USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 709 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 -17:sc= -3.63! USER MOD Set 1.2: A 714 HIS : no HD1:sc= -10.7! C(o=-14!,f=-20!) USER MOD Set 2.1: A 688 ASN : amide:sc= -13.4! C(o=-13!,f=-16!) USER MOD Set 2.2: A 692 SER OG : rot 167:sc= 0.829 USER MOD Single : A 647 SER OG : rot 180:sc= 0 USER MOD Single : A 648 SER OG : rot 180:sc= 0 USER MOD Single : A 650 CYS SG : rot 13:sc= 0.145 USER MOD Single : A 656 GLN :FLIP amide:sc= -0.142 F(o=-1,f=-0.14) USER MOD Single : A 657 MET CE :methyl -167:sc= -4.61! (180deg=-5.68!) USER MOD Single : A 664 SER OG : rot -27:sc= 0.107 USER MOD Single : A 666 TYR OH : rot 180:sc= 0 USER MOD Single : A 667 LYS NZ :NH3+ -126:sc= -3.72! (180deg=-4.05!) USER MOD Single : A 668 SER OG : rot -149:sc= 0.39 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 :FLIP amide:sc= -0.0279 F(o=-0.98,f=-0.028) USER MOD Single : A 676 LYS NZ :NH3+ -177:sc= -3! (180deg=-3.37!) 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+ 144:sc= -0.103 (180deg=-0.836) USER MOD Single : A 689 ASN : amide:sc= -5.62! C(o=-5.6!,f=-13!) USER MOD Single : A 696 SER OG : rot 170:sc= 0.126 USER MOD Single : A 702 GLN : amide:sc= -10.2! C(o=-10!,f=-17!) USER MOD Single : A 715 SER OG : rot 180:sc= 0 USER MOD Single : A 717 ASN : amide:sc= -2.45 K(o=-2.5,f=-3.9!) USER MOD Single : A 720 TYR OH : rot 180:sc= 0 USER MOD Single : A 722 MET CE :methyl -156:sc= -0.452 (180deg=-1.14) USER MOD Single : A 726 SER OG : rot 130:sc= 0.33 USER MOD Single : A 727 HIS : no HE2:sc= -18.9! C(o=-19!,f=-22!) USER MOD Single : A 733 GLN : amide:sc= -9.39! C(o=-9.4!,f=-12!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 646 -23.426 8.598 -8.494 1.00 0.00 N ATOM 2 CA GLY A 646 -23.731 7.481 -9.435 1.00 0.00 C ATOM 3 C GLY A 646 -24.130 6.231 -8.645 1.00 0.00 C ATOM 4 O GLY A 646 -24.003 6.180 -7.437 1.00 0.00 O ATOM 0 HA2 GLY A 646 -24.538 7.770 -10.108 1.00 0.00 H new ATOM 0 HA3 GLY A 646 -22.860 7.268 -10.055 1.00 0.00 H new ATOM 10 N SER A 647 -24.613 5.220 -9.319 1.00 0.00 N ATOM 11 CA SER A 647 -25.022 3.969 -8.611 1.00 0.00 C ATOM 12 C SER A 647 -23.814 3.306 -7.935 1.00 0.00 C ATOM 13 O SER A 647 -23.940 2.697 -6.890 1.00 0.00 O ATOM 14 CB SER A 647 -25.600 3.068 -9.703 1.00 0.00 C ATOM 15 OG SER A 647 -24.577 2.742 -10.632 1.00 0.00 O ATOM 0 H SER A 647 -24.742 5.206 -10.331 1.00 0.00 H new ATOM 0 HA SER A 647 -25.745 4.164 -7.819 1.00 0.00 H new ATOM 0 HB2 SER A 647 -26.010 2.159 -9.262 1.00 0.00 H new ATOM 0 HB3 SER A 647 -26.421 3.574 -10.211 1.00 0.00 H new ATOM 0 HG SER A 647 -24.944 2.163 -11.333 1.00 0.00 H new ATOM 21 N SER A 648 -22.645 3.424 -8.508 1.00 0.00 N ATOM 22 CA SER A 648 -21.441 2.805 -7.874 1.00 0.00 C ATOM 23 C SER A 648 -20.276 3.794 -7.880 1.00 0.00 C ATOM 24 O SER A 648 -20.170 4.638 -8.746 1.00 0.00 O ATOM 25 CB SER A 648 -21.096 1.593 -8.736 1.00 0.00 C ATOM 26 OG SER A 648 -20.731 2.036 -10.037 1.00 0.00 O ATOM 0 H SER A 648 -22.471 3.919 -9.383 1.00 0.00 H new ATOM 0 HA SER A 648 -21.632 2.526 -6.838 1.00 0.00 H new ATOM 0 HB2 SER A 648 -20.277 1.033 -8.286 1.00 0.00 H new ATOM 0 HB3 SER A 648 -21.950 0.918 -8.794 1.00 0.00 H new ATOM 0 HG SER A 648 -20.507 1.262 -10.595 1.00 0.00 H new ATOM 32 N ASP A 649 -19.400 3.695 -6.920 1.00 0.00 N ATOM 33 CA ASP A 649 -18.242 4.629 -6.871 1.00 0.00 C ATOM 34 C ASP A 649 -16.952 3.875 -6.528 1.00 0.00 C ATOM 35 O ASP A 649 -16.967 2.912 -5.789 1.00 0.00 O ATOM 36 CB ASP A 649 -18.610 5.628 -5.774 1.00 0.00 C ATOM 37 CG ASP A 649 -19.735 6.537 -6.278 1.00 0.00 C ATOM 38 OD1 ASP A 649 -19.820 6.730 -7.481 1.00 0.00 O ATOM 39 OD2 ASP A 649 -20.486 7.031 -5.455 1.00 0.00 O ATOM 0 H ASP A 649 -19.436 3.008 -6.167 1.00 0.00 H new ATOM 0 HA ASP A 649 -18.056 5.119 -7.827 1.00 0.00 H new ATOM 0 HB2 ASP A 649 -18.928 5.099 -4.876 1.00 0.00 H new ATOM 0 HB3 ASP A 649 -17.739 6.224 -5.501 1.00 0.00 H new ATOM 44 N CYS A 650 -15.831 4.304 -7.056 1.00 0.00 N ATOM 45 CA CYS A 650 -14.551 3.599 -6.747 1.00 0.00 C ATOM 46 C CYS A 650 -13.418 4.589 -6.502 1.00 0.00 C ATOM 47 O CYS A 650 -13.466 5.733 -6.906 1.00 0.00 O ATOM 48 CB CYS A 650 -14.216 2.781 -7.992 1.00 0.00 C ATOM 49 SG CYS A 650 -13.940 3.905 -9.382 1.00 0.00 S ATOM 0 H CYS A 650 -15.748 5.105 -7.682 1.00 0.00 H new ATOM 0 HA CYS A 650 -14.661 2.989 -5.850 1.00 0.00 H new ATOM 0 HB2 CYS A 650 -13.327 2.175 -7.816 1.00 0.00 H new ATOM 0 HB3 CYS A 650 -15.030 2.093 -8.220 1.00 0.00 H new ATOM 0 HG CYS A 650 -13.831 5.123 -8.940 1.00 0.00 H new ATOM 55 N ARG A 651 -12.384 4.131 -5.862 1.00 0.00 N ATOM 56 CA ARG A 651 -11.207 4.997 -5.594 1.00 0.00 C ATOM 57 C ARG A 651 -9.958 4.197 -5.985 1.00 0.00 C ATOM 58 O ARG A 651 -10.004 2.985 -6.050 1.00 0.00 O ATOM 59 CB ARG A 651 -11.260 5.245 -4.088 1.00 0.00 C ATOM 60 CG ARG A 651 -12.619 5.844 -3.712 1.00 0.00 C ATOM 61 CD ARG A 651 -12.564 6.345 -2.265 1.00 0.00 C ATOM 62 NE ARG A 651 -13.981 6.392 -1.794 1.00 0.00 N ATOM 63 CZ ARG A 651 -14.440 5.448 -1.009 1.00 0.00 C ATOM 64 NH1 ARG A 651 -13.907 4.259 -1.041 1.00 0.00 N ATOM 65 NH2 ARG A 651 -15.435 5.690 -0.193 1.00 0.00 N ATOM 0 H ARG A 651 -12.303 3.178 -5.507 1.00 0.00 H new ATOM 0 HA ARG A 651 -11.194 5.938 -6.144 1.00 0.00 H new ATOM 0 HB2 ARG A 651 -11.102 4.310 -3.550 1.00 0.00 H new ATOM 0 HB3 ARG A 651 -10.459 5.922 -3.793 1.00 0.00 H new ATOM 0 HG2 ARG A 651 -12.867 6.665 -4.385 1.00 0.00 H new ATOM 0 HG3 ARG A 651 -13.403 5.095 -3.821 1.00 0.00 H new ATOM 0 HD2 ARG A 651 -11.968 5.678 -1.643 1.00 0.00 H new ATOM 0 HD3 ARG A 651 -12.101 7.330 -2.210 1.00 0.00 H new ATOM 0 HE ARG A 651 -14.590 7.157 -2.083 1.00 0.00 H new ATOM 0 HH11 ARG A 651 -13.133 4.064 -1.677 1.00 0.00 H new ATOM 0 HH12 ARG A 651 -14.263 3.524 -0.431 1.00 0.00 H new ATOM 0 HH21 ARG A 651 -15.858 6.618 -0.165 1.00 0.00 H new ATOM 0 HH22 ARG A 651 -15.787 4.951 0.415 1.00 0.00 H new ATOM 79 N ILE A 652 -8.845 4.822 -6.253 1.00 0.00 N ATOM 80 CA ILE A 652 -7.658 4.001 -6.633 1.00 0.00 C ATOM 81 C ILE A 652 -6.533 4.186 -5.617 1.00 0.00 C ATOM 82 O ILE A 652 -6.380 5.233 -5.019 1.00 0.00 O ATOM 83 CB ILE A 652 -7.248 4.476 -8.028 1.00 0.00 C ATOM 84 CG1 ILE A 652 -6.702 5.906 -7.967 1.00 0.00 C ATOM 85 CG2 ILE A 652 -8.479 4.435 -8.943 1.00 0.00 C ATOM 86 CD1 ILE A 652 -6.085 6.266 -9.322 1.00 0.00 C ATOM 0 H ILE A 652 -8.705 5.832 -6.228 1.00 0.00 H new ATOM 0 HA ILE A 652 -7.885 2.935 -6.642 1.00 0.00 H new ATOM 0 HB ILE A 652 -6.467 3.823 -8.417 1.00 0.00 H new ATOM 0 HG12 ILE A 652 -7.502 6.604 -7.721 1.00 0.00 H new ATOM 0 HG13 ILE A 652 -5.953 5.989 -7.179 1.00 0.00 H new ATOM 0 HG21 ILE A 652 -8.201 4.771 -9.942 1.00 0.00 H new ATOM 0 HG22 ILE A 652 -8.859 3.415 -8.996 1.00 0.00 H new ATOM 0 HG23 ILE A 652 -9.253 5.090 -8.542 1.00 0.00 H new ATOM 0 HD11 ILE A 652 -5.694 7.283 -9.285 1.00 0.00 H new ATOM 0 HD12 ILE A 652 -5.274 5.574 -9.548 1.00 0.00 H new ATOM 0 HD13 ILE A 652 -6.847 6.198 -10.098 1.00 0.00 H new ATOM 98 N ILE A 653 -5.761 3.159 -5.406 1.00 0.00 N ATOM 99 CA ILE A 653 -4.650 3.234 -4.407 1.00 0.00 C ATOM 100 C ILE A 653 -3.290 3.079 -5.112 1.00 0.00 C ATOM 101 O ILE A 653 -3.120 2.243 -5.977 1.00 0.00 O ATOM 102 CB ILE A 653 -4.915 2.075 -3.394 1.00 0.00 C ATOM 103 CG1 ILE A 653 -3.629 1.273 -3.153 1.00 0.00 C ATOM 104 CG2 ILE A 653 -5.991 1.123 -3.933 1.00 0.00 C ATOM 105 CD1 ILE A 653 -3.892 0.107 -2.195 1.00 0.00 C ATOM 0 H ILE A 653 -5.849 2.262 -5.884 1.00 0.00 H new ATOM 0 HA ILE A 653 -4.619 4.195 -3.893 1.00 0.00 H new ATOM 0 HB ILE A 653 -5.255 2.520 -2.459 1.00 0.00 H new ATOM 0 HG12 ILE A 653 -3.248 0.893 -4.101 1.00 0.00 H new ATOM 0 HG13 ILE A 653 -2.860 1.925 -2.739 1.00 0.00 H new ATOM 0 HG21 ILE A 653 -6.162 0.322 -3.214 1.00 0.00 H new ATOM 0 HG22 ILE A 653 -6.918 1.674 -4.090 1.00 0.00 H new ATOM 0 HG23 ILE A 653 -5.658 0.696 -4.879 1.00 0.00 H new ATOM 0 HD11 ILE A 653 -2.968 -0.449 -2.037 1.00 0.00 H new ATOM 0 HD12 ILE A 653 -4.251 0.494 -1.241 1.00 0.00 H new ATOM 0 HD13 ILE A 653 -4.645 -0.554 -2.625 1.00 0.00 H new ATOM 117 N ARG A 654 -2.319 3.872 -4.734 1.00 0.00 N ATOM 118 CA ARG A 654 -0.965 3.768 -5.360 1.00 0.00 C ATOM 119 C ARG A 654 0.100 3.724 -4.255 1.00 0.00 C ATOM 120 O ARG A 654 0.079 4.517 -3.339 1.00 0.00 O ATOM 121 CB ARG A 654 -0.797 5.047 -6.176 1.00 0.00 C ATOM 122 CG ARG A 654 -1.976 5.225 -7.127 1.00 0.00 C ATOM 123 CD ARG A 654 -1.740 6.479 -7.981 1.00 0.00 C ATOM 124 NE ARG A 654 -2.374 6.189 -9.295 1.00 0.00 N ATOM 125 CZ ARG A 654 -2.097 5.079 -9.914 1.00 0.00 C ATOM 126 NH1 ARG A 654 -0.887 4.587 -9.856 1.00 0.00 N ATOM 127 NH2 ARG A 654 -3.028 4.448 -10.570 1.00 0.00 N ATOM 0 H ARG A 654 -2.406 4.590 -4.015 1.00 0.00 H new ATOM 0 HA ARG A 654 -0.861 2.874 -5.974 1.00 0.00 H new ATOM 0 HB2 ARG A 654 -0.726 5.906 -5.509 1.00 0.00 H new ATOM 0 HB3 ARG A 654 0.133 5.006 -6.742 1.00 0.00 H new ATOM 0 HG2 ARG A 654 -2.081 4.348 -7.766 1.00 0.00 H new ATOM 0 HG3 ARG A 654 -2.904 5.322 -6.563 1.00 0.00 H new ATOM 0 HD2 ARG A 654 -2.184 7.360 -7.517 1.00 0.00 H new ATOM 0 HD3 ARG A 654 -0.675 6.682 -8.095 1.00 0.00 H new ATOM 0 HE ARG A 654 -3.023 6.858 -9.709 1.00 0.00 H new ATOM 0 HH11 ARG A 654 -0.164 5.073 -9.326 1.00 0.00 H new ATOM 0 HH12 ARG A 654 -0.667 3.717 -10.340 1.00 0.00 H new ATOM 0 HH21 ARG A 654 -3.976 4.824 -10.599 1.00 0.00 H new ATOM 0 HH22 ARG A 654 -2.810 3.578 -11.055 1.00 0.00 H new ATOM 141 N VAL A 655 1.039 2.823 -4.316 1.00 0.00 N ATOM 142 CA VAL A 655 2.076 2.789 -3.239 1.00 0.00 C ATOM 143 C VAL A 655 3.447 2.473 -3.829 1.00 0.00 C ATOM 144 O VAL A 655 3.560 1.815 -4.842 1.00 0.00 O ATOM 145 CB VAL A 655 1.648 1.666 -2.294 1.00 0.00 C ATOM 146 CG1 VAL A 655 2.332 1.828 -0.940 1.00 0.00 C ATOM 147 CG2 VAL A 655 0.140 1.698 -2.090 1.00 0.00 C ATOM 0 H VAL A 655 1.137 2.120 -5.048 1.00 0.00 H new ATOM 0 HA VAL A 655 2.154 3.749 -2.728 1.00 0.00 H new ATOM 0 HB VAL A 655 1.938 0.714 -2.740 1.00 0.00 H new ATOM 0 HG11 VAL A 655 2.019 1.022 -0.276 1.00 0.00 H new ATOM 0 HG12 VAL A 655 3.413 1.791 -1.072 1.00 0.00 H new ATOM 0 HG13 VAL A 655 2.053 2.787 -0.504 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -0.153 0.894 -1.415 