.179 -7.281 1.00 0.00 H new ATOM 0 HG21 VAL A 665 10.668 2.392 -9.772 1.00 0.00 H new ATOM 0 HG22 VAL A 665 10.133 0.926 -8.917 1.00 0.00 H new ATOM 0 HG23 VAL A 665 8.988 2.259 -9.199 1.00 0.00 H new ATOM 293 N TYR A 666 7.131 1.787 -6.908 1.00 0.00 N ATOM 294 CA TYR A 666 5.727 2.282 -7.040 1.00 0.00 C ATOM 295 C TYR A 666 4.696 1.183 -6.750 1.00 0.00 C ATOM 296 O TYR A 666 5.022 0.043 -6.476 1.00 0.00 O ATOM 297 CB TYR A 666 5.613 2.694 -8.498 1.00 0.00 C ATOM 298 CG TYR A 666 5.621 1.439 -9.332 1.00 0.00 C ATOM 299 CD1 TYR A 666 6.827 0.795 -9.610 1.00 0.00 C ATOM 300 CD2 TYR A 666 4.416 0.908 -9.799 1.00 0.00 C ATOM 301 CE1 TYR A 666 6.833 -0.380 -10.357 1.00 0.00 C ATOM 302 CE2 TYR A 666 4.419 -0.267 -10.550 1.00 0.00 C ATOM 303 CZ TYR A 666 5.629 -0.913 -10.830 1.00 0.00 C ATOM 304 OH TYR A 666 5.634 -2.077 -11.567 1.00 0.00 O ATOM 0 H TYR A 666 7.256 0.783 -7.037 1.00 0.00 H new ATOM 0 HA TYR A 666 5.527 3.087 -6.333 1.00 0.00 H new ATOM 0 HB2 TYR A 666 4.695 3.258 -8.665 1.00 0.00 H new ATOM 0 HB3 TYR A 666 6.442 3.344 -8.777 1.00 0.00 H new ATOM 0 HD1 TYR A 666 7.756 1.208 -9.246 1.00 0.00 H new ATOM 0 HD2 TYR A 666 3.484 1.407 -9.579 1.00 0.00 H new ATOM 0 HE1 TYR A 666 7.766 -0.880 -10.571 1.00 0.00 H new ATOM 0 HE2 TYR A 666 3.489 -0.678 -10.915 1.00 0.00 H new ATOM 0 HH TYR A 666 4.715 -2.310 -11.817 1.00 0.00 H new ATOM 314 N LYS A 667 3.446 1.547 -6.847 1.00 0.00 N ATOM 315 CA LYS A 667 2.333 0.585 -6.625 1.00 0.00 C ATOM 316 C LYS A 667 1.019 1.212 -7.120 1.00 0.00 C ATOM 317 O LYS A 667 0.738 2.366 -6.858 1.00 0.00 O ATOM 318 CB LYS A 667 2.318 0.359 -5.118 1.00 0.00 C ATOM 319 CG LYS A 667 1.168 -0.570 -4.743 1.00 0.00 C ATOM 320 CD LYS A 667 1.142 -1.792 -5.659 1.00 0.00 C ATOM 321 CE LYS A 667 0.487 -2.938 -4.886 1.00 0.00 C ATOM 322 NZ LYS A 667 -0.204 -3.781 -5.897 1.00 0.00 N ATOM 0 H LYS A 667 3.145 2.494 -7.076 1.00 0.00 H new ATOM 0 HA LYS A 667 2.454 -0.356 -7.163 1.00 0.00 H new ATOM 0 HB2 LYS A 667 3.266 -0.074 -4.797 1.00 0.00 H new ATOM 0 HB3 LYS A 667 2.211 1.312 -4.600 1.00 0.00 H new ATOM 0 HG2 LYS A 667 1.274 -0.889 -3.706 1.00 0.00 H new ATOM 0 HG3 LYS A 667 0.222 -0.034 -4.816 1.00 0.00 H new ATOM 0 HD2 LYS A 667 0.583 -1.576 -6.569 1.00 0.00 H new ATOM 0 HD3 LYS A 667 2.153 -2.064 -5.963 1.00 0.00 H new ATOM 0 HE2 LYS A 667 1.233 -3.517 -4.342 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -0.220 -2.556 -4.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -0.906 -4.385 -5.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -0.683 -3.170 -6.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 0.493 -4.378 -6.386 1.00 0.00 H new ATOM 336 N SER A 668 0.222 0.474 -7.851 1.00 0.00 N ATOM 337 CA SER A 668 -1.063 1.037 -8.372 1.00 0.00 C ATOM 338 C SER A 668 -2.138 -0.054 -8.479 1.00 0.00 C ATOM 339 O SER A 668 -2.011 -0.987 -9.245 1.00 0.00 O ATOM 340 CB SER A 668 -0.715 1.563 -9.766 1.00 0.00 C ATOM 341 OG SER A 668 -1.867 2.164 -10.344 1.00 0.00 O ATOM 0 H SER A 668 0.405 -0.495 -8.110 1.00 0.00 H new ATOM 0 HA SER A 668 -1.464 1.809 -7.715 1.00 0.00 H new ATOM 0 HB2 SER A 668 0.094 2.290 -9.701 1.00 0.00 H new ATOM 0 HB3 SER A 668 -0.361 0.748 -10.397 1.00 0.00 H new ATOM 0 HG SER A 668 -1.646 2.503 -11.237 1.00 0.00 H new ATOM 347 N ILE A 669 -3.210 0.071 -7.744 1.00 0.00 N ATOM 348 CA ILE A 669 -4.298 -0.950 -7.839 1.00 0.00 C ATOM 349 C ILE A 669 -5.656 -0.254 -7.941 1.00 0.00 C ATOM 350 O ILE A 669 -5.868 0.800 -7.375 1.00 0.00 O ATOM 351 CB ILE A 669 -4.207 -1.786 -6.558 1.00 0.00 C ATOM 352 CG1 ILE A 669 -5.156 -2.985 -6.678 1.00 0.00 C ATOM 353 CG2 ILE A 669 -4.601 -0.931 -5.353 1.00 0.00 C ATOM 354 CD1 ILE A 669 -4.896 -3.980 -5.544 1.00 0.00 C ATOM 0 H ILE A 669 -3.381 0.831 -7.085 1.00 0.00 H new ATOM 0 HA ILE A 669 -4.191 -1.579 -8.723 1.00 0.00 H new ATOM 0 HB ILE A 669 -3.185 -2.139 -6.420 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -6.191 -2.644 -6.643 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -5.015 -3.475 -7.641 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -4.535 -1.530 -4.445 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.926 -0.078 -5.276 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -5.623 -0.574 -5.479 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -5.576 -4.827 -5.640 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -3.866 -4.333 -5.599 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -5.061 -3.489 -4.585 1.00 0.00 H new ATOM 366 N LEU A 670 -6.577 -0.826 -8.663 1.00 0.00 N ATOM 367 CA LEU A 670 -7.915 -0.181 -8.794 1.00 0.00 C ATOM 368 C LEU A 670 -8.732 -0.467 -7.523 1.00 0.00 C ATOM 369 O LEU A 670 -8.968 -1.608 -7.179 1.00 0.00 O ATOM 370 CB LEU A 670 -8.551 -0.851 -10.023 1.00 0.00 C ATOM 371 CG LEU A 670 -9.689 0.015 -10.588 1.00 0.00 C ATOM 372 CD1 LEU A 670 -10.506 0.631 -9.451 1.00 0.00 C ATOM 373 CD2 LEU A 670 -9.104 1.140 -11.447 1.00 0.00 C ATOM 0 H LEU A 670 -6.464 -1.706 -9.166 1.00 0.00 H new ATOM 0 HA LEU A 670 -7.866 0.901 -8.912 1.00 0.00 H new ATOM 0 HB2 LEU A 670 -7.793 -1.009 -10.790 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -8.937 -1.833 -9.749 1.00 0.00 H new ATOM 0 HG LEU A 670 -10.337 -0.618 -11.194 1.00 0.00 H new ATOM 0 HD11 LEU A 670 -11.307 1.241 -9.868 1.00 0.00 H new ATOM 0 HD12 LEU A 670 -10.935 -0.163 -8.839 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -9.859 1.255 -8.834 1.00 0.00 H new ATOM 0 HD21 LEU A 670 -9.913 1.752 -11.846 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -8.447 1.760 -10.837 1.00 0.00 H new ATOM 0 HD23 LEU A 670 -8.534 0.710 -12.271 1.00 0.00 H new ATOM 385 N VAL A 671 -9.163 0.553 -6.817 1.00 0.00 N ATOM 386 CA VAL A 671 -9.955 0.308 -5.571 1.00 0.00 C ATOM 387 C VAL A 671 -11.430 0.599 -5.811 1.00 0.00 C ATOM 388 O VAL A 671 -11.805 1.355 -6.681 1.00 0.00 O ATOM 389 CB VAL A 671 -9.380 1.260 -4.494 1.00 0.00 C ATOM 390 CG1 VAL A 671 -10.493 2.022 -3.755 1.00 0.00 C ATOM 391 CG2 VAL A 671 -8.590 0.449 -3.462 1.00 0.00 C ATOM 0 H VAL A 671 -9.002 1.534 -7.047 1.00 0.00 H new ATOM 0 HA VAL A 671 -9.882 -0.733 -5.255 1.00 0.00 H new ATOM 0 HB VAL A 671 -8.738 1.979 -5.002 1.00 0.00 H new ATOM 0 HG11 VAL A 671 -10.049 2.680 -3.007 1.00 0.00 H new ATOM 0 HG12 VAL A 671 -11.063 2.617 -4.469 1.00 0.00 H new ATOM 0 HG13 VAL A 671 -11.157 1.310 -3.264 1.00 0.00 H new ATOM 0 HG21 VAL A 671 -8.186 1.120 -2.704 1.00 0.00 H new ATOM 0 HG22 VAL A 671 -9.250 -0.278 -2.988 1.00 0.00 H new ATOM 0 HG23 VAL A 671 -7.772 -0.073 -3.958 1.00 0.00 H new ATOM 401 N THR A 672 -12.253 0.014 -5.006 1.00 0.00 N ATOM 402 CA THR A 672 -13.709 0.238 -5.106 1.00 0.00 C ATOM 403 C THR A 672 -14.151 0.997 -3.858 1.00 0.00 C ATOM 404 O THR A 672 -13.384 1.180 -2.935 1.00 0.00 O ATOM 405 CB THR A 672 -14.297 -1.165 -5.153 1.00 0.00 C ATOM 406 OG1 THR A 672 -13.769 -1.842 -6.284 1.00 0.00 O ATOM 407 CG2 THR A 672 -15.819 -1.089 -5.263 1.00 0.00 C ATOM 0 H THR A 672 -11.971 -0.626 -4.264 1.00 0.00 H new ATOM 0 HA THR A 672 -14.023 0.821 -5.971 1.00 0.00 H new ATOM 0 HB THR A 672 -14.038 -1.704 -4.241 1.00 0.00 H new ATOM 0 HG1 THR A 672 -14.139 -2.749 -6.325 1.00 0.00 H new ATOM 0 HG21 THR A 672 -16.232 -2.097 -5.296 1.00 0.00 H new ATOM 0 HG22 THR A 672 -16.220 -0.561 -4.398 1.00 0.00 H new ATOM 0 HG23 THR A 672 -16.092 -0.555 -6.173 1.00 0.00 H new ATOM 415 N SER A 673 -15.355 1.462 -3.815 1.00 0.00 N ATOM 416 CA SER A 673 -15.784 2.220 -2.613 1.00 0.00 C ATOM 417 C SER A 673 -15.599 1.379 -1.340 1.00 0.00 C ATOM 418 O SER A 673 -15.326 1.906 -0.281 1.00 0.00 O ATOM 419 CB SER A 673 -17.265 2.502 -2.842 1.00 0.00 C ATOM 420 OG SER A 673 -17.756 3.311 -1.780 1.00 0.00 O ATOM 0 H SER A 673 -16.057 1.355 -4.547 1.00 0.00 H new ATOM 0 HA SER A 673 -15.199 3.129 -2.476 1.00 0.00 H new ATOM 0 HB2 SER A 673 -17.408 3.008 -3.797 1.00 0.00 H new ATOM 0 HB3 SER A 673 -17.822 1.567 -2.890 1.00 0.00 H new ATOM 0 HG SER A 673 -18.708 3.497 -1.923 1.00 0.00 H new ATOM 426 N GLN