USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 694 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 711 THR OG1 : rot 170:sc= -2.58! USER MOD Set 1.2: A 714 HIS : no HE2:sc= -2.8! C(o=-7!,f=-11!) USER MOD Set 1.3: A 722 MET CE :methyl -171:sc= -1.67! (180deg=-1.75!) USER MOD Set 2.1: A 688 ASN : amide:sc= -10.8! C(o=-11!,f=-13!) USER MOD Set 2.2: A 692 SER OG : rot 157:sc= 0.324 USER MOD Single : A 650 CYS SG : rot 14:sc= 0.141 USER MOD Single : A 656 GLN : amide:sc= -0.554 X(o=-0.55,f=-0.1) USER MOD Single : A 657 MET CE :methyl 177:sc= -7.9! (180deg=-8.21!) USER MOD Single : A 664 SER OG : rot 180:sc= 0.00182 USER MOD Single : A 666 TYR OH : rot 180:sc= 0 USER MOD Single : A 667 LYS NZ :NH3+ -161:sc= -0.499 (180deg=-0.798) USER MOD Single : A 668 SER OG : rot -127:sc= -1.9! 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= -0.0307 X(o=-0.031,f=0) USER MOD Single : A 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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+ -158:sc= -0.0654 (180deg=-0.73) USER MOD Single : A 687 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 ASN : amide:sc= -4.51! C(o=-4.5!,f=-13!) USER MOD Single : A 696 SER OG : rot 151:sc= -0.89 USER MOD Single : A 702 GLN : amide:sc= -13.2! C(o=-13!,f=-16!) USER MOD Single : A 715 SER OG : rot 180:sc= 0 USER MOD Single : A 717 ASN : amide:sc= -2.13! C(o=-2.1!,f=-3.7!) 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 HE2:sc= -26.7! C(o=-27!,f=-28!) USER MOD Single : A 733 GLN : amide:sc= -14.3! C(o=-14!,f=-23!) USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 649 -19.215 4.328 -6.750 1.00 0.00 N ATOM 33 CA ASP A 649 -17.982 4.872 -7.380 1.00 0.00 C ATOM 34 C ASP A 649 -16.734 4.176 -6.843 1.00 0.00 C ATOM 35 O ASP A 649 -16.692 3.713 -5.720 1.00 0.00 O ATOM 36 CB ASP A 649 -17.970 6.355 -7.020 1.00 0.00 C ATOM 37 CG ASP A 649 -19.126 7.057 -7.733 1.00 0.00 C ATOM 38 OD1 ASP A 649 -19.483 6.615 -8.813 1.00 0.00 O ATOM 39 OD2 ASP A 649 -19.635 8.022 -7.186 1.00 0.00 O ATOM 0 HA ASP A 649 -17.978 4.712 -8.458 1.00 0.00 H new ATOM 0 HB2 ASP A 649 -18.063 6.480 -5.941 1.00 0.00 H new ATOM 0 HB3 ASP A 649 -17.021 6.804 -7.312 1.00 0.00 H new ATOM 44 N CYS A 650 -15.718 4.101 -7.654 1.00 0.00 N ATOM 45 CA CYS A 650 -14.456 3.439 -7.232 1.00 0.00 C ATOM 46 C CYS A 650 -13.386 4.481 -6.921 1.00 0.00 C ATOM 47 O CYS A 650 -13.466 5.618 -7.341 1.00 0.00 O ATOM 48 CB CYS A 650 -14.036 2.595 -8.436 1.00 0.00 C ATOM 49 SG CYS A 650 -13.832 3.659 -9.888 1.00 0.00 S ATOM 0 H CYS A 650 -15.709 4.475 -8.603 1.00 0.00 H new ATOM 0 HA CYS A 650 -14.588 2.840 -6.331 1.00 0.00 H new ATOM 0 HB2 CYS A 650 -13.102 2.076 -8.220 1.00 0.00 H new ATOM 0 HB3 CYS A 650 -14.787 1.831 -8.636 1.00 0.00 H new ATOM 0 HG CYS A 650 -13.795 4.903 -9.513 1.00 0.00 H new ATOM 55 N ARG A 651 -12.373 4.093 -6.205 1.00 0.00 N ATOM 56 CA ARG A 651 -11.279 5.040 -5.887 1.00 0.00 C ATOM 57 C ARG A 651 -9.972 4.399 -6.322 1.00 0.00 C ATOM 58 O ARG A 651 -9.857 3.193 -6.373 1.00 0.00 O ATOM 59 CB ARG A 651 -11.313 5.217 -4.376 1.00 0.00 C ATOM 60 CG ARG A 651 -12.672 5.774 -3.958 1.00 0.00 C ATOM 61 CD ARG A 651 -12.537 6.437 -2.587 1.00 0.00 C ATOM 62 NE ARG A 651 -13.841 6.202 -1.913 1.00 0.00 N ATOM 63 CZ ARG A 651 -13.983 5.176 -1.123 1.00 0.00 C ATOM 64 NH1 ARG A 651 -13.472 4.026 -1.454 1.00 0.00 N ATOM 65 NH2 ARG A 651 -14.632 5.302 -0.001 1.00 0.00 N ATOM 0 H ARG A 651 -12.257 3.154 -5.825 1.00 0.00 H new ATOM 0 HA ARG A 651 -11.380 6.003 -6.388 1.00 0.00 H new ATOM 0 HB2 ARG A 651 -11.133 4.262 -3.883 1.00 0.00 H new ATOM 0 HB3 ARG A 651 -10.518 5.893 -4.061 1.00 0.00 H new ATOM 0 HG2 ARG A 651 -13.025 6.497 -4.693 1.00 0.00 H new ATOM 0 HG3 ARG A 651 -13.411 4.974 -3.918 1.00 0.00 H new ATOM 0 HD2 ARG A 651 -11.715 6.002 -2.018 1.00 0.00 H new ATOM 0 HD3 ARG A 651 -12.329 7.503 -2.683 1.00 0.00 H new ATOM 0 HE ARG A 651 -14.621 6.841 -2.068 1.00 0.00 H new ATOM 0 HH11 ARG A 651 -12.961 3.929 -2.331 1.00 0.00 H new ATOM 0 HH12 ARG A 651 -13.583 3.222 -0.836 1.00 0.00 H new ATOM 0 HH21 ARG A 651 -15.030 6.204 0.260 