USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=19 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 711 THR OG1 : rot -165:sc= -3.78! USER MOD Set 1.2: A 714 HIS : no HE2:sc= -2.29 X(o=-6.1,f=-6!) USER MOD Set 1.3: A 722 MET CE :methyl -137:sc=-0.00775 (180deg=-0.698) USER MOD Single : A 650 CYS SG : rot 24:sc= 0.403 USER MOD Single : A 656 GLN : amide:sc= 0.222 X(o=0.22,f=-0.21) USER MOD Single : A 657 MET CE :methyl 178:sc= -5.38! (180deg=-5.43!) USER MOD Single : A 664 SER OG : rot -18:sc= 0.945 USER MOD Single : A 666 TYR OH : rot 180:sc= 0 USER MOD Single : A 667 LYS NZ :NH3+ 135:sc= -2.88 (180deg=-5.9!) USER MOD Single : A 668 SER OG : rot -147:sc= -1.63! 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= -0.543 X(o=-0.54,f=-0.16) USER MOD Single : A 676 LYS NZ :NH3+ 155:sc= -1.4 (180deg=-2.67) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 687 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 688 ASN : amide:sc= -14.3! C(o=-14!,f=-12!) USER MOD Single : A 689 ASN : amide:sc= -4.21! C(o=-4.2!,f=-11!) USER MOD Single : A 692 SER OG : rot 180:sc= 0 USER MOD Single : A 696 SER OG : rot 180:sc= 0.00942 USER MOD Single : A 702 GLN : amide:sc= -7.91! C(o=-7.9!,f=-16!) USER MOD Single : A 715 SER OG : rot 180:sc= 0 USER MOD Single : A 717 ASN : amide:sc= -4.4! K(o=-4.4!,f=-1.6) USER MOD Single : A 720 TYR OH : rot 180:sc= 0 USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 HIS : no HD1:sc= -21.4! C(o=-21!,f=-22!) USER MOD Single : A 733 GLN : amide:sc= -14.8! C(o=-15!,f=-11!) USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 649 -19.486 3.810 -6.933 1.00 0.00 N ATOM 33 CA ASP A 649 -18.278 4.666 -7.032 1.00 0.00 C ATOM 34 C ASP A 649 -17.023 3.902 -6.629 1.00 0.00 C ATOM 35 O ASP A 649 -17.054 3.014 -5.799 1.00 0.00 O ATOM 36 CB ASP A 649 -18.545 5.839 -6.092 1.00 0.00 C ATOM 37 CG ASP A 649 -19.769 6.622 -6.597 1.00 0.00 C ATOM 38 OD1 ASP A 649 -20.094 6.491 -7.767 1.00 0.00 O ATOM 39 OD2 ASP A 649 -20.362 7.339 -5.806 1.00 0.00 O ATOM 0 HA ASP A 649 -18.100 5.001 -8.054 1.00 0.00 H new ATOM 0 HB2 ASP A 649 -18.722 5.476 -5.080 1.00 0.00 H new ATOM 0 HB3 ASP A 649 -17.673 6.492 -6.049 1.00 0.00 H new ATOM 44 N CYS A 650 -15.918 4.243 -7.223 1.00 0.00 N ATOM 45 CA CYS A 650 -14.653 3.542 -6.891 1.00 0.00 C ATOM 46 C CYS A 650 -13.522 4.540 -6.656 1.00 0.00 C ATOM 47 O CYS A 650 -13.483 5.621 -7.219 1.00 0.00 O ATOM 48 CB CYS A 650 -14.348 2.689 -8.115 1.00 0.00 C ATOM 49 SG CYS A 650 -14.109 3.766 -9.541 1.00 0.00 S ATOM 0 H CYS A 650 -15.837 4.978 -7.925 1.00 0.00 H new ATOM 0 HA CYS A 650 -14.746 2.951 -5.980 1.00 0.00 H new ATOM 0 HB2 CYS A 650 -13.454 2.090 -7.942 1.00 0.00 H new ATOM 0 HB3 CYS A 650 -15.166 1.994 -8.302 1.00 0.00 H new ATOM 0 HG CYS A 650 -13.760 4.951 -9.136 1.00 0.00 H new ATOM 55 N ARG A 651 -12.584 4.166 -5.843 1.00 0.00 N ATOM 56 CA ARG A 651 -11.432 5.055 -5.573 1.00 0.00 C ATOM 57 C ARG A 651 -10.165 4.283 -5.944 1.00 0.00 C ATOM 58 O ARG A 651 -10.149 3.067 -5.942 1.00 0.00 O ATOM 59 CB ARG A 651 -11.473 5.373 -4.065 1.00 0.00 C ATOM 60 CG ARG A 651 -12.840 5.958 -3.670 1.00 0.00 C ATOM 61 CD ARG A 651 -12.825 6.383 -2.191 1.00 0.00 C ATOM 62 NE ARG A 651 -14.151 5.977 -1.636 1.00 0.00 N ATOM 63 CZ ARG A 651 -14.222 4.923 -0.878 1.00 0.00 C ATOM 64 NH1 ARG A 651 -13.411 3.931 -1.109 1.00 0.00 N ATOM 65 NH2 ARG A 651 -15.111 4.839 0.080 1.00 0.00 N ATOM 0 H ARG A 651 -12.566 3.274 -5.349 1.00 0.00 H new ATOM 0 HA ARG A 651 -11.456 5.983 -6.144 1.00 0.00 H new ATOM 0 HB2 ARG A 651 -11.280 4.466 -3.492 1.00 0.00 H new ATOM 0 HB3 ARG A 651 -10.683 6.081 -3.816 1.00 0.00 H new ATOM 0 HG2 ARG A 651 -13.073 6.816 -4.301 1.00 0.00 H new ATOM 0 HG3 ARG A 651 -13.623 5.218 -3.836 1.00 0.00 H new ATOM 0 HD2 ARG A 651 -12.011 5.897 -1.653 1.00 0.00 H new ATOM 0 HD3 ARG A 651 -12.674 7.458 -2.095 1.00 0.00 H new ATOM 0 HE ARG A 651 -14.989 6.519 -1.849 1.00 0.00 H new ATOM 0 HH11 ARG A 651 -12.737 3.990 -1.872 1.00 0.00 H new ATOM 0 HH12 ARG A 651 -13.450 3.095 -0.527 1.00 0.00 H new ATOM 0 HH21 ARG A 651 -15.762 5.608 0.241 1.00 0.00 H new ATOM 0 HH22 ARG A 651 -15.153 4.005 0.665 1.00 0.00 H new ATOM 79 N ILE A 652 -9.117 4.955 -6.290 1.00 0.00 N ATOM 80 CA ILE A 652 -7.888 4.221 -6.684 1.00 0.00 C ATOM 81 C ILE A 652 -6.758 4.475 -5.693 1.00 0.00 C ATOM 82 O ILE A 652 -6.707 5.489 -5.025 1.00 0.00 O ATOM 83 CB ILE A 652 -7.572 4.733 -8.080 1.00 0.00 C ATOM 84 CG1 ILE A 652 -7.258 6.226 -8.030 1.00 0.00 C ATOM 85 CG2 ILE A 652 -8.798 4.511 -8.968 1.00 0.00 C ATOM 86 CD1 ILE A 652 -6.573 6.631 -9.333 1.00 0.00 C ATOM 0 H ILE A 652 -9.052 5.973 -6.319 1.00 0.00 H new ATOM 0 HA ILE A 652 -8.020 3.139 -6.681 1.00 0.00 H new ATOM 0 HB ILE A 652 -6.709 4.200 -8.478 1.00 0.00 H new ATOM 0 HG12 ILE A 652 -8.175 6.800 -7.892 1.00 0.00 H new ATOM 0 HG13 ILE A 652 -6.612 6.447 -7.180 1.00 0.00 H new ATOM 0 HG21 ILE A 652 -8.589 4.873 -9.975 1.00 0.00 H new ATOM 0 HG22 ILE A 652 -9.032 3.447 -9.006 1.00 0.00 H new ATOM 0 HG23 ILE A 652 -9.649 5.055 -8.557 1.00 0.00 H new ATOM 0 HD11 ILE A 652 -6.344 7.696 -9.308 1.00 0.00 H new ATOM 0 HD12 ILE A 652 -5.649 6.064 -9.450 1.00 0.00 H new ATOM 0 HD13 ILE A 652 -7.236 6.422 -10.173 1.00 0.00 H new ATOM 98 N ILE A 653 -5.871 3.529 -5.568 1.00 0.00 N ATOM 99 CA ILE A 653 -4.758 3.672 -4.588 1.00 0.00 C ATOM 100 C ILE A 653 -3.406 3.490 -5.275 1.00 0.00 C ATOM 101 O ILE A 653 -3.271 2.802 -6.269 1.00 0.00 O ATOM 102 CB ILE A 653 -5.011 2.588 -3.497 1.00 0.00 C ATOM 103 CG1 ILE A 653 -3.755 1.705 -3.304 1.00 0.00 C ATOM 104 CG2 ILE A 653 -6.193 1.695 -3.904 1.00 0.00 C ATOM 105 CD1 ILE A 653 -4.114 0.404 -2.585 1.00 0.00 C ATOM 0 H ILE A 653 -5.868 2.661 -6.103 1.00 0.00 H new ATOM 0 HA ILE A 653 -4.732 4.667 -4.143 1.00 0.00 H new ATOM 0 HB ILE A 653 -5.239 3.097 -2.560 1.00 0.00 H new ATOM 0 HG12 ILE A 653 -3.310 1.480 -4.273 1.00 0.00 H new ATOM 0 HG13 ILE A 653 -3.006 2.250 -2.729 1.00 0.00 H new ATOM 0 HG21 ILE A 653 -6.361 0.941 -3.135 1.00 0.00 H new ATOM 0 HG22 ILE A 653 -7.089 2.306 -4.016 1.00 0.00 H new ATOM 0 HG23 ILE A 653 -5.969 1.204 -4.851 1.00 0.00 H new ATOM 0 HD11 ILE A 653 -3.217 -0.202 -2.460 1.00 0.00 H new ATOM 0 HD12 ILE A 653 -4.537 0.634 -1.607 1.00 0.00 H new ATOM 0 HD13 ILE A 653 -4.845 -0.148 -3.175 1.00 0.00 H new ATOM 117 N ARG A 654 -2.410 4.117 -4.735 1.00 0.00 N ATOM 118 CA ARG A 654 -1.060 4.028 -5.313 1.00 0.00 C ATOM 119 C ARG A 654 -0.013 4.022 -4.202 1.00 0.00 C ATOM 120 O ARG A 654 0.101 4.953 -3.434 1.00 0.00 O ATOM 121 CB ARG A 654 -0.991 5.283 -6.164 1.00 0.00 C ATOM 122 CG ARG A 654 0.409 5.455 -6.728 1.00 0.00 C ATOM 123 CD ARG A 654 0.425 6.638 -7.697 1.00 0.00 C ATOM 124 NE ARG A 654 -0.654 6.354 -8.697 1.00 0.00 N ATOM 125 CZ ARG A 654 -0.488 5.436 -9.619 1.00 0.00 C ATOM 126 NH1 ARG A 654 0.709 5.177 -10.078 1.00 0.00 N ATOM 127 NH2 ARG A 654 -1.521 4.783 -10.082 1.00 0.00 N ATOM 0 H ARG A 654 -2.480 4.699 -3.900 1.00 0.00 H new ATOM 0 HA ARG A 654 -0.869 3.122 -5.888 1.00 0.00 H new ATOM 0 HB2 ARG A 654 -1.714 5.220 -6.977 1.00 0.00 H new ATOM 0 HB3 ARG A 654 -1.260 6.153 -5.565 1.00 0.00 H new ATOM 0 HG2 ARG A 654 1.120 5.623 -5.920 1.00 0.00 H new ATOM 0 HG3 ARG A 654 0.720 4.546 -7.242 1.00 0.00 H new ATOM 0 HD2 ARG A 654 0.238 7.576 -7.174 1.00 0.00 H new ATOM 0 HD3 ARG A 654 1.396 6.733 -8.184 1.00 0.00 H new ATOM 0 HE ARG A 654 -1.527 6.880 -8.660 1.00 0.00 H new ATOM 0 HH11 ARG A 654 1.515 5.689 -9.719 1.00 0.00 H new ATOM 0 HH12 ARG A 654 0.837 4.463 -10.795 1.00 0.00 H new ATOM 0 HH21 ARG A 654 -2.455 4.988 -9.726 1.00 0.00 H new ATOM 0 HH22 ARG A 654 -1.393 4.069 -10.799 1.00 0.00 H new ATOM 141 N VAL A 655 0.744 2.975 -4.108 1.00 0.00 N ATOM 142 CA VAL A 655 1.769 2.904 -3.049 1.00 0.00 C ATOM 143 C VAL A 655 3.143 2.698 -3.681 1.00 0.00 C ATOM 144 O VAL A 655 3.256 2.317 -4.825 1.00 0.00 O ATOM 145 CB VAL A 655 1.378 1.705 -2.199 1.00 0.00 C ATOM 146 CG1 VAL A 655 2.373 1.570 -1.065 1.00 0.00 C ATOM 147 CG2 VAL A 655 -0.029 1.900 -1.625 1.00 0.00 C ATOM 0 H VAL A 655 0.695 2.162 -4.723 1.00 0.00 H new ATOM 0 HA VAL A 655 1.823 3.815 -2.453 1.00 0.00 H new ATOM 0 HB VAL A 655 1.383 0.805 -2.814 1.00 0.00 H new ATOM 0 HG11 VAL A 655 2.105 0.714 -0.446 1.00 0.00 H new ATOM 0 HG12 VAL A 655 3.373 1.424 -1.474 1.00 0.00 H new ATOM 0 HG13 VAL A 655 2.358 2.475 -0.458 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -0.298 1.035 -1.018 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -0.048 2.797 -1.006 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -0.743 2.007 -2.441 1.00 0.00 H new ATOM 157 N GLN A 656 4.187 2.971 -2.962 1.00 0.00 N ATOM 158 CA GLN A 656 5.549 2.809 -3.544 1.00 0.00 C ATOM 159 C GLN A 656 6.520 2.227 -2.514 1.00 0.00 C ATOM 160 O GLN A 656 6.993 2.934 -1.649 1.00 0.00 O ATOM 161 CB GLN A 656 5.979 4.225 -3.874 1.00 0.00 C ATOM 162 CG GLN A 656 5.079 4.799 -4.963 1.00 0.00 C ATOM 163 CD GLN A 656 4.832 6.283 -4.689 1.00 0.00 C ATOM 164 OE1 GLN A 656 4.939 7.100 -5.581 1.00 0.00 O ATOM 165 NE2 GLN A 656 4.500 6.668 -3.483 1.00 0.00 N ATOM 0 H GLN A 656 4.162 3.299 -1.997 1.00 0.00 H new ATOM 0 HA GLN A 656 5.545 2.137 -4.402 1.00 0.00 H new ATOM 0 HB2 GLN A 656 5.927 4.848 -2.981 1.00 0.00 H new ATOM 0 HB3 GLN A 656 7.017 4.231 -4.207 1.00 0.00 H new ATOM 0 HG2 GLN A 656 5.545 4.671 -5.940 1.00 0.00 H new ATOM 0 HG3 GLN A 656 4.132 4.260 -4.989 1.00 0.00 H new ATOM 0 HE21 GLN A 656 4.410 5.981 -2.735 1.00 0.00 H new ATOM 0 HE22 GLN A 656 4.331 7.655 -3.291 1.00 0.00 H new ATOM 174 N MET A 657 6.848 0.973 -2.609 1.00 0.00 N ATOM 175 CA MET A 657 7.822 0.389 -1.634 1.00 0.00 C ATOM 176 C MET A 657 9.219 0.443 -2.268 1.00 0.00 C ATOM 177 O MET A 657 9.405 -0.020 -3.369 1.00 0.00 O ATOM 178 CB MET A 657 7.341 -1.051 -1.425 1.00 0.00 C ATOM 179 CG MET A 657 8.117 -1.698 -0.273 1.00 0.00 C ATOM 180 SD MET A 657 7.820 -3.493 -0.218 1.00 0.00 S ATOM 181 CE MET A 657 6.381 -3.590 -1.315 1.00 0.00 C ATOM 0 H MET A 