A 674 -15.786 0.084 -1.421 1.00 0.00 N ATOM 427 CA GLN A 674 -15.667 -0.759 -0.186 1.00 0.00 C ATOM 428 C GLN A 674 -14.479 -1.744 -0.234 1.00 0.00 C ATOM 429 O GLN A 674 -14.461 -2.713 0.498 1.00 0.00 O ATOM 430 CB GLN A 674 -16.983 -1.535 -0.150 1.00 0.00 C ATOM 431 CG GLN A 674 -18.148 -0.556 -0.298 1.00 0.00 C ATOM 432 CD GLN A 674 -19.155 -1.116 -1.307 1.00 0.00 C ATOM 433 OE1 GLN A 674 -20.237 -1.534 -0.937 1.00 0.00 O ATOM 434 NE2 GLN A 674 -18.843 -1.134 -2.576 1.00 0.00 N ATOM 0 H GLN A 674 -16.013 -0.423 -2.277 1.00 0.00 H new ATOM 0 HA GLN A 674 -15.486 -0.141 0.693 1.00 0.00 H new ATOM 0 HB2 GLN A 674 -17.007 -2.271 -0.953 1.00 0.00 H new ATOM 0 HB3 GLN A 674 -17.070 -2.083 0.788 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -18.631 -0.399 0.666 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -17.782 0.415 -0.633 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -17.936 -0.783 -2.883 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -19.507 -1.499 -3.259 1.00 0.00 H new ATOM 443 N ASP A 675 -13.510 -1.540 -1.086 1.00 0.00 N ATOM 444 CA ASP A 675 -12.364 -2.519 -1.152 1.00 0.00 C ATOM 445 C ASP A 675 -11.150 -2.051 -0.335 1.00 0.00 C ATOM 446 O ASP A 675 -10.599 -0.997 -0.572 1.00 0.00 O ATOM 447 CB ASP A 675 -11.974 -2.592 -2.626 1.00 0.00 C ATOM 448 CG ASP A 675 -10.992 -3.753 -2.847 1.00 0.00 C ATOM 449 OD1 ASP A 675 -10.451 -4.246 -1.870 1.00 0.00 O ATOM 450 OD2 ASP A 675 -10.805 -4.131 -3.993 1.00 0.00 O ATOM 0 H ASP A 675 -13.454 -0.754 -1.733 1.00 0.00 H new ATOM 0 HA ASP A 675 -12.668 -3.480 -0.738 1.00 0.00 H new ATOM 0 HB2 ASP A 675 -12.863 -2.734 -3.240 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -11.517 -1.653 -2.938 1.00 0.00 H new ATOM 455 N LYS A 676 -10.710 -2.850 0.600 1.00 0.00 N ATOM 456 CA LYS A 676 -9.516 -2.485 1.407 1.00 0.00 C ATOM 457 C LYS A 676 -8.262 -3.059 0.726 1.00 0.00 C ATOM 458 O LYS A 676 -7.956 -4.226 0.862 1.00 0.00 O ATOM 459 CB LYS A 676 -9.776 -3.174 2.744 1.00 0.00 C ATOM 460 CG LYS A 676 -11.084 -2.633 3.334 1.00 0.00 C ATOM 461 CD LYS A 676 -11.780 -3.730 4.145 1.00 0.00 C ATOM 462 CE LYS A 676 -12.527 -4.672 3.196 1.00 0.00 C ATOM 463 NZ LYS A 676 -13.728 -3.907 2.743 1.00 0.00 N ATOM 0 H LYS A 676 -11.132 -3.747 0.839 1.00 0.00 H new ATOM 0 HA LYS A 676 -9.357 -1.412 1.517 1.00 0.00 H new ATOM 0 HB2 LYS A 676 -9.843 -4.253 2.606 1.00 0.00 H new ATOM 0 HB3 LYS A 676 -8.949 -2.991 3.430 1.00 0.00 H new ATOM 0 HG2 LYS A 676 -10.878 -1.773 3.971 1.00 0.00 H new ATOM 0 HG3 LYS A 676 -11.739 -2.288 2.534 1.00 0.00 H new ATOM 0 HD2 LYS A 676 -11.046 -4.289 4.726 1.00 0.00 H new ATOM 0 HD3 LYS A 676 -12.477 -3.285 4.856 1.00 0.00 H new ATOM 0 HE2 LYS A 676 -11.900 -4.956 2.351 1.00 0.00 H new ATOM 0 HE3 LYS A 676 -12.816 -5.593 3.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 -14.557 -4.535 2.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 -13.899 -3.113 3.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 -13.564 -3.540 1.784 1.00 0.00 H new ATOM 477 N ALA A 677 -7.545 -2.262 -0.022 1.00 0.00 N ATOM 478 CA ALA A 677 -6.334 -2.795 -0.720 1.00 0.00 C ATOM 479 C ALA A 677 -5.008 -2.129 -0.297 1.00 0.00 C ATOM 480 O ALA A 677 -4.023 -2.324 -0.972 1.00 0.00 O ATOM 481 CB ALA A 677 -6.603 -2.533 -2.202 1.00 0.00 C ATOM 0 H ALA A 677 -7.741 -1.274 -0.180 1.00 0.00 H new ATOM 0 HA ALA A 677 -6.196 -3.847 -0.469 1.00 0.00 H new ATOM 0 HB1 ALA A 677 -5.762 -2.894 -2.794 1.00 0.00 H new ATOM 0 HB2 ALA A 677 -7.510 -3.055 -2.505 1.00 0.00 H new ATOM 0 HB3 ALA A 677 -6.729 -1.463 -2.365 1.00 0.00 H new ATOM 487 N PRO A 678 -4.959 -1.379 0.785 1.00 0.00 N ATOM 488 CA PRO A 678 -3.665 -0.779 1.166 1.00 0.00 C ATOM 489 C PRO A 678 -2.682 -1.923 1.423 1.00 0.00 C ATOM 490 O PRO A 678 -1.481 -1.766 1.340 1.00 0.00 O ATOM 491 CB PRO A 678 -3.989 -0.056 2.473 1.00 0.00 C ATOM 492 CG PRO A 678 -5.447 -0.352 2.843 1.00 0.00 C ATOM 493 CD PRO A 678 -6.114 -1.085 1.667 1.00 0.00 C ATOM 0 HA PRO A 678 -3.230 -0.115 0.420 1.00 0.00 H new ATOM 0 HB2 PRO A 678 -3.321 -0.391 3.267 1.00 0.00 H new ATOM 0 HB3 PRO A 678 -3.837 1.017 2.360 1.00 0.00 H new ATOM 0 HG2 PRO A 678 -5.492 -0.964 3.744 1.00 0.00 H new ATOM 0 HG3 PRO A 678 -5.978 0.575 3.061 1.00 0.00 H new ATOM 0 HD2 PRO A 678 -6.622 -1.994 1.989 1.00 0.00 H new ATOM 0 HD3 PRO A 678 -6.858 -0.463 1.169 1.00 0.00 H new ATOM 501 N SER A 679 -3.206 -3.079 1.766 1.00 0.00 N ATOM 502 CA SER A 679 -2.326 -4.251 2.067 1.00 0.00 C ATOM 503 C SER A 679 -2.096 -5.130 0.827 1.00 0.00 C ATOM 504 O SER A 679 -1.383 -6.112 0.889 1.00 0.00 O ATOM 505 CB SER A 679 -3.075 -5.047 3.134 1.00 0.00 C ATOM 506 OG SER A 679 -3.211 -4.258 4.311 1.00 0.00 O ATOM 0 H SER A 679 -4.207 -3.259 1.850 1.00 0.00 H new ATOM 0 HA SER A 679 -1.340 -3.922 2.395 1.00 0.00 H new ATOM 0 HB2 SER A 679 -4.058 -5.337 2.763 1.00 0.00 H new ATOM 0 HB3 SER A 679 -2.536 -5.967 3.361 1.00 0.00 H new ATOM 0 HG SER A 679 -3.693 -4.770 4.994 1.00 0.00 H new ATOM 512 N VAL A 680 -2.686 -4.802 -0.291 1.00 0.00 N ATOM 513 CA VAL A 680 -2.478 -5.647 -1.508 1.00 0.00 C ATOM 514 C VAL A 680 -0.990 -5.748 -1.844 1.00 0.00 C ATOM 515 O VAL A 680 -0.546 -6.709 -2.439 1.00 0.00 O ATOM 516 CB VAL A 680 -3.228 -4.940 -2.644 1.00 0.00 C ATOM 517 CG1 VAL A 680 -2.629 -3.554 -2.895 1.00 0.00 C ATOM 518 CG2 VAL A 680 -3.086 -5.763 -3.922 1.00 0.00 C ATOM 0 H VAL A 680 -3.297 -3.995 -0.417 1.00 0.00 H new ATOM 0 HA VAL A 680 -2.843 -6.662 -1.353 1.00 0.00 H new ATOM 0 HB VAL A 680 -4.276 -4.838 -2.363 1.00 0.00 H new ATOM 0 HG11 VAL A 680 -3.171 -3.064 -3.704 1.00 0.00 H new ATOM 0 HG12 VAL A 680 -2.709 -2.954 -1.989 1.00 0.00 H new ATOM 0 HG13 VAL A 680 -1.580 -3.656 -3.171 1.00 0.00 H new ATOM 0 HG21 VAL A 680 -3.617 -5.267 -4.735 1.00 0.00 H new ATOM 0 HG22 VAL A 680 -2.031 -5.855 -4.180 1.00 0.00 H new ATOM 0 HG23 VAL A 680 -3.509 -6.755 -3.765 1.00 0.00 H new ATOM 528 N ILE A 681 -0.215 -4.769 -1.478 1.00 0.00 N ATOM 529 CA ILE A 681 1.245 -4.840 -1.800 1.00 0.00 C ATOM 530 C ILE A 681 1.837 -6.087 -1.135 1.00 0.00 C ATOM 531 O ILE A 681 2.665 -6.777 -1.698 1.00 0.00 O ATOM 532 CB ILE A 681 1.868 -3.550 -1.221 1.00 0.00 C ATOM 533 CG1 ILE A 681 3.271 -3.333 -1.806 1.00 0.00 C ATOM 534 CG2 ILE A 681 2.008 -3.657 0.297 1.00 0.00 C ATOM 535 CD1 ILE A 681 3.177 -2.977 -3.286 1.00 0.00 C ATOM 0 H ILE A 681 -0.517 -3.933 -0.978 1.00 0.00 H new ATOM 0 HA ILE A 681 1.439 -4.912 -2.870 1.00 0.00 H new ATOM 0 HB ILE A 681 1.212 -2.719 -1.480 1.00 0.00 H new ATOM 0 HG12 ILE A 681 3.779 -2.535 -1.264 1.00 0.00 H new ATOM 0 HG13 ILE A 681 3.869 -4.235 -1.679 1.00 0.00 H new ATOM 0 HG21 ILE A 681 2.448 -2.740 0.687 1.00 0.00 H new ATOM 0 HG22 ILE A 681 1.025 -3.806 0.743 1.00 0.00 H new ATOM 0 HG23 ILE A 681 2.651 -4.502 0.544 1.00 0.00 H new ATOM 0 HD11 ILE A 681 4.179 -2.826 -3.688 1.00 0.00 H new ATOM 0 HD12 ILE A 681 2.688 -3.789 -3.825 1.00 0.00 H new ATOM 0 HD13 ILE A 681 2.597 -2.062 -3.404 1.00 0.00 H new ATOM 547 N SER A 682 1.394 -6.372 0.060 1.00 0.00 N ATOM 548 CA SER A 682 1.881 -7.566 0.813 1.00 0.00 C ATOM 549 C SER A 682 1.584 -8.866 0.057 1.00 0.00 C ATOM 550 O SER A 682 2.433 -9.728 -0.068 1.00 0.00 O ATOM 551 CB SER A 682 1.079 -7.511 2.115 1.00 0.00 C ATOM 552 OG SER A 682 1.502 -8.544 2.993 1.00 0.00 O ATOM 0 H SER A 682 0.699 -5.815 0.557 1.00 0.00 H new ATOM 0 HA SER A 682 2.960 -7.553 0.965 1.00 0.00 H new ATOM 0 HB2 SER A 682 1.212 -6.540 2.592 1.00 0.00 H new ATOM 0 HB3 SER A 682 0.016 -7.618 1.901 1.00 0.00 H new ATOM 0 HG SER A 682 0.984 -8.500 3.824 1.00 0.00 H new ATOM 558 N ARG A 683 0.393 -9.019 -0.455 1.00 0.00 N ATOM 559 CA ARG A 683 0.082 -10.266 -1.201 1.00 0.00 C ATOM 560 C ARG A 683 0.766 -10.206 -2.562 1.00 0.00 C ATOM 561 O ARG A 683 1.266 -11.191 -3.079 1.00 0.00 O ATOM 562 CB ARG A 683 -1.442 -10.303 -1.327 1.00 0.00 C ATOM 563 CG ARG A 683 -1.927 -9.099 -2.131 1.00 0.00 C ATOM 564 CD ARG A 683 -3.439 -9.195 -2.337 1.00 0.00 C ATOM 565 NE ARG A 