1.00 0.00 H new ATOM 0 HH22 ARG A 651 -14.743 4.498 0.617 1.00 0.00 H new ATOM 79 N ILE A 652 -8.994 5.173 -6.655 1.00 0.00 N ATOM 80 CA ILE A 652 -7.720 4.568 -7.106 1.00 0.00 C ATOM 81 C ILE A 652 -6.632 4.846 -6.066 1.00 0.00 C ATOM 82 O ILE A 652 -6.654 5.856 -5.392 1.00 0.00 O ATOM 83 CB ILE A 652 -7.451 5.275 -8.422 1.00 0.00 C ATOM 84 CG1 ILE A 652 -7.197 6.759 -8.147 1.00 0.00 C ATOM 85 CG2 ILE A 652 -8.704 5.140 -9.300 1.00 0.00 C ATOM 86 CD1 ILE A 652 -6.399 7.365 -9.298 1.00 0.00 C ATOM 0 H ILE A 652 -9.017 6.193 -6.636 1.00 0.00 H new ATOM 0 HA ILE A 652 -7.748 3.485 -7.226 1.00 0.00 H new ATOM 0 HB ILE A 652 -6.585 4.839 -8.920 1.00 0.00 H new ATOM 0 HG12 ILE A 652 -8.145 7.285 -8.032 1.00 0.00 H new ATOM 0 HG13 ILE A 652 -6.651 6.877 -7.211 1.00 0.00 H new ATOM 0 HG21 ILE A 652 -8.536 5.641 -10.253 1.00 0.00 H new ATOM 0 HG22 ILE A 652 -8.913 4.085 -9.476 1.00 0.00 H new ATOM 0 HG23 ILE A 652 -9.554 5.598 -8.794 1.00 0.00 H new ATOM 0 HD11 ILE A 652 -6.220 8.422 -9.100 1.00 0.00 H new ATOM 0 HD12 ILE A 652 -5.445 6.846 -9.392 1.00 0.00 H new ATOM 0 HD13 ILE A 652 -6.962 7.260 -10.226 1.00 0.00 H new ATOM 98 N ILE A 653 -5.700 3.948 -5.901 1.00 0.00 N ATOM 99 CA ILE A 653 -4.646 4.166 -4.871 1.00 0.00 C ATOM 100 C ILE A 653 -3.264 3.985 -5.485 1.00 0.00 C ATOM 101 O ILE A 653 -3.090 3.275 -6.456 1.00 0.00 O ATOM 102 CB ILE A 653 -4.921 3.108 -3.773 1.00 0.00 C ATOM 103 CG1 ILE A 653 -4.166 1.799 -4.057 1.00 0.00 C ATOM 104 CG2 ILE A 653 -6.413 2.778 -3.746 1.00 0.00 C ATOM 105 CD1 ILE A 653 -3.022 1.613 -3.058 1.00 0.00 C ATOM 0 H ILE A 653 -5.623 3.079 -6.430 1.00 0.00 H new ATOM 0 HA ILE A 653 -4.670 5.175 -4.460 1.00 0.00 H new ATOM 0 HB ILE A 653 -4.587 3.525 -2.823 1.00 0.00 H new ATOM 0 HG12 ILE A 653 -4.853 0.955 -3.994 1.00 0.00 H new ATOM 0 HG13 ILE A 653 -3.771 1.813 -5.073 1.00 0.00 H new ATOM 0 HG21 ILE A 653 -6.607 2.034 -2.974 1.00 0.00 H new ATOM 0 HG22 ILE A 653 -6.982 3.682 -3.530 1.00 0.00 H new ATOM 0 HG23 ILE A 653 -6.716 2.382 -4.715 1.00 0.00 H new ATOM 0 HD11 ILE A 653 -2.498 0.682 -3.274 1.00 0.00 H new ATOM 0 HD12 ILE A 653 -2.326 2.448 -3.142 1.00 0.00 H new ATOM 0 HD13 ILE A 653 -3.425 1.577 -2.046 1.00 0.00 H new ATOM 117 N ARG A 654 -2.282 4.618 -4.926 1.00 0.00 N ATOM 118 CA ARG A 654 -0.916 4.480 -5.476 1.00 0.00 C ATOM 119 C ARG A 654 0.114 4.465 -4.355 1.00 0.00 C ATOM 120 O ARG A 654 0.284 5.424 -3.638 1.00 0.00 O ATOM 121 CB ARG A 654 -0.734 5.710 -6.355 1.00 0.00 C ATOM 122 CG ARG A 654 0.692 5.744 -6.902 1.00 0.00 C ATOM 123 CD ARG A 654 0.835 6.921 -7.863 1.00 0.00 C ATOM 124 NE ARG A 654 1.298 6.317 -9.148 1.00 0.00 N ATOM 125 CZ ARG A 654 0.472 5.621 -9.885 1.00 0.00 C ATOM 126 NH1 ARG A 654 -0.816 5.768 -9.749 1.00 0.00 N ATOM 127 NH2 ARG A 654 0.937 4.770 -10.757 1.00 0.00 N ATOM 0 H ARG A 654 -2.366 5.226 -4.111 1.00 0.00 H new ATOM 0 HA ARG A 654 -0.783 3.551 -6.030 1.00 0.00 H new ATOM 0 HB2 ARG A 654 -1.449 5.690 -7.177 1.00 0.00 H new ATOM 0 HB3 ARG A 654 -0.935 6.614 -5.779 1.00 0.00 H new ATOM 0 HG2 ARG A 654 1.406 5.839 -6.084 1.00 0.00 H new ATOM 0 HG3 ARG A 654 0.919 4.810 -7.416 1.00 0.00 H new ATOM 0 HD2 ARG A 654 -0.113 7.443 -7.991 1.00 0.00 H new ATOM 0 HD3 ARG A 654 1.553 7.651 -7.489 1.00 0.00 H new ATOM 0 HE ARG A 654 2.263 6.448 -9.452 1.00 0.00 H new ATOM 0 HH11 ARG A 654 -1.184 6.429 -9.065 1.00 0.00 H new ATOM 0 HH12 ARG A 654 -1.455 5.222 -10.327 1.00 0.00 H new ATOM 0 HH21 ARG A 654 1.944 4.648 -10.864 1.00 0.00 H new ATOM 0 HH22 ARG A 654 0.294 4.227 -11.332 1.00 0.00 H new ATOM 141 N VAL A 655 0.826 3.400 -4.213 1.00 0.00 N ATOM 142 CA VAL A 655 1.857 3.362 -3.155 1.00 0.00 C ATOM 143 C VAL A 655 3.203 3.051 -3.796 1.00 0.00 C ATOM 144 O VAL A 655 3.281 2.734 -4.965 1.00 0.00 O ATOM 145 CB VAL A 655 1.440 2.245 -2.208 1.00 0.00 C ATOM 146 CG1 VAL A 655 2.236 2.361 -0.908 1.00 0.00 C ATOM 147 CG2 VAL A 655 -0.057 2.354 -1.904 1.00 0.00 C ATOM 0 H VAL A 655 0.743 2.555 -4.779 1.00 0.00 H new ATOM 0 HA VAL A 655 1.948 4.308 -2.621 1.00 0.00 H new ATOM 0 HB VAL A 655 1.640 1.281 -2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 