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -0.149 2.657 -1.659 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -0.360 1.567 -3.050 1.00 0.00 H new ATOM 157 N GLN A 656 4.493 2.930 -3.202 1.00 0.00 N ATOM 158 CA GLN A 656 5.848 2.639 -3.738 1.00 0.00 C ATOM 159 C GLN A 656 6.688 1.908 -2.692 1.00 0.00 C ATOM 160 O GLN A 656 6.716 2.269 -1.533 1.00 0.00 O ATOM 161 CB GLN A 656 6.434 4.009 -4.066 1.00 0.00 C ATOM 162 CG GLN A 656 5.547 4.664 -5.126 1.00 0.00 C ATOM 163 CD GLN A 656 5.045 6.019 -4.624 1.00 0.00 C ATOM 164 OE1 GLN A 656 4.692 6.146 -3.374 1.00 0.00 O flip ATOM 165 NE2 GLN A 656 4.965 6.968 -5.380 1.00 0.00 N flip ATOM 0 H GLN A 656 4.469 3.488 -2.348 1.00 0.00 H new ATOM 0 HA GLN A 656 5.825 1.990 -4.614 1.00 0.00 H new ATOM 0 HB2 GLN A 656 6.477 4.629 -3.170 1.00 0.00 H new ATOM 0 HB3 GLN A 656 7.455 3.908 -4.434 1.00 0.00 H new ATOM 0 HG2 GLN A 656 6.108 4.795 -6.051 1.00 0.00 H new ATOM 0 HG3 GLN A 656 4.701 4.016 -5.355 1.00 0.00 H new ATOM 0 HE21 GLN A 656 5.241 6.867 -6.357 1.00 0.00 H new ATOM 0 HE22 GLN A 656 4.622 7.865 -5.038 1.00 0.00 H new ATOM 174 N MET A 657 7.379 0.888 -3.103 1.00 0.00 N ATOM 175 CA MET A 657 8.236 0.134 -2.153 1.00 0.00 C ATOM 176 C MET A 657 9.673 0.198 -2.661 1.00 0.00 C ATOM 177 O MET A 657 10.023 -0.430 -3.636 1.00 0.00 O ATOM 178 CB MET A 657 7.665 -1.289 -2.149 1.00 0.00 C ATOM 179 CG MET A 657 8.459 -2.149 -1.170 1.00 0.00 C ATOM 180 SD MET A 657 8.068 -1.640 0.522 1.00 0.00 S ATOM 181 CE MET A 657 9.464 -0.508 0.745 1.00 0.00 C ATOM 0 H MET A 657 7.388 0.541 -4.062 1.00 0.00 H new ATOM 0 HA MET A 657 8.244 0.530 -1.138 1.00 0.00 H new ATOM 0 HB2 MET A 657 6.613 -1.270 -1.864 1.00 0.00 H new ATOM 0 HB3 MET A 657 7.716 -1.716 -3.150 1.00 0.00 H new ATOM 0 HG2 MET A 657 8.215 -3.202 -1.311 1.00 0.00 H new ATOM 0 HG3 MET A 657 9.527 -2.042 -1.357 1.00 0.00 H new ATOM 0 HE1 MET A 657 9.558 -0.249 1.800 1.00 0.00 H new ATOM 0 HE2 MET A 657 10.381 -0.990 0.407 1.00 0.00 H new ATOM 0 HE3 MET A 657 9.294 0.398 0.163 1.00 0.00 H new ATOM 191 N GLU A 658 10.488 1.005 -2.030 1.00 0.00 N ATOM 192 CA GLU A 658 11.894 1.187 -2.504 1.00 0.00 C ATOM 193 C GLU A 658 12.854 0.156 -1.933 1.00 0.00 C ATOM 194 O GLU A 658 14.025 0.430 -1.749 1.00 0.00 O ATOM 195 CB GLU A 658 12.282 2.580 -2.014 1.00 0.00 C ATOM 196 CG GLU A 658 13.568 3.004 -2.717 1.00 0.00 C ATOM 197 CD GLU A 658 13.852 4.481 -2.446 1.00 0.00 C ATOM 198 OE1 GLU A 658 13.033 5.116 -1.803 1.00 0.00 O ATOM 199 OE2 GLU A 658 14.886 4.952 -2.890 1.00 0.00 O ATOM 0 H GLU A 658 10.239 1.548 -1.203 1.00 0.00 H new ATOM 0 HA GLU A 658 11.953 1.067 -3.586 1.00 0.00 H new ATOM 0 HB2 GLU A 658 11.483 3.291 -2.225 1.00 0.00 H new ATOM 0 HB3 GLU A 658 12.426 2.574 -0.934 1.00 0.00 H new ATOM 0 HG2 GLU A 658 14.401 2.395 -2.366 1.00 0.00 H new ATOM 0 HG3 GLU A 658 13.478 2.834 -3.790 1.00 0.00 H new ATOM 206 N LEU A 659 12.395 -1.006 -1.613 1.00 0.00 N ATOM 207 CA LEU A 659 13.330 -1.990 -1.016 1.00 0.00 C ATOM 208 C LEU A 659 12.948 -3.413 -1.385 1.00 0.00 C ATOM 209 O LEU A 659 11.815 -3.707 -1.713 1.00 0.00 O ATOM 210 CB LEU A 659 13.155 -1.783 0.477 1.00 0.00 C ATOM 211 CG LEU A 659 14.447 -2.132 1.244 1.00 0.00 C ATOM 212 CD1 LEU A 659 14.732 -3.635 1.187 1.00 0.00 C ATOM 213 CD2 LEU A 659 15.633 -1.376 0.636 1.00 0.00 C ATOM 0 H LEU A 659 11.432 -1.319 -1.733 1.00 0.00 H new ATOM 0 HA LEU A 659 14.354 -1.850 -1.363 1.00 0.00 H new ATOM 0 HB2 LEU A 659 12.881 -0.746 0.673 1.00 0.00 H new ATOM 0 HB3 LEU A 659 12.335 -2.403 0.839 1.00 0.00 H new ATOM 0 HG LEU A 659 14.310 -1.839 2.285 1.00 0.00 H new ATOM 0 HD11 LEU A 659 15.648 -3.853 1.736 1.00 0.00 H new ATOM 0 HD12 LEU A 659 13.902 -4.180 1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 659 14.849 -3.944 0.148 1.00 0.00 H new ATOM 0 HD21 LEU A 659 16.543 -1.627 1.182 1.00 0.00 H new ATOM 0 HD22 LEU A 659 15.748 -1.660 -0.410 1.00 0.00 H new ATOM 0 HD23 LEU A 659 15.453 -0.303 0.703 1.00 0.00 H new ATOM 225 N GLY A 660 13.885 -4.300 -1.321 1.00 0.00 N ATOM 226 CA GLY A 660 13.592 -5.705 -1.643 1.00 0.00 C ATOM 227 C GLY A 660 14.826 -6.329 -2.256 1.00 0.00 C ATOM 228 O GLY A 660 15.791 -5.655 -2.552 1.00 0.00 O ATOM 0 H GLY A 660 14.851 -4.108 -1.056 1.00 0.00 H new ATOM 0 HA2 GLY A 660 13.302 -6.247 -0.743 1.00 0.00 H new ATOM 0 HA3 GLY A 660 12.753 -5.767 -2.336 1.00 0.00 H new ATOM 232 N GLU A 661 14.792 -7.600 -2.493 1.00 0.00 N ATOM 233 CA GLU A 661 15.952 -8.238 -3.141 1.00 0.00 C ATOM 234 C GLU A 661 16.157 -7.501 -4.453 1.00 0.00 C ATOM 235 O GLU A 661 17.257 -7.180 -4.849 1.00 0.00 O ATOM 236 CB GLU A 661 15.541 -9.691 -3.360 1.00 0.00 C ATOM 237 CG GLU A 661 15.471 -10.401 -2.008 1.00 0.00 C ATOM 238 CD GLU A 661 15.089 -11.865 -2.226 1.00 0.00 C ATOM 239 OE1 GLU A 661 14.907 -12.243 -3.372 1.00 0.00 O ATOM 240 OE2 GLU A 661 14.978 -12.581 -1.246 1.00 0.00 O ATOM 0 H GLU A 661 14.015 -8.221 -2.267 1.00 0.00 H new ATOM 0 HA GLU A 661 16.879 -8.204 -2.569 1.00 0.00 H new ATOM 0 HB2 GLU A 661 14.573 -9.737 -3.859 1.00 0.00 H new ATOM 0 HB3 GLU A 661 16.259 -10.191 -4.010 1.00 0.00 H new ATOM 0 HG2 GLU A 661 16.433 -10.336 -1.500 1.00 0.00 H new ATOM 0 HG3 GLU A 661 14.738 -9.913 -1.366 1.00 0.00 H new ATOM 247 N ASP A 662 15.072 -7.186 -5.098 1.00 0.00 N ATOM 248 CA ASP A 662 15.138 -6.408 -6.356 1.00 0.00 C ATOM 249 C ASP A 662 14.595 -5.001 -6.077 1.00 0.00 C ATOM 250 O ASP A 662 14.821 -4.070 -6.824 1.00 0.00 O ATOM 251 CB ASP A 662 14.249 -7.161 -7.349 1.00 0.00 C ATOM 252 CG ASP A 662 14.923 -8.475 -7.757 1.00 0.00 C ATOM 253 OD1 ASP A 662 16.140 -8.540 -7.695 1.00 0.00 O ATOM 254 OD2 ASP A 662 14.210 -9.391 -8.134 1.00 0.00 O ATOM 0 H ASP A 662 14.130 -7.440 -4.800 1.00 0.00 H new ATOM 0 HA ASP A 662 16.149 -6.305 -6.751 1.00 0.00 H new ATOM 0 HB2 ASP A 662 13.277 -7.365 -6.899 1.00 0.00 H new ATOM 0 HB3 ASP A 662 14.070 -6.545 -8.230 1.00 0.00 H new ATOM 259 N GLY A 663 13.883 -4.846 -4.981 1.00 0.00 N ATOM 260 CA GLY A 663 13.320 -3.516 -4.610 1.00 0.00 C ATOM 261 C GLY A 663 12.439 -2.979 -5.741 1.00 0.00 C ATOM 262 O GLY A 663 12.604 -3.327 -6.894 1.00 0.00 O ATOM 0 H GLY A 663 13.669 -5.597 -4.325 1.00 0.00 H new ATOM 0 HA2 GLY A 663 12.735 -3.603 -3.694 1.00 0.00 H new ATOM 0 HA3 GLY A 663 14.129 -2.815 -4.406 1.00 0.00 H new ATOM 266 N SER A 664 11.517 -2.111 -5.419 1.00 0.00 N ATOM 267 CA SER A 664 10.636 -1.522 -6.473 1.00 0.00 C ATOM 268 C SER A 664 10.462 -0.038 -6.210 1.00 0.00 C ATOM 269 O SER A 664 11.099 0.528 -5.350 1.00 0.00 O ATOM 270 CB SER A 664 9.283 -2.233 -6.389 1.00 0.00 C ATOM 271 OG SER A 664 8.637 -1.887 -5.173 1.00 0.00 O ATOM 0 H SER A 664 11.335 -1.783 -4.470 1.00 0.00 H new ATOM 0 HA SER A 664 11.071 -1.649 -7.465 1.00 0.00 H new ATOM 0 HB2 SER A 664 8.659 -1.950 -7.237 1.00 0.00 H new ATOM 0 HB3 SER A 664 9.424 -3.312 -6.443 1.00 0.00 H new ATOM 0 HG SER A 664 9.310 -1.660 -4.498 1.00 0.00 H new ATOM 277 N VAL A 665 9.627 0.607 -6.958 1.00 0.00 N ATOM 278 CA VAL A 665 9.448 2.058 -6.744 1.00 0.00 C ATOM 279 C VAL A 665 7.992 2.473 -6.968 1.00 0.00 C ATOM 280 O VAL A 665 7.674 3.645 -6.960 1.00 0.00 O ATOM 281 CB VAL A 665 10.370 2.713 -7.781 1.00 0.00 C ATOM 282 CG1 VAL A 665 11.830 2.416 -7.433 1.00 0.00 C ATOM 283 CG2 VAL A 665 10.078 2.145 -9.175 1.00 0.00 C ATOM 0 H VAL A 665 9.064 0.197 -7.703 1.00 0.00 H new ATOM 0 HA VAL A 665 9.690 2.357 -5.724 1.00 0.00 H new ATOM 0 HB VAL A 665 10.193 3.789 -7.775 1.00 0.00 H new ATOM 0 HG11 VAL A 665 12.482 2.883 -8.171 1.00 0.00 H new ATOM 0 HG12 VAL A 665 12.057 2.815 -6.445 1.00 0.00 H new ATOM 0 HG13 VAL A 665 11.992 1.338 -7.435 1.00 0.00 H new ATOM 0 HG21 VAL A 665 10.737 2.615 -9.905 1.00 0.00 H new ATOM 0 HG22 VAL A 665 10.249 1.069 -9.172 1.00 0.00 H new ATOM 0 HG23 VAL A 665 9.040 2.347 -9.440 1.00 0.00 H new ATOM 293 N TYR A 666 7.096 1.546 -7.179 1.00 0.00 N ATOM 294 CA TYR A 666 5.687 1.968 -7.407 1.00 0.00 C ATOM 295 C TYR A 666 4.705 0.804 -7.240 1.00 0.00 C ATOM 296 O TYR A 666 5.081 -0.343 -7.111 1.00 0.00 O ATOM 297 CB TYR A 666 5.669 2.454 -8.852 1.00 0.00 C ATOM 298 CG TYR A 666 5.784 1.253 -9.753 1.00 0.00 C ATOM 299 CD1 TYR A 666 7.022 0.632 -9.958 1.00 0.00 C ATOM 300 CD2 TYR A 666 4.635 0.742 -10.355 1.00 0.00 C ATOM 301 CE1 TYR A 666 7.099 -0.504 -10.772 1.00 0.00 C ATOM 302 CE2 TYR A 666 4.711 -0.385 -11.170 1.00 0.00 C ATOM 303 CZ TYR A 666 5.944 -1.012 -11.379 1.00 0.00 C ATOM 304 OH TYR A 666 6.022 -2.136 -12.177 1.00 0.00 O ATOM 0 H TYR A 666 7.272 0.542 -7.203 1.00 0.00 H new ATOM 0 HA TYR A 666 5.379 2.727 -6.688 1.00 0.00 H new ATOM 0 HB2 TYR A 666 4.747 2.998 -9.059 1.00 0.00 H new ATOM 0 HB3 TYR A 666 6.493 3.144 -9.031 1.00 0.00 H new ATOM 0 HD1 TYR A 666 7.912 1.027 -9.491 1.00 0.00 H new ATOM 0 HD2 TYR A 666 3.682 1.222 -10.189 1.00 0.00 H new ATOM 0 HE1 TYR A 666 8.050 -0.989 -10.932 1.00 0.00 H new ATOM 0 HE2 TYR A 666 3.820 -0.774 -11.640 1.00 0.00 H new ATOM 0 HH TYR A 666 5.131 -2.356 -12.520 1.00 0.00 H new ATOM 314 N LYS A 667 3.442 1.114 -7.277 1.00 0.00 N ATOM 315 CA LYS A 667 2.393 0.070 -7.165 1.00 0.00 C ATOM 316 C LYS A 667 1.045 0.723 -7.480 1.00 0.00 C ATOM 317 O LYS A 667 0.625 1.643 -6.811 1.00 0.00 O ATOM 318 CB LYS A 667 2.454 -0.419 -5.721 1.00 0.00 C ATOM 319 CG LYS A 667 1.834 -1.812 -5.643 1.00 0.00 C ATOM 320 CD LYS A 667 0.314 -1.676 -5.658 1.00 0.00 C ATOM 321 CE LYS A 667 -0.149 -0.995 -4.373 1.00 0.00 C ATOM 322 NZ LYS A 667 -1.196 -0.045 -4.829 1.00 0.00 N ATOM 0 H LYS A 667 3.087 2.065 -7.382 1.00 0.00 H new ATOM 0 HA LYS A 667 2.531 -0.765 -7.851 1.00 0.00 H new ATOM 0 HB2 LYS A 667 3.488 -0.447 -5.376 1.00 0.00 H new ATOM 0 HB3 LYS A 667 1.918 0.269 -5.067 1.00 0.00 H new ATOM 0 HG2 LYS A 667 2.167 -2.421 -6.484 1.00 0.00 H new ATOM 0 HG3 LYS A 667 2.158 -2.319 -4.734 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -0.001 -1.094 -6.524 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -0.149 -2.659 -5.748 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -0.548 -1.717 -3.660 1.00 0.00 H new ATOM 0 HE3 LYS A 667 0.672 -0.477 -3.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -0.968 0.912 -4.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -1.235 -0.044 -5.