683 -4.031 -8.576 -1.121 1.00 0.00 N ATOM 566 CZ ARG A 683 -5.277 -8.206 -1.133 1.00 0.00 C ATOM 567 NH1 ARG A 683 -6.189 -9.031 -1.569 1.00 0.00 N ATOM 568 NH2 ARG A 683 -5.608 -7.011 -0.727 1.00 0.00 N ATOM 0 H ARG A 683 -0.368 -8.343 -0.389 1.00 0.00 H new ATOM 0 HA ARG A 683 0.439 -11.167 -0.702 1.00 0.00 H new ATOM 0 HB2 ARG A 683 -1.753 -11.226 -1.816 1.00 0.00 H new ATOM 0 HB3 ARG A 683 -1.898 -10.297 -0.337 1.00 0.00 H new ATOM 0 HG2 ARG A 683 -1.679 -8.176 -1.607 1.00 0.00 H new ATOM 0 HG3 ARG A 683 -1.420 -9.065 -3.095 1.00 0.00 H new ATOM 0 HD2 ARG A 683 -3.749 -8.668 -3.239 1.00 0.00 H new ATOM 0 HD3 ARG A 683 -3.758 -10.231 -2.448 1.00 0.00 H new ATOM 0 HE ARG A 683 -3.463 -8.443 -0.284 1.00 0.00 H new ATOM 0 HH11 ARG A 683 -5.922 -9.959 -1.897 1.00 0.00 H new ATOM 0 HH12 ARG A 683 -7.169 -8.748 -1.581 1.00 0.00 H new ATOM 0 HH21 ARG A 683 -4.889 -6.366 -0.400 1.00 0.00 H new ATOM 0 HH22 ARG A 683 -6.586 -6.722 -0.737 1.00 0.00 H new ATOM 582 N VAL A 684 0.825 -9.033 -3.122 1.00 0.00 N ATOM 583 CA VAL A 684 1.507 -8.860 -4.424 1.00 0.00 C ATOM 584 C VAL A 684 2.992 -8.980 -4.207 1.00 0.00 C ATOM 585 O VAL A 684 3.739 -9.286 -5.108 1.00 0.00 O ATOM 586 CB VAL A 684 1.152 -7.452 -4.876 1.00 0.00 C ATOM 587 CG1 VAL A 684 2.104 -7.009 -5.986 1.00 0.00 C ATOM 588 CG2 VAL A 684 -0.272 -7.454 -5.406 1.00 0.00 C ATOM 0 H VAL A 684 0.425 -8.181 -2.727 1.00 0.00 H new ATOM 0 HA VAL A 684 1.209 -9.603 -5.164 1.00 0.00 H new ATOM 0 HB VAL A 684 1.239 -6.764 -4.035 1.00 0.00 H new ATOM 0 HG11 VAL A 684 1.845 -6.000 -6.306 1.00 0.00 H new ATOM 0 HG12 VAL A 684 3.128 -7.020 -5.613 1.00 0.00 H new ATOM 0 HG13 VAL A 684 2.019 -7.691 -6.832 1.00 0.00 H new ATOM 0 HG21 VAL A 684 -0.540 -6.449 -5.734 1.00 0.00 H new ATOM 0 HG22 VAL A 684 -0.346 -8.142 -6.248 1.00 0.00 H new ATOM 0 HG23 VAL A 684 -0.953 -7.772 -4.617 1.00 0.00 H new ATOM 598 N LEU A 685 3.427 -8.732 -3.008 1.00 0.00 N ATOM 599 CA LEU A 685 4.869 -8.818 -2.735 1.00 0.00 C ATOM 600 C LEU A 685 5.380 -10.200 -3.074 1.00 0.00 C ATOM 601 O LEU A 685 6.334 -10.343 -3.795 1.00 0.00 O ATOM 602 CB LEU A 685 5.021 -8.560 -1.239 1.00 0.00 C ATOM 603 CG LEU A 685 6.135 -7.533 -1.000 1.00 0.00 C ATOM 604 CD1 LEU A 685 7.261 -7.737 -2.013 1.00 0.00 C ATOM 605 CD2 LEU A 685 5.575 -6.123 -1.168 1.00 0.00 C ATOM 0 H LEU A 685 2.843 -8.475 -2.212 1.00 0.00 H new ATOM 0 HA LEU A 685 5.436 -8.102 -3.330 1.00 0.00 H new ATOM 0 HB2 LEU A 685 4.081 -8.193 -0.826 1.00 0.00 H new ATOM 0 HB3 LEU A 685 5.255 -9.491 -0.722 1.00 0.00 H new ATOM 0 HG LEU A 685 6.523 -7.664 0.010 1.00 0.00 H new ATOM 0 HD11 LEU A 685 8.047 -7.003 -1.836 1.00 0.00 H new ATOM 0 HD12 LEU A 685 7.670 -8.741 -1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 685 6.869 -7.612 -3.022 1.00 0.00 H new ATOM 0 HD21 LEU A 685 6.367 -5.394 -0.998 1.00 0.00 H new ATOM 0 HD22 LEU A 685 5.184 -6.005 -2.179 1.00 0.00 H new ATOM 0 HD23 LEU A 685 4.773 -5.962 -0.448 1.00 0.00 H new ATOM 617 N LYS A 686 4.749 -11.219 -2.564 1.00 0.00 N ATOM 618 CA LYS A 686 5.214 -12.600 -2.865 1.00 0.00 C ATOM 619 C LYS A 686 4.930 -12.928 -4.320 1.00 0.00 C ATOM 620 O LYS A 686 5.730 -13.513 -5.014 1.00 0.00 O ATOM 621 CB LYS A 686 4.365 -13.503 -1.976 1.00 0.00 C ATOM 622 CG LYS A 686 4.652 -13.209 -0.507 1.00 0.00 C ATOM 623 CD LYS A 686 3.694 -14.028 0.358 1.00 0.00 C ATOM 624 CE LYS A 686 3.870 -13.637 1.825 1.00 0.00 C ATOM 625 NZ LYS A 686 5.177 -14.227 2.224 1.00 0.00 N ATOM 0 H LYS A 686 3.934 -11.156 -1.954 1.00 0.00 H new ATOM 0 HA LYS A 686 6.283 -12.722 -2.690 1.00 0.00 H new ATOM 0 HB2 LYS A 686 3.307 -13.344 -2.187 1.00 0.00 H new ATOM 0 HB3 LYS A 686 4.580 -14.549 -2.195 1.00 0.00 H new ATOM 0 HG2 LYS A 686 5.685 -13.460 -0.267 1.00 0.00 H new ATOM 0 HG3 LYS A 686 4.527 -12.145 -0.304 1.00 0.00 H new ATOM 0 HD2 LYS A 686 2.665 -13.853 0.045 1.00 0.00 H new ATOM 0 HD3 LYS A 686 3.890 -15.092 0.228 1.00 0.00 H new ATOM 0 HE2 LYS A 686 3.871 -12.554 1.948 1.00 0.00 H new ATOM 0 HE3 LYS A 686 3.057 -14.026 2.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 686 5.227 -14.290 3.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 686 5.268 -15.179 1.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 686 5.950 -13.625 1.876 1.00 0.00 H new ATOM 639 N LYS A 687 3.783 -12.561 -4.787 1.00 0.00 N ATOM 640 CA LYS A 687 3.437 -12.858 -6.196 1.00 0.00 C ATOM 641 C LYS A 687 4.339 -12.066 -7.130 1.00 0.00 C ATOM 642 O LYS A 687 4.758 -12.552 -8.164 1.00 0.00 O ATOM 643 CB LYS A 687 1.983 -12.434 -6.309 1.00 0.00 C ATOM 644 CG LYS A 687 1.131 -13.419 -5.512 1.00 0.00 C ATOM 645 CD LYS A 687 -0.286 -12.873 -5.380 1.00 0.00 C ATOM 646 CE LYS A 687 -1.074 -13.735 -4.391 1.00 0.00 C ATOM 647 NZ LYS A 687 -1.705 -14.803 -5.215 1.00 0.00 N ATOM 0 H LYS A 687 3.066 -12.067 -4.256 1.00 0.00 H new ATOM 0 HA LYS A 687 3.574 -13.904 -6.471 1.00 0.00 H new ATOM 0 HB2 LYS A 687 1.852 -11.422 -5.925 1.00 0.00 H new ATOM 0 HB3 LYS A 687 1.672 -12.422 -7.353 1.00 0.00 H new ATOM 0 HG2 LYS A 687 1.114 -14.388 -6.011 1.00 0.00 H new ATOM 0 HG3 LYS A 687 1.565 -13.576 -4.525 1.00 0.00 H new ATOM 0 HD2 LYS A 687 -0.258 -11.839 -5.036 1.00 0.00 H new ATOM 0 HD3 LYS A 687 -0.779 -12.873 -6.352 1.00 0.00 H new ATOM 0 HE2 LYS A 687 -0.418 -14.160 -3.631 1.00 0.00 H new ATOM 0 HE3 LYS A 687 -1.827 -13.145 -3.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 -2.262 -15.432 -4.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 -2.330 -14.370 -5.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 -0.965 -15.354 -5.695 1.00 0.00 H new ATOM 661 N ASN A 688 4.654 -10.855 -6.778 1.00 0.00 N ATOM 662 CA ASN A 688 5.541 -10.056 -7.654 1.00 0.00 C ATOM 663 C ASN A 688 6.929 -9.961 -7.013 1.00 0.00 C ATOM 664 O ASN A 688 7.763 -9.179 -7.416 1.00 0.00 O ATOM 665 CB ASN A 688 4.843 -8.695 -7.782 1.00 0.00 C ATOM 666 CG ASN A 688 5.318 -7.693 -6.726 1.00 0.00 C ATOM 667 OD1 ASN A 688 5.332 -6.507 -6.984 1.00 0.00 O ATOM 668 ND2 ASN A 688 5.688 -8.097 -5.546 1.00 0.00 N ATOM 0 H ASN A 688 4.338 -10.388 -5.928 1.00 0.00 H new ATOM 0 HA ASN A 688 5.698 -10.492 -8.641 1.00 0.00 H new ATOM 0 HB2 ASN A 688 5.028 -8.287 -8.776 1.00 0.00 H new ATOM 0 HB3 ASN A 688 3.766 -8.832 -7.690 1.00 0.00 H new ATOM 0 HD21 ASN A 688 5.987 -7.419 -4.845 1.00 0.00 H new ATOM 0 HD22 ASN A 688 5.679 -9.092 -5.322 1.00 0.00 H new ATOM 675 N ASN A 689 7.179 -10.769 -6.006 1.00 0.00 N ATOM 676 CA ASN A 689 8.511 -10.737 -5.325 1.00 0.00 C ATOM 677 C ASN A 689 9.641 -11.057 -6.295 1.00 0.00 C ATOM 678 O ASN A 689 10.802 -10.910 -5.969 1.00 0.00 O ATOM 679 CB ASN A 689 8.472 -11.835 -4.270 1.00 0.00 C ATOM 680 CG ASN A 689 8.208 -13.171 -4.956 1.00 0.00 C ATOM 681 OD1 ASN A 689 7.918 -13.214 -6.137 1.00 0.00 O ATOM 682 ND2 ASN A 689 8.277 -14.271 -4.264 1.00 0.00 N ATOM 0 H ASN A 689 6.517 -11.447 -5.629 1.00 0.00 H new ATOM 0 HA ASN A 689 8.692 -9.746 -4.909 1.00 0.00 H new ATOM 0 HB2 ASN A 689 9.417 -11.870 -3.728 1.00 0.00 H new ATOM 0 HB3 ASN A 689 7.692 -11.627 -3.538 1.00 0.00 H new ATOM 0 HD21 ASN A 689 8.088 -15.168 -4.712 1.00 0.00 H new ATOM 0 HD22 ASN A 689 8.520 -14.236 -3.274 1.00 0.00 H new ATOM 689 N ARG A 690 9.332 -11.471 -7.483 1.00 0.00 N ATOM 690 CA ARG A 690 10.429 -11.763 -8.447 1.00 0.00 C ATOM 691 C ARG A 690 10.665 -10.554 -9.345 1.00 0.00 C ATOM 692 O ARG A 690 11.685 -10.442 -9.994 1.00 0.00 O ATOM 693 CB ARG A 690 9.968 -12.966 -9.272 1.00 0.00 C ATOM 694 CG ARG A 690 11.072 -13.345 -10.268 1.00 0.00 C ATOM 695 CD ARG A 690 10.592 -14.478 -11.182 1.00 0.00 C ATOM 696 NE ARG A 690 10.725 -15.718 -10.368 1.00 0.00 N ATOM 697 CZ ARG A 690 10.823 -16.880 -10.957 1.00 0.00 C ATOM 698 NH1 ARG A 690 9.776 -17.405 -11.531 1.00 0.00 N ATOM 699 NH2 ARG A 690 11.966 -17.514 -10.979 1.00 0.00 N ATOM 0 H ARG A 690 8.384 -11.620 -7.830 1.00 0.00 H new ATOM 0 HA ARG A 690 11.367 -11.978 -7.936 1.00 0.00 H new ATOM 0 HB2 ARG A 690 9.747 -13.809 -8.617 1.00 0.00 H new ATOM 0 HB3 ARG A 690 