655 1.940 1.563 -0.228 1.00 0.00 H new ATOM 0 HG12 VAL A 655 3.301 2.277 -1.125 1.00 0.00 H new ATOM 0 HG13 VAL A 655 2.036 3.327 -0.444 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -0.350 1.552 -1.226 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -0.264 3.317 -1.438 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -0.624 2.270 -2.831 1.00 0.00 H new ATOM 157 N GLN A 656 4.262 3.145 -3.050 1.00 0.00 N ATOM 158 CA GLN A 656 5.600 2.847 -3.633 1.00 0.00 C ATOM 159 C GLN A 656 6.448 2.055 -2.633 1.00 0.00 C ATOM 160 O GLN A 656 6.670 2.482 -1.516 1.00 0.00 O ATOM 161 CB GLN A 656 6.255 4.210 -3.895 1.00 0.00 C ATOM 162 CG GLN A 656 5.625 4.896 -5.114 1.00 0.00 C ATOM 163 CD GLN A 656 5.696 6.411 -4.919 1.00 0.00 C ATOM 164 OE1 GLN A 656 6.206 7.124 -5.760 1.00 0.00 O ATOM 165 NE2 GLN A 656 5.208 6.932 -3.829 1.00 0.00 N ATOM 0 H GLN A 656 4.263 3.414 -2.066 1.00 0.00 H new ATOM 0 HA GLN A 656 5.514 2.252 -4.542 1.00 0.00 H new ATOM 0 HB2 GLN A 656 6.143 4.846 -3.017 1.00 0.00 H new ATOM 0 HB3 GLN A 656 7.324 4.078 -4.059 1.00 0.00 H new ATOM 0 HG2 GLN A 656 6.152 4.608 -6.023 1.00 0.00 H new ATOM 0 HG3 GLN A 656 4.589 4.579 -5.232 1.00 0.00 H new ATOM 0 HE21 GLN A 656 4.780 6.332 -3.124 1.00 0.00 H new ATOM 0 HE22 GLN A 656 5.254 7.940 -3.681 1.00 0.00 H new ATOM 174 N MET A 657 6.960 0.926 -3.035 1.00 0.00 N ATOM 175 CA MET A 657 7.833 0.140 -2.117 1.00 0.00 C ATOM 176 C MET A 657 9.278 0.322 -2.573 1.00 0.00 C ATOM 177 O MET A 657 9.647 -0.101 -3.643 1.00 0.00 O ATOM 178 CB MET A 657 7.369 -1.313 -2.253 1.00 0.00 C ATOM 179 CG MET A 657 8.269 -2.224 -1.419 1.00 0.00 C ATOM 180 SD MET A 657 7.972 -1.920 0.334 1.00 0.00 S ATOM 181 CE MET A 657 9.511 -1.032 0.667 1.00 0.00 C ATOM 0 H MET A 657 6.813 0.514 -3.956 1.00 0.00 H new ATOM 0 HA MET A 657 7.772 0.454 -1.075 1.00 0.00 H new ATOM 0 HB2 MET A 657 6.335 -1.407 -1.922 1.00 0.00 H new ATOM 0 HB3 MET A 657 7.398 -1.617 -3.299 1.00 0.00 H new ATOM 0 HG2 MET A 657 8.068 -3.269 -1.657 1.00 0.00 H new ATOM 0 HG3 MET A 657 9.316 -2.038 -1.659 1.00 0.00 H new ATOM 0 HE1 MET A 657 9.519 -0.694 1.703 1.00 0.00 H new ATOM 0 HE2 MET A 657 10.358 -1.695 0.495 1.00 0.00 H new ATOM 0 HE3 MET A 657 9.584 -0.170 0.004 1.00 0.00 H new ATOM 191 N GLU A 658 10.079 1.002 -1.793 1.00 0.00 N ATOM 192 CA GLU A 658 11.492 1.288 -2.205 1.00 0.00 C ATOM 193 C GLU A 658 12.514 0.294 -1.641 1.00 0.00 C ATOM 194 O GLU A 658 13.691 0.592 -1.600 1.00 0.00 O ATOM 195 CB GLU A 658 11.769 2.671 -1.612 1.00 0.00 C ATOM 196 CG GLU A 658 10.964 3.736 -2.355 1.00 0.00 C ATOM 197 CD GLU A 658 11.288 5.116 -1.771 1.00 0.00 C ATOM 198 OE1 GLU A 658 12.119 5.180 -0.878 1.00 0.00 O ATOM 199 OE2 GLU A 658 10.707 6.086 -2.231 1.00 0.00 O ATOM 0 H GLU A 658 9.815 1.375 -0.881 1.00 0.00 H new ATOM 0 HA GLU A 658 11.592 1.220 -3.288 1.00 0.00 H new ATOM 0 HB2 GLU A 658 11.507 2.680 -0.554 1.00 0.00 H new ATOM 0 HB3 GLU A 658 12.833 2.897 -1.679 1.00 0.00 H new ATOM 0 HG2 GLU A 658 11.203 3.713 -3.418 1.00 0.00 H new ATOM 0 HG3 GLU A 658 9.897 3.531 -2.264 1.00 0.00 H new ATOM 206 N LEU A 659 12.110 -0.842 -1.155 1.00 0.00 N ATOM 207 CA LEU A 659 13.125 -1.751 -0.555 1.00 0.00 C ATOM 208 C LEU A 659 12.721 -3.223 -0.712 1.00 0.00 C ATOM 209 O LEU A 659 11.613 -3.531 -1.100 1.00 0.00 O ATOM 210 CB LEU A 659 13.128 -1.346 0.911 1.00 0.00 C ATOM 211 CG LEU A 659 14.329 -1.983 1.624 1.00 0.00 C ATOM 212 CD1 LEU A 659 15.594 -1.733 0.800 1.00 0.00 C ATOM 213 CD2 LEU A 659 14.517 -1.345 3.005 1.00 0.00 C ATOM 0 H LEU A 659 11.147 -1.177 -1.145 1.00 0.00 H new ATOM 0 HA LEU A 659 14.102 -1.666 -1.030 1.00 0.00 H new ATOM 0 HB2 LEU A 659 13.176 -0.261 0.998 1.00 0.00 H new ATOM 0 HB3 LEU A 659 12.200 -1.663 1.387 1.00 0.00 H new ATOM 0 HG LEU A 659 14.149 -3.053 1.734 1.00 0.00 H new ATOM 0 HD11 LEU A 659 16.450 -2.183 1.302 1.00 0.00 H new ATOM 0 HD12 LEU A 659 15.478 -2.177 -0.189 1.00 0.00 H new ATOM 0 HD13 LEU A 659 15.756 -0.660 0.699 1.00 0.00 H new ATOM 0 HD21 LEU A 659 15.371 -1.803 3.504 1.00 0.00 H new ATOM 0 HD22 LEU A 659 14.694 -0.276 