657 6.491 0.326 -3.312 1.00 0.00 H new ATOM 0 HA MET A 657 7.878 0.917 -0.682 1.00 0.00 H new ATOM 0 HB2 MET A 657 6.273 -1.059 -1.205 1.00 0.00 H new ATOM 0 HB3 MET A 657 7.483 -1.627 -2.339 1.00 0.00 H new ATOM 0 HG2 MET A 657 9.183 -1.505 -0.394 1.00 0.00 H new ATOM 0 HG3 MET A 657 7.816 -1.246 0.672 1.00 0.00 H new ATOM 0 HE1 MET A 657 6.080 -4.631 -1.429 1.00 0.00 H new ATOM 0 HE2 MET A 657 5.558 -3.019 -0.886 1.00 0.00 H new ATOM 0 HE3 MET A 657 6.639 -3.178 -2.291 1.00 0.00 H new ATOM 191 N GLU A 658 10.182 1.047 -1.603 1.00 0.00 N ATOM 192 CA GLU A 658 11.557 1.186 -2.198 1.00 0.00 C ATOM 193 C GLU A 658 12.571 0.222 -1.573 1.00 0.00 C ATOM 194 O GLU A 658 13.742 0.536 -1.469 1.00 0.00 O ATOM 195 CB GLU A 658 11.962 2.634 -1.898 1.00 0.00 C ATOM 196 CG GLU A 658 13.275 2.952 -2.612 1.00 0.00 C ATOM 197 CD GLU A 658 13.459 4.469 -2.713 1.00 0.00 C ATOM 198 OE1 GLU A 658 12.474 5.178 -2.592 1.00 0.00 O ATOM 199 OE2 GLU A 658 14.584 4.895 -2.916 1.00 0.00 O ATOM 0 H GLU A 658 10.075 1.450 -0.672 1.00 0.00 H new ATOM 0 HA GLU A 658 11.544 0.949 -3.262 1.00 0.00 H new ATOM 0 HB2 GLU A 658 11.180 3.318 -2.229 1.00 0.00 H new ATOM 0 HB3 GLU A 658 12.076 2.776 -0.823 1.00 0.00 H new ATOM 0 HG2 GLU A 658 14.111 2.511 -2.069 1.00 0.00 H new ATOM 0 HG3 GLU A 658 13.274 2.510 -3.608 1.00 0.00 H new ATOM 206 N LEU A 659 12.147 -0.934 -1.140 1.00 0.00 N ATOM 207 CA LEU A 659 13.126 -1.876 -0.508 1.00 0.00 C ATOM 208 C LEU A 659 12.785 -3.335 -0.843 1.00 0.00 C ATOM 209 O LEU A 659 11.708 -3.634 -1.319 1.00 0.00 O ATOM 210 CB LEU A 659 13.009 -1.619 0.993 1.00 0.00 C ATOM 211 CG LEU A 659 14.204 -2.250 1.730 1.00 0.00 C ATOM 212 CD1 LEU A 659 15.498 -1.912 0.993 1.00 0.00 C ATOM 213 CD2 LEU A 659 14.305 -1.673 3.143 1.00 0.00 C ATOM 0 H LEU A 659 11.184 -1.267 -1.193 1.00 0.00 H new ATOM 0 HA LEU A 659 14.140 -1.713 -0.873 1.00 0.00 H new ATOM 0 HB2 LEU A 659 12.978 -0.547 1.185 1.00 0.00 H new ATOM 0 HB3 LEU A 659 12.076 -2.038 1.370 1.00 0.00 H new ATOM 0 HG LEU A 659 14.057 -3.329 1.770 1.00 0.00 H new ATOM 0 HD11 LEU A 659 16.343 -2.360 1.517 1.00 0.00 H new ATOM 0 HD12 LEU A 659 15.451 -2.305 -0.023 1.00 0.00 H new ATOM 0 HD13 LEU A 659 15.625 -0.830 0.958 1.00 0.00 H new ATOM 0 HD21 LEU A 659 15.152 -2.123 3.660 1.00 0.00 H new ATOM 0 HD22 LEU A 659 14.446 -0.594 3.086 1.00 0.00 H new ATOM 0 HD23 LEU A 659 13.388 -1.890 3.691 1.00 0.00 H new ATOM 225 N GLY A 660 13.710 -4.238 -0.605 1.00 0.00 N ATOM 226 CA GLY A 660 13.484 -5.674 -0.914 1.00 0.00 C ATOM 227 C GLY A 660 14.751 -6.225 -1.570 1.00 0.00 C ATOM 228 O GLY A 660 15.617 -5.470 -1.965 1.00 0.00 O ATOM 0 H GLY A 660 14.624 -4.029 -0.203 1.00 0.00 H new ATOM 0 HA2 GLY A 660 13.255 -6.228 -0.003 1.00 0.00 H new ATOM 0 HA3 GLY A 660 12.629 -5.790 -1.580 1.00 0.00 H new ATOM 232 N GLU A 661 14.862 -7.518 -1.745 1.00 0.00 N ATOM 233 CA GLU A 661 16.070 -8.043 -2.441 1.00 0.00 C ATOM 234 C GLU A 661 16.072 -7.424 -3.833 1.00 0.00 C ATOM 235 O GLU A 661 17.106 -7.128 -4.391 1.00 0.00 O ATOM 236 CB GLU A 661 15.893 -9.560 -2.511 1.00 0.00 C ATOM 237 CG GLU A 661 14.555 -9.869 -3.179 1.00 0.00 C ATOM 238 CD GLU A 661 14.404 -11.373 -3.439 1.00 0.00 C ATOM 239 OE1 GLU A 661 14.453 -12.132 -2.484 1.00 0.00 O ATOM 240 OE2 GLU A 661 14.226 -11.737 -4.589 1.00 0.00 O ATOM 0 H GLU A 661 14.184 -8.217 -1.443 1.00 0.00 H new ATOM 0 HA GLU A 661 17.009 -7.806 -1.941 1.00 0.00 H new ATOM 0 HB2 GLU A 661 16.710 -10.010 -3.076 1.00 0.00 H new ATOM 0 HB3 GLU A 661 15.923 -9.990 -1.510 1.00 0.00 H new ATOM 0 HG2 GLU A 661 13.739 -9.522 -2.545 1.00 0.00 H new ATOM 0 HG3 GLU A 661 14.480 -9.324 -4.120 1.00 0.00 H new ATOM 247 N ASP A 662 14.901 -7.179 -4.368 1.00 0.00 N ATOM 248 CA ASP A 662 14.809 -6.513 -5.700 1.00 0.00 C ATOM 249 C ASP A 662 14.231 -5.100 -5.523 1.00 0.00 C ATOM 250 O ASP A 662 14.405 -4.236 -6.359 1.00 0.00 O ATOM 251 CB ASP A 662 13.864 -7.373 -6.539 1.00 0.00 C ATOM 252 CG ASP A 662 14.526 -8.719 -6.828 1.00 0.00 C ATOM 253 OD1 ASP A 662 15.740 -8.787 -6.728 1.00 0.00 O ATOM 254 OD2 ASP A 662 13.812 -9.654 -7.142 1.00 0.00 O ATOM 0 H ASP A 662 14.006 -7.412 -3.938 1.00 0.00 H new ATOM 0 HA ASP A 662 15.783 -6.419 -6.180 1.00 0.00 H new ATOM 0 HB2 ASP A 662 12.924 -7.524 -6.008 1.00 0.00 H new ATOM 0 HB3 ASP A 662 13.625 -6.865 -7.473 1.00 0.00 H new ATOM 259 N GLY A 663 13.552 -4.863 -4.424 1.00 0.00 N ATOM 260 CA GLY A 663 12.958 -3.516 -4.152 1.00 0.00 C ATOM 261 C GLY A 663 12.065 -3.048 -5.313 1.00 0.00 C ATOM 262 O GLY A 663 12.176 -3.500 -6.435 1.00 0.00 O ATOM 0 H GLY A 663 13.383 -5.556 -3.695 1.00 0.00 H new ATOM 0 HA2 GLY A 663 12.372 -3.555 -3.234 1.00 0.00 H new ATOM 0 HA3 GLY A 663 13.756 -2.791 -3.991 1.00 0.00 H new ATOM 266 N SER A 664 11.183 -2.122 -5.030 1.00 0.00 N ATOM 267 CA SER A 664 10.269 -1.571 -6.074 1.00 0.00 C ATOM 268 C SER A 664 10.127 -0.078 -5.846 1.00 0.00 C ATOM 269 O SER A 664 10.810 0.493 -5.030 1.00 0.00 O ATOM 270 CB SER A 664 8.926 -2.261 -5.870 1.00 0.00 C ATOM 271 OG SER A 664 8.349 -1.853 -4.631 1.00 0.00 O ATOM 0 H SER A 664 11.057 -1.718 -4.102 1.00 0.00 H new ATOM 0 HA SER A 664 10.642 -1.738 -7.085 1.00 0.00 H new ATOM 0 HB2 SER A 664 8.253 -2.015 -6.692 1.00 0.00 H new ATOM 0 HB3 SER A 664 9.059 -3.343 -5.880 1.00 0.00 H new ATOM 0 HG SER A 664 9.041 -1.454 -4.063 1.00 0.00 H new ATOM 277 N VAL A 665 9.294 0.578 -6.579 1.00 0.00 N ATOM 278 CA VAL A 665 9.173 2.043 -6.370 1.00 0.00 C ATOM 279 C VAL A 665 7.747 2.520 -6.639 1.00 0.00 C ATOM 280 O VAL A 665 7.461 3.700 -6.624 1.00 0.00 O ATOM 281 CB VAL A 665 10.136 2.651 -7.383 1.00 0.00 C ATOM 282 CG1 VAL A 665 11.575 2.329 -6.964 1.00 0.00 C ATOM 283 CG2 VAL A 665 9.855 2.044 -8.759 1.00 0.00 C ATOM 0 H VAL A 665 8.698 0.179 -7.304 1.00 0.00 H new ATOM 0 HA VAL A 665 9.403 2.331 -5.344 1.00 0.00 H new ATOM 0 HB VAL A 665 10.004 3.732 -7.424 1.00 0.00 H new ATOM 0 HG11 VAL A 665 12.269 2.761 -7.685 1.00 0.00 H new ATOM 0 HG12 VAL A 665 11.769 2.748 -5.977 1.00 0.00 H new ATOM 0 HG13 VAL A 665 11.711 1.248 -6.932 1.00 0.00 H new ATOM 0 HG21 VAL A 665 10.539 2.472 -9.492 1.00 0.00 H new ATOM 0 HG22 VAL A 665 9.998 0.964 -8.716 1.00 0.00 H new ATOM 0 HG23 VAL A 665 8.828 2.263 -9.050 1.00 0.00 H new ATOM 293 N TYR A 666 6.847 1.618 -6.891 1.00 0.00 N ATOM 294 CA TYR A 666 5.452 2.048 -7.168 1.00 0.00 C ATOM 295 C TYR A 666 4.467 0.928 -6.795 1.00 0.00 C ATOM 296 O TYR A 666 4.850 -0.161 -6.410 1.00 0.00 O ATOM 297 CB TYR A 666 5.403 2.308 -8.675 1.00 0.00 C ATOM 298 CG TYR A 666 5.324 0.990 -9.389 1.00 0.00 C ATOM 299 CD1 TYR A 666 6.480 0.249 -9.637 1.00 0.00 C ATOM 300 CD2 TYR A 666 4.083 0.511 -9.791 1.00 0.00 C ATOM 301 CE1 TYR A 666 6.387 -0.978 -10.292 1.00 0.00 C ATOM 302 CE2 TYR A 666 3.984 -0.712 -10.443 1.00 0.00 C ATOM 303 CZ TYR A 666 5.135 -1.461 -10.701 1.00 0.00 C ATOM 304 OH TYR A 666 5.032 -2.673 -11.352 1.00 0.00 O ATOM 0 H TYR A 666 7.012 0.612 -6.918 1.00 0.00 H new ATOM 0 HA TYR A 666 5.175 2.930 -6.590 1.00 0.00 H new ATOM 0 HB2 TYR A 666 4.540 2.925 -8.924 1.00 0.00 H new ATOM 0 HB3 TYR A 666 6.289 2.857 -8.993 1.00 0.00 H new ATOM 0 HD1 TYR A 666 7.443 0.624 -9.323 1.00 0.00 H new ATOM 0 HD2 TYR A 666 3.193 1.091 -9.596 1.00 0.00 H new ATOM 0 HE1 TYR A 666 7.278 -1.557 -10.485 1.00 0.00 H new ATOM 0 HE2 TYR A 666 3.018 -1.084 -10.750 1.00 0.00 H new ATOM 0 HH TYR A 666 4.092 -2.853 -11.562 1.00 0.00 H new ATOM 314 N LYS A 667 3.203 1.197 -6.937 1.00 0.00 N ATOM 315 CA LYS A 667 2.153 0.179 -6.630 1.00 0.00 C ATOM 316 C LYS A 667 0.791 0.820 -6.888 1.00 0.00 C ATOM 317 O LYS A 667 0.379 1.705 -6.183 1.00 0.00 O ATOM 318 CB LYS A 667 2.330 -0.152 -5.141 1.00 0.00 C ATOM 319 CG LYS A 667 1.518 -1.400 -4.750 1.00 0.00 C ATOM 320 CD LYS A 667 0.035 -1.167 -5.064 1.00 0.00 C ATOM 321 CE LYS A 667 -0.851 -1.938 -4.071 1.00 0.00 C ATOM 322 NZ LYS A 667 -0.601 -3.389 -4.330 1.00 0.00 N ATOM 0 H LYS A 667 2.842 2.095 -7.259 1.00 0.00 H new ATOM 0 HA LYS A 667 2.228 -0.723 -7.237 1.00 0.00 H new ATOM 0 HB2 LYS A 667 3.385 -0.319 -4.925 1.00 0.00 H new ATOM 0 HB3 LYS A 667 2.011 0.697 -4.536 1.00 0.00 H new ATOM 0 HG2 LYS A 667 1.883 -2.270 -5.296 1.00 0.00 H new ATOM 0 HG3 LYS A 667 1.647 -1.612 -3.689 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -0.191 -0.102 -5.012 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -0.183 -1.490 -6.082 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -0.601 -1.677 -3.043 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -1.903 -1.692 -4.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -0.477 -3.887 -3.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -1.411 -3.795 -4.