9.048 -12.726 -9.804 1.00 0.00 H new ATOM 0 HG2 ARG A 690 11.346 -12.476 -10.866 1.00 0.00 H new ATOM 0 HG3 ARG A 690 11.967 -13.656 -9.729 1.00 0.00 H new ATOM 0 HD2 ARG A 690 9.560 -14.321 -11.495 1.00 0.00 H new ATOM 0 HD3 ARG A 690 11.195 -14.535 -12.088 1.00 0.00 H new ATOM 0 HE ARG A 690 10.740 -15.660 -9.350 1.00 0.00 H new ATOM 0 HH11 ARG A 690 8.885 -16.909 -11.519 1.00 0.00 H new ATOM 0 HH12 ARG A 690 9.848 -18.312 -11.992 1.00 0.00 H new ATOM 0 HH21 ARG A 690 12.787 -17.102 -10.535 1.00 0.00 H new ATOM 0 HH22 ARG A 690 12.037 -18.421 -11.440 1.00 0.00 H new ATOM 713 N ASP A 691 9.733 -9.648 -9.393 1.00 0.00 N ATOM 714 CA ASP A 691 9.917 -8.449 -10.254 1.00 0.00 C ATOM 715 C ASP A 691 10.000 -7.182 -9.401 1.00 0.00 C ATOM 716 O ASP A 691 10.799 -6.304 -9.653 1.00 0.00 O ATOM 717 CB ASP A 691 8.666 -8.411 -11.130 1.00 0.00 C ATOM 718 CG ASP A 691 8.683 -9.594 -12.096 1.00 0.00 C ATOM 719 OD1 ASP A 691 9.762 -9.986 -12.505 1.00 0.00 O ATOM 720 OD2 ASP A 691 7.612 -10.087 -12.415 1.00 0.00 O ATOM 0 H ASP A 691 8.855 -9.684 -8.876 1.00 0.00 H new ATOM 0 HA ASP A 691 10.837 -8.498 -10.837 1.00 0.00 H new ATOM 0 HB2 ASP A 691 7.772 -8.449 -10.507 1.00 0.00 H new ATOM 0 HB3 ASP A 691 8.627 -7.474 -11.686 1.00 0.00 H new ATOM 725 N SER A 692 9.160 -7.069 -8.405 1.00 0.00 N ATOM 726 CA SER A 692 9.170 -5.837 -7.565 1.00 0.00 C ATOM 727 C SER A 692 9.986 -6.029 -6.282 1.00 0.00 C ATOM 728 O SER A 692 11.117 -6.448 -6.323 1.00 0.00 O ATOM 729 CB SER A 692 7.711 -5.583 -7.224 1.00 0.00 C ATOM 730 OG SER A 692 6.943 -5.549 -8.420 1.00 0.00 O ATOM 0 H SER A 692 8.472 -7.773 -8.139 1.00 0.00 H new ATOM 0 HA SER A 692 9.632 -5.003 -8.094 1.00 0.00 H new ATOM 0 HB2 SER A 692 7.339 -6.366 -6.563 1.00 0.00 H new ATOM 0 HB3 SER A 692 7.611 -4.639 -6.688 1.00 0.00 H new ATOM 0 HG SER A 692 6.063 -5.948 -8.255 1.00 0.00 H new ATOM 736 N ALA A 693 9.429 -5.695 -5.143 1.00 0.00 N ATOM 737 CA ALA A 693 10.196 -5.822 -3.872 1.00 0.00 C ATOM 738 C ALA A 693 9.908 -7.149 -3.159 1.00 0.00 C ATOM 739 O ALA A 693 9.221 -8.009 -3.667 1.00 0.00 O ATOM 740 CB ALA A 693 9.734 -4.648 -3.007 1.00 0.00 C ATOM 0 H ALA A 693 8.478 -5.341 -5.042 1.00 0.00 H new ATOM 0 HA ALA A 693 11.269 -5.809 -4.061 1.00 0.00 H new ATOM 0 HB1 ALA A 693 10.256 -4.673 -2.051 1.00 0.00 H new ATOM 0 HB2 ALA A 693 9.956 -3.711 -3.517 1.00 0.00 H new ATOM 0 HB3 ALA A 693 8.660 -4.722 -2.836 1.00 0.00 H new ATOM 746 N VAL A 694 10.454 -7.303 -1.981 1.00 0.00 N ATOM 747 CA VAL A 694 10.262 -8.559 -1.195 1.00 0.00 C ATOM 748 C VAL A 694 10.135 -8.230 0.302 1.00 0.00 C ATOM 749 O VAL A 694 10.411 -7.126 0.728 1.00 0.00 O ATOM 750 CB VAL A 694 11.529 -9.366 -1.497 1.00 0.00 C ATOM 751 CG1 VAL A 694 11.912 -10.264 -0.318 1.00 0.00 C ATOM 752 CG2 VAL A 694 11.293 -10.238 -2.733 1.00 0.00 C ATOM 0 H VAL A 694 11.034 -6.600 -1.523 1.00 0.00 H new ATOM 0 HA VAL A 694 9.356 -9.107 -1.455 1.00 0.00 H new ATOM 0 HB VAL A 694 12.344 -8.664 -1.675 1.00 0.00 H new ATOM 0 HG11 VAL A 694 12.815 -10.823 -0.565 1.00 0.00 H new ATOM 0 HG12 VAL A 694 12.095 -9.649 0.563 1.00 0.00 H new ATOM 0 HG13 VAL A 694 11.099 -10.960 -0.112 1.00 0.00 H new ATOM 0 HG21 VAL A 694 12.193 -10.813 -2.950 1.00 0.00 H new ATOM 0 HG22 VAL A 694 10.464 -10.920 -2.544 1.00 0.00 H new ATOM 0 HG23 VAL A 694 11.054 -9.603 -3.586 1.00 0.00 H new ATOM 762 N ALA A 695 9.716 -9.178 1.098 1.00 0.00 N ATOM 763 CA ALA A 695 9.563 -8.926 2.565 1.00 0.00 C ATOM 764 C ALA A 695 8.802 -7.626 2.812 1.00 0.00 C ATOM 765 O ALA A 695 9.376 -6.554 2.836 1.00 0.00 O ATOM 766 CB ALA A 695 10.986 -8.816 3.117 1.00 0.00 C ATOM 0 H ALA A 695 9.472 -10.121 0.796 1.00 0.00 H new ATOM 0 HA ALA A 695 8.999 -9.724 3.049 1.00 0.00 H new ATOM 0 HB1 ALA A 695 10.947 -8.631 4.190 1.00 0.00 H new ATOM 0 HB2 ALA A 695 11.522 -9.746 2.929 1.00 0.00 H new ATOM 0 HB3 ALA A 695 11.504 -7.993 2.626 1.00 0.00 H new ATOM 772 N SER A 696 7.517 -7.708 2.999 1.00 0.00 N ATOM 773 CA SER A 696 6.730 -6.472 3.248 1.00 0.00 C ATOM 774 C SER A 696 6.875 -6.074 4.726 1.00 0.00 C ATOM 775 O SER A 696 5.952 -6.185 5.508 1.00 0.00 O ATOM 776 CB SER A 696 5.279 -6.859 2.912 1.00 0.00 C ATOM 777 OG SER A 696 5.253 -7.514 1.650 1.00 0.00 O ATOM 0 H SER A 696 6.979 -8.574 2.990 1.00 0.00 H new ATOM 0 HA SER A 696 7.060 -5.620 2.653 1.00 0.00 H new ATOM 0 HB2 SER A 696 4.876 -7.514 3.684 1.00 0.00 H new ATOM 0 HB3 SER A 696 4.649 -5.970 2.887 1.00 0.00 H new ATOM 0 HG SER A 696 4.894 -8.420 1.759 1.00 0.00 H new ATOM 783 N GLU A 697 8.041 -5.610 5.105 1.00 0.00 N ATOM 784 CA GLU A 697 8.279 -5.189 6.520 1.00 0.00 C ATOM 785 C GLU A 697 8.642 -3.715 6.531 1.00 0.00 C ATOM 786 O GLU A 697 9.795 -3.348 6.636 1.00 0.00 O ATOM 787 CB GLU A 697 9.464 -6.028 6.988 1.00 0.00 C ATOM 788 CG GLU A 697 9.040 -7.486 6.980 1.00 0.00 C ATOM 789 CD GLU A 697 10.090 -8.332 7.699 1.00 0.00 C ATOM 790 OE1 GLU A 697 11.180 -8.463 7.169 1.00 0.00 O ATOM 791 OE2 GLU A 697 9.782 -8.842 8.763 1.00 0.00 O ATOM 0 H GLU A 697 8.846 -5.504 4.487 1.00 0.00 H new ATOM 0 HA GLU A 697 7.409 -5.331 7.162 1.00 0.00 H new ATOM 0 HB2 GLU A 697 10.321 -5.877 6.331 1.00 0.00 H new ATOM 0 HB3 GLU A 697 9.773 -5.726 7.989 1.00 0.00 H new ATOM 0 HG2 GLU A 697 8.073 -7.596 7.470 1.00 0.00 H new ATOM 0 HG3 GLU A 697 8.919 -7.834 5.954 1.00 0.00 H new ATOM 798 N PHE A 698 7.672 -2.866 6.383 1.00 0.00 N ATOM 799 CA PHE A 698 7.983 -1.420 6.333 1.00 0.00 C ATOM 800 C PHE A 698 6.906 -0.554 6.971 1.00 0.00 C ATOM 801 O PHE A 698 5.814 -0.992 7.273 1.00 0.00 O ATOM 802 CB PHE A 698 8.073 -1.112 4.836 1.00 0.00 C ATOM 803 CG PHE A 698 6.843 -1.609 4.132 1.00 0.00 C ATOM 804 CD1 PHE A 698 6.699 -2.978 3.910 1.00 0.00 C ATOM 805 CD2 PHE A 698 5.878 -0.720 3.667 1.00 0.00 C ATOM 806 CE1 PHE A 698 5.589 -3.461 3.228 1.00 0.00 C ATOM 807 CE2 PHE A 698 4.762 -1.206 2.982 1.00 0.00 C ATOM 808 CZ PHE A 698 4.614 -2.577 2.759 1.00 0.00 C ATOM 0 H PHE A 698 6.685 -3.108 6.295 1.00 0.00 H new ATOM 0 HA PHE A 698 8.894 -1.200 6.890 1.00 0.00 H new ATOM 0 HB2 PHE A 698 8.180 -0.038 4.684 1.00 0.00 H new ATOM 0 HB3 PHE A 698 8.960 -1.584 4.412 1.00 0.00 H new ATOM 0 HD1 PHE A 698 7.452 -3.664 4.269 1.00 0.00 H new ATOM 0 HD2 PHE A 698 5.992 0.341 3.835 1.00 0.00 H new ATOM 0 HE1 PHE A 698 5.480 -4.522 3.060 1.00 0.00 H new ATOM 0 HE2 PHE A 698 4.010 -0.519 2.623 1.00 0.00 H new ATOM 0 HZ PHE A 698 3.752 -2.951 2.228 1.00 0.00 H new ATOM 818 N GLU A 699 7.222 0.704 7.112 1.00 0.00 N ATOM 819 CA GLU A 699 6.263 1.693 7.649 1.00 0.00 C ATOM 820 C GLU A 699 5.624 2.388 6.454 1.00 0.00 C ATOM 821 O GLU A 699 6.303 2.906 5.591 1.00 0.00 O ATOM 822 CB GLU A 699 7.111 2.674 8.460 1.00 0.00 C ATOM 823 CG GLU A 699 6.208 3.720 9.112 1.00 0.00 C ATOM 824 CD GLU A 699 6.685 3.977 10.542 1.00 0.00 C ATOM 825 OE1 GLU A 699 7.630 3.327 10.955 1.00 0.00 O ATOM 826 OE2 GLU A 699 6.095 4.818 11.201 1.00 0.00 O ATOM 0 H GLU A 699 8.133 1.092 6.868 1.00 0.00 H new ATOM 0 HA GLU A 699 5.477 1.263 8.269 1.00 0.00 H new ATOM 0 HB2 GLU A 699 7.673 2.138 9.225 1.00 0.00 H new ATOM 0 HB3 GLU A 699 7.839 3.162 7.812 1.00 0.00 H new ATOM 0 HG2 GLU A 699 6.230 4.646 8.537 1.00 0.00 H new ATOM 0 HG3 GLU A 699 5.175 3.373 9.118 1.00 0.00 H new ATOM 833 N LEU A 700 4.335 2.362 6.377 1.00 0.00 N ATOM 834 CA LEU A 700 3.637 2.979 5.218 1.00 0.00 C ATOM 835 C LEU A 700 3.019 4.308 5.640 1.00 0.00 C ATOM 836 O LEU A 700 2.491 4.447 6.729 1.00 0.00 O ATOM 837 CB LEU A 700 2.542 1.981 4.839 1.00 0.00 C ATOM 838 CG LEU A 700 3.149 0.588 4.617 1.00 0.00 C ATOM 839 CD1 LEU A 700 3.457 -0.074 5.958 1.00 0.00 C ATOM 840 CD2 LEU A 700 2.162 -0.305 3.867 1.00 0.00 C ATOM 0 H LEU A 700 3.722 1.936 7.072 1.00 0.00 H new ATOM 0 HA LEU A 700 4.309 3.181 4.384 1.00 0.00 H new ATOM 0 HB2 LEU A 700 1.791 1.937 5.628 1.00 0.00 H new ATOM 0 HB3 LEU A 700 2.034 2.313 3.933 1.00 0.00 H new ATOM 0 HG LEU A 700 4.064 0.709 4.037 1.00 0.00 H new ATOM 0 HD11 LEU A 700 3.887 -1.061 5.786 1.00 0.00 H new