2.891 1.00 0.00 H new ATOM 0 HD23 LEU A 659 13.620 -1.502 3.604 1.00 0.00 H new ATOM 225 N GLY A 660 13.611 -4.135 -0.411 1.00 0.00 N ATOM 226 CA GLY A 660 13.282 -5.584 -0.541 1.00 0.00 C ATOM 227 C GLY A 660 14.513 -6.321 -1.066 1.00 0.00 C ATOM 228 O GLY A 660 15.475 -5.700 -1.472 1.00 0.00 O ATOM 0 H GLY A 660 14.555 -3.936 -0.080 1.00 0.00 H new ATOM 0 HA2 GLY A 660 12.981 -5.991 0.424 1.00 0.00 H new ATOM 0 HA3 GLY A 660 12.441 -5.721 -1.221 1.00 0.00 H new ATOM 232 N GLU A 661 14.503 -7.634 -1.102 1.00 0.00 N ATOM 233 CA GLU A 661 15.697 -8.326 -1.661 1.00 0.00 C ATOM 234 C GLU A 661 15.818 -7.855 -3.104 1.00 0.00 C ATOM 235 O GLU A 661 16.894 -7.635 -3.622 1.00 0.00 O ATOM 236 CB GLU A 661 15.430 -9.834 -1.581 1.00 0.00 C ATOM 237 CG GLU A 661 14.195 -10.197 -2.405 1.00 0.00 C ATOM 238 CD GLU A 661 13.888 -11.683 -2.225 1.00 0.00 C ATOM 239 OE1 GLU A 661 13.806 -12.116 -1.088 1.00 0.00 O ATOM 240 OE2 GLU A 661 13.741 -12.363 -3.227 1.00 0.00 O ATOM 0 H GLU A 661 13.745 -8.235 -0.779 1.00 0.00 H new ATOM 0 HA GLU A 661 16.621 -8.110 -1.125 1.00 0.00 H new ATOM 0 HB2 GLU A 661 16.296 -10.384 -1.949 1.00 0.00 H new ATOM 0 HB3 GLU A 661 15.283 -10.130 -0.542 1.00 0.00 H new ATOM 0 HG2 GLU A 661 13.342 -9.597 -2.088 1.00 0.00 H new ATOM 0 HG3 GLU A 661 14.368 -9.974 -3.458 1.00 0.00 H new ATOM 247 N ASP A 662 14.693 -7.636 -3.730 1.00 0.00 N ATOM 248 CA ASP A 662 14.696 -7.100 -5.115 1.00 0.00 C ATOM 249 C ASP A 662 14.290 -5.625 -5.058 1.00 0.00 C ATOM 250 O ASP A 662 14.690 -4.828 -5.881 1.00 0.00 O ATOM 251 CB ASP A 662 13.664 -7.919 -5.895 1.00 0.00 C ATOM 252 CG ASP A 662 14.195 -9.336 -6.139 1.00 0.00 C ATOM 253 OD1 ASP A 662 15.383 -9.545 -5.952 1.00 0.00 O ATOM 254 OD2 ASP A 662 13.402 -10.188 -6.509 1.00 0.00 O ATOM 0 H ASP A 662 13.768 -7.808 -3.336 1.00 0.00 H new ATOM 0 HA ASP A 662 15.673 -7.170 -5.593 1.00 0.00 H new ATOM 0 HB2 ASP A 662 12.727 -7.963 -5.339 1.00 0.00 H new ATOM 0 HB3 ASP A 662 13.447 -7.434 -6.847 1.00 0.00 H new ATOM 259 N GLY A 663 13.507 -5.266 -4.064 1.00 0.00 N ATOM 260 CA GLY A 663 13.070 -3.861 -3.902 1.00 0.00 C ATOM 261 C GLY A 663 12.415 -3.347 -5.179 1.00 0.00 C ATOM 262 O GLY A 663 12.738 -3.748 -6.279 1.00 0.00 O ATOM 0 H GLY A 663 13.153 -5.906 -3.353 1.00 0.00 H new ATOM 0 HA2 GLY A 663 12.367 -3.788 -3.072 1.00 0.00 H new ATOM 0 HA3 GLY A 663 13.927 -3.236 -3.650 1.00 0.00 H new ATOM 266 N SER A 664 11.521 -2.426 -5.030 1.00 0.00 N ATOM 267 CA SER A 664 10.856 -1.816 -6.208 1.00 0.00 C ATOM 268 C SER A 664 10.803 -0.325 -5.951 1.00 0.00 C ATOM 269 O SER A 664 11.410 0.166 -5.022 1.00 0.00 O ATOM 270 CB SER A 664 9.441 -2.404 -6.293 1.00 0.00 C ATOM 271 OG SER A 664 8.817 -1.945 -7.486 1.00 0.00 O ATOM 0 H SER A 664 11.215 -2.061 -4.128 1.00 0.00 H new ATOM 0 HA SER A 664 11.380 -2.012 -7.143 1.00 0.00 H new ATOM 0 HB2 SER A 664 9.485 -3.493 -6.287 1.00 0.00 H new ATOM 0 HB3 SER A 664 8.856 -2.104 -5.423 1.00 0.00 H new ATOM 0 HG SER A 664 7.913 -2.319 -7.547 1.00 0.00 H new ATOM 277 N VAL A 665 10.108 0.408 -6.746 1.00 0.00 N ATOM 278 CA VAL A 665 10.050 1.867 -6.497 1.00 0.00 C ATOM 279 C VAL A 665 8.636 2.393 -6.736 1.00 0.00 C ATOM 280 O VAL A 665 8.390 3.575 -6.639 1.00 0.00 O ATOM 281 CB VAL A 665 11.037 2.460 -7.493 1.00 0.00 C ATOM 282 CG1 VAL A 665 12.436 1.914 -7.190 1.00 0.00 C ATOM 283 CG2 VAL A 665 10.615 2.054 -8.903 1.00 0.00 C ATOM 0 H VAL A 665 9.580 0.073 -7.552 1.00 0.00 H new ATOM 0 HA VAL A 665 10.300 2.131 -5.469 1.00 0.00 H new ATOM 0 HB VAL A 665 11.049 3.547 -7.416 1.00 0.00 H new ATOM 0 HG11 VAL A 665 13.151 2.333 -7.898 1.00 0.00 H new ATOM 0 HG12 VAL A 665 12.724 2.193 -6.176 1.00 0.00 H new ATOM 0 HG13 VAL A 665 12.430 0.828 -7.280 1.00 0.00 H new ATOM 0 HG21 VAL A 665 11.314 2.473 -9.627 1.00 0.00 H new ATOM 0 HG22 VAL A 665 10.616 0.967 -8.984 1.00 0.00 H new ATOM 0 HG23 VAL A 665 9.613 2.432 -9.106 1.00 0.00 H new ATOM 293 N TYR A 666 7.701 1.534 -7.059 1.00 0.00 N ATOM 294 CA TYR A 666 6.320 2.031 -7.308 1.00 0.00 C ATOM 295 C TYR A 666 5.271 0.973 -6.944 1.00 0.00 C ATOM 296 O TYR A 666 5.592 -0.152 -6.614 