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 0.259 -3.496 -4.904 1.00 0.00 H new ATOM 336 N SER A 668 0.110 0.404 -7.911 1.00 0.00 N ATOM 337 CA SER A 668 -1.215 1.017 -8.230 1.00 0.00 C ATOM 338 C SER A 668 -2.293 -0.070 -8.326 1.00 0.00 C ATOM 339 O SER A 668 -2.156 -1.021 -9.069 1.00 0.00 O ATOM 340 CB SER A 668 -0.981 1.675 -9.589 1.00 0.00 C ATOM 341 OG SER A 668 -2.149 2.389 -9.982 1.00 0.00 O ATOM 0 H SER A 668 0.409 -0.336 -8.546 1.00 0.00 H new ATOM 0 HA SER A 668 -1.560 1.722 -7.474 1.00 0.00 H new ATOM 0 HB2 SER A 668 -0.129 2.353 -9.534 1.00 0.00 H new ATOM 0 HB3 SER A 668 -0.738 0.917 -10.334 1.00 0.00 H new ATOM 0 HG SER A 668 -2.239 2.358 -10.957 1.00 0.00 H new ATOM 347 N ILE A 669 -3.366 0.050 -7.589 1.00 0.00 N ATOM 348 CA ILE A 669 -4.420 -0.999 -7.677 1.00 0.00 C ATOM 349 C ILE A 669 -5.803 -0.358 -7.620 1.00 0.00 C ATOM 350 O ILE A 669 -5.996 0.679 -7.018 1.00 0.00 O ATOM 351 CB ILE A 669 -4.210 -1.912 -6.472 1.00 0.00 C ATOM 352 CG1 ILE A 669 -5.025 -3.190 -6.690 1.00 0.00 C ATOM 353 CG2 ILE A 669 -4.700 -1.203 -5.209 1.00 0.00 C ATOM 354 CD1 ILE A 669 -4.803 -4.168 -5.531 1.00 0.00 C ATOM 0 H ILE A 669 -3.555 0.815 -6.941 1.00 0.00 H new ATOM 0 HA ILE A 669 -4.355 -1.555 -8.612 1.00 0.00 H new ATOM 0 HB ILE A 669 -3.153 -2.155 -6.359 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -6.084 -2.945 -6.770 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -4.735 -3.658 -7.630 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -4.551 -1.852 -4.346 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -4.138 -0.279 -5.069 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -5.760 -0.971 -5.310 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -5.389 -5.072 -5.700 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -3.746 -4.427 -5.471 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -5.116 -3.702 -4.597 1.00 0.00 H new ATOM 366 N LEU A 670 -6.768 -0.964 -8.245 1.00 0.00 N ATOM 367 CA LEU A 670 -8.132 -0.373 -8.236 1.00 0.00 C ATOM 368 C LEU A 670 -8.829 -0.643 -6.899 1.00 0.00 C ATOM 369 O LEU A 670 -8.875 -1.761 -6.421 1.00 0.00 O ATOM 370 CB LEU A 670 -8.862 -1.071 -9.392 1.00 0.00 C ATOM 371 CG LEU A 670 -10.195 -0.376 -9.698 1.00 0.00 C ATOM 372 CD1 LEU A 670 -11.114 -0.390 -8.476 1.00 0.00 C ATOM 373 CD2 LEU A 670 -9.919 1.071 -10.094 1.00 0.00 C ATOM 0 H LEU A 670 -6.673 -1.839 -8.760 1.00 0.00 H new ATOM 0 HA LEU A 670 -8.118 0.710 -8.356 1.00 0.00 H new ATOM 0 HB2 LEU A 670 -8.232 -1.065 -10.281 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -9.042 -2.115 -9.136 1.00 0.00 H new ATOM 0 HG LEU A 670 -10.688 -0.910 -10.510 1.00 0.00 H new ATOM 0 HD11 LEU A 670 -12.052 0.109 -8.720 1.00 0.00 H new ATOM 0 HD12 LEU A 670 -11.316 -1.421 -8.185 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -10.630 0.132 -7.651 1.00 0.00 H new ATOM 0 HD21 LEU A 670 -10.861 1.574 -10.314 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -9.417 1.583 -9.273 1.00 0.00 H new ATOM 0 HD23 LEU A 670 -9.282 1.091 -10.978 1.00 0.00 H new ATOM 385 N VAL A 671 -9.393 0.382 -6.311 1.00 0.00 N ATOM 386 CA VAL A 671 -10.126 0.212 -5.020 1.00 0.00 C ATOM 387 C VAL A 671 -11.592 0.566 -5.231 1.00 0.00 C ATOM 388 O VAL A 671 -11.914 1.526 -5.904 1.00 0.00 O ATOM 389 CB VAL A 671 -9.498 1.207 -4.018 1.00 0.00 C ATOM 390 CG1 VAL A 671 -10.599 1.947 -3.225 1.00 0.00 C ATOM 391 CG2 VAL A 671 -8.614 0.453 -3.030 1.00 0.00 C ATOM 0 H VAL A 671 -9.377 1.336 -6.673 1.00 0.00 H new ATOM 0 HA VAL A 671 -10.058 -0.812 -4.654 1.00 0.00 H new ATOM 0 HB VAL A 671 -8.907 1.930 -4.580 1.00 0.00 H new ATOM 0 HG11 VAL A 671 -10.137 2.643 -2.525 1.00 0.00 H new ATOM 0 HG12 VAL A 671 -11.238 2.497 -3.916 1.00 0.00 H new ATOM 0 HG13 VAL A 671 -11.200 1.223 -2.674 1.00 0.00 H new ATOM 0 HG21 VAL A 671 -8.173 1.158 -2.325 1.00 0.00 H new ATOM 0 HG22 VAL A 671 -9.215 -0.276 -2.486 1.00 0.00 H new ATOM 0 HG23 VAL A 671 -7.821 -0.063 -3.571 1.00 0.00 H new ATOM 401 N THR A 672 -12.474 -0.144 -4.601 1.00 0.00 N ATOM 402 CA THR A 672 -13.901 0.224 -4.709 1.00 0.00 C ATOM 403 C THR A 672 -14.223 1.108 -3.502 1.00 0.00 C ATOM 404 O THR A 672 -13.384 1.319 -2.648 1.00 0.00 O ATOM 405 CB THR A 672 -14.702 -1.099 -4.706 1.00 0.00 C ATOM 406 OG1 THR A 672 -15.802 -0.969 -5.593 1.00 0.00 O ATOM 407 CG2 THR A 672 -15.233 -1.426 -3.304 1.00 0.00 C ATOM 0 H THR A 672 -12.270 -0.957 -4.020 1.00 0.00 H new ATOM 0 HA THR A 672 -14.150 0.777 -5.615 1.00 0.00 H new ATOM 0 HB THR A 672 -14.039 -1.905 -5.021 1.00 0.00 H new ATOM 0 HG1 THR A 672 -16.316 -1.803 -5.601 1.00 0.00 H new ATOM 0 HG21 THR A 672 -15.791 -2.362 -3.336 1.00 0.00 H new ATOM 0 HG22 THR A 672 -14.397 -1.526 -2.612 1.00 0.00 H new ATOM 0 HG23 THR A 672 -15.889 -0.623 -2.967 1.00 0.00 H new ATOM 415 N SER A 673 -15.405 1.641 -3.426 1.00 0.00 N ATOM 416 CA SER A 673 -15.744 2.524 -2.271 1.00 0.00 C ATOM 417 C SER A 673 -15.601 1.779 -0.930 1.00 0.00 C ATOM 418 O SER A 673 -15.324 2.377 0.090 1.00 0.00 O ATOM 419 CB SER A 673 -17.208 2.892 -2.472 1.00 0.00 C ATOM 420 OG SER A 673 -17.562 3.923 -1.562 1.00 0.00 O ATOM 0 H SER A 673 -16.152 1.507 -4.108 1.00 0.00 H new ATOM 0 HA SER A 673 -15.080 3.387 -2.234 1.00 0.00 H new ATOM 0 HB2 SER A 673 -17.374 3.223 -3.497 1.00 0.00 H new ATOM 0 HB3 SER A 673 -17.840 2.018 -2.313 1.00 0.00 H new ATOM 0 HG SER A 673 -18.503 4.163 -1.690 1.00 0.00 H new ATOM 426 N GLN A 674 -15.845 0.492 -0.905 1.00 0.00 N ATOM 427 CA GLN A 674 -15.770 -0.257 0.400 1.00 0.00 C ATOM 428 C GLN A 674 -14.705 -1.363 0.382 1.00 0.00 C ATOM 429 O GLN A 674 -14.763 -2.309 1.146 1.00 0.00 O ATOM 430 CB GLN A 674 -17.151 -0.881 0.544 1.00 0.00 C ATOM 431 CG GLN A 674 -18.206 0.196 0.321 1.00 0.00 C ATOM 432 CD GLN A 674 -19.198 -0.288 -0.733 1.00 0.00 C ATOM 433 OE1 GLN A 674 -20.390 -0.140 -0.572 1.00 0.00 O ATOM 434 NE2 GLN A 674 -18.750 -0.864 -1.817 1.00 0.00 N ATOM 0 H GLN A 674 -16.091 -0.072 -1.719 1.00 0.00 H new ATOM 0 HA GLN A 674 -15.494 0.406 1.220 1.00 0.00 H new ATOM 0 HB2 GLN A 674 -17.277 -1.687 -0.178 1.00 0.00 H new ATOM 0 HB3 GLN A 674 -17.265 -1.320 1.535 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -18.725 0.413 1.255 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -17.734 1.123 -0.004 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -17.746 -0.988 -1.951 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -19.404 -1.190 -2.529 1.00 0.00 H new ATOM 443 N ASP A 675 -13.760 -1.271 -0.496 1.00 0.00 N ATOM 444 CA ASP A 675 -12.716 -2.330 -0.597 1.00 0.00 C ATOM 445 C ASP A 675 -11.445 -1.971 0.171 1.00 0.00 C ATOM 446 O ASP A 675 -10.818 -0.966 -0.089 1.00 0.00 O ATOM 447 CB ASP A 675 -12.398 -2.372 -2.083 1.00 0.00 C ATOM 448 CG ASP A 675 -11.450 -3.530 -2.386 1.00 0.00 C ATOM 449 OD1 ASP A 675 -10.948 -4.124 -1.447 1.00 0.00 O ATOM 450 OD2 ASP A 675 -11.241 -3.803 -3.557 1.00 0.00 O ATOM 0 H ASP A 675 -13.659 -0.502 -1.158 1.00 0.00 H new ATOM 0 HA ASP A 675 -13.066 -3.274 -0.179 1.00 0.00 H new ATOM 0 HB2 ASP A 675 -13.318 -2.486 -2.656 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -11.944 -1.430 -2.392 1.00 0.00 H new ATOM 455 N LYS A 676 -11.041 -2.805 1.090 1.00 0.00 N ATOM 456 CA LYS A 676 -9.787 -2.541 1.838 1.00 0.00 C ATOM 457 C LYS A 676 -8.648 -3.303 1.176 1.00 0.00 C ATOM 458 O LYS A 676 -8.312 -4.403 1.571 1.00 0.00 O ATOM 459 CB LYS A 676 -10.035 -3.105 3.219 1.00 0.00 C ATOM 460 CG LYS A 676 -11.171 -2.329 3.886 1.00 0.00 C ATOM 461 CD LYS A 676 -12.519 -2.992 3.593 1.00 0.00 C ATOM 462 CE LYS A 676 -12.473 -4.468 3.997 1.00 0.00 C ATOM 463 NZ LYS A 676 -12.038 -4.480 5.421 1.00 0.00 N ATOM 0 H LYS A 676 -11.530 -3.660 1.353 1.00 0.00 H new ATOM 0 HA LYS A 676 -9.525 -1.483 1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 676 -10.292 -4.162 3.152 1.00 0.00 H new ATOM 0 HB3 LYS A 676 -9.129 -3.035 3.821 1.00 0.00 H new ATOM 0 HG2 LYS A 676 -11.007 -2.286 4.963 1.00 0.00 H new ATOM 0 HG3 LYS A 676 -11.179 -1.301 3.524 1.00 0.00 H new ATOM 0 HD2 LYS A 676 -13.312 -2.481 4.139 1.00 0.00 H new ATOM 0 HD3 LYS A 676 -12.755 -2.903 2.532 1.00 0.00 H new ATOM 0 HE2 LYS A 676 -13.450 -4.937 3.882 1.00 0.00 H new ATOM 0 HE3 LYS A 676 -11.777 -5.025 3.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 -12.377 -5.349 5.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 -11.000 -4.446 5.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 -12.433 -3.653 5.912 1.00 0.00 H new ATOM 477 N ALA A 677 -8.061 -2.750 0.172 1.00 0.00 N ATOM 478 CA ALA A 677 -6.967 -3.482 -0.511 1.00 0.00 C ATOM 479 C ALA A 677 -5.539 -2.976 -0.177 1.00 0.00 C ATOM 480 O ALA A 677 -4.621 -3.331 -0.889 1.00 0.00 O ATOM 481 CB ALA A 677 -7.298 -3.306 -1.986 1.00 0.00 C ATOM 0 H ALA A 677 -8.283 -1.830 -0.209 1.00 0.00 H new ATOM 0 HA ALA A 677 -6.928 -4.521 -0.185 1.00 0.00 H new ATOM 0 HB1 ALA A 677 -6.546 -3.813 -2.591 1.00 0.00 H new ATOM 0 HB2 ALA A 677 -8.279 -3.735 -2.192 1.00 0.00 H new ATOM 0 HB3 ALA A 677 -7.307 -2.244 -2.233 1.00 0.00 H new ATOM 487 N PRO A 678 -5.337 -2.222 0.898 1.00 0.00 N ATOM 488 CA PRO A 678 -3.959 -1.810 1.227 1.00 0.00 C ATOM 489 C PRO A 678 -3.150 -3.072 1.533 1.00 0.00 C ATOM 490 O PRO A 678 -1.937 -3.073 1.539 1.00 0.00 O ATOM 491 CB PRO A 678 -4.136 -0.941 2.475 1.00 0.00 C ATOM 492 CG PRO A 678 -5.632 -0.852 2.792 1.00 0.00 C ATOM 493 CD PRO A 678 -6.400 -1.762 1.822 1.00 0.00 C ATOM 0 HA PRO A 678 -3.438 -1.273 0.434 1.00 0.00 H new ATOM 0 HB2 PRO A 678 -3.595 -1.372 3.317 1.00 0.00 H new ATOM 0 HB3 PRO A 678 -3.724 0.054 2.306 1.00 0.00 H new ATOM 0 HG2 PRO A 678 -5.818 -1.156 3.822 1.00 0.00 H new ATOM 0 HG3 PRO A 678 -5.977 0.178 2.697 1.00 0.00 H new ATOM 0 HD2 PRO A 678 -6.876 -2.595 2.339 1.00 0.00 H new ATOM 0 HD3 PRO A 678 -7.187 -1.221 1.297 1.00 0.00 H new ATOM 501 N SER A 679 -3.843 -4.152 1.807 1.00 0.00 N ATOM 502 CA SER A 679 -3.171 -5.436 2.131 1.00 0.00 C ATOM 503 C SER A 679 -2.827 -6.218 0.853 1.00 0.00 C ATOM 504 O SER A 679 -2.062 -7.161 0.888 1.00 0.00 O ATOM 505 CB SER A 679 -4.214 -6.195 2.951 1.00 0.00 C ATOM 506 OG SER A 679 -4.407 -5.546 4.203 1.00 0.00 O ATOM 0 H SER A 679 -4.862 -4.191 1.818 1.00 0.00 H new ATOM 0 HA SER A 679 -2.230 -5.291 2.661 1.00 0.00 H new ATOM 0 HB2 SER A 679 -5.156 -6.241 2.405 1.00 0.00 H new ATOM 0 HB3 SER A 679 -3.888 -7.223 3.110 1.00 0.00 H new ATOM 0 HG SER A 679 -5.077 -6.035 4.725 1.00 0.00 H new ATOM 512 N VAL A 680 -3.374 -5.835 -0.275 1.00 0.00 N ATOM 513 CA VAL A 680 -3.058 -6.562 -1.538 1.00 0.00 C ATOM 514 C VAL A 680 -1.560 -6.472 -1.798 1.00 0.00 C ATOM 515 O VAL A 680 -0.973 -7.304 -2.456 1.00 0.00 O ATOM 516 CB VAL A 680 -3.847 -5.837 -2.624 1.00 0.00 C ATOM 517 CG1 VAL A 680 -3.249 -4.440 -2.822 1.00 0.00 C ATOM 518 CG2 VAL A 680 -3.762 -6.650 -3.923 1.00 0.00 C ATOM 0 H VAL A 680 -4.022 -5.054 -0.373 1.00 0.00 H new ATOM 0 HA VAL A 680 -3.321 -7.619 -1.501 1.00 0.00 H new ATOM 0 HB VAL A 680 -4.894 -5.736 -2.337 1.00 0.00 H new ATOM 0 HG11 VAL A 680 -3.806 -3.912 -3.597 1.00 0.00 H new ATOM 0 HG12 VAL A 680 -3.310 -3.882 -1.888 1.00 0.00 H new ATOM 0 HG13 VAL A 680 -2.205 -4.530 -3.123 1.00 0.00 H new ATOM 0 HG21 VAL A 680 -4.323 -6.142 -4.708 1.00 0.00 H new ATOM 0 HG22 VAL A 680 -2.719 -6.745 -4.225 1.00 0.00 H new ATOM 0 HG23 VAL A 680 -4.184 -7.642 -3.760 1.00 0.00 H