ATOM 0 HD12 LEU A 700 4.167 0.540 6.512 1.00 0.00 H new ATOM 0 HD13 LEU A 700 2.537 -0.174 6.534 1.00 0.00 H new ATOM 0 HD21 LEU A 700 2.604 -1.290 3.716 1.00 0.00 H new ATOM 0 HD22 LEU A 700 1.246 -0.404 4.449 1.00 0.00 H new ATOM 0 HD23 LEU A 700 1.930 0.141 2.900 1.00 0.00 H new ATOM 852 N VAL A 701 3.073 5.279 4.784 1.00 0.00 N ATOM 853 CA VAL A 701 2.491 6.601 5.119 1.00 0.00 C ATOM 854 C VAL A 701 1.544 7.031 4.002 1.00 0.00 C ATOM 855 O VAL A 701 1.932 7.115 2.855 1.00 0.00 O ATOM 856 CB VAL A 701 3.687 7.543 5.189 1.00 0.00 C ATOM 857 CG1 VAL A 701 3.185 8.979 5.281 1.00 0.00 C ATOM 858 CG2 VAL A 701 4.546 7.221 6.420 1.00 0.00 C ATOM 0 H VAL A 701 3.498 5.215 3.859 1.00 0.00 H new ATOM 0 HA VAL A 701 1.923 6.593 6.049 1.00 0.00 H new ATOM 0 HB VAL A 701 4.296 7.417 4.293 1.00 0.00 H new ATOM 0 HG11 VAL A 701 4.035 9.659 5.331 1.00 0.00 H new ATOM 0 HG12 VAL A 701 2.586 9.212 4.401 1.00 0.00 H new ATOM 0 HG13 VAL A 701 2.574 9.094 6.177 1.00 0.00 H new ATOM 0 HG21 VAL A 701 5.397 7.901 6.458 1.00 0.00 H new ATOM 0 HG22 VAL A 701 3.947 7.339 7.323 1.00 0.00 H new ATOM 0 HG23 VAL A 701 4.905 6.194 6.354 1.00 0.00 H new ATOM 868 N GLN A 702 0.307 7.296 4.312 1.00 0.00 N ATOM 869 CA GLN A 702 -0.643 7.704 3.235 1.00 0.00 C ATOM 870 C GLN A 702 -0.738 9.222 3.112 1.00 0.00 C ATOM 871 O GLN A 702 -0.425 9.944 4.031 1.00 0.00 O ATOM 872 CB GLN A 702 -2.001 7.161 3.634 1.00 0.00 C ATOM 873 CG GLN A 702 -2.973 7.452 2.491 1.00 0.00 C ATOM 874 CD GLN A 702 -4.315 6.777 2.751 1.00 0.00 C ATOM 875 OE1 GLN A 702 -4.545 6.238 3.815 1.00 0.00 O ATOM 876 NE2 GLN A 702 -5.219 6.779 1.806 1.00 0.00 N ATOM 0 H GLN A 702 -0.087 7.250 5.252 1.00 0.00 H new ATOM 0 HA GLN A 702 -0.301 7.318 2.275 1.00 0.00 H new ATOM 0 HB2 GLN A 702 -1.944 6.089 3.823 1.00 0.00 H new ATOM 0 HB3 GLN A 702 -2.344 7.630 4.556 1.00 0.00 H new ATOM 0 HG2 GLN A 702 -3.113 8.528 2.389 1.00 0.00 H new ATOM 0 HG3 GLN A 702 -2.555 7.095 1.550 1.00 0.00 H new ATOM 0 HE21 GLN A 702 -5.023 7.232 0.914 1.00 0.00 H new ATOM 0 HE22 GLN A 702 -6.120 6.327 1.961 1.00 0.00 H new ATOM 885 N LEU A 703 -1.184 9.682 1.965 1.00 0.00 N ATOM 886 CA LEU A 703 -1.349 11.151 1.693 1.00 0.00 C ATOM 887 C LEU A 703 -0.042 11.734 1.194 1.00 0.00 C ATOM 888 O LEU A 703 0.995 11.563 1.798 1.00 0.00 O ATOM 889 CB LEU A 703 -1.759 11.817 3.006 1.00 0.00 C ATOM 890 CG LEU A 703 -2.203 13.244 2.718 1.00 0.00 C ATOM 891 CD1 LEU A 703 -3.333 13.227 1.693 1.00 0.00 C ATOM 892 CD2 LEU A 703 -2.692 13.880 4.005 1.00 0.00 C ATOM 0 H LEU A 703 -1.448 9.083 1.183 1.00 0.00 H new ATOM 0 HA LEU A 703 -2.107 11.320 0.928 1.00 0.00 H new ATOM 0 HB2 LEU A 703 -2.568 11.258 3.475 1.00 0.00 H new ATOM 0 HB3 LEU A 703 -0.923 11.816 3.706 1.00 0.00 H new ATOM 0 HG LEU A 703 -1.366 13.818 2.321 1.00 0.00 H new ATOM 0 HD11 LEU A 703 -3.652 14.249 1.486 1.00 0.00 H new ATOM 0 HD12 LEU A 703 -2.981 12.763 0.772 1.00 0.00 H new ATOM 0 HD13 LEU A 703 -4.174 12.657 2.088 1.00 0.00 H new ATOM 0 HD21 LEU A 703 -3.012 14.903 3.807 1.00 0.00 H new ATOM 0 HD22 LEU A 703 -3.532 13.307 4.398 1.00 0.00 H new ATOM 0 HD23 LEU A 703 -1.884 13.888 4.737 1.00 0.00 H new ATOM 904 N LEU A 704 -0.082 12.417 0.092 1.00 0.00 N ATOM 905 CA LEU A 704 1.168 13.001 -0.433 1.00 0.00 C ATOM 906 C LEU A 704 1.683 14.053 0.554 1.00 0.00 C ATOM 907 O LEU A 704 2.833 14.000 0.942 1.00 0.00 O ATOM 908 CB LEU A 704 0.797 13.610 -1.780 1.00 0.00 C ATOM 909 CG LEU A 704 0.084 12.562 -2.629 1.00 0.00 C ATOM 910 CD1 LEU A 704 -0.996 13.264 -3.454 1.00 0.00 C ATOM 911 CD2 LEU A 704 1.094 11.870 -3.556 1.00 0.00 C ATOM 0 H LEU A 704 -0.920 12.594 -0.462 1.00 0.00 H new ATOM 0 HA LEU A 704 1.967 12.269 -0.556 1.00 0.00 H new ATOM 0 HB2 LEU A 704 0.152 14.477 -1.635 1.00 0.00 H new ATOM 0 HB3 LEU A 704 1.693 13.961 -2.292 1.00 0.00 H new ATOM 0 HG LEU A 704 -0.372 11.805 -1.991 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -1.518 12.531 -4.069 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -1.707 13.749 -2.785 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -0.533 14.013 -4.097 1.00 0.00 H new ATOM 0 HD21 LEU A 704 0.580 11.122 -4.160 1.00 0.00 H new ATOM 0 HD22 LEU A 704 1.555 12.611 -4.210 1.00 0.00 H new ATOM 0 HD23 LEU A 704 1.865 11.385 -2.957 1.00 0.00 H new ATOM 923 N PRO A 705 0.828 14.969 0.980 1.00 0.00 N ATOM 924 CA PRO A 705 1.274 15.972 1.973 1.00 0.00 C ATOM 925 C PRO A 705 1.746 15.277 3.261 1.00 0.00 C ATOM 926 O PRO A 705 2.738 15.654 3.854 1.00 0.00 O ATOM 927 CB PRO A 705 0.006 16.788 2.233 1.00 0.00 C ATOM 928 CG PRO A 705 -1.144 16.201 1.394 1.00 0.00 C ATOM 929 CD PRO A 705 -0.581 15.085 0.502 1.00 0.00 C ATOM 0 HA PRO A 705 2.112 16.579 1.630 1.00 0.00 H new ATOM 0 HB2 PRO A 705 -0.249 16.762 3.293 1.00 0.00 H new ATOM 0 HB3 PRO A 705 0.169 17.833 1.970 1.00 0.00 H new ATOM 0 HG2 PRO A 705 -1.924 15.807 2.045 1.00 0.00 H new ATOM 0 HG3 PRO A 705 -1.602 16.979 0.783 1.00 0.00 H new ATOM 0 HD2 PRO A 705 -1.130 14.151 0.626 1.00 0.00 H new ATOM 0 HD3 PRO A 705 -0.631 15.346 -0.555 1.00 0.00 H new ATOM 937 N GLY A 706 1.041 14.254 3.687 1.00 0.00 N ATOM 938 CA GLY A 706 1.440 13.514 4.928 1.00 0.00 C ATOM 939 C GLY A 706 0.428 13.778 6.055 1.00 0.00 C ATOM 940 O GLY A 706 0.408 14.839 6.646 1.00 0.00 O ATOM 0 H GLY A 706 0.203 13.899 3.226 1.00 0.00 H new ATOM 0 HA2 GLY A 706 1.493 12.445 4.721 1.00 0.00 H new ATOM 0 HA3 GLY A 706 2.435 13.828 5.243 1.00 0.00 H new ATOM 944 N ASP A 707 -0.406 12.813 6.367 1.00 0.00 N ATOM 945 CA ASP A 707 -1.402 13.015 7.469 1.00 0.00 C ATOM 946 C ASP A 707 -1.946 11.677 7.950 1.00 0.00 C ATOM 947 O ASP A 707 -2.140 11.460 9.130 1.00 0.00 O ATOM 948 CB ASP A 707 -2.536 13.816 6.851 1.00 0.00 C ATOM 949 CG ASP A 707 -3.462 14.341 7.948 1.00 0.00 C ATOM 950 OD1 ASP A 707 -3.046 14.350 9.094 1.00 0.00 O ATOM 951 OD2 ASP A 707 -4.571 14.732 7.621 1.00 0.00 O ATOM 0 H ASP A 707 -0.440 11.901 5.911 1.00 0.00 H new ATOM 0 HA ASP A 707 -0.948 13.518 8.323 1.00 0.00 H new ATOM 0 HB2 ASP A 707 -2.132 14.649 6.275 1.00 0.00 H new ATOM 0 HB3 ASP A 707 -3.098 13.191 6.157 1.00 0.00 H new ATOM 956 N ARG A 708 -2.214 10.780 7.049 1.00 0.00 N ATOM 957 CA ARG A 708 -2.756 9.476 7.480 1.00 0.00 C ATOM 958 C ARG A 708 -1.629 8.444 7.496 1.00 0.00 C ATOM 959 O ARG A 708 -0.829 8.375 6.585 1.00 0.00 O ATOM 960 CB ARG A 708 -3.839 9.130 6.456 1.00 0.00 C ATOM 961 CG ARG A 708 -4.683 7.975 6.989 1.00 0.00 C ATOM 962 CD ARG A 708 -5.400 8.423 8.267 1.00 0.00 C ATOM 963 NE ARG A 708 -6.284 9.547 7.845 1.00 0.00 N ATOM 964 CZ ARG A 708 -7.161 10.029 8.679 1.00 0.00 C ATOM 965 NH1 ARG A 708 -6.942 9.963 9.965 1.00 0.00 N ATOM 966 NH2 ARG A 708 -8.258 10.574 8.229 1.00 0.00 N ATOM 0 H ARG A 708 -2.082 10.894 6.044 1.00 0.00 H new ATOM 0 HA ARG A 708 -3.176 9.495 8.486 1.00 0.00 H new ATOM 0 HB2 ARG A 708 -4.469 9.999 6.267 1.00 0.00 H new ATOM 0 HB3 ARG A 708 -3.383 8.854 5.505 1.00 0.00 H new ATOM 0 HG2 ARG A 708 -5.411 7.664 6.239 1.00 0.00 H new ATOM 0 HG3 ARG A 708 -4.050 7.112 7.196 1.00 0.00 H new ATOM 0 HD2 ARG A 708 -5.979 7.608 8.700 1.00 0.00 H new ATOM 0 HD3 ARG A 708 -4.687 8.746 9.026 1.00 0.00 H new ATOM 0 HE ARG A 708 -6.202 9.937 6.906 1.00 0.00 H new ATOM 0 HH11 ARG A 708 -6.085 9.534 10.315 1.00 0.00 H new ATOM 0 HH12 ARG A 708 -7.628 10.340 10.619 1.00 0.00 H new ATOM 0 HH21 ARG A 708 -8.429 10.622 7.225 1.00 0.00 H new ATOM 0 HH22 ARG A 708 -8.945 10.951 8.882 1.00 0.00 H new ATOM 980 N GLU A 709 -1.547 7.658 8.535 1.00 0.00 N ATOM 981 CA GLU A 709 -0.457 6.646 8.612 1.00 0.00 C ATOM 982 C GLU A 709 -1.040 5.245 8.474 1.00 0.00 C ATOM 983 O GLU A 709 -1.896 4.843 9.229 1.00 0.00 O ATOM 984 CB GLU A 709 0.170 6.831 9.997 1.00 0.00 C ATOM 985 CG GLU A 709 -0.807 6.331 11.066 1.00 0.00 C ATOM 986 CD GLU A 709 -0.326 6.770 12.452 1.00 0.00 C ATOM 987 OE1 GLU A 709 0.863 6.994 12.604 1.00 0.00 O ATOM 988 OE2 GLU A 709 -1.158 6.873 13.340 1.00 0.00 O ATOM 0 H GLU A 709 -2.185 7.673 9.331 1.00 0.00 H new