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 -2.119 -0.336 -4.448 1.00 0.00 H new ATOM 336 N SER A 668 0.377 0.283 -8.505 1.00 0.00 N ATOM 337 CA SER A 668 -0.919 0.924 -8.860 1.00 0.00 C ATOM 338 C SER A 668 -2.081 -0.072 -8.782 1.00 0.00 C ATOM 339 O SER A 668 -2.047 -1.142 -9.359 1.00 0.00 O ATOM 340 CB SER A 668 -0.710 1.419 -10.286 1.00 0.00 C ATOM 341 OG SER A 668 -1.860 2.146 -10.696 1.00 0.00 O ATOM 0 H SER A 668 0.667 -0.486 -9.109 1.00 0.00 H new ATOM 0 HA SER A 668 -1.184 1.727 -8.173 1.00 0.00 H new ATOM 0 HB2 SER A 668 0.175 2.053 -10.339 1.00 0.00 H new ATOM 0 HB3 SER A 668 -0.539 0.576 -10.956 1.00 0.00 H new ATOM 0 HG SER A 668 -1.982 2.047 -11.663 1.00 0.00 H new ATOM 347 N ILE A 669 -3.106 0.287 -8.056 1.00 0.00 N ATOM 348 CA ILE A 669 -4.288 -0.611 -7.904 1.00 0.00 C ATOM 349 C ILE A 669 -5.587 0.184 -7.868 1.00 0.00 C ATOM 350 O ILE A 669 -5.629 1.307 -7.406 1.00 0.00 O ATOM 351 CB ILE A 669 -4.055 -1.307 -6.572 1.00 0.00 C ATOM 352 CG1 ILE A 669 -2.919 -2.303 -6.752 1.00 0.00 C ATOM 353 CG2 ILE A 669 -5.326 -2.017 -6.100 1.00 0.00 C ATOM 354 CD1 ILE A 669 -2.748 -3.131 -5.481 1.00 0.00 C ATOM 0 H ILE A 669 -3.175 1.174 -7.556 1.00 0.00 H new ATOM 0 HA ILE A 669 -4.385 -1.307 -8.737 1.00 0.00 H new ATOM 0 HB ILE A 669 -3.792 -0.573 -5.810 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -3.129 -2.958 -7.598 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -1.993 -1.775 -6.980 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -5.136 -2.508 -5.146 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -6.127 -1.288 -5.980 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -5.622 -2.762 -6.838 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -1.933 -3.842 -5.617 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -2.518 -2.471 -4.645 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -3.671 -3.672 -5.273 1.00 0.00 H new ATOM 366 N LEU A 670 -6.654 -0.400 -8.330 1.00 0.00 N ATOM 367 CA LEU A 670 -7.952 0.315 -8.300 1.00 0.00 C ATOM 368 C LEU A 670 -8.814 -0.247 -7.155 1.00 0.00 C ATOM 369 O LEU A 670 -9.036 -1.437 -7.049 1.00 0.00 O ATOM 370 CB LEU A 670 -8.584 0.043 -9.674 1.00 0.00 C ATOM 371 CG LEU A 670 -9.800 0.959 -9.938 1.00 0.00 C ATOM 372 CD1 LEU A 670 -10.936 0.124 -10.534 1.00 0.00 C ATOM 373 CD2 LEU A 670 -10.292 1.631 -8.646 1.00 0.00 C ATOM 0 H LEU A 670 -6.682 -1.340 -8.726 1.00 0.00 H new ATOM 0 HA LEU A 670 -7.852 1.386 -8.122 1.00 0.00 H new ATOM 0 HB2 LEU A 670 -7.838 0.196 -10.454 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -8.896 -1.000 -9.731 1.00 0.00 H new ATOM 0 HG LEU A 670 -9.493 1.741 -10.632 1.00 0.00 H new ATOM 0 HD11 LEU A 670 -11.798 0.764 -10.723 1.00 0.00 H new ATOM 0 HD12 LEU A 670 -10.605 -0.325 -11.471 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -11.215 -0.663 -9.833 1.00 0.00 H new ATOM 0 HD21 LEU A 670 -11.148 2.268 -8.870 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -10.587 0.866 -7.928 1.00 0.00 H new ATOM 0 HD23 LEU A 670 -9.491 2.237 -8.223 1.00 0.00 H new ATOM 385 N VAL A 671 -9.289 0.616 -6.297 1.00 0.00 N ATOM 386 CA VAL A 671 -10.135 0.183 -5.137 1.00 0.00 C ATOM 387 C VAL A 671 -11.615 0.483 -5.404 1.00 0.00 C ATOM 388 O VAL A 671 -11.953 1.439 -6.068 1.00 0.00 O ATOM 389 CB VAL A 671 -9.650 1.054 -3.953 1.00 0.00 C ATOM 390 CG1 VAL A 671 -10.803 1.354 -2.989 1.00 0.00 C ATOM 391 CG2 VAL A 671 -8.564 0.339 -3.155 1.00 0.00 C ATOM 0 H VAL A 671 -9.126 1.621 -6.349 1.00 0.00 H new ATOM 0 HA VAL A 671 -10.045 -0.887 -4.950 1.00 0.00 H new ATOM 0 HB VAL A 671 -9.259 1.977 -4.381 1.00 0.00 H new ATOM 0 HG11 VAL A 671 -10.438 1.967 -2.165 1.00 0.00 H new ATOM 0 HG12 VAL A 671 -11.590 1.890 -3.519 1.00 0.00 H new ATOM 0 HG13 VAL A 671 -11.202 0.419 -2.596 1.00 0.00 H new ATOM 0 HG21 VAL A 671 -8.242 0.974 -2.329 1.00 0.00 H new ATOM 0 HG22 VAL A 671 -8.959 -0.597 -2.760 1.00 0.00 H new ATOM 0 HG23 VAL A 671 -7.714 0.129 -3.804 1.00 0.00 H new ATOM 401 N THR A 672 -12.494 -0.275 -4.813 1.00 0.00 N ATOM 402 CA THR A 672 -13.934 0.037 -4.955 1.00 0.00 C ATOM 403 C THR A 672 -14.293 0.906 -3.741 1.00 0.00 C ATOM 404 O THR A 672 -13.462 1.129 -2.882 1.00 0.00 O ATOM 405 CB THR A 672 -14.668 -1.318 -4.976 1.00 0.00 C ATOM 406 OG1 THR A 672 -15.761 -1.241 -5.882 1.00 0.00 O ATOM 407 CG2 THR A 672 -15.203 -1.677 -3.587 1.00 0.00 C ATOM 0 H THR A 672 -12.276 -1.091 -4.242 1.00 0.00 H new ATOM 0 HA THR A 672 -14.206 0.580 -5.860 1.00 0.00 H new ATOM 0 HB THR A 672 -13.962 -2.087 -5.288 1.00 0.00 H new ATOM 0 HG1 THR A 672 -16.231 -2.101 -5.901 1.00 0.00 H new ATOM 0 HG21 THR A 672 -15.716 -2.638 -3.632 1.00 0.00 H new ATOM 0 HG22 THR A 672 -14.373 -1.741 -2.883 1.00 0.00 H new ATOM 0 HG23 THR A 672 -15.901 -0.908 -3.256 1.00 0.00 H new ATOM 415 N SER A 673 -15.473 1.431 -3.658 1.00 0.00 N ATOM 416 CA SER A 673 -15.785 2.308 -2.490 1.00 0.00 C ATOM 417 C SER A 673 -15.595 1.562 -1.157 1.00 0.00 C ATOM 418 O SER A 673 -15.182 2.142 -0.175 1.00 0.00 O ATOM 419 CB SER A 673 -17.245 2.719 -2.677 1.00 0.00 C ATOM 420 OG SER A 673 -17.591 3.689 -1.696 1.00 0.00 O ATOM 0 H SER A 673 -16.229 1.300 -4.330 1.00 0.00 H new ATOM 0 HA SER A 673 -15.117 3.169 -2.449 1.00 0.00 H new ATOM 0 HB2 SER A 673 -17.394 3.127 -3.677 1.00 0.00 H new ATOM 0 HB3 SER A 673 -17.894 1.848 -2.588 1.00 0.00 H new ATOM 0 HG SER A 673 -18.527 3.955 -1.815 1.00 0.00 H new ATOM 426 N GLN A 674 -15.915 0.300 -1.102 1.00 0.00 N ATOM 427 CA GLN A 674 -15.780 -0.450 0.188 1.00 0.00 C ATOM 428 C GLN A 674 -14.644 -1.482 0.155 1.00 0.00 C ATOM 429 O GLN A 674 -14.641 -2.427 0.917 1.00 0.00 O ATOM 430 CB GLN A 674 -17.121 -1.152 0.347 1.00 0.00 C ATOM 431 CG GLN A 674 -18.221 -0.097 0.374 1.00 0.00 C ATOM 432 CD GLN A 674 -19.250 -0.362 -0.734 1.00 0.00 C ATOM 433 OE1 GLN A 674 -18.846 -0.667 -1.939 1.00 0.00 O flip ATOM 434 NE2 GLN A 674 -20.440 -0.285 -0.501 1.00 0.00 N flip ATOM 0 H GLN A 674 -16.264 -0.248 -1.889 1.00 0.00 H new ATOM 0 HA GLN A 674 -15.535 0.220 1.012 1.00 0.00 H new ATOM 0 HB2 GLN A 674 -17.284 -1.848 -0.476 1.00 0.00 H new ATOM 0 HB3 GLN A 674 -17.135 -1.737 1.266 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -18.715 -0.103 1.346 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -17.786 0.894 0.244 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -20.762 -0.047 0.437 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -21.117 -0.458 -1.244 1.00 0.00 H new ATOM 443 N ASP A 675 -13.696 -1.336 -0.723 1.00 0.00 N ATOM 444 CA ASP A 675 -12.589 -2.349 -0.796 1.00 0.00 C ATOM 445 C ASP A 675 -11.344 -1.922 0.001 1.00 0.00 C ATOM 446 O ASP A 675 -10.699 -0.944 -0.322 1.00 0.00 O ATOM 447 CB ASP A 675 -12.229 -2.428 -2.279 1.00 0.00 C ATOM 448 CG ASP A 675 -11.224 -3.558 -2.512 1.00 0.00 C ATOM 449 OD1 ASP A 675 -11.634 -4.706 -2.465 1.00 0.00 O ATOM 450 OD2 ASP A 675 -10.064 -3.257 -2.738 1.00 0.00 O ATOM 0 H ASP A 675 -13.631 -0.569 -1.392 1.00 0.00 H new ATOM 0 HA ASP A 675 -12.914 -3.298 -0.370 1.00 0.00 H new ATOM 0 HB2 ASP A 675 -13.127 -2.601 -2.871 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -11.806 -1.480 -2.610 1.00 0.00 H new ATOM 455 N LYS A 676 -10.972 -2.672 1.011 1.00 0.00 N ATOM 456 CA LYS A 676 -9.745 -2.334 1.777 1.00 0.00 C ATOM 457 C LYS A 676 -8.556 -2.969 1.054 1.00 0.00 C ATOM 458 O LYS A 676 -8.261 -4.134 1.227 1.00 0.00 O ATOM 459 CB LYS A 676 -9.956 -2.975 3.150 1.00 0.00 C ATOM 460 CG LYS A 676 -11.326 -2.561 3.697 1.00 0.00 C ATOM 461 CD LYS A 676 -11.481 -1.040 3.600 1.00 0.00 C ATOM 462 CE LYS A 676 -12.941 -0.650 3.853 1.00 0.00 C ATOM 463 NZ LYS A 676 -13.621 -0.805 2.534 1.00 0.00 N ATOM 0 H LYS A 676 -11.469 -3.502 1.333 1.00 0.00 H new ATOM 0 HA LYS A 676 -9.557 -1.264 1.869 1.00 0.00 H new ATOM 0 HB2 LYS A 676 -9.896 -4.060 3.070 1.00 0.00 H new ATOM 0 HB3 LYS A 676 -9.168 -2.662 3.835 1.00 0.00 H new ATOM 0 HG2 LYS A 676 -12.118 -3.054 3.133 1.00 0.00 H new ATOM 0 HG3 LYS A 676 -11.427 -2.881 4.734 1.00 0.00 H new ATOM 0 HD2 LYS A 676 -10.833 -0.552 4.328 1.00 0.00 H new ATOM 0 HD3 LYS A 676 -11.169 -0.696 2.614 1.00 0.00 H new ATOM 0 HE2 LYS A 676 -13.395 -1.292 4.608 1.00 0.00 H new ATOM 0 HE3 LYS A 676 -13.018 0.374 4.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 -14.614 -0.506 2.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 -13.141 -0.215 1.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 -13.583 -1.802 2.239 1.00 0.00 H new ATOM 477 N ALA A 677 -7.890 -2.228 0.213 1.00 0.00 N ATOM 478 CA ALA A 677 -6.750 -2.813 -0.552 1.00 0.00 C ATOM 479 C ALA A 677 -5.337 -2.415 -0.039 1.00 0.00 C ATOM 480 O ALA A 677 -4.375 -2.724 -0.711 1.00 0.00 O ATOM 481 CB ALA A 677 -6.988 -2.299 -1.975 1.00 0.00 C ATOM 0 H ALA A 677 -8.084 -1.245 0.022 1.00 0.00 H new ATOM 0 HA ALA A 677 -6.738 -3.899 -0.456 1.00 0.00 H new ATOM 0 HB1 ALA A 677 -6.202 -2.670 -2.632 1.00 0.00 H new ATOM 0 HB2 ALA A 677 -7.956 -2.651 -2.332 1.00 0.00 H new ATOM 0 HB3 ALA A 677 -6.976 -1.209 -1.975 1.00 0.00 H new ATOM 487 N PRO A 678 -5.203 -1.782 1.118 1.00 0.00 N ATOM 488 CA PRO A 678 -3.842 -1.440 1.607 1.00 0.00 C ATOM 489 C PRO A 678 -3.051 -2.728 1.899 1.00 0.00 C ATOM 490 O PRO A 678 -1.840 -2.759 1.803 1.00 0.00 O ATOM 491 CB PRO A 678 -4.128 -0.662 2.898 1.00 0.00 C ATOM 492 CG PRO A 678 -5.648 -0.613 3.119 1.00 0.00 C ATOM 493 CD PRO A 678 -6.338 -1.374 1.983 1.00 0.00 C ATOM 0 HA PRO A 678 -3.245 -0.872 0.894 1.00 0.00 H new ATOM 0 HB2 PRO A 678 -3.639 -1.143 3.745 1.00 0.00 H new ATOM 0 HB3 PRO A 678 -3.724 0.348 2.828 1.00 0.00 H new ATOM 0 HG2 PRO A 678 -5.904 -1.058 4.081 1.00 0.00 H new ATOM 0 HG3 PRO A 678 -5.992 0.421 3.144 1.00 0.00 H new ATOM 0 HD2 PRO A 678 -6.893 -2.236 2.353 1.00 0.00 H new ATOM 0 HD3 PRO A 678 -7.048 -0.743 1.447 1.00 0.00 H new ATOM 501 N SER A 679 -3.734 -3.787 2.265 1.00 0.00 N ATOM 502 CA SER A 679 -3.030 -5.073 2.575 1.00 0.00 C ATOM 503 C SER A 679 -2.683 -5.850 1.294 1.00 0.00 C ATOM 504 O SER A 679 -1.912 -6.789 1.325 1.00 0.00 O ATOM 505 CB SER A 679 -4.022 -5.862 3.427 1.00 0.00 C ATOM 506 OG SER A 679 -5.146 -6.217 2.633 1.00 0.00 O ATOM 0 H SER A 679 -4.749 -3.817 2.363 1.00 0.00 H new ATOM 0 HA SER A 679 -2.083 -4.900 3.086 1.00 0.00 H new ATOM 0 