new ATOM 528 N ILE A 681 -0.924 -5.473 -1.265 1.00 0.00 N ATOM 529 CA ILE A 681 0.549 -5.367 -1.475 1.00 0.00 C ATOM 530 C ILE A 681 1.241 -6.633 -0.950 1.00 0.00 C ATOM 531 O ILE A 681 2.173 -7.121 -1.548 1.00 0.00 O ATOM 532 CB ILE A 681 1.025 -4.139 -0.687 1.00 0.00 C ATOM 533 CG1 ILE A 681 0.534 -2.850 -1.355 1.00 0.00 C ATOM 534 CG2 ILE A 681 2.557 -4.125 -0.620 1.00 0.00 C ATOM 535 CD1 ILE A 681 1.157 -1.657 -0.627 1.00 0.00 C ATOM 0 H ILE A 681 -1.347 -4.735 -0.702 1.00 0.00 H new ATOM 0 HA ILE A 681 0.790 -5.266 -2.533 1.00 0.00 H new ATOM 0 HB ILE A 681 0.615 -4.195 0.321 1.00 0.00 H new ATOM 0 HG12 ILE A 681 0.814 -2.839 -2.408 1.00 0.00 H new ATOM 0 HG13 ILE A 681 -0.554 -2.793 -1.314 1.00 0.00 H new ATOM 0 HG21 ILE A 681 2.889 -3.251 -0.059 1.00 0.00 H new ATOM 0 HG22 ILE A 681 2.908 -5.029 -0.123 1.00 0.00 H new ATOM 0 HG23 ILE A 681 2.965 -4.085 -1.630 1.00 0.00 H new ATOM 0 HD11 ILE A 681 0.818 -0.730 -1.090 1.00 0.00 H new ATOM 0 HD12 ILE A 681 0.854 -1.671 0.420 1.00 0.00 H new ATOM 0 HD13 ILE A 681 2.243 -1.718 -0.692 1.00 0.00 H new ATOM 547 N SER A 682 0.777 -7.172 0.163 1.00 0.00 N ATOM 548 CA SER A 682 1.412 -8.416 0.727 1.00 0.00 C ATOM 549 C SER A 682 1.300 -9.570 -0.269 1.00 0.00 C ATOM 550 O SER A 682 2.251 -10.282 -0.514 1.00 0.00 O ATOM 551 CB SER A 682 0.632 -8.744 2.009 1.00 0.00 C ATOM 552 OG SER A 682 1.243 -9.853 2.664 1.00 0.00 O ATOM 0 H SER A 682 -0.009 -6.806 0.701 1.00 0.00 H new ATOM 0 HA SER A 682 2.472 -8.265 0.929 1.00 0.00 H new ATOM 0 HB2 SER A 682 0.619 -7.878 2.671 1.00 0.00 H new ATOM 0 HB3 SER A 682 -0.405 -8.976 1.767 1.00 0.00 H new ATOM 0 HG SER A 682 0.747 -10.063 3.483 1.00 0.00 H new ATOM 558 N ARG A 683 0.157 -9.747 -0.874 1.00 0.00 N ATOM 559 CA ARG A 683 0.033 -10.840 -1.867 1.00 0.00 C ATOM 560 C ARG A 683 0.868 -10.462 -3.086 1.00 0.00 C ATOM 561 O ARG A 683 1.421 -11.304 -3.773 1.00 0.00 O ATOM 562 CB ARG A 683 -1.466 -10.962 -2.207 1.00 0.00 C ATOM 563 CG ARG A 683 -2.018 -9.622 -2.702 1.00 0.00 C ATOM 564 CD ARG A 683 -3.444 -9.810 -3.253 1.00 0.00 C ATOM 565 NE ARG A 683 -4.353 -9.553 -2.095 1.00 0.00 N ATOM 566 CZ ARG A 683 -5.647 -9.661 -2.227 1.00 0.00 C ATOM 567 NH1 ARG A 683 -6.215 -9.469 -3.383 1.00 0.00 N ATOM 568 NH2 ARG A 683 -6.378 -9.928 -1.180 1.00 0.00 N ATOM 0 H ARG A 683 -0.683 -9.188 -0.724 1.00 0.00 H new ATOM 0 HA ARG A 683 0.394 -11.800 -1.497 1.00 0.00 H new ATOM 0 HB2 ARG A 683 -1.610 -11.725 -2.972 1.00 0.00 H new ATOM 0 HB3 ARG A 683 -2.019 -11.286 -1.325 1.00 0.00 H new ATOM 0 HG2 ARG A 683 -2.027 -8.899 -1.886 1.00 0.00 H new ATOM 0 HG3 ARG A 683 -1.370 -9.217 -3.479 1.00 0.00 H new ATOM 0 HD2 ARG A 683 -3.644 -9.118 -4.071 1.00 0.00 H new ATOM 0 HD3 ARG A 683 -3.584 -10.817 -3.647 1.00 0.00 H new ATOM 0 HE ARG A 683 -3.958 -9.290 -1.192 1.00 0.00 H new ATOM 0 HH11 ARG A 683 -5.648 -9.232 -4.197 1.00 0.00 H new ATOM 0 HH12 ARG A 683 -7.227 -9.556 -3.475 1.00 0.00 H new ATOM 0 HH21 ARG A 683 -5.937 -10.050 -0.268 1.00 0.00 H new ATOM 0 HH22 ARG A 683 -7.390 -10.014 -1.273 1.00 0.00 H new ATOM 582 N VAL A 684 0.992 -9.182 -3.319 1.00 0.00 N ATOM 583 CA VAL A 684 1.808 -8.685 -4.450 1.00 0.00 C ATOM 584 C VAL A 684 3.268 -8.930 -4.129 1.00 0.00 C ATOM 585 O VAL A 684 4.073 -9.171 -4.998 1.00 0.00 O ATOM 586 CB VAL A 684 1.501 -7.187 -4.522 1.00 0.00 C ATOM 587 CG1 VAL A 684 2.576 -6.461 -5.328 1.00 0.00 C ATOM 588 CG2 VAL A 684 0.157 -6.978 -5.208 1.00 0.00 C ATOM 0 H VAL A 684 0.552 -8.452 -2.759 1.00 0.00 H new ATOM 0 HA VAL A 684 1.591 -9.176 -5.399 1.00 0.00 H new ATOM 0 HB VAL A 684 1.477 -6.788 -3.508 1.00 0.00 H new ATOM 0 HG11 VAL A 684 2.343 -5.397 -5.370 1.00 0.00 H new ATOM 0 HG12 VAL A 684 3.546 -6.602 -4.851 1.00 0.00 H new ATOM 0 HG13 VAL A 684 2.608 -6.865 -6.340 1.00 0.00 H new ATOM 0 HG21 VAL A 684 -0.063 -5.912 -5.260 1.00 0.00 H new ATOM 0 HG22 VAL A 684 0.195 -7.390 -6.216 1.00 0.00 H new ATOM 0 HG23 VAL A 684 -0.624 -7.482 -4.639 1.00 0.00 H new ATOM 598 N LEU A 685 3.612 -8.881 -2.872 1.00 0.00 N ATOM 599 CA LEU A 685 5.025 -9.125 -2.493 1.00 0.00 C ATOM 600 C LEU A 685 5.531 -10.435 -3.079 1.00 0.00 C ATOM 601 O LEU A 685 6.402 -10.431 -3.917 1.00 0.00 O ATOM 602 CB LEU A 685 5.058 -9.162 -0.967 1.00 0.00 C ATOM 603 CG LEU A 685 5.568 -7.820 -0.432 1.00 0.00 C ATOM 604 CD1 LEU A 685 6.836 -7.420 -1.188 1.00 0.00 C ATOM 605 CD2 LEU A 685 4.502 -6.741 -0.637 1.00 0.00 C ATOM 0 H LEU A 685 2.978 -8.684 -2.098 1.00 0.00 H new ATOM 0 HA LEU A 685 5.675 -8.342 -2.883 1.00 0.00 H new ATOM 0 HB2 LEU A 685 4.061 -9.366 -0.576 1.00 0.00 H new ATOM 0 HB3 LEU A 685 5.705 -9.970 -0.627 1.00 0.00 H new ATOM 0 HG LEU A 685 5.786 -7.919 0.631 1.00 0.00 H new ATOM 0 HD11 LEU A 685 7.200 -6.465 -0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 685 7.601 -8.183 -1.045 1.00 0.00 H new ATOM 0 HD13 LEU A 685 6.612 -7.326 -2.251 1.00 0.00 H new ATOM 0 HD21 LEU A 685 4.870 -5.789 -0.255 1.00 0.00 H new ATOM 0 HD22 LEU A 685 4.282 -6.645 -1.700 1.00 0.00 H new ATOM 0 HD23 LEU A 685 3.594 -7.020 -0.102 1.00 0.00 H new ATOM 617 N LYS A 686 5.019 -11.557 -2.650 1.00 0.00 N ATOM 618 CA LYS A 686 5.529 -12.844 -3.205 1.00 0.00 C ATOM 619 C LYS A 686 5.315 -12.901 -4.713 1.00 0.00 C ATOM 620 O LYS A 686 6.185 -13.310 -5.457 1.00 0.00 O ATOM 621 CB LYS A 686 4.730 -13.947 -2.511 1.00 0.00 C ATOM 622 CG LYS A 686 5.130 -14.014 -1.043 1.00 0.00 C ATOM 623 CD LYS A 686 4.259 -15.050 -0.344 1.00 0.00 C ATOM 624 CE LYS A 686 4.017 -14.618 1.102 1.00 0.00 C ATOM 625 NZ LYS A 686 3.018 -15.586 1.624 1.00 0.00 N ATOM 0 H LYS A 686 4.281 -11.639 -1.950 1.00 0.00 H new ATOM 0 HA LYS A 686 6.599 -12.955 -3.031 1.00 0.00 H new ATOM 0 HB2 LYS A 686 3.662 -13.748 -2.600 1.00 0.00 H new ATOM 0 HB3 LYS A 686 4.917 -14.906 -2.994 1.00 0.00 H new ATOM 0 HG2 LYS A 686 6.183 -14.281 -0.950 1.00 0.00 H new ATOM 0 HG3 LYS A 686 5.007 -13.038 -0.573 1.00 0.00 H new ATOM 0 HD2 LYS A 686 3.309 -15.155 -0.868 1.00 0.00 H new ATOM 0 HD3 LYS A 686 4.745 -16.025 -0.367 1.00 0.00 H new ATOM 0 HE2 LYS A 686 4.938 -14.648 1.683 1.00 0.00 H new ATOM 0 HE3 LYS A 686 3.642 -13.596 1.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 686 2.798 -15.357 2.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 686 2.150 -15.530 1.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 686 3.406 -16.549 1.569 1.00 0.00 H new ATOM 639 N LYS A 687 4.180 -12.473 -5.177 1.00 0.00 N ATOM 640 CA LYS A 687 3.947 -12.496 -6.641 1.00 0.00 C ATOM 641 C LYS A 687 4.906 -11.505 -7.323 1.00 0.00 C ATOM 642 O LYS A 687 5.370 -11.739 -8.421 1.00 0.00 O ATOM 643 CB LYS A 687 2.480 -12.084 -6.832 1.00 0.00 C ATOM 644 CG LYS A 687 2.123 -12.172 -8.321 1.00 0.00 C ATOM 645 CD LYS A 687 0.666 -11.754 -8.561 1.00 0.00 C ATOM 646 CE LYS A 687 0.290 -12.056 -10.020 1.00 0.00 C ATOM 647 NZ LYS A 687 0.728 -10.861 -10.785 1.00 0.00 N ATOM 0 H LYS A 687 3.411 -12.112 -4.613 1.00 0.00 H new ATOM 0 HA LYS A 687 4.131 -13.475 -7.084 1.00 0.00 H new ATOM 0 HB2 LYS A 687 1.828 -12.735 -6.250 1.00 0.00 H new ATOM 0 HB3 LYS A 687 2.324 -11.069 -6.467 1.00 0.00 H new ATOM 0 HG2 LYS A 687 2.789 -11.530 -8.897 1.00 0.00 H new ATOM 0 HG3 LYS A 687 2.276 -13.191 -8.676 1.00 0.00 H new ATOM 0 HD2 LYS A 687 0.004 -12.292 -7.883 1.00 0.00 H new ATOM 0 HD3 LYS A 687 0.540 -10.692 -8.353 1.00 0.00 H new ATOM 0 HE2 LYS A 687 0.788 -12.958 -10.377 1.00 0.00 H new ATOM 0 HE3 LYS A 687 -0.782 -12.221 -10.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 0.505 -10.992 -11.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 0.233 -10.019 -10.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 1.754 -10.733 -10.672 1.00 0.00 H new ATOM 661 N ASN A 688 5.206 -10.393 -6.689 1.00 0.00 N ATOM 662 CA ASN A 688 6.127 -9.399 -7.320 1.00 0.00 C ATOM 663 C ASN A 688 7.471 -9.347 -6.568 1.00 0.00 C ATOM 664 O ASN A 688 8.196 -8.370 -6.616 1.00 0.00 O ATOM 665 CB ASN A 688 5.366 -8.063 -7.252 1.00 0.00 C ATOM 666 CG ASN A 688 5.738 -7.232 -6.010 1.00 0.00 C ATOM 667 OD1 ASN A 688 5.698 -6.019 -6.062 1.00 0.00 O ATOM 668 ND2 ASN A 688 6.075 -7.807 -4.891 1.00 0.00 N ATOM 0 H ASN A 688 4.854 -10.135 -5.767 1.00 0.00 H new ATOM 0 HA ASN A 688 6.384 -9.654 -8.348 1.00 0.00 H new ATOM 0 HB2 ASN A 688 5.578 -7.482 -8.150 1.00 0.00 H new ATOM 0 HB3 ASN A 688 4.294 -8.260 -7.245 1.00 0.00 H new ATOM 0 HD21 ASN A 688 6.301 -7.240 -4.074 1.00 0.00 H new ATOM 0 HD22 ASN A 688 6.113 -8.825 -4.832 1.00 0.00 H new ATOM 675 N ASN A 689 7.801 -10.401 -5.870 1.00 0.00 N ATOM 676 CA ASN A 689 9.090 -10.425 -5.116 1.00 0.00 C ATOM 677 C ASN A 689 10.258 -10.763 -6.048 1.00 0.00 C ATOM 678 O ASN A 689 11.410 -10.760 -5.649 1.00 0.00 O ATOM 679 CB ASN A 689 8.926 -11.509 -4.043 1.00 0.00 C ATOM 680 CG ASN A 689 8.757 -12.883 -4.702 1.00 0.00 C ATOM 681 OD1 ASN A 689 8.784 -13.002 -5.912 1.00 0.00 O ATOM 682 ND2 ASN A 689 8.586 -13.933 -3.944 1.00 0.00 N ATOM 0 H ASN A 689 7.235 -11.246 -5.789 1.00 0.00 H new ATOM 0 HA ASN A 689 9.311 -9.453 -4.675 1.00 0.00 H new ATOM 0 HB2 ASN A 689 9.796 -11.517 -3.387 1.00 0.00 H new ATOM 0 HB3 ASN A 689 8.059 -11.287 -3.420 1.00 0.00 H new ATOM 0 HD21 ASN A 689 8.475 -14.855 -4.367 1.00 0.00 H new ATOM 0 HD22 ASN A 689 8.564 -13.831 -2.929 1.00 0.00 H new ATOM 689 N ARG A 690 9.973 -11.011 -7.296 1.00 0.00 N ATOM 690 CA ARG A 690 11.077 -11.304 -8.266 1.00 0.00 C ATOM 691 C ARG A 690 11.471 -10.034 -9.034 1.00 0.00 C ATOM 692 O ARG A 690 12.578 -9.921 -9.512 1.00 0.00 O ATOM 693 CB ARG A 690 10.533 -12.366 -9.229 1.00 0.00 C ATOM 694 CG ARG A 690 11.643 -12.792 -10.197 1.00 0.00 C ATOM 695 CD ARG A 690 12.695 -13.593 -9.429 1.00 0.00 C ATOM 696 NE ARG A 690 12.012 -14.868 -9.065 1.00 0.00 N ATOM 697 CZ ARG A 690 12.600 -15.730 -8.282 1.00 0.00 C ATOM 698 NH1 ARG A 690 12.713 -15.481 -6.999 1.00 0.00 N ATOM 699 NH2 ARG A 690 13.083 -16.837 -8.786 1.00 0.00 N ATOM 0 H ARG A 690 9.032 -11.025 -7.689 1.00 0.00 H new ATOM 0 HA ARG A 690 11.971 -11.657 -7.751 1.00 0.00 H new