ATOM 0 HA GLU A 709 0.278 6.770 7.817 1.00 0.00 H new ATOM 0 HB2 GLU A 709 1.109 6.281 10.060 1.00 0.00 H new ATOM 0 HB3 GLU A 709 0.404 7.882 10.165 1.00 0.00 H new ATOM 0 HG2 GLU A 709 -1.804 6.727 10.874 1.00 0.00 H new ATOM 0 HG3 GLU A 709 -0.882 5.244 11.024 1.00 0.00 H new ATOM 995 N LEU A 710 -0.574 4.497 7.522 1.00 0.00 N ATOM 996 CA LEU A 710 -1.098 3.117 7.336 1.00 0.00 C ATOM 997 C LEU A 710 0.052 2.131 7.517 1.00 0.00 C ATOM 998 O LEU A 710 0.314 1.297 6.682 1.00 0.00 O ATOM 999 CB LEU A 710 -1.638 3.123 5.901 1.00 0.00 C ATOM 1000 CG LEU A 710 -2.068 1.720 5.451 1.00 0.00 C ATOM 1001 CD1 LEU A 710 -3.165 1.158 6.359 1.00 0.00 C ATOM 1002 CD2 LEU A 710 -2.601 1.823 4.027 1.00 0.00 C ATOM 0 H LEU A 710 0.149 4.780 6.861 1.00 0.00 H new ATOM 0 HA LEU A 710 -1.871 2.824 8.046 1.00 0.00 H new ATOM 0 HB2 LEU A 710 -2.487 3.803 5.835 1.00 0.00 H new ATOM 0 HB3 LEU A 710 -0.872 3.503 5.225 1.00 0.00 H new ATOM 0 HG LEU A 710 -1.210 1.049 5.503 1.00 0.00 H new ATOM 0 HD11 LEU A 710 -3.448 0.163 6.015 1.00 0.00 H new ATOM 0 HD12 LEU A 710 -2.794 1.096 7.382 1.00 0.00 H new ATOM 0 HD13 LEU A 710 -4.035 1.814 6.328 1.00 0.00 H new ATOM 0 HD21 LEU A 710 -2.914 0.837 3.683 1.00 0.00 H new ATOM 0 HD22 LEU A 710 -3.453 2.502 4.006 1.00 0.00 H new ATOM 0 HD23 LEU A 710 -1.817 2.204 3.372 1.00 0.00 H new ATOM 1014 N THR A 711 0.753 2.227 8.614 1.00 0.00 N ATOM 1015 CA THR A 711 1.891 1.304 8.825 1.00 0.00 C ATOM 1016 C THR A 711 1.392 -0.143 8.841 1.00 0.00 C ATOM 1017 O THR A 711 0.242 -0.407 8.550 1.00 0.00 O ATOM 1018 CB THR A 711 2.579 1.756 10.118 1.00 0.00 C ATOM 1019 OG1 THR A 711 1.762 1.486 11.246 1.00 0.00 O ATOM 1020 CG2 THR A 711 2.835 3.263 10.026 1.00 0.00 C ATOM 0 H THR A 711 0.585 2.899 9.363 1.00 0.00 H new ATOM 0 HA THR A 711 2.623 1.335 8.018 1.00 0.00 H new ATOM 0 HB THR A 711 3.516 1.211 10.237 1.00 0.00 H new ATOM 0 HG1 THR A 711 2.221 1.781 12.060 1.00 0.00 H new ATOM 0 HG21 THR A 711 3.325 3.605 10.938 1.00 0.00 H new ATOM 0 HG22 THR A 711 3.476 3.472 9.169 1.00 0.00 H new ATOM 0 HG23 THR A 711 1.887 3.786 9.905 1.00 0.00 H new ATOM 1028 N ILE A 712 2.245 -1.093 9.087 1.00 0.00 N ATOM 1029 CA ILE A 712 1.788 -2.514 9.007 1.00 0.00 C ATOM 1030 C ILE A 712 0.507 -2.764 9.817 1.00 0.00 C ATOM 1031 O ILE A 712 -0.389 -3.420 9.325 1.00 0.00 O ATOM 1032 CB ILE A 712 2.947 -3.369 9.520 1.00 0.00 C ATOM 1033 CG1 ILE A 712 4.209 -3.079 8.710 1.00 0.00 C ATOM 1034 CG2 ILE A 712 2.599 -4.842 9.354 1.00 0.00 C ATOM 1035 CD1 ILE A 712 3.986 -3.440 7.236 1.00 0.00 C ATOM 0 H ILE A 712 3.225 -0.957 9.337 1.00 0.00 H new ATOM 0 HA ILE A 712 1.530 -2.770 7.979 1.00 0.00 H new ATOM 0 HB ILE A 712 3.120 -3.134 10.570 1.00 0.00 H new ATOM 0 HG12 ILE A 712 4.472 -2.025 8.798 1.00 0.00 H new ATOM 0 HG13 ILE A 712 5.046 -3.651 9.110 1.00 0.00 H new ATOM 0 HG21 ILE A 712 3.424 -5.454 9.719 1.00 0.00 H new ATOM 0 HG22 ILE A 712 1.698 -5.070 9.924 1.00 0.00 H new ATOM 0 HG23 ILE A 712 2.426 -5.058 8.300 1.00 0.00 H new ATOM 0 HD11 ILE A 712 4.892 -3.229 6.669 1.00 0.00 H new ATOM 0 HD12 ILE A 712 3.745 -4.500 7.153 1.00 0.00 H new ATOM 0 HD13 ILE A 712 3.162 -2.848 6.837 1.00 0.00 H new ATOM 1047 N PRO A 713 0.430 -2.241 11.018 1.00 0.00 N ATOM 1048 CA PRO A 713 -0.785 -2.439 11.838 1.00 0.00 C ATOM 1049 C PRO A 713 -1.956 -1.679 11.216 1.00 0.00 C ATOM 1050 O PRO A 713 -2.318 -0.607 11.657 1.00 0.00 O ATOM 1051 CB PRO A 713 -0.396 -1.828 13.183 1.00 0.00 C ATOM 1052 CG PRO A 713 1.042 -1.290 13.075 1.00 0.00 C ATOM 1053 CD PRO A 713 1.515 -1.444 11.621 1.00 0.00 C ATOM 0 HA PRO A 713 -1.098 -3.480 11.920 1.00 0.00 H new ATOM 0 HB2 PRO A 713 -1.083 -1.024 13.447 1.00 0.00 H new ATOM 0 HB3 PRO A 713 -0.463 -2.576 13.973 1.00 0.00 H new ATOM 0 HG2 PRO A 713 1.078 -0.243 13.376 1.00 0.00 H new ATOM 0 HG3 PRO A 713 1.702 -1.837 13.748 1.00 0.00 H new ATOM 0 HD2 PRO A 713 1.633 -0.479 11.128 1.00 0.00 H new ATOM 0 HD3 PRO A 713 2.477 -1.954 11.558 1.00 0.00 H new ATOM 1061 N HIS A 714 -2.536 -2.216 10.188 1.00 0.00 N ATOM 1062 CA HIS A 714 -3.668 -1.517 9.533 1.00 0.00 C ATOM 1063 C HIS A 714 -4.996 -1.994 10.107 1.00 0.00 C ATOM 1064 O HIS A 714 -5.048 -2.791 11.025 1.00 0.00 O ATOM 1065 CB HIS A 714 -3.575 -1.894 8.053 1.00 0.00 C ATOM 1066 CG HIS A 714 -3.813 -3.373 7.883 1.00 0.00 C ATOM 1067 ND1 HIS A 714 -5.087 -3.897 7.726 1.00 0.00 N ATOM 1068 CD2 HIS A 714 -2.959 -4.448 7.840 1.00 0.00 C ATOM 1069 CE1 HIS A 714 -4.967 -5.232 7.601 1.00 0.00 C ATOM 1070 NE2 HIS A 714 -3.690 -5.620 7.663 1.00 0.00 N ATOM 0 H HIS A 714 -2.276 -3.110 9.771 1.00 0.00 H new ATOM 0 HA HIS A 714 -3.618 -0.439 9.689 1.00 0.00 H new ATOM 0 HB2 HIS A 714 -4.310 -1.330 7.479 1.00 0.00 H new ATOM 0 HB3 HIS A 714 -2.593 -1.628 7.662 1.00 0.00 H new ATOM 0 HD2 HIS A 714 -1.884 -4.393 7.930 1.00 0.00 H new ATOM 0 HE1 HIS A 714 -5.800 -5.906 7.467 1.00 0.00 H new ATOM 0 HE2 HIS A 714 -3.328 -6.571 7.595 1.00 0.00 H new ATOM 1078 N SER A 715 -6.072 -1.521 9.549 1.00 0.00 N ATOM 1079 CA SER A 715 -7.418 -1.945 10.013 1.00 0.00 C ATOM 1080 C SER A 715 -8.181 -2.519 8.820 1.00 0.00 C ATOM 1081 O SER A 715 -7.996 -2.088 7.700 1.00 0.00 O ATOM 1082 CB SER A 715 -8.101 -0.670 10.506 1.00 0.00 C ATOM 1083 OG SER A 715 -7.375 -0.134 11.605 1.00 0.00 O ATOM 0 H SER A 715 -6.075 -0.850 8.781 1.00 0.00 H new ATOM 0 HA SER A 715 -7.377 -2.702 10.796 1.00 0.00 H new ATOM 0 HB2 SER A 715 -8.153 0.062 9.700 1.00 0.00 H new ATOM 0 HB3 SER A 715 -9.126 -0.887 10.806 1.00 0.00 H new ATOM 0 HG SER A 715 -7.813 0.684 11.919 1.00 0.00 H new ATOM 1089 N ALA A 716 -9.031 -3.476 9.035 1.00 0.00 N ATOM 1090 CA ALA A 716 -9.792 -4.048 7.889 1.00 0.00 C ATOM 1091 C ALA A 716 -10.473 -2.914 7.114 1.00 0.00 C ATOM 1092 O ALA A 716 -10.272 -2.745 5.928 1.00 0.00 O ATOM 1093 CB ALA A 716 -10.841 -4.946 8.539 1.00 0.00 C ATOM 0 H ALA A 716 -9.234 -3.887 9.946 1.00 0.00 H new ATOM 0 HA ALA A 716 -9.160 -4.593 7.187 1.00 0.00 H new ATOM 0 HB1 ALA A 716 -11.451 -5.412 7.765 1.00 0.00 H new ATOM 0 HB2 ALA A 716 -10.345 -5.720 9.125 1.00 0.00 H new ATOM 0 HB3 ALA A 716 -11.477 -4.349 9.192 1.00 0.00 H new ATOM 1099 N ASN A 717 -11.248 -2.113 7.795 1.00 0.00 N ATOM 1100 CA ASN A 717 -11.931 -0.965 7.133 1.00 0.00 C ATOM 1101 C ASN A 717 -10.909 0.159 7.007 1.00 0.00 C ATOM 1102 O ASN A 717 -10.910 1.116 7.758 1.00 0.00 O ATOM 1103 CB ASN A 717 -13.064 -0.594 8.095 1.00 0.00 C ATOM 1104 CG ASN A 717 -14.305 -0.157 7.316 1.00 0.00 C ATOM 1105 OD1 ASN A 717 -15.410 -0.277 7.802 1.00 0.00 O ATOM 1106 ND2 ASN A 717 -14.177 0.363 6.130 1.00 0.00 N ATOM 0 H ASN A 717 -11.439 -2.207 8.793 1.00 0.00 H new ATOM 0 HA ASN A 717 -12.322 -1.176 6.138 1.00 0.00 H new ATOM 0 HB2 ASN A 717 -13.306 -1.448 8.728 1.00 0.00 H new ATOM 0 HB3 ASN A 717 -12.740 0.210 8.755 1.00 0.00 H new ATOM 0 HD21 ASN A 717 -15.003 0.667 5.615 1.00 0.00 H new ATOM 0 HD22 ASN A 717 -13.251 0.467 5.716 1.00 0.00 H new ATOM 1113 N VAL A 718 -9.998 0.003 6.091 1.00 0.00 N ATOM 1114 CA VAL A 718 -8.912 1.009 5.933 1.00 0.00 C ATOM 1115 C VAL A 718 -9.230 2.054 4.865 1.00 0.00 C ATOM 1116 O VAL A 718 -9.113 3.237 5.109 1.00 0.00 O ATOM 1117 CB VAL A 718 -7.693 0.162 5.539 1.00 0.00 C ATOM 1118 CG1 VAL A 718 -7.933 -0.506 4.182 1.00 0.00 C ATOM 1119 CG2 VAL A 718 -6.445 1.041 5.449 1.00 0.00 C ATOM 0 H VAL A 718 -9.958 -0.782 5.441 1.00 0.00 H new ATOM 0 HA VAL A 718 -8.758 1.590 6.842 1.00 0.00 H new ATOM 0 HB VAL A 718 -7.544 -0.602 6.302 1.00 0.00 H new ATOM 0 HG11 VAL A 718 -7.063 -1.104 3.912 1.00 0.00 H new ATOM 0 HG12 VAL A 718 -8.811 -1.149 4.243 1.00 0.00 H new ATOM 0 HG13 VAL A 718 -8.097 0.260 3.424 1.00 0.00 H new ATOM 0 HG21 VAL A 718 -5.588 0.428 5.169 1.00 0.00 H new ATOM 0 HG22 VAL A 718 -6.599 1.815 4.697 1.00 0.00 H new ATOM 0 HG23 VAL A 718 -6.257 1.507 6.416 1.00 0.00 H new ATOM 1129 N PHE A 719 -9.617 1.655 3.690 1.00 0.00 N ATOM 1130 CA PHE A 719 -9.906 2.672 2.649 1.00 0.00 C ATOM 1131 C PHE A 719 -11.229 3.391 2.912 1.00 