HB2 SER A 679 -3.545 -6.758 3.824 1.00 0.00 H new ATOM 0 HB3 SER A 679 -4.340 -5.265 4.282 1.00 0.00 H new ATOM 0 HG SER A 679 -5.783 -6.725 3.177 1.00 0.00 H new ATOM 512 N VAL A 680 -3.224 -5.463 0.169 1.00 0.00 N ATOM 513 CA VAL A 680 -2.896 -6.180 -1.103 1.00 0.00 C ATOM 514 C VAL A 680 -1.390 -6.133 -1.319 1.00 0.00 C ATOM 515 O VAL A 680 -0.825 -6.915 -2.057 1.00 0.00 O ATOM 516 CB VAL A 680 -3.609 -5.392 -2.208 1.00 0.00 C ATOM 517 CG1 VAL A 680 -2.928 -4.033 -2.377 1.00 0.00 C ATOM 518 CG2 VAL A 680 -3.528 -6.154 -3.536 1.00 0.00 C ATOM 0 H VAL A 680 -3.877 -4.685 0.074 1.00 0.00 H new ATOM 0 HA VAL A 680 -3.207 -7.225 -1.090 1.00 0.00 H new ATOM 0 HB VAL A 680 -4.655 -5.259 -1.930 1.00 0.00 H new ATOM 0 HG11 VAL A 680 -3.432 -3.469 -3.162 1.00 0.00 H new ATOM 0 HG12 VAL A 680 -2.983 -3.479 -1.440 1.00 0.00 H new ATOM 0 HG13 VAL A 680 -1.883 -4.181 -2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 680 -4.038 -5.585 -4.314 1.00 0.00 H new ATOM 0 HG22 VAL A 680 -2.483 -6.292 -3.813 1.00 0.00 H new ATOM 0 HG23 VAL A 680 -4.006 -7.128 -3.427 1.00 0.00 H new ATOM 528 N ILE A 681 -0.737 -5.205 -0.683 1.00 0.00 N ATOM 529 CA ILE A 681 0.740 -5.091 -0.857 1.00 0.00 C ATOM 530 C ILE A 681 1.416 -6.399 -0.439 1.00 0.00 C ATOM 531 O ILE A 681 2.256 -6.930 -1.137 1.00 0.00 O ATOM 532 CB ILE A 681 1.176 -3.971 0.090 1.00 0.00 C ATOM 533 CG1 ILE A 681 0.475 -2.661 -0.281 1.00 0.00 C ATOM 534 CG2 ILE A 681 2.690 -3.787 -0.025 1.00 0.00 C ATOM 535 CD1 ILE A 681 1.096 -2.094 -1.560 1.00 0.00 C ATOM 0 H ILE A 681 -1.157 -4.522 -0.052 1.00 0.00 H new ATOM 0 HA ILE A 681 1.011 -4.887 -1.893 1.00 0.00 H new ATOM 0 HB ILE A 681 0.906 -4.237 1.112 1.00 0.00 H new ATOM 0 HG12 ILE A 681 -0.591 -2.836 -0.428 1.00 0.00 H new ATOM 0 HG13 ILE A 681 0.571 -1.942 0.532 1.00 0.00 H new ATOM 0 HG21 ILE A 681 3.012 -2.991 0.646 1.00 0.00 H new ATOM 0 HG22 ILE A 681 3.191 -4.716 0.248 1.00 0.00 H new ATOM 0 HG23 ILE A 681 2.948 -3.523 -1.051 1.00 0.00 H new ATOM 0 HD11 ILE A 681 0.597 -1.162 -1.824 1.00 0.00 H new ATOM 0 HD12 ILE A 681 2.157 -1.904 -1.396 1.00 0.00 H new ATOM 0 HD13 ILE A 681 0.977 -2.812 -2.372 1.00 0.00 H new ATOM 547 N SER A 682 1.062 -6.913 0.706 1.00 0.00 N ATOM 548 CA SER A 682 1.688 -8.176 1.183 1.00 0.00 C ATOM 549 C SER A 682 1.434 -9.320 0.201 1.00 0.00 C ATOM 550 O SER A 682 2.329 -10.072 -0.126 1.00 0.00 O ATOM 551 CB SER A 682 1.004 -8.457 2.518 1.00 0.00 C ATOM 552 OG SER A 682 1.601 -9.595 3.131 1.00 0.00 O ATOM 0 H SER A 682 0.365 -6.511 1.333 1.00 0.00 H new ATOM 0 HA SER A 682 2.771 -8.088 1.275 1.00 0.00 H new ATOM 0 HB2 SER A 682 1.093 -7.590 3.173 1.00 0.00 H new ATOM 0 HB3 SER A 682 -0.061 -8.632 2.363 1.00 0.00 H new ATOM 0 HG SER A 682 1.162 -9.773 3.989 1.00 0.00 H new ATOM 558 N ARG A 683 0.231 -9.457 -0.290 1.00 0.00 N ATOM 559 CA ARG A 683 -0.024 -10.557 -1.257 1.00 0.00 C ATOM 560 C ARG A 683 0.611 -10.196 -2.591 1.00 0.00 C ATOM 561 O ARG A 683 1.063 -11.047 -3.336 1.00 0.00 O ATOM 562 CB ARG A 683 -1.539 -10.678 -1.388 1.00 0.00 C ATOM 563 CG ARG A 683 -2.105 -9.433 -2.061 1.00 0.00 C ATOM 564 CD ARG A 683 -3.602 -9.625 -2.258 1.00 0.00 C ATOM 565 NE ARG A 683 -4.204 -9.179 -0.977 1.00 0.00 N ATOM 566 CZ ARG A 683 -5.498 -9.116 -0.857 1.00 0.00 C ATOM 567 NH1 ARG A 683 -6.259 -9.568 -1.812 1.00 0.00 N ATOM 568 NH2 ARG A 683 -6.029 -8.596 0.218 1.00 0.00 N ATOM 0 H ARG A 683 -0.570 -8.866 -0.067 1.00 0.00 H new ATOM 0 HA ARG A 683 0.402 -11.504 -0.927 1.00 0.00 H new ATOM 0 HB2 ARG A 683 -1.792 -11.564 -1.971 1.00 0.00 H new ATOM 0 HB3 ARG A 683 -1.988 -10.805 -0.403 1.00 0.00 H new ATOM 0 HG2 ARG A 683 -1.914 -8.552 -1.448 1.00 0.00 H new ATOM 0 HG3 ARG A 683 -1.616 -9.266 -3.021 1.00 0.00 H new ATOM 0 HD2 ARG A 683 -3.971 -9.035 -3.097 1.00 0.00 H new ATOM 0 HD3 ARG A 683 -3.844 -10.666 -2.469 1.00 0.00 H new ATOM 0 HE ARG A 683 -3.605 -8.922 -0.192 1.00 0.00 H new ATOM 0 HH11 ARG A 683 -5.840 -9.970 -2.651 1.00 0.00 H new ATOM 0 HH12 ARG A 683 -7.274 -9.520 -1.721 1.00 0.00 H new ATOM 0 HH21 ARG A 683 -5.429 -8.240 0.962 1.00 0.00 H new ATOM 0 HH22 ARG A 683 -7.043 -8.546 0.313 1.00 0.00 H new ATOM 582 N VAL A 684 0.677 -8.931 -2.887 1.00 0.00 N ATOM 583 CA VAL A 684 1.311 -8.511 -4.158 1.00 0.00 C ATOM 584 C VAL A 684 2.822 -8.661 -4.022 1.00 0.00 C ATOM 585 O VAL A 684 3.520 -8.886 -4.987 1.00 0.00 O ATOM 586 CB VAL A 684 0.909 -7.045 -4.363 1.00 0.00 C ATOM 587 CG1 VAL A 684 1.973 -6.328 -5.197 1.00 0.00 C ATOM 588 CG2 VAL A 684 -0.424 -6.990 -5.113 1.00 0.00 C ATOM 0 H VAL A 684 0.320 -8.174 -2.304 1.00 0.00 H new ATOM 0 HA VAL A 684 0.996 -9.112 -5.011 1.00 0.00 H new ATOM 0 HB VAL A 684 0.816 -6.559 -3.392 1.00 0.00 H new ATOM 0 HG11 VAL A 684 1.683 -5.287 -5.340 1.00 0.00 H new ATOM 0 HG12 VAL A 684 2.931 -6.370 -4.679 1.00 0.00 H new ATOM 0 HG13 VAL A 684 2.064 -6.816 -6.168 1.00 0.00 H new ATOM 0 HG21 VAL A 684 -0.715 -5.950 -5.262 1.00 0.00 H new ATOM 0 HG22 VAL A 684 -0.317 -7.479 -6.081 1.00 0.00 H new ATOM 0 HG23 VAL A 684 -1.190 -7.502 -4.531 1.00 0.00 H new ATOM 598 N LEU A 685 3.331 -8.534 -2.823 1.00 0.00 N ATOM 599 CA LEU A 685 4.798 -8.663 -2.627 1.00 0.00 C ATOM 600 C LEU A 685 5.307 -9.999 -3.166 1.00 0.00 C ATOM 601 O LEU A 685 5.986 -10.035 -4.162 1.00 0.00 O ATOM 602 CB LEU A 685 5.024 -8.560 -1.118 1.00 0.00 C ATOM 603 CG LEU A 685 5.677 -7.214 -0.786 1.00 0.00 C ATOM 604 CD1 LEU A 685 6.889 -6.991 -1.694 1.00 0.00 C ATOM 605 CD2 LEU A 685 4.664 -6.093 -1.012 1.00 0.00 C ATOM 0 H LEU A 685 2.793 -8.347 -1.977 1.00 0.00 H new ATOM 0 HA LEU A 685 5.343 -7.888 -3.167 1.00 0.00 H new ATOM 0 HB2 LEU A 685 4.075 -8.655 -0.591 1.00 0.00 H new ATOM 0 HB3 LEU A 685 5.660 -9.378 -0.779 1.00 0.00 H new ATOM 0 HG LEU A 685 6.000 -7.215 0.255 1.00 0.00 H new ATOM 0 HD11 LEU A 685 7.351 -6.033 -1.455 1.00 0.00 H new ATOM 0 HD12 LEU A 685 7.612 -7.791 -1.539 1.00 0.00 H new ATOM 0 HD13 LEU A 685 6.568 -6.989 -2.736 1.00 0.00 H new ATOM 0 HD21 LEU A 685 5.125 -5.134 -0.777 1.00 0.00 H new ATOM 0 HD22 LEU A 685 4.344 -6.096 -2.054 1.00 0.00 H new ATOM 0 HD23 LEU A 685 3.799 -6.248 -0.367 1.00 0.00 H new ATOM 617 N LYS A 686 4.982 -11.096 -2.537 1.00 0.00 N ATOM 618 CA LYS A 686 5.475 -12.409 -3.051 1.00 0.00 C ATOM 619 C LYS A 686 4.984 -12.609 -4.485 1.00 0.00 C ATOM 620 O LYS A 686 5.716 -13.063 -5.341 1.00 0.00 O ATOM 621 CB LYS A 686 4.884 -13.452 -2.102 1.00 0.00 C ATOM 622 CG LYS A 686 5.557 -13.310 -0.734 1.00 0.00 C ATOM 623 CD LYS A 686 6.974 -13.899 -0.775 1.00 0.00 C ATOM 624 CE LYS A 686 7.548 -13.936 0.647 1.00 0.00 C ATOM 625 NZ LYS A 686 8.912 -14.527 0.514 1.00 0.00 N ATOM 0 H LYS A 686 4.403 -11.142 -1.699 1.00 0.00 H new ATOM 0 HA LYS A 686 6.562 -12.478 -3.079 1.00 0.00 H new ATOM 0 HB2 LYS A 686 3.807 -13.311 -2.010 1.00 0.00 H new ATOM 0 HB3 LYS A 686 5.041 -14.455 -2.498 1.00 0.00 H new ATOM 0 HG2 LYS A 686 5.601 -12.259 -0.450 1.00 0.00 H new ATOM 0 HG3 LYS A 686 4.965 -13.821 0.025 1.00 0.00 H new ATOM 0 HD2 LYS A 686 6.951 -14.904 -1.197 1.00 0.00 H new ATOM 0 HD3 LYS A 686 7.612 -13.297 -1.422 1.00 0.00 H new ATOM 0 HE2 LYS A 686 7.595 -12.936 1.077 1.00 0.00 H new ATOM 0 HE3 LYS A 686 6.923 -14.538 1.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 686 9.360 -14.581 1.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 686 8.838 -15.483 0.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 686 9.489 -13.930 -0.112 1.00 0.00 H new ATOM 639 N LYS A 687 3.767 -12.238 -4.768 1.00 0.00 N ATOM 640 CA LYS A 687 3.268 -12.374 -6.162 1.00 0.00 C ATOM 641 C LYS A 687 4.095 -11.500 -7.097 1.00 0.00 C ATOM 642 O LYS A 687 4.370 -11.861 -8.222 1.00 0.00 O ATOM 643 CB LYS A 687 1.825 -11.888 -6.126 1.00 0.00 C ATOM 644 CG LYS A 687 1.197 -12.081 -7.501 1.00 0.00 C ATOM 645 CD LYS A 687 -0.135 -11.342 -7.549 1.00 0.00 C ATOM 646 CE LYS A 687 -0.755 -11.501 -8.935 1.00 0.00 C ATOM 647 NZ LYS A 687 -1.136 -12.938 -9.015 1.00 0.00 N ATOM 0 H LYS A 687 3.102 -11.850 -4.100 1.00 0.00 H new ATOM 0 HA LYS A 687 3.340 -13.400 -6.524 1.00 0.00 H new ATOM 0 HB2 LYS A 687 1.261 -12.441 -5.375 1.00 0.00 H new ATOM 0 HB3 LYS A 687 1.790 -10.836 -5.841 1.00 0.00 H new ATOM 0 HG2 LYS A 687 1.865 -11.704 -8.276 1.00 0.00 H new ATOM 0 HG3 LYS A 687 1.046 -13.142 -7.700 1.00 0.00 H new ATOM 0 HD2 LYS A 687 -0.810 -11.737 -6.789 1.00 0.00 H new ATOM 0 HD3 LYS A 687 0.014 -10.286 -7.325 1.00 0.00 H new ATOM 0 HE2 LYS A 687 -1.623 -10.854 -9.057 1.00 0.00 H new ATOM 0 HE3 LYS A 687 -0.046 -11.235 -9.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 -2.023 -13.033 -9.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 -0.383 -13.470 -9.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 -1.268 -13.316 -8.055 1.00 0.00 H new ATOM 661 N ASN A 688 4.490 -10.346 -6.644 1.00 0.00 N ATOM 662 CA ASN A 688 5.295 -9.459 -7.519 1.00 0.00 C ATOM 663 C ASN A 688 6.718 -9.363 -6.957 1.00 0.00 C ATOM 664 O ASN A 688 7.437 -8.418 -7.210 1.00 0.00 O ATOM 665 CB ASN A 688 4.556 -8.111 -7.488 1.00 0.00 C ATOM 666 CG ASN A 688 5.119 -7.176 -6.415 1.00 0.00 C ATOM 667 OD1 ASN A 688 5.157 -5.979 -6.610 1.00 0.00 O ATOM 668 ND2 ASN A 688 5.541 -7.656 -5.282 1.00 0.00 N ATOM 0 H ASN A 688 4.291 -9.982 -5.712 1.00 0.00 H new ATOM 0 HA ASN A 688 5.395 -9.817 -8.544 1.00 0.00 H new ATOM 0 HB2 ASN A 688 4.634 -7.632 -8.464 1.00 0.00 H new ATOM 0 HB3 ASN A 688 3.496 -8.282 -7.300 1.00 0.00 H new ATOM 0 HD21 ASN A 688 5.901 -7.027 -4.564 1.00 0.00 H new ATOM 0 HD22 ASN A 688 5.512 -8.661 -5.111 1.00 0.00 H new ATOM 675 N ASN A 689 7.120 -10.347 -6.187 1.00 0.00 N ATOM 676 CA ASN A 689 8.488 -10.334 -5.587 1.00 0.00 C ATOM 677 C ASN A 689 9.515 -10.786 -6.616 1.00 0.00 C ATOM 678 O ASN A 689 10.700 -10.816 -6.350 1.00 0.00 O ATOM 679 CB ASN A 689 8.457 -11.338 -4.432 1.00 0.00 C ATOM 680 CG ASN A 689 8.269 -12.753 -4.991 1.00 0.00 C ATOM 681 OD1 ASN A 689 7.909 -12.922 -6.140 1.00 0.00 O ATOM 682 ND2 ASN A 689 8.508 -13.784 -4.227 1.00 0.00 N ATOM 0 H ASN A 689 6.554 -11.162 -5.949 1.00 0.00 H new ATOM 0 HA ASN A 689 8.760 -9.333 -5.251 1.00 0.00 H new ATOM 0 HB2 ASN A 689 9.384 -11.281 -3.861 1.00 0.00 H new ATOM 0 HB3 ASN A 689 7.645 -11.095 -3.746 1.00 0.00 H new ATOM 0 HD21 