ATOM 0 HB2 ARG A 690 10.172 -13.229 -8.670 1.00 0.00 H new ATOM 0 HB3 ARG A 690 9.684 -11.968 -9.785 1.00 0.00 H new ATOM 0 HG2 ARG A 690 11.227 -13.394 -11.005 1.00 0.00 H new ATOM 0 HG3 ARG A 690 12.099 -11.915 -10.656 1.00 0.00 H new ATOM 0 HD2 ARG A 690 13.577 -13.778 -10.042 1.00 0.00 H new ATOM 0 HD3 ARG A 690 13.031 -13.057 -8.541 1.00 0.00 H new ATOM 0 HE ARG A 690 11.081 -15.067 -9.430 1.00 0.00 H new ATOM 0 HH11 ARG A 690 12.341 -14.613 -6.613 1.00 0.00 H new ATOM 0 HH12 ARG A 690 13.173 -16.155 -6.387 1.00 0.00 H new ATOM 0 HH21 ARG A 690 12.999 -17.022 -9.786 1.00 0.00 H new ATOM 0 HH22 ARG A 690 13.544 -17.515 -8.179 1.00 0.00 H new ATOM 713 N ASP A 691 10.583 -9.085 -9.156 1.00 0.00 N ATOM 714 CA ASP A 691 10.926 -7.828 -9.897 1.00 0.00 C ATOM 715 C ASP A 691 10.806 -6.610 -8.985 1.00 0.00 C ATOM 716 O ASP A 691 11.613 -5.705 -9.023 1.00 0.00 O ATOM 717 CB ASP A 691 9.893 -7.736 -11.024 1.00 0.00 C ATOM 718 CG ASP A 691 10.265 -8.699 -12.156 1.00 0.00 C ATOM 719 OD1 ASP A 691 11.443 -8.975 -12.307 1.00 0.00 O ATOM 720 OD2 ASP A 691 9.367 -9.130 -12.862 1.00 0.00 O ATOM 0 H ASP A 691 9.637 -9.121 -8.777 1.00 0.00 H new ATOM 0 HA ASP A 691 11.951 -7.848 -10.268 1.00 0.00 H new ATOM 0 HB2 ASP A 691 8.902 -7.978 -10.641 1.00 0.00 H new ATOM 0 HB3 ASP A 691 9.847 -6.715 -11.404 1.00 0.00 H new ATOM 725 N SER A 692 9.782 -6.580 -8.190 1.00 0.00 N ATOM 726 CA SER A 692 9.560 -5.420 -7.284 1.00 0.00 C ATOM 727 C SER A 692 10.092 -5.702 -5.879 1.00 0.00 C ATOM 728 O SER A 692 11.213 -6.133 -5.720 1.00 0.00 O ATOM 729 CB SER A 692 8.053 -5.256 -7.283 1.00 0.00 C ATOM 730 OG SER A 692 7.623 -5.073 -8.626 1.00 0.00 O ATOM 0 H SER A 692 9.079 -7.316 -8.126 1.00 0.00 H new ATOM 0 HA SER A 692 10.082 -4.521 -7.611 1.00 0.00 H new ATOM 0 HB2 SER A 692 7.576 -6.134 -6.848 1.00 0.00 H new ATOM 0 HB3 SER A 692 7.765 -4.401 -6.672 1.00 0.00 H new ATOM 0 HG SER A 692 6.649 -4.967 -8.646 1.00 0.00 H new ATOM 736 N ALA A 693 9.321 -5.432 -4.860 1.00 0.00 N ATOM 737 CA ALA A 693 9.814 -5.654 -3.472 1.00 0.00 C ATOM 738 C ALA A 693 9.537 -7.081 -3.013 1.00 0.00 C ATOM 739 O ALA A 693 8.793 -7.801 -3.638 1.00 0.00 O ATOM 740 CB ALA A 693 9.027 -4.657 -2.631 1.00 0.00 C ATOM 0 H ALA A 693 8.371 -5.067 -4.930 1.00 0.00 H new ATOM 0 HA ALA A 693 10.892 -5.515 -3.390 1.00 0.00 H new ATOM 0 HB1 ALA A 693 9.325 -4.747 -1.586 1.00 0.00 H new ATOM 0 HB2 ALA A 693 9.232 -3.645 -2.980 1.00 0.00 H new ATOM 0 HB3 ALA A 693 7.961 -4.864 -2.724 1.00 0.00 H new ATOM 746 N VAL A 694 10.144 -7.499 -1.934 1.00 0.00 N ATOM 747 CA VAL A 694 9.925 -8.896 -1.455 1.00 0.00 C ATOM 748 C VAL A 694 9.470 -8.929 -0.003 1.00 0.00 C ATOM 749 O VAL A 694 8.694 -9.773 0.401 1.00 0.00 O ATOM 750 CB VAL A 694 11.295 -9.531 -1.604 1.00 0.00 C ATOM 751 CG1 VAL A 694 11.268 -10.978 -1.098 1.00 0.00 C ATOM 752 CG2 VAL A 694 11.641 -9.505 -3.080 1.00 0.00 C ATOM 0 H VAL A 694 10.779 -6.938 -1.366 1.00 0.00 H new ATOM 0 HA VAL A 694 9.143 -9.412 -2.012 1.00 0.00 H new ATOM 0 HB VAL A 694 12.037 -8.986 -1.020 1.00 0.00 H new ATOM 0 HG11 VAL A 694 12.257 -11.421 -1.211 1.00 0.00 H new ATOM 0 HG12 VAL A 694 10.983 -10.990 -0.046 1.00 0.00 H new ATOM 0 HG13 VAL A 694 10.545 -11.552 -1.677 1.00 0.00 H new ATOM 0 HG21 VAL A 694 12.623 -9.954 -3.232 1.00 0.00 H new ATOM 0 HG22 VAL A 694 10.894 -10.069 -3.639 1.00 0.00 H new ATOM 0 HG23 VAL A 694 11.656 -8.474 -3.432 1.00 0.00 H new ATOM 762 N ALA A 695 9.958 -8.032 0.788 1.00 0.00 N ATOM 763 CA ALA A 695 9.573 -8.018 2.218 1.00 0.00 C ATOM 764 C ALA A 695 8.608 -6.867 2.502 1.00 0.00 C ATOM 765 O ALA A 695 8.978 -5.712 2.450 1.00 0.00 O ATOM 766 CB ALA A 695 10.895 -7.810 2.960 1.00 0.00 C ATOM 0 H ALA A 695 10.612 -7.301 0.507 1.00 0.00 H new ATOM 0 HA ALA A 695 9.062 -8.931 2.524 1.00 0.00 H new ATOM 0 HB1 ALA A 695 10.710 -7.786 4.034 1.00 0.00 H new ATOM 0 HB2 ALA A 695 11.575 -8.629 2.728 1.00 0.00 H new ATOM 0 HB3 ALA A 695 11.343 -6.867 2.648 1.00 0.00 H new ATOM 772 N SER A 696 7.378 -7.164 2.805 1.00 0.00 N ATOM 773 CA SER A 696 6.411 -6.064 3.094 1.00 0.00 C ATOM 774 C SER A 696 6.538 -5.586 4.533 1.00 0.00 C ATOM 775 O SER A 696 5.747 -4.789 5.000 1.00 0.00 O ATOM 776 CB SER A 696 5.023 -6.623 2.844 1.00 0.00 C ATOM 777 OG SER A 696 4.821 -7.763 3.662 1.00 0.00 O ATOM 0 H SER A 696 7.000 -8.109 2.866 1.00 0.00 H new ATOM 0 HA SER A 696 6.611 -5.204 2.455 1.00 0.00 H new ATOM 0 HB2 SER A 696 4.269 -5.867 3.063 1.00 0.00 H new ATOM 0 HB3 SER A 696 4.910 -6.891 1.793 1.00 0.00 H new ATOM 0 HG SER A 696 3.924 -8.125 3.503 1.00 0.00 H new ATOM 783 N GLU A 697 7.531 -6.048 5.234 1.00 0.00 N ATOM 784 CA GLU A 697 7.710 -5.583 6.631 1.00 0.00 C ATOM 785 C GLU A 697 8.170 -4.134 6.563 1.00 0.00 C ATOM 786 O GLU A 697 9.340 -3.831 6.702 1.00 0.00 O ATOM 787 CB GLU A 697 8.806 -6.474 7.215 1.00 0.00 C ATOM 788 CG GLU A 697 8.320 -7.922 7.246 1.00 0.00 C ATOM 789 CD GLU A 697 9.409 -8.826 7.832 1.00 0.00 C ATOM 790 OE1 GLU A 697 10.370 -9.100 7.130 1.00 0.00 O ATOM 791 OE2 GLU A 697 9.265 -9.228 8.976 1.00 0.00 O ATOM 0 H GLU A 697 8.221 -6.722 4.903 1.00 0.00 H new ATOM 0 HA GLU A 697 6.807 -5.639 7.239 1.00 0.00 H new ATOM 0 HB2 GLU A 697 9.712 -6.396 6.614 1.00 0.00 H new ATOM 0 HB3 GLU A 697 9.061 -6.143 8.222 1.00 0.00 H new ATOM 0 HG2 GLU A 697 7.412 -7.997 7.844 1.00 0.00 H new ATOM 0 HG3 GLU A 697 8.066 -8.251 6.238 1.00 0.00 H new ATOM 798 N PHE A 698 7.257 -3.247 6.289 1.00 0.00 N ATOM 799 CA PHE A 698 7.625 -1.816 6.127 1.00 0.00 C ATOM 800 C PHE A 698 6.634 -0.851 6.808 1.00 0.00 C ATOM 801 O PHE A 698 5.613 -1.239 7.346 1.00 0.00 O ATOM 802 CB PHE A 698 7.610 -1.592 4.599 1.00 0.00 C ATOM 803 CG PHE A 698 6.396 -2.230 3.948 1.00 0.00 C ATOM 804 CD1 PHE A 698 5.160 -2.280 4.600 1.00 0.00 C ATOM 805 CD2 PHE A 698 6.514 -2.766 2.655 1.00 0.00 C ATOM 806 CE1 PHE A 698 4.061 -2.865 3.980 1.00 0.00 C ATOM 807 CE2 PHE A 698 5.408 -3.354 2.034 1.00 0.00 C ATOM 808 CZ PHE A 698 4.177 -3.396 2.695 1.00 0.00 C ATOM 0 H PHE A 698 6.265 -3.454 6.170 1.00 0.00 H new ATOM 0 HA PHE A 698 8.587 -1.611 6.596 1.00 0.00 H new ATOM 0 HB2 PHE A 698 7.616 -0.523 4.388 1.00 0.00 H new ATOM 0 HB3 PHE A 698 8.518 -2.008 4.162 1.00 0.00 H new ATOM 0 HD1 PHE A 698 5.058 -1.862 5.591 1.00 0.00 H new ATOM 0 HD2 PHE A 698 7.462 -2.724 2.139 1.00 0.00 H new ATOM 0 HE1 PHE A 698 3.113 -2.908 4.496 1.00 0.00 H new ATOM 0 HE2 PHE A 698 5.505 -3.775 1.044 1.00 0.00 H new ATOM 0 HZ PHE A 698 3.318 -3.838 2.212 1.00 0.00 H new ATOM 818 N GLU A 699 6.938 0.417 6.739 1.00 0.00 N ATOM 819 CA GLU A 699 6.054 1.471 7.294 1.00 0.00 C ATOM 820 C GLU A 699 5.467 2.229 6.101 1.00 0.00 C ATOM 821 O GLU A 699 6.187 2.715 5.252 1.00 0.00 O ATOM 822 CB GLU A 699 6.975 2.388 8.101 1.00 0.00 C ATOM 823 CG GLU A 699 6.144 3.469 8.794 1.00 0.00 C ATOM 824 CD GLU A 699 7.067 4.569 9.329 1.00 0.00 C ATOM 825 OE1 GLU A 699 7.843 4.280 10.224 1.00 0.00 O ATOM 826 OE2 GLU A 699 6.980 5.684 8.835 1.00 0.00 O ATOM 0 H GLU A 699 7.791 0.772 6.306 1.00 0.00 H new ATOM 0 HA GLU A 699 5.245 1.089 7.916 1.00 0.00 H new ATOM 0 HB2 GLU A 699 7.525 1.807 8.842 1.00 0.00 H new ATOM 0 HB3 GLU A 699 7.713 2.848 7.444 1.00 0.00 H new ATOM 0 HG2 GLU A 699 5.425 3.894 8.093 1.00 0.00 H new ATOM 0 HG3 GLU A 699 5.571 3.032 9.612 1.00 0.00 H new ATOM 833 N LEU A 700 4.179 2.301 6.001 1.00 0.00 N ATOM 834 CA LEU A 700 3.565 2.993 4.832 1.00 0.00 C ATOM 835 C LEU A 700 3.037 4.381 5.224 1.00 0.00 C ATOM 836 O LEU A 700 2.474 4.570 6.281 1.00 0.00 O ATOM 837 CB LEU A 700 2.425 2.065 4.407 1.00 0.00 C ATOM 838 CG LEU A 700 2.850 0.591 4.549 1.00 0.00 C ATOM 839 CD1 LEU A 700 1.948 -0.272 3.674 1.00 0.00 C ATOM 840 CD2 LEU A 700 4.325 0.385 4.141 1.00 0.00 C ATOM 0 H LEU A 700 3.518 1.913 6.674 1.00 0.00 H new ATOM 0 HA LEU A 700 4.280 3.169 4.028 1.00 0.00 H new ATOM 0 HB2 LEU A 700 1.544 2.257 5.020 1.00 0.00 H new ATOM 0 HB3 LEU A 700 2.146 2.271 3.374 1.00 0.00 H new ATOM 0 HG LEU A 700 2.751 0.302 5.595 1.00 0.00 H new ATOM 0 HD11 LEU A 700 2.242 -1.317 3.768 1.00 0.00 H new ATOM 0 HD12 LEU A 700 0.912 -0.156 3.993 1.00 0.00 H new ATOM 0 HD13 LEU A 700 2.044 0.039 2.634 1.00 0.00 H new ATOM 0 HD21 LEU A 700 4.590 -0.666 4.254 1.00 0.00 H new ATOM 0 HD22 LEU A 700 4.460 0.684 3.102 1.00 0.00 H new ATOM 0 HD23 LEU A 700 4.967 0.992 4.779 1.00 0.00 H new ATOM 852 N VAL A 701 3.218 5.355 4.369 1.00 0.00 N ATOM 853 CA VAL A 701 2.729 6.727 4.677 1.00 0.00 C ATOM 854 C VAL A 701 1.820 7.194 3.560 1.00 0.00 C ATOM 855 O VAL A 701 2.191 7.176 2.407 1.00 0.00 O ATOM 856 CB VAL A 701 3.979 7.595 4.729 1.00 0.00 C ATOM 857 CG1 VAL A 701 3.590 9.061 4.963 1.00 0.00 C ATOM 858 CG2 VAL A 701 4.865 7.099 5.869 1.00 0.00 C ATOM 0 H VAL A 701 3.686 5.256 3.468 1.00 0.00 H new ATOM 0 HA VAL A 701 2.167 6.771 5.610 1.00 0.00 H new ATOM 0 HB VAL A 701 4.519 7.529 3.784 1.00 0.00 H new ATOM 0 HG11 VAL A 701 4.490 9.675 4.999 1.00 0.00 H new ATOM 0 HG12 VAL A 701 2.950 9.402 4.149 1.00 0.00 H new ATOM 0 HG13 VAL A 701 3.053 9.149 5.908 1.00 0.00 H new ATOM 0 HG21 VAL A 701 5.766 7.710 5.921 1.00 0.00 H new ATOM 0 HG22 VAL A 701 4.321 7.173 6.811 1.00 0.00 H new ATOM 0 HG23 VAL A 701 5.141 6.060 5.690 1.00 0.00 H new ATOM 868 N GLN A 702 0.628 7.566 3.885 1.00 0.00 N ATOM 869 CA GLN A 702 -0.319 7.994 2.832 1.00 0.00 C ATOM 870 C GLN A 702 -0.373 9.513 2.688 1.00 0.00 C ATOM 871 O GLN A 702 -0.149 10.256 3.628 1.00 0.00 O ATOM 872 CB GLN A 702 -1.656 7.460 3.305 1.00 0.00 C ATOM 873 CG GLN A 702 -2.725 7.728 2.246 1.00 0.00 C ATOM 874 CD GLN A 702 -4.042 7.088 2.680 1.00 0.00 C ATOM 875 OE1 GLN A 702 -4.208 6.717 3.826 1.00 0.00 O ATOM 876 NE2 GLN A 702 -5.000 6.964 1.809 1.00 0.00 N ATOM 0 H GLN A 702 0.264 7.594 4.837 1.00 0.00 H new ATOM 0 HA GLN A 702 -0.026 7.621 1.851 1.00 0.00 H new ATOM 0 HB2 GLN A 702 -1.583 6.390 3.498 1.00 0.00 H new ATOM 0 HB3 GLN A 702 -1.936 7.935 4.245 1.00 0.00 H new ATOM 0 HG2 GLN A 702 -2.857 8.801 2.111 1.00 0.00 H new ATOM 0 HG3 GLN A 