0.00 C ATOM 1132 O PHE A 719 -11.329 4.579 2.705 1.00 0.00 O ATOM 1133 CB PHE A 719 -9.853 1.936 1.316 1.00 0.00 C ATOM 1134 CG PHE A 719 -8.398 1.902 0.866 1.00 0.00 C ATOM 1135 CD1 PHE A 719 -7.363 2.134 1.792 1.00 0.00 C ATOM 1136 CD2 PHE A 719 -8.081 1.673 -0.476 1.00 0.00 C ATOM 1137 CE1 PHE A 719 -6.029 2.140 1.373 1.00 0.00 C ATOM 1138 CE2 PHE A 719 -6.741 1.670 -0.890 1.00 0.00 C ATOM 1139 CZ PHE A 719 -5.718 1.906 0.033 1.00 0.00 C ATOM 0 H PHE A 719 -9.744 0.683 3.408 1.00 0.00 H new ATOM 0 HA PHE A 719 -9.172 3.478 2.650 1.00 0.00 H new ATOM 0 HB2 PHE A 719 -10.245 0.924 1.421 1.00 0.00 H new ATOM 0 HB3 PHE A 719 -10.471 2.442 0.574 1.00 0.00 H new ATOM 0 HD1 PHE A 719 -7.601 2.308 2.831 1.00 0.00 H new ATOM 0 HD2 PHE A 719 -8.868 1.498 -1.194 1.00 0.00 H new ATOM 0 HE1 PHE A 719 -5.240 2.326 2.086 1.00 0.00 H new ATOM 0 HE2 PHE A 719 -6.499 1.485 -1.926 1.00 0.00 H new ATOM 0 HZ PHE A 719 -4.688 1.907 -0.291 1.00 0.00 H new ATOM 1149 N TYR A 720 -12.236 2.734 3.420 1.00 0.00 N ATOM 1150 CA TYR A 720 -13.488 3.492 3.713 1.00 0.00 C ATOM 1151 C TYR A 720 -13.084 4.724 4.523 1.00 0.00 C ATOM 1152 O TYR A 720 -13.754 5.733 4.528 1.00 0.00 O ATOM 1153 CB TYR A 720 -14.353 2.547 4.537 1.00 0.00 C ATOM 1154 CG TYR A 720 -15.635 3.219 4.992 1.00 0.00 C ATOM 1155 CD1 TYR A 720 -16.639 3.534 4.067 1.00 0.00 C ATOM 1156 CD2 TYR A 720 -15.825 3.504 6.353 1.00 0.00 C ATOM 1157 CE1 TYR A 720 -17.831 4.131 4.506 1.00 0.00 C ATOM 1158 CE2 TYR A 720 -17.014 4.104 6.787 1.00 0.00 C ATOM 1159 CZ TYR A 720 -18.017 4.416 5.865 1.00 0.00 C ATOM 1160 OH TYR A 720 -19.192 5.001 6.296 1.00 0.00 O ATOM 0 H TYR A 720 -12.251 1.738 3.639 1.00 0.00 H new ATOM 0 HA TYR A 720 -14.031 3.819 2.826 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -14.594 1.664 3.945 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -13.792 2.204 5.407 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -16.496 3.318 3.019 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -15.053 3.260 7.067 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -18.607 4.371 3.794 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -17.156 4.326 7.834 1.00 0.00 H new ATOM 0 HH TYR A 720 -19.157 5.129 7.267 1.00 0.00 H new ATOM 1170 N ALA A 721 -11.950 4.644 5.185 1.00 0.00 N ATOM 1171 CA ALA A 721 -11.454 5.809 5.963 1.00 0.00 C ATOM 1172 C ALA A 721 -10.188 6.388 5.293 1.00 0.00 C ATOM 1173 O ALA A 721 -9.854 7.538 5.489 1.00 0.00 O ATOM 1174 CB ALA A 721 -11.137 5.291 7.372 1.00 0.00 C ATOM 0 H ALA A 721 -11.352 3.818 5.215 1.00 0.00 H new ATOM 0 HA ALA A 721 -12.194 6.608 6.005 1.00 0.00 H new ATOM 0 HB1 ALA A 721 -10.767 6.112 7.987 1.00 0.00 H new ATOM 0 HB2 ALA A 721 -12.042 4.880 7.821 1.00 0.00 H new ATOM 0 HB3 ALA A 721 -10.377 4.512 7.311 1.00 0.00 H new ATOM 1180 N MET A 722 -9.457 5.598 4.522 1.00 0.00 N ATOM 1181 CA MET A 722 -8.204 6.133 3.879 1.00 0.00 C ATOM 1182 C MET A 722 -8.414 6.536 2.418 1.00 0.00 C ATOM 1183 O MET A 722 -7.614 7.248 1.847 1.00 0.00 O ATOM 1184 CB MET A 722 -7.194 4.966 3.918 1.00 0.00 C ATOM 1185 CG MET A 722 -6.418 5.002 5.235 1.00 0.00 C ATOM 1186 SD MET A 722 -5.136 3.730 5.241 1.00 0.00 S ATOM 1187 CE MET A 722 -4.932 3.664 7.036 1.00 0.00 C ATOM 0 H MET A 722 -9.672 4.623 4.315 1.00 0.00 H new ATOM 0 HA MET A 722 -7.872 7.026 4.409 1.00 0.00 H new ATOM 0 HB2 MET A 722 -7.718 4.015 3.819 1.00 0.00 H new ATOM 0 HB3 MET A 722 -6.505 5.040 3.076 1.00 0.00 H new ATOM 0 HG2 MET A 722 -5.966 5.984 5.372 1.00 0.00 H new ATOM 0 HG3 MET A 722 -7.100 4.845 6.071 1.00 0.00 H new ATOM 0 HE1 MET A 722 -4.086 4.285 7.329 1.00 0.00 H new ATOM 0 HE2 MET A 722 -5.837 4.032 7.519 1.00 0.00 H new ATOM 0 HE3 MET A 722 -4.750 2.634 7.344 1.00 0.00 H new ATOM 1197 N ASP A 723 -9.434 6.036 1.783 1.00 0.00 N ATOM 1198 CA ASP A 723 -9.625 6.339 0.333 1.00 0.00 C ATOM 1199 C ASP A 723 -10.517 7.551 0.061 1.00 0.00 C ATOM 1200 O ASP A 723 -10.899 7.781 -1.072 1.00 0.00 O ATOM 1201 CB ASP A 723 -10.269 5.083 -0.234 1.00 0.00 C ATOM 1202 CG ASP A 723 -11.693 4.915 0.291 1.00 0.00 C ATOM 1203 OD1 ASP A 723 -12.335 5.916 0.570 1.00 0.00 O ATOM 1204 OD2 ASP A 723 -12.120 3.782 0.409 1.00 0.00 O ATOM 0 H ASP A 723 -10.143 5.433 2.200 1.00 0.00 H new ATOM 0 HA ASP A 723 -8.669 6.596 -0.124 1.00 0.00 H new ATOM 0 HB2 ASP A 723 -10.283 5.136 -1.323 1.00 0.00 H new ATOM 0 HB3 ASP A 723 -9.673 4.211 0.035 1.00 0.00 H new ATOM 1209 N GLY A 724 -10.854 8.332 1.055 1.00 0.00 N ATOM 1210 CA GLY A 724 -11.716 9.527 0.787 1.00 0.00 C ATOM 1211 C GLY A 724 -11.197 10.184 -0.490 1.00 0.00 C ATOM 1212 O GLY A 724 -11.901 10.309 -1.473 1.00 0.00 O ATOM 0 H GLY A 724 -10.576 8.199 2.027 1.00 0.00 H new ATOM 0 HA2 GLY A 724 -12.758 9.230 0.670 1.00 0.00 H new ATOM 0 HA3 GLY A 724 -11.675 10.226 1.623 1.00 0.00 H new ATOM 1216 N ALA A 725 -9.954 10.569 -0.487 1.00 0.00 N ATOM 1217 CA ALA A 725 -9.340 11.179 -1.702 1.00 0.00 C ATOM 1218 C ALA A 725 -8.609 10.086 -2.479 1.00 0.00 C ATOM 1219 O ALA A 725 -8.829 8.915 -2.253 1.00 0.00 O ATOM 1220 CB ALA A 725 -8.322 12.185 -1.173 1.00 0.00 C ATOM 0 H ALA A 725 -9.328 10.487 0.314 1.00 0.00 H new ATOM 0 HA ALA A 725 -10.076 11.646 -2.356 1.00 0.00 H new ATOM 0 HB1 ALA A 725 -7.827 12.676 -2.011 1.00 0.00 H new ATOM 0 HB2 ALA A 725 -8.831 12.932 -0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 725 -7.580 11.667 -0.566 1.00 0.00 H new ATOM 1226 N SER A 726 -7.688 10.437 -3.343 1.00 0.00 N ATOM 1227 CA SER A 726 -6.933 9.358 -4.028 1.00 0.00 C ATOM 1228 C SER A 726 -6.043 8.738 -2.965 1.00 0.00 C ATOM 1229 O SER A 726 -5.765 9.359 -1.957 1.00 0.00 O ATOM 1230 CB SER A 726 -6.110 10.021 -5.135 1.00 0.00 C ATOM 1231 OG SER A 726 -5.162 10.911 -4.563 1.00 0.00 O ATOM 0 H SER A 726 -7.436 11.393 -3.594 1.00 0.00 H new ATOM 0 HA SER A 726 -7.562 8.589 -4.476 1.00 0.00 H new ATOM 0 HB2 SER A 726 -5.599 9.261 -5.725 1.00 0.00 H new ATOM 0 HB3 SER A 726 -6.768 10.563 -5.814 1.00 0.00 H new ATOM 0 HG SER A 726 -4.637 11.331 -5.275 1.00 0.00 H new ATOM 1237 N HIS A 727 -5.619 7.530 -3.120 1.00 0.00 N ATOM 1238 CA HIS A 727 -4.796 6.946 -2.032 1.00 0.00 C ATOM 1239 C HIS A 727 -3.334 6.850 -2.464 1.00 0.00 C ATOM 1240 O HIS A 727 -2.980 6.143 -3.386 1.00 0.00 O ATOM 1241 CB HIS A 727 -5.396 5.560 -1.714 1.00 0.00 C ATOM 1242 CG HIS A 727 -6.825 5.469 -2.188 1.00 0.00 C ATOM 1243 ND1 HIS A 727 -7.696 6.545 -2.139 1.00 0.00 N ATOM 1244 CD2 HIS A 727 -7.538 4.436 -2.745 1.00 0.00 C ATOM 1245 CE1 HIS A 727 -8.862 6.139 -2.659 1.00 0.00 C ATOM 1246 NE2 HIS A 727 -8.824 4.864 -3.043 1.00 0.00 N ATOM 0 H HIS A 727 -5.796 6.930 -3.926 1.00 0.00 H new ATOM 0 HA HIS A 727 -4.811 7.571 -1.139 1.00 0.00 H new ATOM 0 HB2 HIS A 727 -4.800 4.783 -2.193 1.00 0.00 H new ATOM 0 HB3 HIS A 727 -5.353 5.379 -0.640 1.00 0.00 H new ATOM 0 HD1 HIS A 727 -7.488 7.475 -1.774 1.00 0.00 H new ATOM 0 HD2 HIS A 727 -7.156 3.442 -2.924 1.00 0.00 H new ATOM 0 HE1 HIS A 727 -9.732 6.772 -2.756 1.00 0.00 H new ATOM 1254 N ASP A 728 -2.482 7.575 -1.787 1.00 0.00 N ATOM 1255 CA ASP A 728 -1.028 7.555 -2.119 1.00 0.00 C ATOM 1256 C ASP A 728 -0.241 7.146 -0.869 1.00 0.00 C ATOM 1257 O ASP A 728 -0.332 7.780 0.164 1.00 0.00 O ATOM 1258 CB ASP A 728 -0.691 9.005 -2.508 1.00 0.00 C ATOM 1259 CG ASP A 728 -1.430 9.385 -3.792 1.00 0.00 C ATOM 1260 OD1 ASP A 728 -1.834 8.486 -4.507 1.00 0.00 O ATOM 1261 OD2 ASP A 728 -1.584 10.572 -4.034 1.00 0.00 O ATOM 0 H ASP A 728 -2.735 8.186 -1.010 1.00 0.00 H new ATOM 0 HA ASP A 728 -0.782 6.855 -2.917 1.00 0.00 H new ATOM 0 HB2 ASP A 728 -0.973 9.682 -1.702 1.00 0.00 H new ATOM 0 HB3 ASP A 728 0.384 9.112 -2.652 1.00 0.00 H new ATOM 1266 N PHE A 729 0.522 6.087 -0.936 1.00 0.00 N ATOM 1267 CA PHE A 729 1.280 5.657 0.271 1.00 0.00 C ATOM 1268 C PHE A 729 2.760 5.462 -0.040 1.00 0.00 C ATOM 1269 O PHE A 729 3.140 5.057 -1.120 1.00 0.00 O ATOM 1270 CB PHE A 729 0.714 4.293 0.642 1.00 0.00 C ATOM 1271 CG PHE A 729 -0.781 4.308 0.637 1.00 0.00 C ATOM 