ASN A 689 8.393 -14.729 -4.594 1.00 0.00 H new ATOM 0 HD22 ASN A 689 8.810 -13.645 -3.263 1.00 0.00 H new ATOM 689 N ARG A 690 9.077 -11.084 -7.803 1.00 0.00 N ATOM 690 CA ARG A 690 10.042 -11.472 -8.863 1.00 0.00 C ATOM 691 C ARG A 690 10.419 -10.214 -9.625 1.00 0.00 C ATOM 692 O ARG A 690 11.540 -10.038 -10.059 1.00 0.00 O ATOM 693 CB ARG A 690 9.302 -12.453 -9.774 1.00 0.00 C ATOM 694 CG ARG A 690 10.242 -12.968 -10.871 1.00 0.00 C ATOM 695 CD ARG A 690 10.915 -14.270 -10.429 1.00 0.00 C ATOM 696 NE ARG A 690 11.740 -13.916 -9.245 1.00 0.00 N ATOM 697 CZ ARG A 690 11.995 -14.824 -8.346 1.00 0.00 C ATOM 698 NH1 ARG A 690 12.313 -16.031 -8.720 1.00 0.00 N ATOM 699 NH2 ARG A 690 11.920 -14.531 -7.076 1.00 0.00 N ATOM 0 H ARG A 690 8.097 -11.076 -8.085 1.00 0.00 H new ATOM 0 HA ARG A 690 10.949 -11.931 -8.470 1.00 0.00 H new ATOM 0 HB2 ARG A 690 8.922 -13.290 -9.188 1.00 0.00 H new ATOM 0 HB3 ARG A 690 8.439 -11.962 -10.225 1.00 0.00 H new ATOM 0 HG2 ARG A 690 9.681 -13.135 -11.791 1.00 0.00 H new ATOM 0 HG3 ARG A 690 11.000 -12.216 -11.092 1.00 0.00 H new ATOM 0 HD2 ARG A 690 10.173 -15.028 -10.177 1.00 0.00 H new ATOM 0 HD3 ARG A 690 11.533 -14.682 -11.227 1.00 0.00 H new ATOM 0 HE ARG A 690 12.104 -12.969 -9.137 1.00 0.00 H new ATOM 0 HH11 ARG A 690 12.361 -16.261 -9.712 1.00 0.00 H new ATOM 0 HH12 ARG A 690 12.514 -16.746 -8.020 1.00 0.00 H new ATOM 0 HH21 ARG A 690 11.661 -13.588 -6.784 1.00 0.00 H new ATOM 0 HH22 ARG A 690 12.120 -15.245 -6.375 1.00 0.00 H new ATOM 713 N ASP A 691 9.483 -9.329 -9.771 1.00 0.00 N ATOM 714 CA ASP A 691 9.767 -8.068 -10.487 1.00 0.00 C ATOM 715 C ASP A 691 9.841 -6.896 -9.512 1.00 0.00 C ATOM 716 O ASP A 691 10.659 -6.010 -9.659 1.00 0.00 O ATOM 717 CB ASP A 691 8.597 -7.898 -11.453 1.00 0.00 C ATOM 718 CG ASP A 691 8.806 -8.816 -12.659 1.00 0.00 C ATOM 719 OD1 ASP A 691 9.747 -9.593 -12.631 1.00 0.00 O ATOM 720 OD2 ASP A 691 8.025 -8.726 -13.590 1.00 0.00 O ATOM 0 H ASP A 691 8.529 -9.426 -9.423 1.00 0.00 H new ATOM 0 HA ASP A 691 10.726 -8.095 -11.004 1.00 0.00 H new ATOM 0 HB2 ASP A 691 7.659 -8.141 -10.954 1.00 0.00 H new ATOM 0 HB3 ASP A 691 8.526 -6.860 -11.778 1.00 0.00 H new ATOM 725 N SER A 692 8.990 -6.860 -8.529 1.00 0.00 N ATOM 726 CA SER A 692 9.021 -5.709 -7.590 1.00 0.00 C ATOM 727 C SER A 692 9.825 -6.009 -6.315 1.00 0.00 C ATOM 728 O SER A 692 10.785 -6.756 -6.323 1.00 0.00 O ATOM 729 CB SER A 692 7.564 -5.439 -7.256 1.00 0.00 C ATOM 730 OG SER A 692 6.777 -5.607 -8.431 1.00 0.00 O ATOM 0 H SER A 692 8.282 -7.569 -8.336 1.00 0.00 H new ATOM 0 HA SER A 692 9.516 -4.850 -8.043 1.00 0.00 H new ATOM 0 HB2 SER A 692 7.225 -6.120 -6.476 1.00 0.00 H new ATOM 0 HB3 SER A 692 7.449 -4.427 -6.868 1.00 0.00 H new ATOM 0 HG SER A 692 5.828 -5.641 -8.187 1.00 0.00 H new ATOM 736 N ALA A 693 9.441 -5.388 -5.227 1.00 0.00 N ATOM 737 CA ALA A 693 10.162 -5.563 -3.926 1.00 0.00 C ATOM 738 C ALA A 693 9.819 -6.899 -3.252 1.00 0.00 C ATOM 739 O ALA A 693 8.867 -7.565 -3.605 1.00 0.00 O ATOM 740 CB ALA A 693 9.674 -4.395 -3.064 1.00 0.00 C ATOM 0 H ALA A 693 8.643 -4.755 -5.184 1.00 0.00 H new ATOM 0 HA ALA A 693 11.243 -5.573 -4.067 1.00 0.00 H new ATOM 0 HB1 ALA A 693 10.152 -4.441 -2.085 1.00 0.00 H new ATOM 0 HB2 ALA A 693 9.930 -3.453 -3.549 1.00 0.00 H new ATOM 0 HB3 ALA A 693 8.593 -4.459 -2.943 1.00 0.00 H new ATOM 746 N VAL A 694 10.605 -7.283 -2.275 1.00 0.00 N ATOM 747 CA VAL A 694 10.373 -8.564 -1.544 1.00 0.00 C ATOM 748 C VAL A 694 10.403 -8.319 -0.025 1.00 0.00 C ATOM 749 O VAL A 694 10.780 -7.256 0.427 1.00 0.00 O ATOM 750 CB VAL A 694 11.533 -9.452 -1.981 1.00 0.00 C ATOM 751 CG1 VAL A 694 11.496 -10.772 -1.208 1.00 0.00 C ATOM 752 CG2 VAL A 694 11.398 -9.717 -3.480 1.00 0.00 C ATOM 0 H VAL A 694 11.412 -6.751 -1.949 1.00 0.00 H new ATOM 0 HA VAL A 694 9.405 -9.014 -1.762 1.00 0.00 H new ATOM 0 HB VAL A 694 12.483 -8.958 -1.775 1.00 0.00 H new ATOM 0 HG11 VAL A 694 12.327 -11.402 -1.524 1.00 0.00 H new ATOM 0 HG12 VAL A 694 11.579 -10.571 -0.140 1.00 0.00 H new ATOM 0 HG13 VAL A 694 10.555 -11.285 -1.408 1.00 0.00 H new ATOM 0 HG21 VAL A 694 12.220 -10.351 -3.813 1.00 0.00 H new ATOM 0 HG22 VAL A 694 10.450 -10.218 -3.677 1.00 0.00 H new ATOM 0 HG23 VAL A 694 11.428 -8.771 -4.021 1.00 0.00 H new ATOM 762 N ALA A 695 9.998 -9.284 0.763 1.00 0.00 N ATOM 763 CA ALA A 695 9.992 -9.089 2.250 1.00 0.00 C ATOM 764 C ALA A 695 9.070 -7.915 2.631 1.00 0.00 C ATOM 765 O ALA A 695 9.496 -6.777 2.670 1.00 0.00 O ATOM 766 CB ALA A 695 11.447 -8.773 2.625 1.00 0.00 C ATOM 0 H ALA A 695 9.672 -10.196 0.444 1.00 0.00 H new ATOM 0 HA ALA A 695 9.621 -9.969 2.775 1.00 0.00 H new ATOM 0 HB1 ALA A 695 11.520 -8.618 3.701 1.00 0.00 H new ATOM 0 HB2 ALA A 695 12.087 -9.606 2.335 1.00 0.00 H new ATOM 0 HB3 ALA A 695 11.769 -7.870 2.106 1.00 0.00 H new ATOM 772 N SER A 696 7.805 -8.171 2.903 1.00 0.00 N ATOM 773 CA SER A 696 6.885 -7.044 3.268 1.00 0.00 C ATOM 774 C SER A 696 6.831 -6.812 4.784 1.00 0.00 C ATOM 775 O SER A 696 5.821 -7.027 5.424 1.00 0.00 O ATOM 776 CB SER A 696 5.490 -7.416 2.748 1.00 0.00 C ATOM 777 OG SER A 696 5.486 -8.750 2.264 1.00 0.00 O ATOM 0 H SER A 696 7.378 -9.097 2.888 1.00 0.00 H new ATOM 0 HA SER A 696 7.249 -6.118 2.822 1.00 0.00 H new ATOM 0 HB2 SER A 696 4.756 -7.309 3.547 1.00 0.00 H new ATOM 0 HB3 SER A 696 5.197 -6.732 1.952 1.00 0.00 H new ATOM 0 HG SER A 696 4.564 -9.031 2.086 1.00 0.00 H new ATOM 783 N GLU A 697 7.892 -6.315 5.340 1.00 0.00 N ATOM 784 CA GLU A 697 7.912 -5.986 6.792 1.00 0.00 C ATOM 785 C GLU A 697 8.249 -4.501 6.889 1.00 0.00 C ATOM 786 O GLU A 697 9.391 -4.138 7.071 1.00 0.00 O ATOM 787 CB GLU A 697 9.041 -6.841 7.370 1.00 0.00 C ATOM 788 CG GLU A 697 8.675 -8.316 7.223 1.00 0.00 C ATOM 789 CD GLU A 697 9.546 -9.165 8.157 1.00 0.00 C ATOM 790 OE1 GLU A 697 10.757 -9.011 8.111 1.00 0.00 O ATOM 791 OE2 GLU A 697 8.991 -9.962 8.897 1.00 0.00 O ATOM 0 H GLU A 697 8.762 -6.118 4.845 1.00 0.00 H new ATOM 0 HA GLU A 697 6.977 -6.177 7.320 1.00 0.00 H new ATOM 0 HB2 GLU A 697 9.976 -6.632 6.850 1.00 0.00 H new ATOM 0 HB3 GLU A 697 9.199 -6.595 8.420 1.00 0.00 H new ATOM 0 HG2 GLU A 697 7.621 -8.464 7.460 1.00 0.00 H new ATOM 0 HG3 GLU A 697 8.817 -8.634 6.190 1.00 0.00 H new ATOM 798 N PHE A 698 7.292 -3.632 6.660 1.00 0.00 N ATOM 799 CA PHE A 698 7.640 -2.193 6.632 1.00 0.00 C ATOM 800 C PHE A 698 6.515 -1.253 7.075 1.00 0.00 C ATOM 801 O PHE A 698 5.393 -1.652 7.315 1.00 0.00 O ATOM 802 CB PHE A 698 8.046 -1.966 5.169 1.00 0.00 C ATOM 803 CG PHE A 698 7.003 -2.434 4.185 1.00 0.00 C ATOM 804 CD1 PHE A 698 6.620 -3.776 4.122 1.00 0.00 C ATOM 805 CD2 PHE A 698 6.452 -1.521 3.302 1.00 0.00 C ATOM 806 CE1 PHE A 698 5.682 -4.193 3.188 1.00 0.00 C ATOM 807 CE2 PHE A 698 5.510 -1.940 2.366 1.00 0.00 C ATOM 808 CZ PHE A 698 5.122 -3.273 2.307 1.00 0.00 C ATOM 0 H PHE A 698 6.311 -3.858 6.496 1.00 0.00 H new ATOM 0 HA PHE A 698 8.426 -1.959 7.350 1.00 0.00 H new ATOM 0 HB2 PHE A 698 8.235 -0.904 5.011 1.00 0.00 H new ATOM 0 HB3 PHE A 698 8.982 -2.489 4.973 1.00 0.00 H new ATOM 0 HD1 PHE A 698 7.056 -4.492 4.803 1.00 0.00 H new ATOM 0 HD2 PHE A 698 6.753 -0.484 3.339 1.00 0.00 H new ATOM 0 HE1 PHE A 698 5.387 -5.231 3.145 1.00 0.00 H new ATOM 0 HE2 PHE A 698 5.078 -1.225 1.682 1.00 0.00 H new ATOM 0 HZ PHE A 698 4.389 -3.593 1.581 1.00 0.00 H new ATOM 818 N GLU A 699 6.852 0.012 7.179 1.00 0.00 N ATOM 819 CA GLU A 699 5.883 1.065 7.602 1.00 0.00 C ATOM 820 C GLU A 699 5.412 1.839 6.367 1.00 0.00 C ATOM 821 O GLU A 699 6.208 2.246 5.546 1.00 0.00 O ATOM 822 CB GLU A 699 6.709 1.976 8.519 1.00 0.00 C ATOM 823 CG GLU A 699 5.828 3.061 9.142 1.00 0.00 C ATOM 824 CD GLU A 699 6.711 4.049 9.906 1.00 0.00 C ATOM 825 OE1 GLU A 699 7.921 3.901 9.844 1.00 0.00 O ATOM 826 OE2 GLU A 699 6.165 4.939 10.538 1.00 0.00 O ATOM 0 H GLU A 699 7.789 0.364 6.981 1.00 0.00 H new ATOM 0 HA GLU A 699 4.997 0.669 8.097 1.00 0.00 H new ATOM 0 HB2 GLU A 699 7.174 1.382 9.306 1.00 0.00 H new ATOM 0 HB3 GLU A 699 7.515 2.438 7.950 1.00 0.00 H new ATOM 0 HG2 GLU A 699 5.267 3.581 8.365 1.00 0.00 H new ATOM 0 HG3 GLU A 699 5.098 2.611 9.815 1.00 0.00 H new ATOM 833 N LEU A 700 4.129 2.011 6.205 1.00 0.00 N ATOM 834 CA LEU A 700 3.608 2.718 4.999 1.00 0.00 C ATOM 835 C LEU A 700 3.032 4.084 5.397 1.00 0.00 C ATOM 836 O LEU A 700 2.505 4.255 6.480 1.00 0.00 O ATOM 837 CB LEU A 700 2.543 1.744 4.464 1.00 0.00 C ATOM 838 CG LEU A 700 3.090 0.299 4.574 1.00 0.00 C ATOM 839 CD1 LEU A 700 2.312 -0.667 3.686 1.00 0.00 C ATOM 840 CD2 LEU A 700 4.554 0.235 4.158 1.00 0.00 C ATOM 0 H LEU A 700 3.415 1.691 6.859 1.00 0.00 H new ATOM 0 HA LEU A 700 4.361 2.945 4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 700 1.620 1.843 5.035 1.00 0.00 H new ATOM 0 HB3 LEU A 700 2.303 1.979 3.427 1.00 0.00 H new ATOM 0 HG LEU A 700 2.980 0.008 5.619 1.00 0.00 H new ATOM 0 HD11 LEU A 700 2.725 -1.670 3.790 1.00 0.00 H new ATOM 0 HD12 LEU A 700 1.264 -0.673 3.986 1.00 0.00 H new ATOM 0 HD13 LEU A 700 2.390 -0.349 2.646 1.00 0.00 H new ATOM 0 HD21 LEU A 700 4.912 -0.791 4.245 1.00 0.00 H new ATOM 0 HD22 LEU A 700 4.654 0.568 3.125 1.00 0.00 H new ATOM 0 HD23 LEU A 700 5.145 0.882 4.806 1.00 0.00 H new ATOM 852 N VAL A 701 3.152 5.072 4.541 1.00 0.00 N ATOM 853 CA VAL A 701 2.636 6.432 4.888 1.00 0.00 C ATOM 854 C VAL A 701 1.673 6.919 3.805 1.00 0.00 C ATOM 855 O VAL A 701 2.045 7.080 2.663 1.00 0.00 O ATOM 856 CB VAL A 701 3.883 7.321 4.942 1.00 0.00 C ATOM 857 CG1 VAL A 701 3.480 8.778 5.173 1.00 0.00 C ATOM 858 CG2 VAL A 701 4.780 6.870 6.094 1.00 0.00 C ATOM 0 H VAL A 701 3.584 4.994 3.620 1.00 0.00 H new ATOM 0 HA VAL A 701 2.086 6.443 5.829 1.00 0.00 H new ATOM 0 HB VAL A 701 4.417 7.237 3.995 1.00 0.00 H new ATOM 0 HG11 VAL A 701 4.374 9.401 5.210 1.00 0.00 H new ATOM 0 HG12 VAL A 701 2.838 9.112 4.358 1.00 0.00 H new ATOM 0 HG13 VAL A 701 2.941 8.861 6.117 1.00 0.00 H new ATOM 0 HG21 VAL A 701 5.667 7.502 6.133 1.00 0.00 H new ATOM 0 HG22 VAL A 701 4.234 6.952 7.034 1.00 0.00 H new ATOM 0 HG23 VAL A 701 5.079 5.834 5.938 1.00 0.00 H new ATOM 868 N GLN A 702 0.436 7.140 4.148 1.00 0.00 N ATOM 869 CA GLN A 702 -0.547 7.593 3.122 1.00 0.00 C ATOM 870 C GLN A 702 -0.436 