1.00 0.00 O ATOM 297 CB TYR A 666 6.274 2.324 -8.811 1.00 0.00 C ATOM 298 CG TYR A 666 5.934 1.059 -9.564 1.00 0.00 C ATOM 299 CD1 TYR A 666 6.940 0.177 -9.981 1.00 0.00 C ATOM 300 CD2 TYR A 666 4.593 0.768 -9.830 1.00 0.00 C ATOM 301 CE1 TYR A 666 6.598 -0.992 -10.666 1.00 0.00 C ATOM 302 CE2 TYR A 666 4.251 -0.398 -10.513 1.00 0.00 C ATOM 303 CZ TYR A 666 5.253 -1.281 -10.933 1.00 0.00 C ATOM 304 OH TYR A 666 4.916 -2.432 -11.614 1.00 0.00 O ATOM 0 H TYR A 666 7.834 0.528 -7.159 1.00 0.00 H new ATOM 0 HA TYR A 666 6.095 2.908 -6.701 1.00 0.00 H new ATOM 0 HB2 TYR A 666 5.531 3.094 -9.019 1.00 0.00 H new ATOM 0 HB3 TYR A 666 7.236 2.711 -9.146 1.00 0.00 H new ATOM 0 HD1 TYR A 666 7.976 0.400 -9.774 1.00 0.00 H new ATOM 0 HD2 TYR A 666 3.820 1.448 -9.505 1.00 0.00 H new ATOM 0 HE1 TYR A 666 7.371 -1.673 -10.990 1.00 0.00 H new ATOM 0 HE2 TYR A 666 3.214 -0.620 -10.718 1.00 0.00 H new ATOM 0 HH TYR A 666 3.942 -2.480 -11.714 1.00 0.00 H new ATOM 314 N LYS A 667 4.019 1.340 -7.039 1.00 0.00 N ATOM 315 CA LYS A 667 2.908 0.387 -6.743 1.00 0.00 C ATOM 316 C LYS A 667 1.548 1.093 -6.898 1.00 0.00 C ATOM 317 O LYS A 667 1.066 1.713 -5.982 1.00 0.00 O ATOM 318 CB LYS A 667 3.127 -0.072 -5.291 1.00 0.00 C ATOM 319 CG LYS A 667 1.802 -0.544 -4.681 1.00 0.00 C ATOM 320 CD LYS A 667 1.008 -1.338 -5.722 1.00 0.00 C ATOM 321 CE LYS A 667 0.322 -2.522 -5.051 1.00 0.00 C ATOM 322 NZ LYS A 667 0.300 -3.585 -6.093 1.00 0.00 N ATOM 0 H LYS A 667 3.715 2.274 -7.313 1.00 0.00 H new ATOM 0 HA LYS A 667 2.905 -0.461 -7.428 1.00 0.00 H new ATOM 0 HB2 LYS A 667 3.857 -0.881 -5.263 1.00 0.00 H new ATOM 0 HB3 LYS A 667 3.537 0.747 -4.700 1.00 0.00 H new ATOM 0 HG2 LYS A 667 1.994 -1.164 -3.806 1.00 0.00 H new ATOM 0 HG3 LYS A 667 1.220 0.314 -4.343 1.00 0.00 H new ATOM 0 HD2 LYS A 667 0.265 -0.695 -6.195 1.00 0.00 H new ATOM 0 HD3 LYS A 667 1.673 -1.690 -6.510 1.00 0.00 H new ATOM 0 HE2 LYS A 667 0.868 -2.847 -4.165 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -0.686 -2.264 -4.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -0.416 -4.298 -5.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 0.066 -3.163 -7.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 1.235 -4.038 -6.147 1.00 0.00 H new ATOM 336 N SER A 668 0.915 0.989 -8.035 1.00 0.00 N ATOM 337 CA SER A 668 -0.416 1.652 -8.203 1.00 0.00 C ATOM 338 C SER A 668 -1.497 0.604 -8.489 1.00 0.00 C ATOM 339 O SER A 668 -1.311 -0.282 -9.298 1.00 0.00 O ATOM 340 CB SER A 668 -0.247 2.584 -9.399 1.00 0.00 C ATOM 341 OG SER A 668 -1.409 3.394 -9.532 1.00 0.00 O ATOM 0 H SER A 668 1.256 0.479 -8.850 1.00 0.00 H new ATOM 0 HA SER A 668 -0.724 2.191 -7.307 1.00 0.00 H new ATOM 0 HB2 SER A 668 0.634 3.211 -9.264 1.00 0.00 H new ATOM 0 HB3 SER A 668 -0.089 2.003 -10.308 1.00 0.00 H new ATOM 0 HG SER A 668 -1.755 3.322 -10.446 1.00 0.00 H new ATOM 347 N ILE A 669 -2.624 0.690 -7.825 1.00 0.00 N ATOM 348 CA ILE A 669 -3.702 -0.317 -8.066 1.00 0.00 C ATOM 349 C ILE A 669 -5.078 0.356 -8.172 1.00 0.00 C ATOM 350 O ILE A 669 -5.297 1.437 -7.659 1.00 0.00 O ATOM 351 CB ILE A 669 -3.659 -1.239 -6.846 1.00 0.00 C ATOM 352 CG1 ILE A 669 -4.513 -2.475 -7.111 1.00 0.00 C ATOM 353 CG2 ILE A 669 -4.209 -0.517 -5.615 1.00 0.00 C ATOM 354 CD1 ILE A 669 -4.362 -3.443 -5.940 1.00 0.00 C ATOM 0 H ILE A 669 -2.842 1.407 -7.133 1.00 0.00 H new ATOM 0 HA ILE A 669 -3.547 -0.853 -9.002 1.00 0.00 H new ATOM 0 HB ILE A 669 -2.624 -1.528 -6.664 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -5.558 -2.191 -7.233 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -4.203 -2.955 -8.039 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -4.172 -1.185 -4.755 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.606 0.368 -5.413 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -5.241 -0.219 -5.799 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -4.969 -4.330 -6.121 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -3.316 -3.733 -5.840 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -4.693 -2.958 -5.022 1.00 0.00 H new ATOM 366 N LEU A 670 -6.015 -0.287 -8.814 1.00 0.00 N ATOM 367 CA LEU A 670 -7.379 0.304 -8.923 1.00 0.00 C ATOM 368 C LEU A 670 -8.204 -0.122 -7.705 1.00 0.00 C ATOM 369 O LEU A 670 -8.202 -1.275 -7.320 1.00 0.00 O ATOM 370 CB LEU A 670 -7.970 -0.268 -10.215 1.00 0.00 C ATOM 371 CG LEU A 670 -9.342 0.361 -10.469 1.00 0.00 C ATOM 372 CD1 LEU A 670 -10.351 -0.235 -9.492 1.00 0.00 C ATOM 373 CD2 LEU A 670 -9.259 1.877 -10.251 1.00 0.00 C ATOM 0 H LEU A 670 -5.896 -1.193 -9.266 1.00 0.00 H new ATOM 0 HA LEU A 670 -7.369 1.394 -8.949 1.00 0.00 H new ATOM 0 HB2 LEU A 670 -7.304 -0.065 -11.054 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -8.063 -1.351 -10.137 1.00 0.00 H new ATOM 0 HG LEU A 670 -9.654 0.159 -11.494 1.00 0.00 H new ATOM 0 HD11 LEU A 670 -11.332 0.208 -9.666 1.00 0.00 H new ATOM 0 HD12 LEU A 670 -10.408 -1.313 -9.641 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -10.035 -0.026 -8.470 1.00 0.00 H new ATOM 0 HD21 LEU A 670 -10.236 2.325 -10.432 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -8.951 2.081 -9.226 1.00 0.00 H new ATOM 0 HD23 LEU A 670 -8.531 2.304 -10.940 1.00 0.00 H new ATOM 385 N VAL A 671 -8.892 0.797 -7.078 1.00 0.00 N ATOM 386 CA VAL A 671 -9.691 0.428 -5.867 1.00 0.00 C ATOM 387 C VAL A 671 -11.191 0.642 -6.104 1.00 0.00 C ATOM 388 O VAL A 671 -11.613 1.253 -7.062 1.00 0.00 O ATOM 389 CB VAL A 671 -9.162 1.354 -4.739 1.00 0.00 C ATOM 390 CG1 VAL A 671 -10.302 2.036 -3.963 1.00 0.00 C ATOM 391 CG2 VAL A 671 -8.334 0.534 -3.749 1.00 0.00 C ATOM 0 H VAL A 671 -8.937 1.780 -7.348 1.00 0.00 H new ATOM 0 HA VAL A 671 -9.580 -0.626 -5.613 1.00 0.00 H new ATOM 0 HB VAL A 671 -8.557 2.126 -5.215 1.00 0.00 H new ATOM 0 HG11 VAL A 671 -9.882 2.673 -3.185 1.00 0.00 H new ATOM 0 HG12 VAL A 671 -10.896 2.642 -4.647 1.00 0.00 H new ATOM 0 HG13 VAL A 671 -10.937 1.276 -3.507 1.00 0.00 H new ATOM 0 HG21 VAL A 671 -7.963 1.185 -2.958 1.00 0.00 H new ATOM 0 HG22 VAL A 671 -8.957 -0.248 -3.314 1.00 0.00 H new ATOM 0 HG23 VAL A 671 -7.491 0.079 -4.269 1.00 0.00 H new ATOM 401 N THR A 672 -11.983 0.165 -5.187 1.00 0.00 N ATOM 402 CA THR A 672 -13.464 0.340 -5.268 1.00 0.00 C ATOM 403 C THR A 672 -13.936 1.009 -3.978 1.00 0.00 C ATOM 404 O THR A 672 -13.175 1.160 -3.043 1.00 0.00 O ATOM 405 CB THR A 672 -14.045 -1.066 -5.395 1.00 0.00 C ATOM 406 OG1 THR A 672 -13.543 -1.676 -6.576 1.00 0.00 O ATOM 407 CG2 THR A 672 -15.573 -0.981 -5.465 1.00 0.00 C ATOM 0 H THR A 672 -11.662 -0.350 -4.367 1.00 0.00 H new ATOM 0 HA THR A 672 -13.776 0.959 -6.109 1.00 0.00 H new ATOM 0 HB THR A 672 -13.758 -1.663 -4.529 1.00 0.00 H new ATOM 0 HG1 THR A 672 -13.913 -2.580 -6.660 1.00 0.00 H new ATOM 0 HG21 THR A 672 -15.989 -1.984 -5.556 1.00 0.00 H new ATOM 0 HG22 THR A 672 -15.953 -0.511 -4.558 1.00 0.00 H new ATOM 0 HG23 THR A 672 -15.865 -0.387 -6.331 1.00 0.00 H new ATOM 415 N SER A 673 -15.163 1.435 -3.908 1.00 0.00 N ATOM 416 CA SER A 673 -15.618 2.113 -2.660 1.00 0.00 C ATOM 417 C SER A 673 -15.479 1.192 -1.430 1.00 0.00 C ATOM 418 O SER A 673 -15.175 1.649 -0.346 1.00 0.00 O ATOM 419 CB SER A 673 -17.090 2.452 -2.893 1.00 0.00 C ATOM 420 OG SER A 673 -17.543 3.302 -1.845 1.00 0.00 O ATOM 0 H SER A 673 -15.862 1.347 -4.645 1.00 0.00 H new ATOM 0 HA SER A 673 -15.013 2.997 -2.456 1.00 0.00 H new ATOM 0 HB2 SER A 673 -17.214 2.945 -3.857 1.00 0.00 H new ATOM 0 HB3 SER A 673 -17.686 1.540 -2.922 1.00 0.00 H new ATOM 0 HG SER A 673 -18.486 3.525 -1.989 1.00 0.00 H new ATOM 426 N GLN A 674 -15.732 -0.085 -1.568 1.00 0.00 N ATOM 427 CA GLN A 674 -15.643 -0.994 -0.374 1.00 0.00 C ATOM 428 C GLN A 674 -14.469 -1.985 -0.473 1.00 0.00 C ATOM 429 O GLN A 674 -14.441 -2.981 0.222 1.00 0.00 O ATOM 430 CB GLN A 674 -16.958 -1.756 -0.401 1.00 0.00 C ATOM 431 CG GLN A 674 -18.113 -0.760 -0.439 1.00 0.00 C ATOM 432 CD GLN A 674 -19.097 -1.176 -1.535 1.00 0.00 C ATOM 433 OE1 GLN A 674 -20.184 -1.643 -1.254 1.00 0.00 O ATOM 434 NE2 GLN A 674 -18.752 -1.022 -2.785 1.00 0.00 N ATOM 0 H GLN A 674 -15.994 -0.538 -2.444 1.00 0.00 H new ATOM 0 HA GLN A 674 -15.474 -0.429 0.543 1.00 0.00 H new ATOM 0 HB2 GLN A 674 -16.996 -2.409 -1.273 1.00 0.00 H new ATOM 0 HB3 GLN A 674 -17.041 -2.394 0.479 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -18.617 -0.731 0.527 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -17.737 0.245 -0.633 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -17.840 -0.630 -3.018 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -19.395 -1.294 -3.529 1.00 0.00 H new ATOM 443 N ASP A 675 -13.524 -1.751 -1.337 1.00 0.00 N ATOM 444 CA ASP A 675 -12.389 -2.724 -1.475 1.00 0.00 C ATOM 445 C ASP A 675 -11.128 -2.289 -0.708 1.00 0.00 C ATOM 446 O ASP A 675 -10.514 -1.293 -1.027 1.00 0.00 O ATOM 447 CB ASP A 675 -12.086 -2.748 -2.971 1.00 0.00 C ATOM 448 CG ASP A 675 -10.909 -3.685 -3.228 1.00 0.00 C ATOM 449 OD1 ASP A 675 -10.409 -4.248 -2.267 1.00 0.00 O ATOM 450 OD2 ASP A 675 -10.528 -3.824 -4.376 1.00 0.00 O ATOM 0 H ASP A 675 -13.481 -0.938 -1.952 1.00 0.00 H new ATOM 0 HA ASP A 675 -12.667 -3.694 -1.062 1.00 0.00 H new ATOM 0 HB2 ASP A 675 -12.962 -3.083 -3.527 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -11.851 -1.744 -3.323 1.00 0.00 H new ATOM 455 N LYS A 676 -10.707 -3.056 0.274 1.00 0.00 N ATOM 456 CA LYS A 676 -9.462 -2.703 1.014 1.00 0.00 C ATOM 457 C LYS A 676 -8.251 -3.251 0.237 1.00 0.00 C ATOM 458 O LYS A 676 -7.931 -4.420 0.332 1.00 0.00 O ATOM 459 CB LYS A 676 -9.586 -3.434 2.352 1.00 0.00 C ATOM 460 CG LYS A 676 -10.901 -3.053 3.032 1.00 0.00 C ATOM 461 CD LYS A 676 -11.445 -4.267 3.800 1.00 0.00 C ATOM 462 CE LYS A 676 -12.977 -4.233 3.807 1.00 0.00 C ATOM 463 NZ LYS A 676 -13.389 -5.571 4.317 1.00 0.00 N ATOM 0 H LYS A 676 -11.174 -3.906 0.590 1.00 0.00 H new ATOM 0 HA LYS A 676 -9.332 -1.628 1.141 1.00 0.00 H new ATOM 0 HB2 LYS A 676 -9.548 -4.512 2.193 1.00 0.00 H new ATOM 0 HB3 LYS A 676 -8.745 -3.177 2.996 1.00 0.00 H new ATOM 0 HG2 LYS A 676 -10.742 -2.218 3.714 1.00 0.00 H new ATOM 0 HG3 LYS A 676 -11.626 -2.724 2.288 1.00 0.00 H new ATOM 0 HD2 LYS A 676 -11.095 -5.189 3.336 1.00 0.00 H new ATOM 0 HD3 LYS A 676 -11.067 -4.261 4.822 1.00 0.00 H new ATOM 0 HE2 LYS A 676 -13.351 -3.434 4.447 1.00 0.00 H new ATOM 0 HE3 LYS A 676 -13.373 -4.052 2.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 -14.427 -5.625 4.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 -13.024 -6.311 3.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 -13.004 -5.712 5.273 1.00 0.00 H new ATOM 477 N ALA A 677 -7.580 -2.435 -0.538 1.00 0.00 N ATOM 478 CA ALA A 677 -6.406 -2.952 -1.317 1.00 0.00 C ATOM 479 C ALA A 677 -5.019 -2.583 -0.735 1.00 0.00 C ATOM 480 O ALA A 677 -4.031 -2.901 -1.365 1.00 0.00 O ATOM 481 CB ALA A 677 -6.552 -2.326 -2.703 1.00 0.00 C ATOM 0 H ALA A 677 -7.789 -1.445 -0.666 1.00 0.00 H new ATOM 0 HA ALA A 677 -6.425 -4.042 -1.303 1.00 0.00 H new ATOM 0 HB1 ALA A 677 -5.730 -2.654 -3.339 1.00 0.00 H new ATOM 0 HB2 ALA A 677 -7.499 -2.637 -3.145 1.00 0.00 H new ATOM 0 HB3 ALA A 677 -6.532 -1.240 -2.616 1.00 0.00 H new ATOM 487 N PRO A 678 -4.924 -1.938 0.414 1.00 0.00 N ATOM 488 CA PRO A 678 -3.579 -1.604 0.928 1.00 0.00 C ATOM 489 C PRO A 678 -2.803 -2.889 1.185 1.00 0.00 C ATOM 490 O PRO A 678 -1.597 -2.940 1.051 1.00 0.00 O ATOM 491 CB PRO A 678 -3.876 -0.865 2.228 1.00 0.00 C ATOM 492 CG PRO A 678 -5.397 -0.823 2.431 1.00 0.00 C ATOM 493 CD PRO A 678 -6.077 -1.527 1.250 1.00 0.00 C ATOM 0 HA PRO A 678 -2.974 -1.010 0.243 1.00 0.00 H new ATOM 0 HB2 PRO A 678 -3.396 -1.368 3.067 1.00 0.00 H new ATOM 0 HB3 PRO A 678 -3.471 0.146 2.189 1.00 0.00 H new ATOM 0 HG2 PRO A 678 -5.666 -1.313 3.367 1.00 0.00 H new ATOM 0 HG3 PRO A 678 -5.739 0.209 2.502 1.00 0.00 H new ATOM 0 HD2 PRO A 678 -6.669 -2.383 1.574 1.00 0.00 H new ATOM 0 HD3 PRO A 678 -6.750 -0.859 0.713 1.00 0.00 H new ATOM 501 N SER A 679 -3.495 -3.935 1.535 1.00 0.00 N ATOM 502 CA SER A 679 -2.806 -5.227 1.781 1.00 0.00 C ATOM 503 C SER A 679 -2.539 -5.921 0.446 1.00 0.00 C ATOM 504 O SER A 679 -1.843 -6.913 0.379 1.00 0.00 O ATOM 505 CB SER A 679 -3.772 -6.042 2.642 1.00 0.00 C ATOM 506 OG SER A 679 -3.883 -5.437 3.922 1.00 0.00 O ATOM 0 H SER A 679 -4.507 -3.950 1.661 1.00 0.00 H new ATOM 0 