1272 CD1 PHE A 729 -1.470 4.054 -0.547 1.00 0.00 C ATOM 1273 CD2 PHE A 729 -1.475 4.544 1.818 1.00 0.00 C ATOM 1274 CE1 PHE A 729 -2.857 4.044 -0.554 1.00 0.00 C ATOM 1275 CE2 PHE A 729 -2.865 4.533 1.820 1.00 0.00 C ATOM 1276 CZ PHE A 729 -3.564 4.282 0.628 1.00 0.00 C ATOM 0 H PHE A 729 0.651 5.508 -1.766 1.00 0.00 H new ATOM 0 HA PHE A 729 1.189 6.406 1.057 1.00 0.00 H new ATOM 0 HB2 PHE A 729 1.075 3.543 -0.062 1.00 0.00 H new ATOM 0 HB3 PHE A 729 1.074 4.003 1.629 1.00 0.00 H new ATOM 0 HD1 PHE A 729 -0.924 3.865 -1.459 1.00 0.00 H new ATOM 0 HD2 PHE A 729 -0.935 4.736 2.733 1.00 0.00 H new ATOM 0 HE1 PHE A 729 -3.391 3.852 -1.473 1.00 0.00 H new ATOM 0 HE2 PHE A 729 -3.406 4.717 2.736 1.00 0.00 H new ATOM 0 HZ PHE A 729 -4.644 4.273 0.625 1.00 0.00 H new ATOM 1286 N LEU A 730 3.595 5.697 0.915 1.00 0.00 N ATOM 1287 CA LEU A 730 5.045 5.474 0.693 1.00 0.00 C ATOM 1288 C LEU A 730 5.518 4.369 1.650 1.00 0.00 C ATOM 1289 O LEU A 730 5.124 4.323 2.801 1.00 0.00 O ATOM 1290 CB LEU A 730 5.685 6.825 0.986 1.00 0.00 C ATOM 1291 CG LEU A 730 7.185 6.782 0.699 1.00 0.00 C ATOM 1292 CD1 LEU A 730 7.407 6.533 -0.791 1.00 0.00 C ATOM 1293 CD2 LEU A 730 7.809 8.126 1.081 1.00 0.00 C ATOM 0 H LEU A 730 3.342 6.035 1.844 1.00 0.00 H new ATOM 0 HA LEU A 730 5.305 5.143 -0.312 1.00 0.00 H new ATOM 0 HB2 LEU A 730 5.214 7.596 0.376 1.00 0.00 H new ATOM 0 HB3 LEU A 730 5.516 7.095 2.028 1.00 0.00 H new ATOM 0 HG LEU A 730 7.646 5.982 1.278 1.00 0.00 H new ATOM 0 HD11 LEU A 730 8.476 6.502 -0.999 1.00 0.00 H new ATOM 0 HD12 LEU A 730 6.955 5.582 -1.072 1.00 0.00 H new ATOM 0 HD13 LEU A 730 6.949 7.337 -1.367 1.00 0.00 H new ATOM 0 HD21 LEU A 730 8.880 8.101 0.878 1.00 0.00 H new ATOM 0 HD22 LEU A 730 7.347 8.921 0.495 1.00 0.00 H new ATOM 0 HD23 LEU A 730 7.645 8.315 2.142 1.00 0.00 H new ATOM 1305 N LEU A 731 6.303 3.444 1.168 1.00 0.00 N ATOM 1306 CA LEU A 731 6.735 2.303 2.033 1.00 0.00 C ATOM 1307 C LEU A 731 8.225 2.377 2.399 1.00 0.00 C ATOM 1308 O LEU A 731 9.075 2.597 1.559 1.00 0.00 O ATOM 1309 CB LEU A 731 6.501 1.090 1.144 1.00 0.00 C ATOM 1310 CG LEU A 731 5.085 1.098 0.549 1.00 0.00 C ATOM 1311 CD1 LEU A 731 4.684 -0.333 0.179 1.00 0.00 C ATOM 1312 CD2 LEU A 731 4.060 1.672 1.539 1.00 0.00 C ATOM 0 H LEU A 731 6.665 3.427 0.214 1.00 0.00 H new ATOM 0 HA LEU A 731 6.195 2.289 2.980 1.00 0.00 H new ATOM 0 HB2 LEU A 731 7.236 1.079 0.339 1.00 0.00 H new ATOM 0 HB3 LEU A 731 6.649 0.178 1.723 1.00 0.00 H new ATOM 0 HG LEU A 731 5.093 1.733 -0.337 1.00 0.00 H new ATOM 0 HD11 LEU A 731 3.679 -0.332 -0.244 1.00 0.00 H new ATOM 0 HD12 LEU A 731 5.386 -0.729 -0.555 1.00 0.00 H new ATOM 0 HD13 LEU A 731 4.701 -0.958 1.072 1.00 0.00 H new ATOM 0 HD21 LEU A 731 3.070 1.662 1.084 1.00 0.00 H new ATOM 0 HD22 LEU A 731 4.049 1.065 2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.333 2.697 1.792 1.00 0.00 H new ATOM 1324 N ARG A 732 8.544 2.158 3.646 1.00 0.00 N ATOM 1325 CA ARG A 732 9.974 2.185 4.075 1.00 0.00 C ATOM 1326 C ARG A 732 10.319 0.866 4.782 1.00 0.00 C ATOM 1327 O ARG A 732 9.982 0.669 5.935 1.00 0.00 O ATOM 1328 CB ARG A 732 10.040 3.350 5.057 1.00 0.00 C ATOM 1329 CG ARG A 732 9.610 4.624 4.335 1.00 0.00 C ATOM 1330 CD ARG A 732 9.583 5.789 5.320 1.00 0.00 C ATOM 1331 NE ARG A 732 11.013 6.074 5.604 1.00 0.00 N ATOM 1332 CZ ARG A 732 11.692 6.820 4.782 1.00 0.00 C ATOM 1333 NH1 ARG A 732 11.406 8.085 4.677 1.00 0.00 N ATOM 1334 NH2 ARG A 732 12.659 6.303 4.067 1.00 0.00 N ATOM 0 H ARG A 732 7.874 1.961 4.389 1.00 0.00 H new ATOM 0 HA ARG A 732 10.673 2.300 3.247 1.00 0.00 H new ATOM 0 HB2 ARG A 732 9.389 3.162 5.911 1.00 0.00 H new ATOM 0 HB3 ARG A 732 11.052 3.459 5.446 1.00 0.00 H new ATOM 0 HG2 ARG A 732 10.299 4.841 3.519 1.00 0.00 H new ATOM 0 HG3 ARG A 732 8.624 4.487 3.892 1.00 0.00 H new ATOM 0 HD2 ARG A 732 9.083 6.658 4.892 1.00 0.00 H new ATOM 0 HD3 ARG A 732 9.043 5.526 6.230 1.00 0.00 H new ATOM 0 HE ARG A 732 11.459 5.688 6.436 1.00 0.00 H new ATOM 0 HH11 ARG A 732 10.654 8.486 5.237 1.00 0.00 H new ATOM 0 HH12 ARG A 732 11.934 8.676 4.035 1.00 0.00 H new ATOM 0 HH21 ARG A 732 12.883 5.312 4.153 1.00 0.00 H new ATOM 0 HH22 ARG A 732 13.189 6.892 3.424 1.00 0.00 H new ATOM 1348 N GLN A 733 10.965 -0.052 4.115 1.00 0.00 N ATOM 1349 CA GLN A 733 11.284 -1.355 4.778 1.00 0.00 C ATOM 1350 C GLN A 733 12.263 -1.213 5.923 1.00 0.00 C ATOM 1351 O GLN A 733 13.455 -1.040 5.752 1.00 0.00 O ATOM 1352 CB GLN A 733 11.861 -2.231 3.687 1.00 0.00 C ATOM 1353 CG GLN A 733 10.829 -3.259 3.260 1.00 0.00 C ATOM 1354 CD GLN A 733 11.458 -4.183 2.232 1.00 0.00 C ATOM 1355 OE1 GLN A 733 12.646 -4.431 2.262 1.00 0.00 O ATOM 1356 NE2 GLN A 733 10.701 -4.704 1.320 1.00 0.00 N ATOM 0 H GLN A 733 11.284 0.039 3.150 1.00 0.00 H new ATOM 0 HA GLN A 733 10.386 -1.780 5.227 1.00 0.00 H new ATOM 0 HB2 GLN A 733 12.155 -1.620 2.834 1.00 0.00 H new ATOM 0 HB3 GLN A 733 12.760 -2.731 4.046 1.00 0.00 H new ATOM 0 HG2 GLN A 733 10.486 -3.831 4.122 1.00 0.00 H new ATOM 0 HG3 GLN A 733 9.955 -2.764 2.838 1.00 0.00 H new ATOM 0 HE21 GLN A 733 9.704 -4.491 1.302 1.00 0.00 H new ATOM 0 HE22 GLN A 733 11.102 -5.328 0.620 1.00 0.00 H new ATOM 1365 N ARG A 734 11.736 -1.348 7.097 1.00 0.00 N ATOM 1366 CA ARG A 734 12.561 -1.290 8.323 1.00 0.00 C ATOM 1367 C ARG A 734 13.476 -2.517 8.372 1.00 0.00 C ATOM 1368 O ARG A 734 14.611 -2.442 8.798 1.00 0.00 O ATOM 1369 CB ARG A 734 11.537 -1.307 9.460 1.00 0.00 C ATOM 1370 CG ARG A 734 12.260 -1.186 10.796 1.00 0.00 C ATOM 1371 CD ARG A 734 11.285 -1.452 11.941 1.00 0.00 C ATOM 1372 NE ARG A 734 12.160 -1.598 13.127 1.00 0.00 N ATOM 1373 CZ ARG A 734 12.106 -2.683 13.831 1.00 0.00 C ATOM 1374 NH1 ARG A 734 11.059 -2.937 14.570 1.00 0.00 N ATOM 1375 NH2 ARG A 734 13.100 -3.525 13.780 1.00 0.00 N ATOM 0 H ARG A 734 10.741 -1.500 7.263 1.00 0.00 H new ATOM 0 HA ARG A 734 13.208 -0.415 8.379 1.00 0.00 H new ATOM 0 HB2 ARG A 734 10.831 -0.485 9.340 1.00 0.00 H new ATOM 0 HB3 ARG A 734 10.959 -2.231 9.429 1.00 0.00 H new ATOM 0 HG2 ARG A 734 13.086 -1.896 10.838 1.00 0.00 H new ATOM 0 HG3 ARG A 734 12.690 -0.190 10.897 1.00 0.00 H new ATOM 0 HD2 ARG A 734 10.579 -0.630 12.064 1.00 0.00 H new ATOM 0 HD3 ARG A 734 10.698 -2.353 11.764 1.00 0.00 H new ATOM 0 HE ARG A 734 12.801 -0.849 13.387 1.00 0.00 H new ATOM 0 HH11 ARG A 734 10.280 -2.279 14.594 1.00 0.00 H new ATOM 0 HH12 ARG A 734 11.021 -3.793 15.123 1.00 0.00 H new ATOM 0 HH21 ARG A 734 13.908 -3.325 13.190 1.00 0.00 H new ATOM 0 HH22 ARG A 734 13.070 -4.384 14.330 1.00 0.00 H new ATOM 1389 N ARG A 735 12.992 -3.651 7.931 1.00 0.00 N ATOM 1390 CA ARG A 735 13.847 -4.874 7.954 1.00 0.00 C ATOM 1391 C ARG A 735 14.363 -5.197 6.548 1.00 0.00 C ATOM 1392 O ARG A 735 13.551 -5.511 5.696 1.00 0.00 O ATOM 1393 CB ARG A 735 12.939 -5.986 8.469 1.00 0.00 C ATOM 1394 CG ARG A 735 12.609 -5.717 9.937 1.00 0.00 C ATOM 1395 CD ARG A 735 11.887 -6.932 10.526 1.00 0.00 C ATOM 1396 NE ARG A 735 11.678 -6.607 11.965 1.00 0.00 N ATOM 1397 CZ ARG A 735 10.735 -5.774 12.324 1.00 0.00 C ATOM 1398 NH1 ARG A 735 10.066 -5.103 11.421 1.00 0.00 N ATOM 1399 NH2 ARG A 735 10.443 -5.627 13.587 1.00 0.00 N ATOM 1400 OXT ARG A 735 15.566 -5.129 6.353 1.00 0.00 O ATOM 0 H ARG A 735 12.051 -3.781 7.560 1.00 0.00 H new ATOM 0 HA ARG A 735 14.727 -4.747 8.584 1.00 0.00 H new ATOM 0 HB2 ARG A 735 12.024 -6.029 7.879 1.00 0.00 H new ATOM 0 HB3 ARG A 735 13.431 -6.953 8.364 1.00 0.00 H new ATOM 0 HG2 ARG A 735 13.523 -5.517 10.496 1.00 0.00 H new ATOM 0 HG3 ARG A 735 11.982 -4.830 10.024 1.00 0.00 H new ATOM 0 HD2 ARG A 735 10.937 -7.108 10.021 1.00 0.00 H new ATOM 0 HD3 ARG A 735 12.482 -7.838 10.410 1.00 0.00 H new ATOM 0 HE ARG A 735 12.273 -7.036 12.674 1.00 0.00 H new ATOM 0 HH11 ARG A 735 10.279 -5.228 10.431 1.00 0.00 H new ATOM 0 HH12 ARG A 735 9.332 -4.455 11.707 1.00 0.00 H new ATOM 0 HH21 ARG A 735 10.950 -6.161 14.293 1.00 0.00 H new ATOM 0 HH22 ARG A 735 9.708 -4.978 13.868 1.00 0.00 H new