9.090 2.859 1.00 0.00 C ATOM 871 O GLN A 702 0.101 9.839 3.653 1.00 0.00 O ATOM 872 CB GLN A 702 -1.917 7.266 3.709 1.00 0.00 C ATOM 873 CG GLN A 702 -3.018 7.703 2.738 1.00 0.00 C ATOM 874 CD GLN A 702 -4.154 6.685 2.771 1.00 0.00 C ATOM 875 OE1 GLN A 702 -4.301 5.957 3.731 1.00 0.00 O ATOM 876 NE2 GLN A 702 -4.975 6.615 1.756 1.00 0.00 N ATOM 0 H GLN A 702 0.062 7.028 5.090 1.00 0.00 H new ATOM 0 HA GLN A 702 -0.371 7.100 2.166 1.00 0.00 H new ATOM 0 HB2 GLN A 702 -1.994 6.196 3.902 1.00 0.00 H new ATOM 0 HB3 GLN A 702 -2.042 7.772 4.666 1.00 0.00 H new ATOM 0 HG2 GLN A 702 -3.391 8.690 3.013 1.00 0.00 H new ATOM 0 HG3 GLN A 702 -2.617 7.784 1.728 1.00 0.00 H new ATOM 0 HE21 GLN A 702 -4.846 7.230 0.952 1.00 0.00 H new ATOM 0 HE22 GLN A 702 -5.745 5.946 1.768 1.00 0.00 H new ATOM 885 N LEU A 703 -0.955 9.520 1.739 1.00 0.00 N ATOM 886 CA LEU A 703 -0.929 10.962 1.379 1.00 0.00 C ATOM 887 C LEU A 703 0.472 11.404 0.987 1.00 0.00 C ATOM 888 O LEU A 703 1.431 11.172 1.693 1.00 0.00 O ATOM 889 CB LEU A 703 -1.436 11.706 2.617 1.00 0.00 C ATOM 890 CG LEU A 703 -2.822 12.258 2.313 1.00 0.00 C ATOM 891 CD1 LEU A 703 -2.710 13.307 1.206 1.00 0.00 C ATOM 892 CD2 LEU A 703 -3.730 11.114 1.848 1.00 0.00 C ATOM 0 H LEU A 703 -1.403 8.918 1.048 1.00 0.00 H new ATOM 0 HA LEU A 703 -1.555 11.173 0.512 1.00 0.00 H new ATOM 0 HB2 LEU A 703 -1.475 11.033 3.474 1.00 0.00 H new ATOM 0 HB3 LEU A 703 -0.754 12.516 2.878 1.00 0.00 H new ATOM 0 HG LEU A 703 -3.245 12.715 3.208 1.00 0.00 H new ATOM 0 HD11 LEU A 703 -3.699 13.707 0.983 1.00 0.00 H new ATOM 0 HD12 LEU A 703 -2.057 14.115 1.536 1.00 0.00 H new ATOM 0 HD13 LEU A 703 -2.294 12.847 0.310 1.00 0.00 H new ATOM 0 HD21 LEU A 703 -4.724 11.504 1.629 1.00 0.00 H new ATOM 0 HD22 LEU A 703 -3.312 10.660 0.949 1.00 0.00 H new ATOM 0 HD23 LEU A 703 -3.800 10.363 2.635 1.00 0.00 H new ATOM 904 N LEU A 704 0.595 12.041 -0.141 1.00 0.00 N ATOM 905 CA LEU A 704 1.933 12.494 -0.581 1.00 0.00 C ATOM 906 C LEU A 704 2.526 13.465 0.458 1.00 0.00 C ATOM 907 O LEU A 704 3.663 13.305 0.856 1.00 0.00 O ATOM 908 CB LEU A 704 1.692 13.208 -1.921 1.00 0.00 C ATOM 909 CG LEU A 704 1.541 12.191 -3.052 1.00 0.00 C ATOM 910 CD1 LEU A 704 0.295 11.334 -2.811 1.00 0.00 C ATOM 911 CD2 LEU A 704 1.379 12.946 -4.373 1.00 0.00 C ATOM 0 H LEU A 704 -0.173 12.265 -0.774 1.00 0.00 H new ATOM 0 HA LEU A 704 2.639 11.670 -0.686 1.00 0.00 H new ATOM 0 HB2 LEU A 704 0.795 13.823 -1.855 1.00 0.00 H new ATOM 0 HB3 LEU A 704 2.523 13.879 -2.137 1.00 0.00 H new ATOM 0 HG LEU A 704 2.421 11.549 -3.088 1.00 0.00 H new ATOM 0 HD11 LEU A 704 0.190 10.610 -3.619 1.00 0.00 H new ATOM 0 HD12 LEU A 704 0.394 10.807 -1.862 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -0.587 11.974 -2.781 1.00 0.00 H new ATOM 0 HD21 LEU A 704 1.270 12.232 -5.189 1.00 0.00 H new ATOM 0 HD22 LEU A 704 0.493 13.579 -4.324 1.00 0.00 H new ATOM 0 HD23 LEU A 704 2.258 13.566 -4.548 1.00 0.00 H new ATOM 923 N PRO A 705 1.742 14.436 0.880 1.00 0.00 N ATOM 924 CA PRO A 705 2.220 15.420 1.886 1.00 0.00 C ATOM 925 C PRO A 705 2.544 14.756 3.226 1.00 0.00 C ATOM 926 O PRO A 705 3.266 15.301 4.036 1.00 0.00 O ATOM 927 CB PRO A 705 1.021 16.354 2.042 1.00 0.00 C ATOM 928 CG PRO A 705 -0.113 15.869 1.126 1.00 0.00 C ATOM 929 CD PRO A 705 0.354 14.617 0.383 1.00 0.00 C ATOM 0 HA PRO A 705 3.139 15.918 1.577 1.00 0.00 H new ATOM 0 HB2 PRO A 705 0.687 16.368 3.079 1.00 0.00 H new ATOM 0 HB3 PRO A 705 1.303 17.375 1.784 1.00 0.00 H new ATOM 0 HG2 PRO A 705 -1.004 15.649 1.713 1.00 0.00 H new ATOM 0 HG3 PRO A 705 -0.384 16.650 0.416 1.00 0.00 H new ATOM 0 HD2 PRO A 705 -0.273 13.755 0.611 1.00 0.00 H new ATOM 0 HD3 PRO A 705 0.326 14.755 -0.698 1.00 0.00 H new ATOM 937 N GLY A 706 1.992 13.607 3.486 1.00 0.00 N ATOM 938 CA GLY A 706 2.253 12.945 4.794 1.00 0.00 C ATOM 939 C GLY A 706 1.138 13.332 5.767 1.00 0.00 C ATOM 940 O GLY A 706 1.206 14.348 6.433 1.00 0.00 O ATOM 0 H GLY A 706 1.374 13.098 2.854 1.00 0.00 H new ATOM 0 HA2 GLY A 706 2.288 11.863 4.670 1.00 0.00 H new ATOM 0 HA3 GLY A 706 3.222 13.253 5.187 1.00 0.00 H new ATOM 944 N ASP A 707 0.109 12.531 5.853 1.00 0.00 N ATOM 945 CA ASP A 707 -1.016 12.855 6.776 1.00 0.00 C ATOM 946 C ASP A 707 -1.379 11.629 7.616 1.00 0.00 C ATOM 947 O ASP A 707 -1.465 11.700 8.824 1.00 0.00 O ATOM 948 CB ASP A 707 -2.174 13.240 5.854 1.00 0.00 C ATOM 949 CG ASP A 707 -1.990 14.684 5.379 1.00 0.00 C ATOM 950 OD1 ASP A 707 -1.187 15.383 5.974 1.00 0.00 O ATOM 951 OD2 ASP A 707 -2.655 15.065 4.429 1.00 0.00 O ATOM 0 H ASP A 707 -0.000 11.666 5.323 1.00 0.00 H new ATOM 0 HA ASP A 707 -0.767 13.653 7.476 1.00 0.00 H new ATOM 0 HB2 ASP A 707 -2.211 12.566 4.998 1.00 0.00 H new ATOM 0 HB3 ASP A 707 -3.122 13.137 6.381 1.00 0.00 H new ATOM 956 N ARG A 708 -1.574 10.503 6.985 1.00 0.00 N ATOM 957 CA ARG A 708 -1.912 9.264 7.752 1.00 0.00 C ATOM 958 C ARG A 708 -0.958 8.134 7.352 1.00 0.00 C ATOM 959 O ARG A 708 -0.473 8.088 6.237 1.00 0.00 O ATOM 960 CB ARG A 708 -3.355 8.910 7.363 1.00 0.00 C ATOM 961 CG ARG A 708 -4.310 10.020 7.811 1.00 0.00 C ATOM 962 CD ARG A 708 -4.546 10.984 6.647 1.00 0.00 C ATOM 963 NE ARG A 708 -5.181 10.157 5.582 1.00 0.00 N ATOM 964 CZ ARG A 708 -6.469 9.961 5.586 1.00 0.00 C ATOM 965 NH1 ARG A 708 -7.176 10.262 6.641 1.00 0.00 N ATOM 966 NH2 ARG A 708 -7.054 9.463 4.532 1.00 0.00 N ATOM 0 H ARG A 708 -1.515 10.385 5.974 1.00 0.00 H new ATOM 0 HA ARG A 708 -1.817 9.410 8.828 1.00 0.00 H new ATOM 0 HB2 ARG A 708 -3.425 8.773 6.284 1.00 0.00 H new ATOM 0 HB3 ARG A 708 -3.642 7.965 7.824 1.00 0.00 H new ATOM 0 HG2 ARG A 708 -5.256 9.591 8.140 1.00 0.00 H new ATOM 0 HG3 ARG A 708 -3.890 10.556 8.662 1.00 0.00 H new ATOM 0 HD2 ARG A 708 -5.193 11.810 6.944 1.00 0.00 H new ATOM 0 HD3 ARG A 708 -3.609 11.421 6.301 1.00 0.00 H new ATOM 0 HE ARG A 708 -4.606 9.743 4.848 1.00 0.00 H new ATOM 0 HH11 ARG A 708 -6.720 10.652 7.466 1.00 0.00 H new ATOM 0 HH12 ARG A 708 -8.184 10.107 6.640 1.00 0.00 H new ATOM 0 HH21 ARG A 708 -6.503 9.228 3.706 1.00 0.00 H new ATOM 0 HH22 ARG A 708 -8.062 9.309 4.533 1.00 0.00 H new ATOM 980 N GLU A 709 -0.696 7.217 8.246 1.00 0.00 N ATOM 981 CA GLU A 709 0.217 6.091 7.900 1.00 0.00 C ATOM 982 C GLU A 709 -0.612 4.848 7.550 1.00 0.00 C ATOM 983 O GLU A 709 -1.701 4.657 8.055 1.00 0.00 O ATOM 984 CB GLU A 709 1.073 5.843 9.153 1.00 0.00 C ATOM 985 CG GLU A 709 0.226 5.156 10.227 1.00 0.00 C ATOM 986 CD GLU A 709 1.056 4.945 11.498 1.00 0.00 C ATOM 987 OE1 GLU A 709 2.209 4.567 11.374 1.00 0.00 O ATOM 988 OE2 GLU A 709 0.519 5.158 12.574 1.00 0.00 O ATOM 0 H GLU A 709 -1.072 7.199 9.194 1.00 0.00 H new ATOM 0 HA GLU A 709 0.844 6.318 7.038 1.00 0.00 H new ATOM 0 HB2 GLU A 709 1.933 5.222 8.901 1.00 0.00 H new ATOM 0 HB3 GLU A 709 1.463 6.788 9.532 1.00 0.00 H new ATOM 0 HG2 GLU A 709 -0.651 5.763 10.453 1.00 0.00 H new ATOM 0 HG3 GLU A 709 -0.137 4.197 9.857 1.00 0.00 H new ATOM 995 N LEU A 710 -0.111 4.008 6.688 1.00 0.00 N ATOM 996 CA LEU A 710 -0.880 2.788 6.304 1.00 0.00 C ATOM 997 C LEU A 710 -0.113 1.532 6.714 1.00 0.00 C ATOM 998 O LEU A 710 -0.110 0.530 6.025 1.00 0.00 O ATOM 999 CB LEU A 710 -1.020 2.878 4.789 1.00 0.00 C ATOM 1000 CG LEU A 710 -2.456 2.531 4.392 1.00 0.00 C ATOM 1001 CD1 LEU A 710 -3.450 3.392 5.180 1.00 0.00 C ATOM 1002 CD2 LEU A 710 -2.642 2.788 2.900 1.00 0.00 C ATOM 0 H LEU A 710 0.796 4.112 6.233 1.00 0.00 H new ATOM 0 HA LEU A 710 -1.851 2.731 6.795 1.00 0.00 H new ATOM 0 HB2 LEU A 710 -0.769 3.882 4.448 1.00 0.00 H new ATOM 0 HB3 LEU A 710 -0.322 2.194 4.307 1.00 0.00 H new ATOM 0 HG LEU A 710 -2.641 1.481 4.617 1.00 0.00 H new ATOM 0 HD11 LEU A 710 -4.467 3.134 4.887 1.00 0.00 H new ATOM 0 HD12 LEU A 710 -3.323 3.210 6.247 1.00 0.00 H new ATOM 0 HD13 LEU A 710 -3.267 4.445 4.967 1.00 0.00 H new ATOM 0 HD21 LEU A 710 -3.664 2.542 2.613 1.00 0.00 H new ATOM 0 HD22 LEU A 710 -2.448 3.839 2.685 1.00 0.00 H new ATOM 0 HD23 LEU A 710 -1.947 2.167 2.334 1.00 0.00 H new ATOM 1014 N THR A 711 0.532 1.591 7.838 1.00 0.00 N ATOM 1015 CA THR A 711 1.310 0.428 8.326 1.00 0.00 C ATOM 1016 C THR A 711 0.345 -0.701 8.753 1.00 0.00 C ATOM 1017 O THR A 711 -0.857 -0.571 8.618 1.00 0.00 O ATOM 1018 CB THR A 711 2.127 1.003 9.481 1.00 0.00 C ATOM 1019 OG1 THR A 711 1.257 1.393 10.530 1.00 0.00 O ATOM 1020 CG2 THR A 711 2.887 2.233 8.980 1.00 0.00 C ATOM 0 H THR A 711 0.553 2.408 8.448 1.00 0.00 H new ATOM 0 HA THR A 711 1.961 -0.029 7.581 1.00 0.00 H new ATOM 0 HB THR A 711 2.825 0.251 9.849 1.00 0.00 H new ATOM 0 HG1 THR A 711 0.342 1.465 10.186 1.00 0.00 H new ATOM 0 HG21 THR A 711 3.475 2.654 9.795 1.00 0.00 H new ATOM 0 HG22 THR A 711 3.551 1.944 8.165 1.00 0.00 H new ATOM 0 HG23 THR A 711 2.177 2.979 8.622 1.00 0.00 H new ATOM 1028 N ILE A 712 0.853 -1.831 9.187 1.00 0.00 N ATOM 1029 CA ILE A 712 -0.055 -2.983 9.527 1.00 0.00 C ATOM 1030 C ILE A 712 -0.959 -2.775 10.772 1.00 0.00 C ATOM 1031 O ILE A 712 -2.023 -3.361 10.825 1.00 0.00 O ATOM 1032 CB ILE A 712 0.850 -4.210 9.726 1.00 0.00 C ATOM 1033 CG1 ILE A 712 1.501 -4.195 11.109 1.00 0.00 C ATOM 1034 CG2 ILE A 712 1.951 -4.242 8.663 1.00 0.00 C ATOM 1035 CD1 ILE A 712 1.558 -5.627 11.619 1.00 0.00 C ATOM 0 H ILE A 712 1.848 -2.008 9.321 1.00 0.00 H new ATOM 0 HA ILE A 712 -0.763 -3.100 8.707 1.00 0.00 H new ATOM 0 HB ILE A 712 0.223 -5.097 9.635 1.00 0.00 H new ATOM 0 HG12 ILE A 712 2.503 -3.770 11.053 1.00 0.00 H new ATOM 0 HG13 ILE A 712 0.927 -3.570 11.793 1.00 0.00 H new ATOM 0 HG21 ILE A 712 2.582 -5.117 8.819 1.00 0.00 H new ATOM 0 HG22 ILE A 712 1.499 -4.293 7.672 1.00 0.00 H new ATOM 0 HG23 ILE A 712 2.557 -3.339 8.740 1.00 0.00 H new ATOM 0 HD11 ILE A 712 2.019 -5.643 12.606 1.00 0.00 H new ATOM 0 HD12 ILE A 712 0.548 -6.031 11.684 1.00 0.00 H new ATOM 0 HD13 ILE A 712 2.148 -6.234 10.933 1.00 0.00 H new ATOM 1047 N PRO A 713 -0.545 -2.001 11.754 1.00 0.00 N ATOM 1048 CA PRO A 713 -1.389 -1.822 12.976 1.00 0.00 C ATOM 1049 C PRO A 713 -2.698 -1.043 12.702 1.00 0.00 C ATOM 1050 O PRO A 713 -3.151 -0.288 13.539 1.00 0.00 O ATOM 1051 CB PRO A 713 -0.464 -1.020 13.899 1.00 0.00 C ATOM 1052 CG PRO A 713 0.867 -0.762 13.166 1.00 0.00 C ATOM 1053 CD PRO A 713 0.748 -1.282 11.728 