702 -2.410 7.322 1.285 1.00 0.00 H new ATOM 0 HE21 GLN A 702 -4.859 7.276 0.848 1.00 0.00 H new ATOM 0 HE22 GLN A 702 -5.892 6.555 2.087 1.00 0.00 H new ATOM 885 N LEU A 703 -0.682 9.945 1.493 1.00 0.00 N ATOM 886 CA LEU A 703 -0.805 11.402 1.150 1.00 0.00 C ATOM 887 C LEU A 703 0.539 12.006 0.756 1.00 0.00 C ATOM 888 O LEU A 703 1.531 11.863 1.444 1.00 0.00 O ATOM 889 CB LEU A 703 -1.370 12.117 2.374 1.00 0.00 C ATOM 890 CG LEU A 703 -2.504 13.043 1.924 1.00 0.00 C ATOM 891 CD1 LEU A 703 -3.765 12.215 1.647 1.00 0.00 C ATOM 892 CD2 LEU A 703 -2.778 14.065 3.033 1.00 0.00 C ATOM 0 H LEU A 703 -0.862 9.323 0.705 1.00 0.00 H new ATOM 0 HA LEU A 703 -1.465 11.520 0.290 1.00 0.00 H new ATOM 0 HB2 LEU A 703 -1.740 11.391 3.098 1.00 0.00 H new ATOM 0 HB3 LEU A 703 -0.588 12.692 2.870 1.00 0.00 H new ATOM 0 HG LEU A 703 -2.219 13.565 1.010 1.00 0.00 H new ATOM 0 HD11 LEU A 703 -4.571 12.875 1.327 1.00 0.00 H new ATOM 0 HD12 LEU A 703 -3.558 11.488 0.861 1.00 0.00 H new ATOM 0 HD13 LEU A 703 -4.064 11.692 2.555 1.00 0.00 H new ATOM 0 HD21 LEU A 703 -3.584 14.730 2.724 1.00 0.00 H new ATOM 0 HD22 LEU A 703 -3.068 13.543 3.945 1.00 0.00 H new ATOM 0 HD23 LEU A 703 -1.877 14.649 3.220 1.00 0.00 H new ATOM 904 N LEU A 704 0.557 12.691 -0.361 1.00 0.00 N ATOM 905 CA LEU A 704 1.811 13.325 -0.845 1.00 0.00 C ATOM 906 C LEU A 704 2.344 14.329 0.192 1.00 0.00 C ATOM 907 O LEU A 704 3.532 14.362 0.439 1.00 0.00 O ATOM 908 CB LEU A 704 1.427 14.054 -2.150 1.00 0.00 C ATOM 909 CG LEU A 704 0.779 13.107 -3.193 1.00 0.00 C ATOM 910 CD1 LEU A 704 0.896 11.637 -2.778 1.00 0.00 C ATOM 911 CD2 LEU A 704 -0.711 13.459 -3.341 1.00 0.00 C ATOM 0 H LEU A 704 -0.255 12.836 -0.961 1.00 0.00 H new ATOM 0 HA LEU A 704 2.598 12.589 -1.007 1.00 0.00 H new ATOM 0 HB2 LEU A 704 0.734 14.863 -1.919 1.00 0.00 H new ATOM 0 HB3 LEU A 704 2.317 14.510 -2.583 1.00 0.00 H new ATOM 0 HG LEU A 704 1.308 13.241 -4.137 1.00 0.00 H new ATOM 0 HD11 LEU A 704 0.430 11.007 -3.535 1.00 0.00 H new ATOM 0 HD12 LEU A 704 1.948 11.369 -2.680 1.00 0.00 H new ATOM 0 HD13 LEU A 704 0.393 11.488 -1.822 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -1.171 12.795 -4.074 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -1.210 13.339 -2.380 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -0.809 14.492 -3.675 1.00 0.00 H new ATOM 923 N PRO A 705 1.467 15.127 0.775 1.00 0.00 N ATOM 924 CA PRO A 705 1.918 16.116 1.786 1.00 0.00 C ATOM 925 C PRO A 705 2.384 15.382 3.057 1.00 0.00 C ATOM 926 O PRO A 705 3.118 15.914 3.870 1.00 0.00 O ATOM 927 CB PRO A 705 0.647 16.929 2.052 1.00 0.00 C ATOM 928 CG PRO A 705 -0.513 16.324 1.231 1.00 0.00 C ATOM 929 CD PRO A 705 0.011 15.103 0.468 1.00 0.00 C ATOM 0 HA PRO A 705 2.757 16.734 1.465 1.00 0.00 H new ATOM 0 HB2 PRO A 705 0.405 16.914 3.115 1.00 0.00 H new ATOM 0 HB3 PRO A 705 0.801 17.972 1.775 1.00 0.00 H new ATOM 0 HG2 PRO A 705 -1.332 16.035 1.890 1.00 0.00 H new ATOM 0 HG3 PRO A 705 -0.909 17.063 0.535 1.00 0.00 H new ATOM 0 HD2 PRO A 705 -0.460 14.180 0.808 1.00 0.00 H new ATOM 0 HD3 PRO A 705 -0.179 15.182 -0.602 1.00 0.00 H new ATOM 937 N GLY A 706 1.946 14.166 3.236 1.00 0.00 N ATOM 938 CA GLY A 706 2.341 13.392 4.449 1.00 0.00 C ATOM 939 C GLY A 706 1.384 13.753 5.588 1.00 0.00 C ATOM 940 O GLY A 706 1.547 14.749 6.266 1.00 0.00 O ATOM 0 H GLY A 706 1.329 13.672 2.592 1.00 0.00 H new ATOM 0 HA2 GLY A 706 2.301 12.322 4.245 1.00 0.00 H new ATOM 0 HA3 GLY A 706 3.368 13.625 4.729 1.00 0.00 H new ATOM 944 N ASP A 707 0.365 12.966 5.783 1.00 0.00 N ATOM 945 CA ASP A 707 -0.628 13.274 6.847 1.00 0.00 C ATOM 946 C ASP A 707 -1.187 11.973 7.423 1.00 0.00 C ATOM 947 O ASP A 707 -1.278 11.787 8.619 1.00 0.00 O ATOM 948 CB ASP A 707 -1.707 14.067 6.103 1.00 0.00 C ATOM 949 CG ASP A 707 -2.796 14.537 7.069 1.00 0.00 C ATOM 950 OD1 ASP A 707 -2.724 14.184 8.232 1.00 0.00 O ATOM 951 OD2 ASP A 707 -3.683 15.247 6.623 1.00 0.00 O ATOM 0 H ASP A 707 0.176 12.118 5.248 1.00 0.00 H new ATOM 0 HA ASP A 707 -0.216 13.827 7.691 1.00 0.00 H new ATOM 0 HB2 ASP A 707 -1.257 14.928 5.608 1.00 0.00 H new ATOM 0 HB3 ASP A 707 -2.149 13.446 5.323 1.00 0.00 H new ATOM 956 N ARG A 708 -1.567 11.073 6.573 1.00 0.00 N ATOM 957 CA ARG A 708 -2.130 9.785 7.051 1.00 0.00 C ATOM 958 C ARG A 708 -1.119 8.664 6.839 1.00 0.00 C ATOM 959 O ARG A 708 -0.476 8.592 5.814 1.00 0.00 O ATOM 960 CB ARG A 708 -3.347 9.564 6.157 1.00 0.00 C ATOM 961 CG ARG A 708 -4.176 8.393 6.679 1.00 0.00 C ATOM 962 CD ARG A 708 -4.676 8.712 8.090 1.00 0.00 C ATOM 963 NE ARG A 708 -5.477 9.967 7.963 1.00 0.00 N ATOM 964 CZ ARG A 708 -6.072 10.461 9.018 1.00 0.00 C ATOM 965 NH1 ARG A 708 -5.435 11.264 9.823 1.00 0.00 N ATOM 966 NH2 ARG A 708 -7.306 10.144 9.275 1.00 0.00 N ATOM 0 H ARG A 708 -1.513 11.172 5.559 1.00 0.00 H new ATOM 0 HA ARG A 708 -2.378 9.798 8.112 1.00 0.00 H new ATOM 0 HB2 ARG A 708 -3.956 10.467 6.129 1.00 0.00 H new ATOM 0 HB3 ARG A 708 -3.026 9.365 5.135 1.00 0.00 H new ATOM 0 HG2 ARG A 708 -5.021 8.207 6.016 1.00 0.00 H new ATOM 0 HG3 ARG A 708 -3.574 7.484 6.691 1.00 0.00 H new ATOM 0 HD2 ARG A 708 -5.285 7.898 8.483 1.00 0.00 H new ATOM 0 HD3 ARG A 708 -3.842 8.848 8.779 1.00 0.00 H new ATOM 0 HE ARG A 708 -5.559 10.435 7.060 1.00 0.00 H new ATOM 0 HH11 ARG A 708 -4.464 11.512 9.633 1.00 0.00 H new ATOM 0 HH12 ARG A 708 -5.907 11.644 10.643 1.00 0.00 H new ATOM 0 HH21 ARG A 708 -7.810 9.510 8.654 1.00 0.00 H new ATOM 0 HH22 ARG A 708 -7.771 10.529 10.097 1.00 0.00 H new ATOM 980 N GLU A 709 -0.984 7.777 7.780 1.00 0.00 N ATOM 981 CA GLU A 709 -0.025 6.659 7.583 1.00 0.00 C ATOM 982 C GLU A 709 -0.814 5.361 7.394 1.00 0.00 C ATOM 983 O GLU A 709 -1.726 5.074 8.143 1.00 0.00 O ATOM 984 CB GLU A 709 0.816 6.596 8.856 1.00 0.00 C ATOM 985 CG GLU A 709 -0.093 6.303 10.057 1.00 0.00 C ATOM 986 CD GLU A 709 0.699 6.440 11.362 1.00 0.00 C ATOM 987 OE1 GLU A 709 0.932 7.564 11.780 1.00 0.00 O ATOM 988 OE2 GLU A 709 1.048 5.416 11.926 1.00 0.00 O ATOM 0 H GLU A 709 -1.489 7.776 8.666 1.00 0.00 H new ATOM 0 HA GLU A 709 0.609 6.801 6.708 1.00 0.00 H new ATOM 0 HB2 GLU A 709 1.576 5.820 8.764 1.00 0.00 H new ATOM 0 HB3 GLU A 709 1.340 7.540 9.005 1.00 0.00 H new ATOM 0 HG2 GLU A 709 -0.937 6.992 10.061 1.00 0.00 H new ATOM 0 HG3 GLU A 709 -0.504 5.297 9.975 1.00 0.00 H new ATOM 995 N LEU A 710 -0.488 4.581 6.396 1.00 0.00 N ATOM 996 CA LEU A 710 -1.241 3.315 6.165 1.00 0.00 C ATOM 997 C LEU A 710 -0.340 2.105 6.400 1.00 0.00 C ATOM 998 O LEU A 710 -0.165 1.256 5.544 1.00 0.00 O ATOM 999 CB LEU A 710 -1.667 3.403 4.702 1.00 0.00 C ATOM 1000 CG LEU A 710 -2.687 2.310 4.337 1.00 0.00 C ATOM 1001 CD1 LEU A 710 -2.043 1.349 3.338 1.00 0.00 C ATOM 1002 CD2 LEU A 710 -3.141 1.515 5.574 1.00 0.00 C ATOM 0 H LEU A 710 0.265 4.766 5.733 1.00 0.00 H new ATOM 0 HA LEU A 710 -2.089 3.196 6.840 1.00 0.00 H new ATOM 0 HB2 LEU A 710 -2.101 4.384 4.508 1.00 0.00 H new ATOM 0 HB3 LEU A 710 -0.790 3.310 4.062 1.00 0.00 H new ATOM 0 HG LEU A 710 -3.564 2.793 3.907 1.00 0.00 H new ATOM 0 HD11 LEU A 710 -2.756 0.569 3.071 1.00 0.00 H new ATOM 0 HD12 LEU A 710 -1.752 1.897 2.442 1.00 0.00 H new ATOM 0 HD13 LEU A 710 -1.160 0.895 3.788 1.00 0.00 H new ATOM 0 HD21 LEU A 710 -3.861 0.754 5.273 1.00 0.00 H new ATOM 0 HD22 LEU A 710 -2.278 1.036 6.036 1.00 0.00 H new ATOM 0 HD23 LEU A 710 -3.607 2.192 6.290 1.00 0.00 H new ATOM 1014 N THR A 711 0.224 2.027 7.562 1.00 0.00 N ATOM 1015 CA THR A 711 1.117 0.888 7.892 1.00 0.00 C ATOM 1016 C THR A 711 0.262 -0.332 8.276 1.00 0.00 C ATOM 1017 O THR A 711 -0.953 -0.262 8.295 1.00 0.00 O ATOM 1018 CB THR A 711 2.007 1.412 9.038 1.00 0.00 C ATOM 1019 OG1 THR A 711 1.216 1.688 10.191 1.00 0.00 O ATOM 1020 CG2 THR A 711 2.676 2.711 8.586 1.00 0.00 C ATOM 0 H THR A 711 0.105 2.711 8.309 1.00 0.00 H new ATOM 0 HA THR A 711 1.741 0.551 7.064 1.00 0.00 H new ATOM 0 HB THR A 711 2.753 0.656 9.284 1.00 0.00 H new ATOM 0 HG1 THR A 711 1.733 2.234 10.820 1.00 0.00 H new ATOM 0 HG21 THR A 711 3.309 3.092 9.387 1.00 0.00 H new ATOM 0 HG22 THR A 711 3.286 2.518 7.703 1.00 0.00 H new ATOM 0 HG23 THR A 711 1.911 3.449 8.345 1.00 0.00 H new ATOM 1028 N ILE A 712 0.870 -1.465 8.540 1.00 0.00 N ATOM 1029 CA ILE A 712 0.053 -2.678 8.868 1.00 0.00 C ATOM 1030 C ILE A 712 -0.645 -2.655 10.261 1.00 0.00 C ATOM 1031 O ILE A 712 -1.601 -3.387 10.438 1.00 0.00 O ATOM 1032 CB ILE A 712 0.995 -3.881 8.721 1.00 0.00 C ATOM 1033 CG1 ILE A 712 2.060 -3.889 9.816 1.00 0.00 C ATOM 1034 CG2 ILE A 712 1.680 -3.808 7.355 1.00 0.00 C ATOM 1035 CD1 ILE A 712 1.439 -4.370 11.133 1.00 0.00 C ATOM 0 H ILE A 712 1.881 -1.602 8.543 1.00 0.00 H new ATOM 0 HA ILE A 712 -0.791 -2.726 8.180 1.00 0.00 H new ATOM 0 HB ILE A 712 0.407 -4.795 8.810 1.00 0.00 H new ATOM 0 HG12 ILE A 712 2.884 -4.542 9.531 1.00 0.00 H new ATOM 0 HG13 ILE A 712 2.475 -2.889 9.942 1.00 0.00 H new ATOM 0 HG21 ILE A 712 2.352 -4.658 7.239 1.00 0.00 H new ATOM 0 HG22 ILE A 712 0.926 -3.832 6.568 1.00 0.00 H new ATOM 0 HG23 ILE A 712 2.250 -2.882 7.283 1.00 0.00 H new ATOM 0 HD11 ILE A 712 2.200 -4.375 11.913 1.00 0.00 H new ATOM 0 HD12 ILE A 712 0.629 -3.699 11.420 1.00 0.00 H new ATOM 0 HD13 ILE A 712 1.046 -5.378 11.003 1.00 0.00 H new ATOM 1047 N PRO A 713 -0.214 -1.828 11.205 1.00 0.00 N ATOM 1048 CA PRO A 713 -0.909 -1.779 12.522 1.00 0.00 C ATOM 1049 C PRO A 713 -2.384 -1.388 12.351 1.00 0.00 C ATOM 1050 O PRO A 713 -3.197 -1.606 13.229 1.00 0.00 O ATOM 1051 CB PRO A 713 -0.125 -0.701 13.283 1.00 0.00 C ATOM 1052 CG PRO A 713 1.038 -0.217 12.392 1.00 0.00 C ATOM 1053 CD PRO A 713 0.953 -0.934 11.042 1.00 0.00 C ATOM 0 HA PRO A 713 -0.926 -2.738 13.040 1.00 0.00 H new ATOM 0 HB2 PRO A 713 -0.779 0.133 13.538 1.00 0.00 H new ATOM 0 HB3 PRO A 713 0.259 -1.103 14.221 1.00 0.00 H new ATOM 0 HG2 PRO A 713 0.982 0.862 12.251 1.00 0.00 H new ATOM 0 HG3 PRO A 713 1.994 -0.427 12.872 1.00 0.00 H new ATOM 0 HD2 PRO A 713 0.810 -0.231 10.221 1.00 0.00 H new ATOM 0 HD3 PRO A 713 1.862 -1.495 