1.00 0.00 C ATOM 0 HA PRO A 713 -1.727 -2.773 13.387 1.00 0.00 H new ATOM 0 HB2 PRO A 713 -0.932 -0.075 14.174 1.00 0.00 H new ATOM 0 HB3 PRO A 713 -0.285 -1.569 14.824 1.00 0.00 H new ATOM 0 HG2 PRO A 713 1.097 0.304 13.164 1.00 0.00 H new ATOM 0 HG3 PRO A 713 1.686 -1.264 13.682 1.00 0.00 H new ATOM 0 HD2 PRO A 713 0.746 -0.469 11.001 1.00 0.00 H new ATOM 0 HD3 PRO A 713 1.574 -1.942 11.465 1.00 0.00 H new ATOM 1061 N HIS A 714 -3.300 -1.193 11.546 1.00 0.00 N ATOM 1062 CA HIS A 714 -4.554 -0.436 11.250 1.00 0.00 C ATOM 1063 C HIS A 714 -5.737 -1.397 11.067 1.00 0.00 C ATOM 1064 O HIS A 714 -5.559 -2.595 10.980 1.00 0.00 O ATOM 1065 CB HIS A 714 -4.222 0.302 9.962 1.00 0.00 C ATOM 1066 CG HIS A 714 -3.039 1.171 10.248 1.00 0.00 C ATOM 1067 ND1 HIS A 714 -3.138 2.547 10.311 1.00 0.00 N ATOM 1068 CD2 HIS A 714 -1.737 0.868 10.559 1.00 0.00 C ATOM 1069 CE1 HIS A 714 -1.932 3.022 10.652 1.00 0.00 C ATOM 1070 NE2 HIS A 714 -1.039 2.042 10.815 1.00 0.00 N ATOM 0 H HIS A 714 -2.977 -1.806 10.797 1.00 0.00 H new ATOM 0 HA HIS A 714 -4.853 0.240 12.051 1.00 0.00 H new ATOM 0 HB2 HIS A 714 -3.998 -0.402 9.161 1.00 0.00 H new ATOM 0 HB3 HIS A 714 -5.070 0.902 9.632 1.00 0.00 H new ATOM 0 HD2 HIS A 714 -1.320 -0.127 10.599 1.00 0.00 H new ATOM 0 HE1 HIS A 714 -1.709 4.071 10.780 1.00 0.00 H new ATOM 0 HE2 HIS A 714 -0.056 2.135 11.072 1.00 0.00 H new ATOM 1078 N SER A 715 -6.944 -0.895 11.024 1.00 0.00 N ATOM 1079 CA SER A 715 -8.118 -1.810 10.868 1.00 0.00 C ATOM 1080 C SER A 715 -8.330 -2.205 9.400 1.00 0.00 C ATOM 1081 O SER A 715 -7.902 -1.520 8.491 1.00 0.00 O ATOM 1082 CB SER A 715 -9.313 -1.023 11.411 1.00 0.00 C ATOM 1083 OG SER A 715 -9.067 -0.683 12.771 1.00 0.00 O ATOM 0 H SER A 715 -7.168 0.098 11.089 1.00 0.00 H new ATOM 0 HA SER A 715 -7.973 -2.747 11.405 1.00 0.00 H new ATOM 0 HB2 SER A 715 -9.469 -0.121 10.820 1.00 0.00 H new ATOM 0 HB3 SER A 715 -10.223 -1.618 11.331 1.00 0.00 H new ATOM 0 HG SER A 715 -9.828 -0.177 13.125 1.00 0.00 H new ATOM 1089 N ALA A 716 -8.984 -3.322 9.169 1.00 0.00 N ATOM 1090 CA ALA A 716 -9.220 -3.787 7.768 1.00 0.00 C ATOM 1091 C ALA A 716 -9.994 -2.720 6.992 1.00 0.00 C ATOM 1092 O ALA A 716 -9.636 -2.358 5.887 1.00 0.00 O ATOM 1093 CB ALA A 716 -10.048 -5.069 7.912 1.00 0.00 C ATOM 0 H ALA A 716 -9.364 -3.930 9.894 1.00 0.00 H new ATOM 0 HA ALA A 716 -8.294 -3.967 7.222 1.00 0.00 H new ATOM 0 HB1 ALA A 716 -10.265 -5.475 6.924 1.00 0.00 H new ATOM 0 HB2 ALA A 716 -9.486 -5.802 8.490 1.00 0.00 H new ATOM 0 HB3 ALA A 716 -10.983 -4.843 8.424 1.00 0.00 H new ATOM 1099 N ASN A 717 -11.031 -2.187 7.579 1.00 0.00 N ATOM 1100 CA ASN A 717 -11.804 -1.110 6.903 1.00 0.00 C ATOM 1101 C ASN A 717 -10.991 0.178 7.004 1.00 0.00 C ATOM 1102 O ASN A 717 -11.355 1.110 7.698 1.00 0.00 O ATOM 1103 CB ASN A 717 -13.103 -1.008 7.704 1.00 0.00 C ATOM 1104 CG ASN A 717 -14.017 0.045 7.086 1.00 0.00 C ATOM 1105 OD1 ASN A 717 -14.702 -0.216 6.117 1.00 0.00 O ATOM 1106 ND2 ASN A 717 -14.047 1.240 7.607 1.00 0.00 N ATOM 0 H ASN A 717 -11.376 -2.453 8.501 1.00 0.00 H new ATOM 0 HA ASN A 717 -12.009 -1.298 5.849 1.00 0.00 H new ATOM 0 HB2 ASN A 717 -13.607 -1.974 7.720 1.00 0.00 H new ATOM 0 HB3 ASN A 717 -12.882 -0.747 8.739 1.00 0.00 H new ATOM 0 HD21 ASN A 717 -14.647 1.958 7.201 1.00 0.00 H new ATOM 0 HD22 ASN A 717 -13.471 1.456 8.420 1.00 0.00 H new ATOM 1113 N VAL A 718 -9.870 0.216 6.337 1.00 0.00 N ATOM 1114 CA VAL A 718 -9.000 1.423 6.416 1.00 0.00 C ATOM 1115 C VAL A 718 -9.281 2.374 5.251 1.00 0.00 C ATOM 1116 O VAL A 718 -9.370 3.567 5.439 1.00 0.00 O ATOM 1117 CB VAL A 718 -7.559 0.848 6.401 1.00 0.00 C ATOM 1118 CG1 VAL A 718 -6.811 1.266 5.131 1.00 0.00 C ATOM 1119 CG2 VAL A 718 -6.786 1.363 7.616 1.00 0.00 C ATOM 0 H VAL A 718 -9.520 -0.535 5.742 1.00 0.00 H new ATOM 0 HA VAL A 718 -9.174 2.027 7.306 1.00 0.00 H new ATOM 0 HB VAL A 718 -7.631 -0.239 6.429 1.00 0.00 H new ATOM 0 HG11 VAL A 718 -5.804 0.849 5.148 1.00 0.00 H new ATOM 0 HG12 VAL A 718 -7.344 0.894 4.256 1.00 0.00 H new ATOM 0 HG13 VAL A 718 -6.752 2.353 5.085 1.00 0.00 H new ATOM 0 HG21 VAL A 718 -5.774 0.957 7.602 1.00 0.00 H new ATOM 0 HG22 VAL A 718 -6.741 2.452 7.584 1.00 0.00 H new ATOM 0 HG23 VAL A 718 -7.291 1.048 8.529 1.00 0.00 H new ATOM 1129 N PHE A 719 -9.437 1.868 4.049 1.00 0.00 N ATOM 1130 CA PHE A 719 -9.732 2.777 2.897 1.00 0.00 C ATOM 1131 C PHE A 719 -11.027 3.514 3.121 1.00 0.00 C ATOM 1132 O PHE A 719 -11.103 4.706 2.917 1.00 0.00 O ATOM 1133 CB PHE A 719 -9.784 1.886 1.658 1.00 0.00 C ATOM 1134 CG PHE A 719 -8.377 1.687 1.152 1.00 0.00 C ATOM 1135 CD1 PHE A 719 -7.283 2.157 1.897 1.00 0.00 C ATOM 1136 CD2 PHE A 719 -8.164 1.067 -0.076 1.00 0.00 C ATOM 1137 CE1 PHE A 719 -5.997 2.004 1.416 1.00 0.00 C ATOM 1138 CE2 PHE A 719 -6.862 0.920 -0.558 1.00 0.00 C ATOM 1139 CZ PHE A 719 -5.780 1.392 0.191 1.00 0.00 C ATOM 0 H PHE A 719 -9.374 0.876 3.819 1.00 0.00 H new ATOM 0 HA PHE A 719 -8.969 3.546 2.780 1.00 0.00 H new ATOM 0 HB2 PHE A 719 -10.238 0.926 1.901 1.00 0.00 H new ATOM 0 HB3 PHE A 719 -10.402 2.345 0.887 1.00 0.00 H new ATOM 0 HD1 PHE A 719 -7.448 2.640 2.849 1.00 0.00 H new ATOM 0 HD2 PHE A 719 -9.001 0.702 -0.653 1.00 0.00 H new ATOM 0 HE1 PHE A 719 -5.159 2.362 1.995 1.00 0.00 H new ATOM 0 HE2 PHE A 719 -6.690 0.441 -1.511 1.00 0.00 H new ATOM 0 HZ PHE A 719 -4.774 1.280 -0.185 1.00 0.00 H new ATOM 1149 N TYR A 720 -12.029 2.866 3.616 1.00 0.00 N ATOM 1150 CA TYR A 720 -13.280 3.607 3.894 1.00 0.00 C ATOM 1151 C TYR A 720 -12.892 4.857 4.692 1.00 0.00 C ATOM 1152 O TYR A 720 -13.602 5.841 4.716 1.00 0.00 O ATOM 1153 CB TYR A 720 -14.134 2.653 4.716 1.00 0.00 C ATOM 1154 CG TYR A 720 -15.464 3.289 5.036 1.00 0.00 C ATOM 1155 CD1 TYR A 720 -16.431 3.388 4.035 1.00 0.00 C ATOM 1156 CD2 TYR A 720 -15.739 3.766 6.327 1.00 0.00 C ATOM 1157 CE1 TYR A 720 -17.673 3.961 4.314 1.00 0.00 C ATOM 1158 CE2 TYR A 720 -16.984 4.342 6.606 1.00 0.00 C ATOM 1159 CZ TYR A 720 -17.951 4.437 5.599 1.00 0.00 C ATOM 1160 OH TYR A 720 -19.177 5.002 5.871 1.00 0.00 O ATOM 0 H TYR A 720 -12.041 1.871 3.839 1.00 0.00 H new ATOM 0 HA TYR A 720 -13.826 3.925 3.006 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -14.289 1.726 4.165 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -13.616 2.392 5.639 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -16.218 3.020 3.042 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -14.992 3.689 7.103 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -18.419 4.037 3.537 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -17.198 4.713 7.598 1.00 0.00 H new ATOM 0 HH TYR A 720 -19.208 5.280 6.810 1.00 0.00 H new ATOM 1170 N ALA A 721 -11.734 4.822 5.314 1.00 0.00 N ATOM 1171 CA ALA A 721 -11.251 6.005 6.069 1.00 0.00 C ATOM 1172 C ALA A 721 -9.962 6.565 5.422 1.00 0.00 C ATOM 1173 O ALA A 721 -9.623 7.712 5.618 1.00 0.00 O ATOM 1174 CB ALA A 721 -10.980 5.500 7.488 1.00 0.00 C ATOM 0 H ALA A 721 -11.107 4.018 5.326 1.00 0.00 H new ATOM 0 HA ALA A 721 -11.978 6.817 6.069 1.00 0.00 H new ATOM 0 HB1 ALA A 721 -10.619 6.323 8.104 1.00 0.00 H new ATOM 0 HB2 ALA A 721 -11.901 5.104 7.915 1.00 0.00 H new ATOM 0 HB3 ALA A 721 -10.227 4.713 7.456 1.00 0.00 H new ATOM 1180 N MET A 722 -9.226 5.767 4.676 1.00 0.00 N ATOM 1181 CA MET A 722 -7.957 6.280 4.055 1.00 0.00 C ATOM 1182 C MET A 722 -8.164 6.667 2.602 1.00 0.00 C ATOM 1183 O MET A 722 -7.424 7.455 2.043 1.00 0.00 O ATOM 1184 CB MET A 722 -6.962 5.113 4.077 1.00 0.00 C ATOM 1185 CG MET A 722 -6.275 5.013 5.444 1.00 0.00 C ATOM 1186 SD MET A 722 -7.497 5.074 6.776 1.00 0.00 S ATOM 1187 CE MET A 722 -6.324 5.007 8.153 1.00 0.00 C ATOM 0 H MET A 722 -9.447 4.792 4.472 1.00 0.00 H new ATOM 0 HA MET A 722 -7.613 7.157 4.603 1.00 0.00 H new ATOM 0 HB2 MET A 722 -7.482 4.181 3.857 1.00 0.00 H new ATOM 0 HB3 MET A 722 -6.213 5.252 3.297 1.00 0.00 H new ATOM 0 HG2 MET A 722 -5.708 4.084 5.505 1.00 0.00 H new ATOM 0 HG3 MET A 722 -5.562 5.829 5.559 1.00 0.00 H new ATOM 0 HE1 MET A 722 -6.824 4.612 9.038 1.00 0.00 H new ATOM 0 HE2 MET A 722 -5.489 4.359 7.888 1.00 0.00 H new ATOM 0 HE3 MET A 722 -5.952 6.010 8.363 1.00 0.00 H new ATOM 1197 N ASP A 723 -9.120 6.068 1.966 1.00 0.00 N ATOM 1198 CA ASP A 723 -9.324 6.344 0.527 1.00 0.00 C ATOM 1199 C ASP A 723 -10.163 7.591 0.292 1.00 0.00 C ATOM 1200 O ASP A 723 -10.621 7.815 -0.809 1.00 0.00 O ATOM 1201 CB ASP A 723 -10.035 5.114 -0.017 1.00 0.00 C ATOM 1202 CG ASP A 723 -11.444 4.987 0.555 1.00 0.00 C ATOM 1203 OD1 ASP A 723 -11.938 5.960 1.099 1.00 0.00 O ATOM 1204 OD2 ASP A 723 -12.009 3.911 0.441 1.00 0.00 O ATOM 0 H ASP A 723 -9.769 5.399 2.380 1.00 0.00 H new ATOM 0 HA ASP A 723 -8.373 6.533 0.030 1.00 0.00 H new ATOM 0 HB2 ASP A 723 -10.086 5.172 -1.104 1.00 0.00 H new ATOM 0 HB3 ASP A 723 -9.459 4.221 0.228 1.00 0.00 H new ATOM 1209 N GLY A 724 -10.366 8.421 1.287 1.00 0.00 N ATOM 1210 CA GLY A 724 -11.172 9.655 1.041 1.00 0.00 C ATOM 1211 C GLY A 724 -10.677 10.252 -0.270 1.00 0.00 C ATOM 1212 O GLY A 724 -11.400 10.345 -1.242 1.00 0.00 O ATOM 0 H GLY A 724 -10.017 8.301 2.238 1.00 0.00 H new ATOM 0 HA2 GLY A 724 -12.234 9.417 0.980 1.00 0.00 H new ATOM 0 HA3 GLY A 724 -11.051 10.365 1.859 1.00 0.00 H new ATOM 1216 N ALA A 725 -9.424 10.588 -0.317 1.00 0.00 N ATOM 1217 CA ALA A 725 -8.840 11.113 -1.575 1.00 0.00 C ATOM 1218 C ALA A 725 -8.226 9.934 -2.314 1.00 0.00 C ATOM 1219 O ALA A 725 -8.701 8.819 -2.213 1.00 0.00 O ATOM 1220 CB ALA A 725 -7.743 12.086 -1.137 1.00 0.00 C ATOM 0 H ALA A 725 -8.775 10.521 0.467 1.00 0.00 H new ATOM 0 HA ALA A 725 -9.565 11.606 -2.222 1.00 0.00 H new ATOM 0 HB1 ALA A 725 -7.265 12.515 -2.017 1.00 0.00 H new ATOM 0 HB2 ALA A 725 -8.182 12.883 -0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 725 -7.000 11.553 -0.544 1.00 0.00 H new ATOM 1226 N SER A 726 -7.147 10.135 -3.002 1.00 0.00 N ATOM 1227 CA SER A 726 -6.506 8.978 -3.662 1.00 0.00 C ATOM 1228 C SER A 726 -5.702 8.250 -2.581 1.00 0.00 C ATOM 1229 O SER A 726 -5.386 8.823 -1.556 1.00 0.00 O ATOM 1230 CB SER A 726 -5.622 9.579 -4.751 1.00 0.00 C ATOM 1231 OG SER A 726 -4.559 10.311 -4.153 1.00 0.00 O ATOM 0 H SER A 726 -6.687 11.036 -3.135 1.00 0.00 H new ATOM 0 HA SER A 726 -7.193 8.260 -4.111 1.00 0.00 H new ATOM 0 HB2 SER A 726 -5.221 8.788 -5.385 1.00 0.00 H new ATOM 0 HB3 SER A 726 -6.212 10.234 -5.392 1.00 0.00 H new ATOM 0 HG SER A 726 -3.708 10.039 -4.555 1.00 0.00 H new ATOM 1237 N HIS A 727 -5.396 6.998 -2.758 1.00 0.00 N ATOM 1238 CA HIS A 727 -4.647 6.293 -1.683 1.00 0.00 C ATOM 1239 C HIS A 727 -3.206 6.117 -2.124 1.00 0.00 C ATOM 1240 O HIS A 727 -2.787 5.055 -2.534 1.00 0.00 O ATOM 1241 CB HIS A 727 -5.324 4.927 -1.442 1.00 0.00 C ATOM 1242 CG HIS A 727 -6.746 4.913 -1.949 1.00 0.00 C ATOM 1243 ND1 HIS A 727 -7.394 3.732 -2.283 1.00 0.00 N ATOM 1244 CD2 HIS A 727 -7.653 5.915 -2.188 1.00 0.00 C ATOM 1245 CE1 HIS A 727 -8.628 4.055 -2.702 1.00 0.00 C ATOM 1246 NE2 HIS A 727 -8.831 5.372 -2.666 1.00 0.00 N ATOM 0 H HIS A 727 -5.625 6.441 -3.581 1.00 0.00 H new ATOM 0 HA HIS A 727 -4.655 6.864 -0.755 1.00 0.00 H new ATOM 0 HB2 HIS A 727 -4.752 4.144 -1.940 1.00 0.00 H new ATOM 0 HB3 HIS A 727 -5.315 4.699 -0.376 1.00 0.00 H new ATOM 0 HD1 HIS A 727 -7.004 2.791 -2.221 1.00 0.00 H new ATOM 0 HD2 HIS A 727 -7.474 6.968 -2.027 1.00 0.00 H new ATOM 0 HE1 HIS A 727 -9.365 3.336 -3.028 1.00 0.00 H new ATOM 1254 N ASP A 728 -2.452 7.166 -2.032 1.00 0.00 N ATOM 1255 CA ASP A 728 -1.030 7.105 -2.444 1.00 0.00 C ATOM 1256 C ASP A 728 -0.138 7.035 -1.205 1.00 0.00 C ATOM 1257 O ASP A 728 -0.008 7.998 -0.478 1.00 0.00 O ATOM 1258 CB ASP A 728 -0.805 8.417 -3.197 1.00 0.00 C ATOM 1259 CG ASP A 728 -1.683 8.430 -4.449 1.00 0.00 C ATOM 1260 OD1 ASP A 728 -2.246 7.394 -4.763 1.00 0.00 O ATOM 1261 OD2 ASP A 728 -1.780 9.475 -5.072 1.00 0.00 O ATOM 0 H ASP A 728 -2.762 8.074 -1.685 1.00 0.00 H new ATOM 0 HA ASP A 728 -0.796 6.232 -3.054 1.00 0.00 H new ATOM 0 HB2 ASP A 728 -1.049 9.265 -2.557 1.00 0.00 H new ATOM 0 HB3 ASP A 728 0.245 8.518 -3.472 1.00 0.00 H new ATOM 1266 N PHE A 729 0.488 5.919 -0.949 1.00 0.00 N ATOM 1267 CA PHE A 729 1.369 5.848 0.253 1.00 0.00 C ATOM 1268 C PHE A 729 2.755 5.378 -0.157 1.00 0.00 C ATOM 1269 O PHE A 729 2.905 4.545 -1.022 1.00 0.00 O ATOM 1270 CB PHE A 729 0.775 4.819 1.231 1.00 0.00 C ATOM 1271 CG PHE A 729 -0.587 4.345 0.790 1.00 0.00 C ATOM 1272 CD1 PHE A 729 -1.645 5.249 0.699 1.00 0.00 C ATOM 1273 CD2 PHE A 729 -0.789 2.994 0.488 1.00 0.00 C ATOM 1274 CE1 PHE A 729 -2.907 4.804 0.308 1.00 0.00 C ATOM 1275 CE2 PHE A 729 -2.054 2.547 0.096 1.00 0.00 C ATOM 1276 CZ PHE A 729 -3.117 3.454 0.006 1.00 0.00 C ATOM 0 H PHE A 729 0.431 5.068 -1.508 1.00 0.00 H new ATOM 0 HA PHE A 729 1.437 6.831 0.718 1.00 0.00 H new ATOM 0 HB2 PHE A 729 1.448 3.965 1.312 1.00 0.00 H new ATOM 0 HB3 PHE A 729 0.701 5.262 2.224 1.00 0.00 H new ATOM 0 HD1 PHE A 729 -1.487 6.292 0.931 1.00 0.00 H new ATOM 0 HD2 PHE A 729 0.033 2.296 0.558 1.00 0.00 H new ATOM 0 HE1 PHE A 729 -3.726 5.504 0.238 1.00 0.00 H new ATOM 0 HE2 PHE A 729 -2.211 1.504 -0.137 1.00 0.00 H new ATOM 0 HZ PHE A 729 -4.096 3.113 -0.296 1.00 0.00 H new ATOM 1286 N LEU A 730 3.772 5.866 0.479 1.00 0.00 N ATOM 1287 CA LEU A 730 5.133 5.386 0.128 1.00 0.00 C ATOM 1288 C LEU A 730 5.528 4.288 1.123 1.00 0.00 C ATOM 1289 O LEU A 730 4.913 4.144 2.162 1.00 0.00 O ATOM 1290 CB LEU A 730 6.046 6.615 0.219 1.00 0.00 C ATOM 1291 CG LEU A 730 5.944 7.245 1.611 1.00 0.00 C ATOM 1292 CD1 LEU A 730 7.334 7.674 2.088 1.00 0.00 C ATOM 1293 CD2 LEU A 730 5.036 8.477 1.552 1.00 0.00 C ATOM 0 H LEU A 730 3.726 6.568 1.218 1.00 0.00 H new ATOM 0 HA LEU A 730 5.200 4.954 -0.871 1.00 0.00 H new ATOM 0 HB2 LEU A 730 7.078 6.327 0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 730 5.764 7.344 -0.540 1.00 0.00 H new ATOM 0 HG LEU A 730 5.529 6.512 2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 730 7.257 8.122 3.079 1.00 0.00 H new ATOM 0 HD12 LEU A 730 7.988 6.803 2.133 1.00 0.00 H new ATOM 0 HD13 LEU A 730 7.749 8.403 1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 730 4.964 8.924 2.544 1.00 0.00 H new ATOM 0 HD22 LEU A 730 5.454 9.204 0.855 1.00 0.00 H new ATOM 0 HD23 LEU A 730 4.043 8.181 1.215 1.00 0.00 H new ATOM 1305 N LEU A 731 6.504 3.475 0.808 1.00 0.00 N ATOM 1306 CA LEU A 731 6.855 2.370 1.756 1.00 0.00 C ATOM 1307 C LEU A 731 8.325 2.369 2.160 1.00 0.00 C ATOM 1308 O LEU A 731 9.214 2.621 1.371 1.00 0.00 O ATOM 1309 CB LEU A 731 6.493 1.095 1.003 1.00 0.00 C ATOM 1310 CG LEU A 731 5.067 1.225 0.455 1.00 0.00 C ATOM 1311 CD1 LEU A 731 4.634 -0.085 -0.199 1.00 0.00 C ATOM 1312 CD2 LEU A 731 4.100 1.569 1.588 1.00 0.00 C ATOM 0 H LEU A 731 7.063 3.524 -0.044 1.00 0.00 H new ATOM 0 HA LEU A 731 6.317 2.478 2.698 1.00 0.00 H new ATOM 0 HB2 LEU A 731 7.196 0.928 0.187 1.00 0.00 H new ATOM 0 HB3 LEU A 731 6.564 0.233 1.667 1.00 0.00 H new ATOM 0 HG LEU A 731 5.052 2.022 -0.289 1.00 0.00 H new ATOM 0 HD11 LEU A 731 3.620 0.019 -0.585 1.00 0.00 H new ATOM 0 HD12 LEU A 731 5.311 -0.324 -1.019 1.00 0.00 H new ATOM 0 HD13 LEU A 731 4.661 -0.887 0.539 1.00 0.00 H new ATOM 0 HD21 LEU A 731 3.090 1.659 1.189 1.00 0.00 H new ATOM 0 HD22 LEU A 731 4.124 0.780 2.339 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.396 2.514 2.044 1.00 0.00 H new ATOM 1324 N ARG A 732 8.560 2.059 3.410 1.00 0.00 N ATOM 1325 CA ARG A 732 9.946 1.998 3.949 1.00 0.00 C ATOM 1326 C ARG A 732 10.213 0.603 4.517 1.00 0.00 C ATOM 1327 O ARG A 732 9.727 0.261 5.582 1.00 0.00 O ATOM 1328 CB ARG A 732 9.975 2.989 5.103 1.00 0.00 C ATOM 1329 CG ARG A 732 9.747 4.408 4.601 1.00 0.00 C ATOM 1330 CD ARG A 732 9.848 5.364 5.788 1.00 0.00 C ATOM 1331 NE ARG A 732 11.230 5.910 5.707 1.00 0.00 N ATOM 1332 CZ ARG A 732 12.235 5.235 6.203 1.00 0.00 C ATOM 1333 NH1 ARG A 732 12.505 5.293 7.481 1.00 0.00 N ATOM 1334 NH2 ARG A 732 12.977 4.513 5.413 1.00 0.00 N ATOM 0 H ARG A 732 7.832 1.842 4.091 1.00 0.00 H new ATOM 0 HA ARG A 732 10.686 2.218 3.179 1.00 0.00 H new ATOM 0 HB2 ARG A 732 9.208 2.728 5.832 1.00 0.00 H new ATOM 0 HB3 ARG A 732 10.935 2.929 5.616 1.00 0.00 H new ATOM 0 HG2 ARG A 732 10.487 4.665 3.843 1.00 0.00 H new ATOM 0 HG3 ARG A 732 8.767 4.491 4.130 1.00 0.00 H new ATOM 0 HD2 ARG A 732 9.103 6.157 5.724 1.00 0.00 H new ATOM 0 HD3 ARG A 732 9.681 4.845 6.732 1.00 0.00 H new ATOM 0 HE ARG A 732 11.394 6.814 5.263 1.00 0.00 H new ATOM 0 HH11 ARG A 732 11.931 5.867 8.098 1.00 0.00 H new ATOM 0 HH12 ARG A 732 13.290 4.764 7.861 1.00 0.00 H new ATOM 0 HH21 ARG A 732 12.773 4.476 4.414 1.00 0.00 H new ATOM 0 HH22 ARG A 732 13.762 3.984 5.793 1.00 0.00 H new ATOM 1348 N GLN A 733 10.972 -0.196 3.833 1.00 0.00 N ATOM 1349 CA GLN A 733 11.260 -1.568 4.338 1.00 0.00 C ATOM 1350 C GLN A 733 11.861 -1.531 5.744 1.00 0.00 C ATOM 1351 O GLN A 733 13.021 -1.232 5.940 1.00 0.00 O ATOM 1352 CB GLN A 733 12.230 -2.144 3.335 1.00 0.00 C ATOM 1353 CG GLN A 733 11.788 -3.566 2.985 1.00 0.00 C ATOM 1354 CD GLN A 733 12.952 -4.538 3.159 1.00 0.00 C ATOM 1355 OE1 GLN A 733 13.827 -4.323 3.975 1.00 0.00 O ATOM 1356 NE2 GLN A 733 13.000 -5.605 2.413 1.00 0.00 N ATOM 0 H GLN A 733 11.409 0.039 2.942 1.00 0.00 H new ATOM 0 HA GLN A 733 10.357 -2.172 4.428 1.00 0.00 H new ATOM 0 HB2 GLN A 733 12.258 -1.525 2.438 1.00 0.00 H new ATOM 0 HB3 GLN A 733 13.239 -2.153 3.747 1.00 0.00 H new ATOM 0 HG2 GLN A 733 10.957 -3.864 3.624 1.00 0.00 H new ATOM 0 HG3 GLN A 733 11.427 -3.600 1.957 1.00 0.00 H new ATOM 0 HE21 GLN A 733 12.264 -5.783 1.729 1.00 0.00 H new ATOM 0 HE22 GLN A 733 13.773 -6.263 2.513 1.00 0.00 H new ATOM 1365 N ARG A 734 11.052 -1.834 6.719 1.00 0.00 N ATOM 1366 CA ARG A 734 11.515 -1.828 8.134 1.00 0.00 C ATOM 1367 C ARG A 734 12.494 -2.979 8.418 1.00 0.00 C ATOM 1368 O ARG A 734 13.506 -2.785 9.061 1.00 0.00 O ATOM 1369 CB ARG A 734 10.231 -1.971 8.957 1.00 0.00 C ATOM 1370 CG ARG A 734 10.580 -1.988 10.443 1.00 0.00 C ATOM 1371 CD ARG A 734 9.426 -1.399 11.256 1.00 0.00 C ATOM 1372 NE ARG A 734 8.264 -2.292 11.010 1.00 0.00 N ATOM 1373 CZ ARG A 734 7.189 -2.140 11.726 1.00 0.00 C ATOM 1374 NH1 ARG A 734 7.299 -1.921 13.005 1.00 0.00 N ATOM 1375 NH2 ARG A 734 6.009 -2.175 11.167 1.00 0.00 N ATOM 0 H ARG A 734 10.073 -2.090 6.593 1.00 0.00 H new ATOM 0 HA ARG A 734 12.065 -0.920 8.379 1.00 0.00 H new ATOM 0 HB2 ARG A 734 9.554 -1.145 8.741 1.00 0.00 H new ATOM 0 HB3 ARG A 734 9.711 -2.889 8.684 1.00 0.00 H new ATOM 0 HG2 ARG A 734 10.780 -3.009 10.767 1.00 0.00 H new ATOM 0 HG3 ARG A 734 11.490 -1.414 10.618 1.00 0.00 H new ATOM 0 HD2 ARG A 734 9.673 -1.362 12.317 1.00 0.00 H new ATOM 0 HD3 ARG A 734 9.208 -0.378 10.943 1.00 0.00 H new ATOM 0 HE ARG A 734 8.309 -3.013 10.290 1.00 0.00 H new ATOM 0 HH11 ARG A 734 8.222 -1.870 13.436 1.00 0.00 H new ATOM 0 HH12 ARG A 734 6.462 -1.800 13.576 1.00 0.00 H new ATOM 0 HH21 ARG A 734 5.925 -2.323 10.161 1.00 0.00 H new ATOM 0 HH22 ARG A 734 5.171 -2.055 11.736 1.00 0.00 H new ATOM 1389 N ARG A 735 12.220 -4.175 7.949 1.00 0.00 N ATOM 1390 CA ARG A 735 13.174 -5.301 8.217 1.00 0.00 C ATOM 1391 C ARG A 735 13.839 -5.755 6.913 1.00 0.00 C ATOM 1392 O ARG A 735 13.649 -6.902 6.540 1.00 0.00 O ATOM 1393 CB ARG A 735 12.335 -6.440 8.805 1.00 0.00 C ATOM 1394 CG ARG A 735 11.726 -5.999 10.134 1.00 0.00 C ATOM 1395 CD ARG A 735 11.216 -7.228 10.882 1.00 0.00 C ATOM 1396 NE ARG A 735 10.554 -6.688 12.098 1.00 0.00 N ATOM 1397 CZ ARG A 735 9.254 -6.596 12.149 1.00 0.00 C ATOM 1398 NH1 ARG A 735 8.545 -7.644 12.464 1.00 0.00 N ATOM 1399 NH2 ARG A 735 8.662 -5.463 11.879 1.00 0.00 N ATOM 1400 OXT ARG A 735 14.531 -4.950 6.312 1.00 0.00 O ATOM 0 H ARG A 735 11.394 -4.418 7.403 1.00 0.00 H new ATOM 0 HA ARG A 735 13.967 -4.995 8.900 1.00 0.00 H new ATOM 0 HB2 ARG A 735 11.546 -6.720 8.108 1.00 0.00 H new ATOM 0 HB3 ARG A 735 12.957 -7.323 8.954 1.00 0.00 H new ATOM 0 HG2 ARG A 735 12.471 -5.476 10.734 1.00 0.00 H new ATOM 0 HG3 ARG A 735 10.909 -5.299 9.959 1.00 0.00 H new ATOM 0 HD2 ARG A 735 10.516 -7.800 10.272 1.00 0.00 H new ATOM 0 HD3 ARG A 735 12.034 -7.900 11.143 1.00 0.00 H new ATOM 0 HE ARG A 735 11.117 -6.389 12.894 1.00 0.00 H new ATOM 0 HH11 ARG A 735 9.007 -8.530 12.669 1.00 0.00 H new ATOM 0 HH12 ARG A 735 7.528 -7.578 12.505 1.00 0.00 H new ATOM 0 HH21 ARG A 735 9.217 -4.645 11.627 1.00 0.00 H new ATOM 0 HH22 ARG A 735 7.645 -5.396 11.920 1.00 0.00 H new TER 1414 ARG A 735