10.826 1.00 0.00 H new ATOM 1061 N HIS A 714 -2.732 -0.820 11.236 1.00 0.00 N ATOM 1062 CA HIS A 714 -4.144 -0.414 11.003 1.00 0.00 C ATOM 1063 C HIS A 714 -5.022 -1.645 10.709 1.00 0.00 C ATOM 1064 O HIS A 714 -4.531 -2.709 10.388 1.00 0.00 O ATOM 1065 CB HIS A 714 -4.054 0.514 9.797 1.00 0.00 C ATOM 1066 CG HIS A 714 -3.185 1.708 10.141 1.00 0.00 C ATOM 1067 ND1 HIS A 714 -3.715 2.923 10.555 1.00 0.00 N ATOM 1068 CD2 HIS A 714 -1.817 1.885 10.130 1.00 0.00 C ATOM 1069 CE1 HIS A 714 -2.683 3.766 10.763 1.00 0.00 C ATOM 1070 NE2 HIS A 714 -1.508 3.182 10.522 1.00 0.00 N ATOM 0 H HIS A 714 -2.094 -0.617 10.467 1.00 0.00 H new ATOM 0 HA HIS A 714 -4.602 0.070 11.866 1.00 0.00 H new ATOM 0 HB2 HIS A 714 -3.635 -0.020 8.944 1.00 0.00 H new ATOM 0 HB3 HIS A 714 -5.050 0.848 9.506 1.00 0.00 H new ATOM 0 HD1 HIS A 714 -4.704 3.139 10.679 1.00 0.00 H new ATOM 0 HD2 HIS A 714 -1.095 1.129 9.858 1.00 0.00 H new ATOM 0 HE1 HIS A 714 -2.794 4.791 11.086 1.00 0.00 H new ATOM 1078 N SER A 715 -6.315 -1.518 10.851 1.00 0.00 N ATOM 1079 CA SER A 715 -7.213 -2.687 10.611 1.00 0.00 C ATOM 1080 C SER A 715 -7.646 -2.801 9.144 1.00 0.00 C ATOM 1081 O SER A 715 -7.342 -1.956 8.321 1.00 0.00 O ATOM 1082 CB SER A 715 -8.416 -2.439 11.509 1.00 0.00 C ATOM 1083 OG SER A 715 -8.039 -2.655 12.863 1.00 0.00 O ATOM 0 H SER A 715 -6.788 -0.656 11.123 1.00 0.00 H new ATOM 0 HA SER A 715 -6.705 -3.626 10.832 1.00 0.00 H new ATOM 0 HB2 SER A 715 -8.779 -1.420 11.378 1.00 0.00 H new ATOM 0 HB3 SER A 715 -9.233 -3.106 11.235 1.00 0.00 H new ATOM 0 HG SER A 715 -8.810 -2.495 13.447 1.00 0.00 H new ATOM 1089 N ALA A 716 -8.338 -3.864 8.818 1.00 0.00 N ATOM 1090 CA ALA A 716 -8.788 -4.083 7.416 1.00 0.00 C ATOM 1091 C ALA A 716 -9.602 -2.896 6.906 1.00 0.00 C ATOM 1092 O ALA A 716 -9.315 -2.350 5.862 1.00 0.00 O ATOM 1093 CB ALA A 716 -9.672 -5.331 7.492 1.00 0.00 C ATOM 0 H ALA A 716 -8.612 -4.596 9.474 1.00 0.00 H new ATOM 0 HA ALA A 716 -7.947 -4.197 6.732 1.00 0.00 H new ATOM 0 HB1 ALA A 716 -10.051 -5.569 6.498 1.00 0.00 H new ATOM 0 HB2 ALA A 716 -9.086 -6.170 7.868 1.00 0.00 H new ATOM 0 HB3 ALA A 716 -10.509 -5.143 8.164 1.00 0.00 H new ATOM 1099 N ASN A 717 -10.603 -2.486 7.633 1.00 0.00 N ATOM 1100 CA ASN A 717 -11.429 -1.330 7.168 1.00 0.00 C ATOM 1101 C ASN A 717 -10.574 -0.056 7.181 1.00 0.00 C ATOM 1102 O ASN A 717 -10.783 0.841 7.975 1.00 0.00 O ATOM 1103 CB ASN A 717 -12.583 -1.229 8.175 1.00 0.00 C ATOM 1104 CG ASN A 717 -13.872 -0.864 7.444 1.00 0.00 C ATOM 1105 OD1 ASN A 717 -14.918 -1.420 7.716 1.00 0.00 O ATOM 1106 ND2 ASN A 717 -13.836 0.050 6.518 1.00 0.00 N ATOM 0 H ASN A 717 -10.886 -2.896 8.523 1.00 0.00 H new ATOM 0 HA ASN A 717 -11.802 -1.458 6.152 1.00 0.00 H new ATOM 0 HB2 ASN A 717 -12.706 -2.177 8.698 1.00 0.00 H new ATOM 0 HB3 ASN A 717 -12.355 -0.476 8.929 1.00 0.00 H new ATOM 0 HD21 ASN A 717 -14.688 0.302 6.017 1.00 0.00 H new ATOM 0 HD22 ASN A 717 -12.956 0.514 6.293 1.00 0.00 H new ATOM 1113 N VAL A 718 -9.559 -0.008 6.358 1.00 0.00 N ATOM 1114 CA VAL A 718 -8.640 1.181 6.365 1.00 0.00 C ATOM 1115 C VAL A 718 -8.985 2.198 5.258 1.00 0.00 C ATOM 1116 O VAL A 718 -9.023 3.391 5.493 1.00 0.00 O ATOM 1117 CB VAL A 718 -7.243 0.562 6.183 1.00 0.00 C ATOM 1118 CG1 VAL A 718 -6.707 0.811 4.762 1.00 0.00 C ATOM 1119 CG2 VAL A 718 -6.271 1.166 7.217 1.00 0.00 C ATOM 0 H VAL A 718 -9.323 -0.735 5.682 1.00 0.00 H new ATOM 0 HA VAL A 718 -8.719 1.764 7.283 1.00 0.00 H new ATOM 0 HB VAL A 718 -7.323 -0.514 6.335 1.00 0.00 H new ATOM 0 HG11 VAL A 718 -5.719 0.363 4.662 1.00 0.00 H new ATOM 0 HG12 VAL A 718 -7.384 0.363 4.034 1.00 0.00 H new ATOM 0 HG13 VAL A 718 -6.639 1.884 4.582 1.00 0.00 H new ATOM 0 HG21 VAL A 718 -5.282 0.727 7.087 1.00 0.00 H new ATOM 0 HG22 VAL A 718 -6.211 2.245 7.073 1.00 0.00 H new ATOM 0 HG23 VAL A 718 -6.632 0.954 8.223 1.00 0.00 H new ATOM 1129 N PHE A 719 -9.220 1.751 4.054 1.00 0.00 N ATOM 1130 CA PHE A 719 -9.544 2.718 2.963 1.00 0.00 C ATOM 1131 C PHE A 719 -10.897 3.356 3.189 1.00 0.00 C ATOM 1132 O PHE A 719 -11.078 4.526 2.947 1.00 0.00 O ATOM 1133 CB PHE A 719 -9.467 1.935 1.663 1.00 0.00 C ATOM 1134 CG PHE A 719 -8.008 1.831 1.240 1.00 0.00 C ATOM 1135 CD1 PHE A 719 -7.013 2.646 1.839 1.00 0.00 C ATOM 1136 CD2 PHE A 719 -7.643 0.934 0.236 1.00 0.00 C ATOM 1137 CE1 PHE A 719 -5.691 2.561 1.427 1.00 0.00 C ATOM 1138 CE2 PHE A 719 -6.304 0.849 -0.171 1.00 0.00 C ATOM 1139 CZ PHE A 719 -5.336 1.668 0.431 1.00 0.00 C ATOM 0 H PHE A 719 -9.202 0.769 3.779 1.00 0.00 H new ATOM 0 HA PHE A 719 -8.840 3.550 2.936 1.00 0.00 H new ATOM 0 HB2 PHE A 719 -9.894 0.941 1.795 1.00 0.00 H new ATOM 0 HB3 PHE A 719 -10.050 2.432 0.888 1.00 0.00 H new ATOM 0 HD1 PHE A 719 -7.287 3.338 2.622 1.00 0.00 H new ATOM 0 HD2 PHE A 719 -8.390 0.306 -0.227 1.00 0.00 H new ATOM 0 HE1 PHE A 719 -4.941 3.190 1.882 1.00 0.00 H new ATOM 0 HE2 PHE A 719 -6.018 0.154 -0.947 1.00 0.00 H new ATOM 0 HZ PHE A 719 -4.306 1.601 0.114 1.00 0.00 H new ATOM 1149 N TYR A 720 -11.833 2.646 3.719 1.00 0.00 N ATOM 1150 CA TYR A 720 -13.134 3.296 4.005 1.00 0.00 C ATOM 1151 C TYR A 720 -12.844 4.584 4.756 1.00 0.00 C ATOM 1152 O TYR A 720 -13.593 5.543 4.712 1.00 0.00 O ATOM 1153 CB TYR A 720 -13.846 2.289 4.888 1.00 0.00 C ATOM 1154 CG TYR A 720 -15.241 2.747 5.203 1.00 0.00 C ATOM 1155 CD1 TYR A 720 -16.158 2.945 4.172 1.00 0.00 C ATOM 1156 CD2 TYR A 720 -15.625 2.931 6.535 1.00 0.00 C ATOM 1157 CE1 TYR A 720 -17.467 3.332 4.471 1.00 0.00 C ATOM 1158 CE2 TYR A 720 -16.934 3.326 6.834 1.00 0.00 C ATOM 1159 CZ TYR A 720 -17.855 3.521 5.800 1.00 0.00 C ATOM 1160 OH TYR A 720 -19.150 3.890 6.089 1.00 0.00 O ATOM 0 H TYR A 720 -11.763 1.659 3.966 1.00 0.00 H new ATOM 0 HA TYR A 720 -13.729 3.549 3.127 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -13.881 1.321 4.388 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -13.287 2.150 5.813 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -15.858 2.800 3.145 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -14.913 2.769 7.331 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -18.180 3.485 3.674 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -17.232 3.480 7.861 1.00 0.00 H new ATOM 0 HH TYR A 720 -19.256 3.979 7.059 1.00 0.00 H new ATOM 1170 N ALA A 721 -11.726 4.605 5.428 1.00 0.00 N ATOM 1171 CA ALA A 721 -11.315 5.817 6.170 1.00 0.00 C ATOM 1172 C ALA A 721 -10.077 6.466 5.501 1.00 0.00 C ATOM 1173 O ALA A 721 -9.871 7.659 5.620 1.00 0.00 O ATOM 1174 CB ALA A 721 -10.991 5.320 7.581 1.00 0.00 C ATOM 0 H ALA A 721 -11.076 3.822 5.492 1.00 0.00 H new ATOM 0 HA ALA A 721 -12.090 6.584 6.182 1.00 0.00 H new ATOM 0 HB1 ALA A 721 -10.676 6.161 8.199 1.00 0.00 H new ATOM 0 HB2 ALA A 721 -11.878 4.860 8.017 1.00 0.00 H new ATOM 0 HB3 ALA A 721 -10.188 4.585 7.532 1.00 0.00 H new ATOM 1180 N MET A 722 -9.254 5.700 4.794 1.00 0.00 N ATOM 1181 CA MET A 722 -8.039 6.297 4.125 1.00 0.00 C ATOM 1182 C MET A 722 -8.332 6.664 2.678 1.00 0.00 C ATOM 1183 O MET A 722 -7.645 7.465 2.077 1.00 0.00 O ATOM 1184 CB MET A 722 -6.954 5.205 4.144 1.00 0.00 C ATOM 1185 CG MET A 722 -6.056 5.423 5.356 1.00 0.00 C ATOM 1186 SD MET A 722 -6.510 4.300 6.688 1.00 0.00 S ATOM 1187 CE MET A 722 -5.192 4.843 7.794 1.00 0.00 C ATOM 0 H MET A 722 -9.373 4.697 4.655 1.00 0.00 H new ATOM 0 HA MET A 722 -7.732 7.204 4.646 1.00 0.00 H new ATOM 0 HB2 MET A 722 -7.414 4.218 4.188 1.00 0.00 H new ATOM 0 HB3 MET A 722 -6.366 5.242 3.227 1.00 0.00 H new ATOM 0 HG2 MET A 722 -5.014 5.264 5.077 1.00 0.00 H new ATOM 0 HG3 MET A 722 -6.140 6.455 5.698 1.00 0.00 H new ATOM 0 HE1 MET A 722 -4.736 3.975 8.270 1.00 0.00 H new ATOM 0 HE2 MET A 722 -4.437 5.382 7.223 1.00 0.00 H new ATOM 0 HE3 MET A 722 -5.606 5.500 8.559 1.00 0.00 H new ATOM 1197 N ASP A 723 -9.299 6.035 2.095 1.00 0.00 N ATOM 1198 CA ASP A 723 -9.581 6.301 0.662 1.00 0.00 C ATOM 1199 C ASP A 723 -10.580 7.430 0.437 1.00 0.00 C ATOM 1200 O ASP A 723 -11.199 7.496 -0.601 1.00 0.00 O ATOM 1201 CB ASP A 723 -10.116 4.989 0.091 1.00 0.00 C ATOM 1202 CG ASP A 723 -11.517 4.667 0.622 1.00 0.00 C ATOM 1203 OD1 ASP A 723 -12.206 5.583 1.042 1.00 0.00 O ATOM 1204 OD2 ASP A 723 -11.878 3.502 0.602 1.00 0.00 O ATOM 0 H ASP A 723 -9.907 5.349 2.542 1.00 0.00 H new ATOM 0 HA ASP A 723 -8.669 6.633 0.166 1.00 0.00 H new ATOM 0 HB2 ASP A 723 -10.145 5.051 -0.997 1.00 0.00 H new ATOM 0 HB3 ASP A 723 -9.435 4.177 0.346 1.00 0.00 H new ATOM 1209 N GLY A 724 -10.753 8.337 1.352 1.00 0.00 N ATOM 1210 CA GLY A 724 -11.720 9.431 1.058 1.00 0.00 C ATOM 1211 C GLY A 724 -11.328 10.031 -0.304 1.00 0.00 C ATOM 1212 O GLY A 724 -12.106 10.040 -1.239 1.00 0.00 O ATOM 0 H GLY A 724 -10.288 8.373 2.259 1.00 0.00 H new ATOM 0 HA2 GLY A 724 -12.739 9.046 1.030 1.00 0.00 H new ATOM 0 HA3 GLY A 724 -11.688 10.192 1.837 1.00 0.00 H new ATOM 1216 N ALA A 725 -10.127 10.543 -0.422 1.00 0.00 N ATOM 1217 CA ALA A 725 -9.670 11.125 -1.729 1.00 0.00 C ATOM 1218 C ALA A 725 -8.893 10.047 -2.502 1.00 0.00 C ATOM 1219 O ALA A 725 -9.159 8.873 -2.364 1.00 0.00 O ATOM 1220 CB ALA A 725 -8.743 12.285 -1.367 1.00 0.00 C ATOM 0 H ALA A 725 -9.440 10.584 0.331 1.00 0.00 H new ATOM 0 HA ALA A 725 -10.500 11.464 -2.350 1.00 0.00 H new ATOM 0 HB1 ALA A 725 -8.374 12.754 -2.279 1.00 0.00 H new ATOM 0 HB2 ALA A 725 -9.292 13.019 -0.778 1.00 0.00 H new ATOM 0 HB3 ALA A 725 -7.901 11.910 -0.785 1.00 0.00 H new ATOM 1226 N SER A 726 -7.900 10.417 -3.267 1.00 0.00 N ATOM 1227 CA SER A 726 -7.104 9.371 -3.960 1.00 0.00 C ATOM 1228 C SER A 726 -6.188 8.751 -2.905 1.00 0.00 C ATOM 1229 O SER A 726 -5.972 9.337 -1.862 1.00 0.00 O ATOM 1230 CB SER A 726 -6.319 10.116 -5.038 1.00 0.00 C ATOM 1231 OG SER A 726 -5.319 10.914 -4.421 1.00 0.00 O ATOM 0 H SER A 726 -7.612 11.380 -3.438 1.00 0.00 H new ATOM 0 HA SER A 726 -7.690 8.574 -4.417 1.00 0.00 H new ATOM 0 HB2 SER A 726 -5.861 9.406 -5.727 1.00 0.00 H new ATOM 0 HB3 SER A 726 -6.990 10.743 -5.625 1.00 0.00 H new ATOM 0 HG SER A 726 -4.812 11.393 -5.109 1.00 0.00 H new ATOM 1237 N HIS A 727 -5.667 7.582 -3.109 1.00 0.00 N ATOM 1238 CA HIS A 727 -4.808 7.010 -2.038 1.00 0.00 C ATOM 1239 C HIS A 727 -3.382 6.862 -2.539 1.00 0.00 C ATOM 1240 O HIS A 727 -3.090 6.039 -3.375 1.00 0.00 O ATOM 1241 CB HIS A 727 -5.410 5.636 -1.670 1.00 0.00 C ATOM 1242 CG HIS A 727 -6.857 5.576 -2.059 1.00 0.00 C ATOM 1243 ND1 HIS A 727 -7.437 4.440 -2.594 1.00 0.00 N ATOM 1244 CD2 HIS A 727 -7.843 6.519 -2.022 1.00 0.00 C ATOM 1245 CE1 HIS A 727 -8.722 4.729 -2.855 1.00 0.00 C ATOM 1246 NE2 HIS A 727 -9.019 5.987 -2.527 1.00 0.00 N ATOM 0 H HIS A 727 -5.790 7.009 -3.943 1.00 0.00 H new ATOM 0 HA HIS A 727 -4.777 7.659 -1.163 1.00 0.00 H new ATOM 0 HB2 HIS A 727 -4.858 4.843 -2.175 1.00 0.00 H new ATOM 0 HB3 HIS A 727 -5.308 5.463 -0.599 1.00 0.00 H new ATOM 0 HD2 HIS A 727 -7.725 7.528 -1.655 1.00 0.00 H new ATOM 0 HE1 HIS A 727 -9.428 4.029 -3.278 1.00 0.00 H new ATOM 0 HE2 HIS A 727 -9.919 6.457 -2.626 1.00 0.00 H new ATOM 1254 N ASP A 728 -2.488 7.643 -2.021 1.00 0.00 N ATOM 1255 CA ASP A 728 -1.070 7.526 -2.448 1.00 0.00 C ATOM 1256 C ASP A 728 -0.236 7.165 -1.225 1.00 0.00 C ATOM 1257 O ASP A 728 -0.355 7.800 -0.197 1.00 0.00 O ATOM 1258 CB ASP A 728 -0.662 8.918 -2.945 1.00 0.00 C ATOM 1259 CG ASP A 728 -1.471 9.319 -4.187 1.00 0.00 C ATOM 1260 OD1 ASP A 728 -2.109 8.458 -4.767 1.00 0.00 O ATOM 1261 OD2 ASP A 728 -1.437 10.491 -4.535 1.00 0.00 O ATOM 0 H ASP A 728 -2.674 8.359 -1.319 1.00 0.00 H new ATOM 0 HA ASP A 728 -0.928 6.770 -3.220 1.00 0.00 H new ATOM 0 HB2 ASP A 728 -0.818 9.651 -2.153 1.00 0.00 H new ATOM 0 HB3 ASP A 728 0.402 8.926 -3.182 1.00 0.00 H new ATOM 1266 N PHE A 729 0.616 6.189 -1.310 1.00 0.00 N ATOM 1267 CA PHE A 729 1.452 5.859 -0.132 1.00 0.00 C ATOM 1268 C PHE A 729 2.854 5.488 -0.586 1.00 0.00 C ATOM 1269 O PHE A 729 3.092 5.137 -1.725 1.00 0.00 O ATOM 1270 CB PHE A 729 0.867 4.612 0.532 1.00 0.00 C ATOM 1271 CG PHE A 729 -0.630 4.617 0.536 1.00 0.00 C ATOM 1272 CD1 PHE A 729 -1.320 4.406 -0.656 1.00 0.00 C ATOM 1273 CD2 PHE A 729 -1.326 4.777 1.736 1.00 0.00 C ATOM 1274 CE1 PHE A 729 -2.712 4.344 -0.653 1.00 0.00 C ATOM 1275 CE2 PHE A 729 -2.720 4.725 1.742 1.00 0.00 C ATOM 1276 CZ PHE A 729 -3.415 4.511 0.547 1.00 0.00 C ATOM 0 H PHE A 729 0.769 5.610 -2.136 1.00 0.00 H new ATOM 0 HA PHE A 729 1.477 6.715 0.542 1.00 0.00 H new ATOM 0 HB2 PHE A 729 1.223 3.724 0.009 1.00 0.00 H new ATOM 0 HB3 PHE A 729 1.230 4.545 1.558 1.00 0.00 H new ATOM 0 HD1 PHE A 729 -0.776 4.291 -1.582 1.00 0.00 H new ATOM 0 HD2 PHE A 729 -0.786 4.941 2.657 1.00 0.00 H new ATOM 0 HE1 PHE A 729 -3.248 4.168 -1.574 1.00 0.00 H new ATOM 0 HE2 PHE A 729 -3.262 4.850 2.668 1.00 0.00 H new ATOM 0 HZ PHE A 729 -4.494 4.475 0.550 1.00 0.00 H new ATOM 1286 N LEU A 730 3.762 5.492 0.324 1.00 0.00 N ATOM 1287 CA LEU A 730 5.144 5.056 0.005 1.00 0.00 C ATOM 1288 C LEU A 730 5.583 4.101 1.113 1.00 0.00 C ATOM 1289 O LEU A 730 5.358 4.354 2.280 1.00 0.00 O ATOM 1290 CB LEU A 730 5.984 6.324 -0.032 1.00 0.00 C ATOM 1291 CG LEU A 730 6.062 6.940 1.363 1.00 0.00 C ATOM 1292 CD1 LEU A 730 7.377 6.534 2.037 1.00 0.00 C ATOM 1293 CD2 LEU A 730 6.001 8.462 1.235 1.00 0.00 C ATOM 0 H LEU A 730 3.613 5.781 1.291 1.00 0.00 H new ATOM 0 HA LEU A 730 5.239 4.534 -0.947 1.00 0.00 H new ATOM 0 HB2 LEU A 730 6.986 6.096 -0.394 1.00 0.00 H new ATOM 0 HB3 LEU A 730 5.548 7.039 -0.730 1.00 0.00 H new ATOM 0 HG LEU A 730 5.229 6.584 1.969 1.00 0.00 H new ATOM 0 HD11 LEU A 730 7.428 6.976 3.032 1.00 0.00 H new ATOM 0 HD12 LEU A 730 7.423 5.448 2.120 1.00 0.00 H new ATOM 0 HD13 LEU A 730 8.217 6.889 1.439 1.00 0.00 H new ATOM 0 HD21 LEU A 730 6.056 8.913 2.226 1.00 0.00 H new ATOM 0 HD22 LEU A 730 6.839 8.810 0.631 1.00 0.00 H new ATOM 0 HD23 LEU A 730 5.065 8.750 0.757 1.00 0.00 H new ATOM 1305 N LEU A 731 6.143 2.973 0.765 1.00 0.00 N ATOM 1306 CA LEU A 731 6.508 1.987 1.820 1.00 0.00 C ATOM 1307 C LEU A 731 8.012 1.874 2.053 1.00 0.00 C ATOM 1308 O LEU A 731 8.807 1.783 1.135 1.00 0.00 O ATOM 1309 CB LEU A 731 5.954 0.665 1.306 1.00 0.00 C ATOM 1310 CG LEU A 731 4.568 0.875 0.688 1.00 0.00 C ATOM 1311 CD1 LEU A 731 3.929 -0.500 0.441 1.00 0.00 C ATOM 1312 CD2 LEU A 731 3.681 1.711 1.630 1.00 0.00 C ATOM 0 H LEU A 731 6.361 2.695 -0.192 1.00 0.00 H new ATOM 0 HA LEU A 731 6.101 2.290 2.785 1.00 0.00 H new ATOM 0 HB2 LEU A 731 6.631 0.243 0.563 1.00 0.00 H new ATOM 0 HB3 LEU A 731 5.890 -0.053 2.124 1.00 0.00 H new ATOM 0 HG LEU A 731 4.664 1.415 -0.254 1.00 0.00 H new ATOM 0 HD11 LEU A 731 2.941 -0.368 0.001 1.00 0.00 H new ATOM 0 HD12 LEU A 731 4.556 -1.075 -0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 731 3.837 -1.033 1.387 1.00 0.00 H new ATOM 0 HD21 LEU A 731 2.700 1.851 1.177 1.00 0.00 H new ATOM 0 HD22 LEU A 731 3.570 1.191 2.582 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.145 2.683 1.799 1.00 0.00 H new ATOM 1324 N ARG A 732 8.378 1.852 3.306 1.00 0.00 N ATOM 1325 CA ARG A 732 9.810 1.720 3.713 1.00 0.00 C ATOM 1326 C ARG A 732 10.000 0.411 4.499 1.00 0.00 C ATOM 1327 O ARG A 732 9.583 0.299 5.633 1.00 0.00 O ATOM 1328 CB ARG A 732 10.047 2.918 4.636 1.00 0.00 C ATOM 1329 CG ARG A 732 9.744 4.216 3.886 1.00 0.00 C ATOM 1330 CD ARG A 732 9.771 5.400 4.861 1.00 0.00 C ATOM 1331 NE ARG A 732 11.196 5.540 5.264 1.00 0.00 N ATOM 1332 CZ ARG A 732 12.010 6.271 4.559 1.00 0.00 C ATOM 1333 NH1 ARG A 732 11.688 6.632 3.344 1.00 0.00 N ATOM 1334 NH2 ARG A 732 13.155 6.632 5.073 1.00 0.00 N ATOM 0 H ARG A 732 7.726 1.922 4.087 1.00 0.00 H new ATOM 0 HA ARG A 732 10.495 1.700 2.865 1.00 0.00 H new ATOM 0 HB2 ARG A 732 9.412 2.840 5.519 1.00 0.00 H new ATOM 0 HB3 ARG A 732 11.080 2.921 4.985 1.00 0.00 H new ATOM 0 HG2 ARG A 732 10.478 4.369 3.094 1.00 0.00 H new ATOM 0 HG3 ARG A 732 8.767 4.150 3.407 1.00 0.00 H new ATOM 0 HD2 ARG A 732 9.405 6.310 4.386 1.00 0.00 H new ATOM 0 HD3 ARG A 732 9.134 5.213 5.725 1.00 0.00 H new ATOM 0 HE ARG A 732 11.537 5.061 6.097 1.00 0.00 H new ATOM 0 HH11 ARG A 732 10.796 6.341 2.945 1.00 0.00 H new ATOM 0 HH12 ARG A 732 12.329 7.205 2.795 1.00 0.00 H new ATOM 0 HH21 ARG A 732 13.404 6.341 6.018 1.00 0.00 H new ATOM 0 HH22 ARG A 732 13.800 7.205 4.529 1.00 0.00 H new ATOM 1348 N GLN A 733 10.611 -0.585 3.917 1.00 0.00 N ATOM 1349 CA GLN A 733 10.792 -1.871 4.668 1.00 0.00 C ATOM 1350 C GLN A 733 11.773 -1.710 5.810 1.00 0.00 C ATOM 1351 O GLN A 733 12.946 -1.446 5.618 1.00 0.00 O ATOM 1352 CB GLN A 733 11.335 -2.880 3.664 1.00 0.00 C ATOM 1353 CG GLN A 733 10.289 -3.193 2.605 1.00 0.00 C ATOM 1354 CD GLN A 733 10.873 -4.182 1.603 1.00 0.00 C ATOM 1355 OE1 GLN A 733 10.445 -4.227 0.474 1.00 0.00 O ATOM 1356 NE2 GLN A 733 11.837 -4.984 1.965 1.00 0.00 N ATOM 0 H GLN A 733 10.989 -0.571 2.970 1.00 0.00 H new ATOM 0 HA GLN A 733 9.846 -2.194 5.102 1.00 0.00 H new ATOM 0 HB2 GLN A 733 12.233 -2.484 3.191 1.00 0.00 H new ATOM 0 HB3 GLN A 733 11.624 -3.796 4.180 1.00 0.00 H new ATOM 0 HG2 GLN A 733 9.397 -3.612 3.070 1.00 0.00 H new ATOM 0 HG3 GLN A 733 9.984 -2.279 2.096 1.00 0.00 H new ATOM 0 HE21 GLN A 733 12.200 -4.948 2.918 1.00 0.00 H new ATOM 0 HE22 GLN A 733 12.227 -5.647 1.295 1.00 0.00 H new ATOM 1365 N ARG A 734 11.297 -1.920 7.000 1.00 0.00 N ATOM 1366 CA ARG A 734 12.183 -1.838 8.172 1.00 0.00 C ATOM 1367 C ARG A 734 13.105 -3.051 8.120 1.00 0.00 C ATOM 1368 O ARG A 734 14.264 -2.992 8.484 1.00 0.00 O ATOM 1369 CB ARG A 734 11.254 -1.907 9.387 1.00 0.00 C ATOM 1370 CG ARG A 734 12.039 -1.579 10.649 1.00 0.00 C ATOM 1371 CD ARG A 734 11.381 -2.276 11.839 1.00 0.00 C ATOM 1372 NE ARG A 734 10.125 -1.517 12.088 1.00 0.00 N ATOM 1373 CZ ARG A 734 8.970 -2.098 11.972 1.00 0.00 C ATOM 1374 NH1 ARG A 734 8.590 -2.961 12.867 1.00 0.00 N ATOM 1375 NH2 ARG A 734 8.189 -1.804 10.971 1.00 0.00 N ATOM 0 H ARG A 734 10.324 -2.146 7.206 1.00 0.00 H new ATOM 0 HA ARG A 734 12.792 -0.935 8.209 1.00 0.00 H new ATOM 0 HB2 ARG A 734 10.429 -1.205 9.267 1.00 0.00 H new ATOM 0 HB3 ARG A 734 10.817 -2.902 9.467 1.00 0.00 H new ATOM 0 HG2 ARG A 734 13.073 -1.907 10.545 1.00 0.00 H new ATOM 0 HG3 ARG A 734 12.061 -0.501 10.809 1.00 0.00 H new ATOM 0 HD2 ARG A 734 11.172 -3.322 11.616 1.00 0.00 H new ATOM 0 HD3 ARG A 734 12.031 -2.260 12.714 1.00 0.00 H new ATOM 0 HE ARG A 734 10.172 -0.533 12.352 1.00 0.00 H new ATOM 0 HH11 ARG A 734 9.199 -3.179 13.656 1.00 0.00 H new ATOM 0 HH12 ARG A 734 7.683 -3.420 12.780 1.00 0.00 H new ATOM 0 HH21 ARG A 734 8.485 -1.117 10.278 1.00 0.00 H new ATOM 0 HH22 ARG A 734 7.282 -2.261 10.881 1.00 0.00 H new ATOM 1389 N ARG A 735 12.579 -4.158 7.654 1.00 0.00 N ATOM 1390 CA ARG A 735 13.403 -5.397 7.554 1.00 0.00 C ATOM 1391 C ARG A 735 13.162 -6.089 6.210 1.00 0.00 C ATOM 1392 O ARG A 735 13.983 -5.914 5.323 1.00 0.00 O ATOM 1393 CB ARG A 735 12.928 -6.273 8.712 1.00 0.00 C ATOM 1394 CG ARG A 735 13.397 -5.651 10.020 1.00 0.00 C ATOM 1395 CD ARG A 735 12.952 -6.518 11.200 1.00 0.00 C ATOM 1396 NE ARG A 735 11.466 -6.402 11.245 1.00 0.00 N ATOM 1397 CZ ARG A 735 10.876 -6.026 12.350 1.00 0.00 C ATOM 1398 NH1 ARG A 735 11.442 -5.129 13.117 1.00 0.00 N ATOM 1399 NH2 ARG A 735 9.729 -6.563 12.688 1.00 0.00 N ATOM 1400 OXT ARG A 735 12.162 -6.775 6.089 1.00 0.00 O ATOM 0 H ARG A 735 11.614 -4.254 7.339 1.00 0.00 H new ATOM 0 HA ARG A 735 14.472 -5.193 7.609 1.00 0.00 H new ATOM 0 HB2 ARG A 735 11.841 -6.356 8.702 1.00 0.00 H new ATOM 0 HB3 ARG A 735 13.326 -7.283 8.610 1.00 0.00 H new ATOM 0 HG2 ARG A 735 14.483 -5.555 10.018 1.00 0.00 H new ATOM 0 HG3 ARG A 735 12.988 -4.646 10.122 1.00 0.00 H new ATOM 0 HD2 ARG A 735 13.260 -7.554 11.063 1.00 0.00 H new ATOM 0 HD3 ARG A 735 13.401 -6.172 12.131 1.00 0.00 H new ATOM 0 HE ARG A 735 10.911 -6.615 10.416 1.00 0.00 H new ATOM 0 HH11 ARG A 735 12.341 -4.725 12.852 1.00 0.00 H new ATOM 0 HH12 ARG A 735 10.984 -4.834 13.979 1.00 0.00 H new ATOM 0 HH21 ARG A 735 9.301 -7.270 12.090 1.00 0.00 H new ATOM 0 HH22 ARG A 735 9.264 -6.274 13.549 1.00 0.00 H new