HA SER A 679 -1.844 -5.105 2.279 1.00 0.00 H new ATOM 0 HB2 SER A 679 -4.750 -6.091 2.164 1.00 0.00 H new ATOM 0 HB3 SER A 679 -3.414 -7.067 2.741 1.00 0.00 H new ATOM 0 HG SER A 679 -4.503 -5.956 4.476 1.00 0.00 H new ATOM 512 N VAL A 680 -3.086 -5.396 -0.623 1.00 0.00 N ATOM 513 CA VAL A 680 -2.863 -6.019 -1.958 1.00 0.00 C ATOM 514 C VAL A 680 -1.353 -6.114 -2.232 1.00 0.00 C ATOM 515 O VAL A 680 -0.898 -6.936 -3.000 1.00 0.00 O ATOM 516 CB VAL A 680 -3.581 -5.092 -2.959 1.00 0.00 C ATOM 517 CG1 VAL A 680 -2.647 -3.972 -3.428 1.00 0.00 C ATOM 518 CG2 VAL A 680 -4.042 -5.910 -4.168 1.00 0.00 C ATOM 0 H VAL A 680 -3.676 -4.564 -0.626 1.00 0.00 H new ATOM 0 HA VAL A 680 -3.252 -7.035 -2.031 1.00 0.00 H new ATOM 0 HB VAL A 680 -4.441 -4.643 -2.463 1.00 0.00 H new ATOM 0 HG11 VAL A 680 -3.174 -3.330 -4.134 1.00 0.00 H new ATOM 0 HG12 VAL A 680 -2.327 -3.382 -2.569 1.00 0.00 H new ATOM 0 HG13 VAL A 680 -1.774 -4.406 -3.915 1.00 0.00 H new ATOM 0 HG21 VAL A 680 -4.550 -5.256 -4.877 1.00 0.00 H new ATOM 0 HG22 VAL A 680 -3.177 -6.366 -4.650 1.00 0.00 H new ATOM 0 HG23 VAL A 680 -4.728 -6.691 -3.839 1.00 0.00 H new ATOM 528 N ILE A 681 -0.567 -5.288 -1.599 1.00 0.00 N ATOM 529 CA ILE A 681 0.908 -5.357 -1.825 1.00 0.00 C ATOM 530 C ILE A 681 1.424 -6.742 -1.433 1.00 0.00 C ATOM 531 O ILE A 681 2.338 -7.264 -2.034 1.00 0.00 O ATOM 532 CB ILE A 681 1.527 -4.294 -0.921 1.00 0.00 C ATOM 533 CG1 ILE A 681 1.043 -2.911 -1.345 1.00 0.00 C ATOM 534 CG2 ILE A 681 3.052 -4.352 -1.045 1.00 0.00 C ATOM 535 CD1 ILE A 681 1.658 -1.868 -0.413 1.00 0.00 C ATOM 0 H ILE A 681 -0.876 -4.573 -0.940 1.00 0.00 H new ATOM 0 HA ILE A 681 1.164 -5.186 -2.871 1.00 0.00 H new ATOM 0 HB ILE A 681 1.231 -4.481 0.111 1.00 0.00 H new ATOM 0 HG12 ILE A 681 1.330 -2.711 -2.377 1.00 0.00 H new ATOM 0 HG13 ILE A 681 -0.045 -2.862 -1.301 1.00 0.00 H new ATOM 0 HG21 ILE A 681 3.498 -3.594 -0.401 1.00 0.00 H new ATOM 0 HG22 ILE A 681 3.404 -5.338 -0.743 1.00 0.00 H new ATOM 0 HG23 ILE A 681 3.340 -4.165 -2.079 1.00 0.00 H new ATOM 0 HD11 ILE A 681 1.320 -0.874 -0.706 1.00 0.00 H new ATOM 0 HD12 ILE A 681 1.349 -2.069 0.613 1.00 0.00 H new ATOM 0 HD13 ILE A 681 2.745 -1.916 -0.480 1.00 0.00 H new ATOM 547 N SER A 682 0.855 -7.338 -0.420 1.00 0.00 N ATOM 548 CA SER A 682 1.317 -8.693 0.005 1.00 0.00 C ATOM 549 C SER A 682 0.958 -9.751 -1.049 1.00 0.00 C ATOM 550 O SER A 682 1.757 -10.610 -1.371 1.00 0.00 O ATOM 551 CB SER A 682 0.579 -8.973 1.310 1.00 0.00 C ATOM 552 OG SER A 682 0.991 -8.032 2.293 1.00 0.00 O ATOM 0 H SER A 682 0.091 -6.947 0.132 1.00 0.00 H new ATOM 0 HA SER A 682 2.400 -8.730 0.126 1.00 0.00 H new ATOM 0 HB2 SER A 682 -0.498 -8.906 1.154 1.00 0.00 H new ATOM 0 HB3 SER A 682 0.789 -9.987 1.650 1.00 0.00 H new ATOM 0 HG SER A 682 0.517 -8.208 3.133 1.00 0.00 H new ATOM 558 N ARG A 683 -0.233 -9.708 -1.594 1.00 0.00 N ATOM 559 CA ARG A 683 -0.595 -10.727 -2.619 1.00 0.00 C ATOM 560 C ARG A 683 0.264 -10.485 -3.863 1.00 0.00 C ATOM 561 O ARG A 683 0.845 -11.398 -4.429 1.00 0.00 O ATOM 562 CB ARG A 683 -2.097 -10.541 -2.887 1.00 0.00 C ATOM 563 CG ARG A 683 -2.353 -9.375 -3.842 1.00 0.00 C ATOM 564 CD ARG A 683 -3.796 -9.456 -4.336 1.00 0.00 C ATOM 565 NE ARG A 683 -4.620 -9.391 -3.099 1.00 0.00 N ATOM 566 CZ ARG A 683 -5.697 -10.116 -2.996 1.00 0.00 C ATOM 567 NH1 ARG A 683 -5.656 -11.386 -3.287 1.00 0.00 N ATOM 568 NH2 ARG A 683 -6.814 -9.570 -2.601 1.00 0.00 N ATOM 0 H ARG A 683 -0.957 -9.023 -1.377 1.00 0.00 H new ATOM 0 HA ARG A 683 -0.410 -11.753 -2.300 1.00 0.00 H new ATOM 0 HB2 ARG A 683 -2.509 -11.457 -3.310 1.00 0.00 H new ATOM 0 HB3 ARG A 683 -2.617 -10.363 -1.946 1.00 0.00 H new ATOM 0 HG2 ARG A 683 -2.180 -8.426 -3.335 1.00 0.00 H new ATOM 0 HG3 ARG A 683 -1.662 -9.417 -4.684 1.00 0.00 H new ATOM 0 HD2 ARG A 683 -4.030 -8.634 -5.012 1.00 0.00 H new ATOM 0 HD3 ARG A 683 -3.976 -10.381 -4.884 1.00 0.00 H new ATOM 0 HE ARG A 683 -4.342 -8.779 -2.332 1.00 0.00 H new ATOM 0 HH11 ARG A 683 -4.781 -11.811 -3.595 1.00 0.00 H new ATOM 0 HH12 ARG A 683 -6.499 -11.955 -3.207 1.00 0.00 H new ATOM 0 HH21 ARG A 683 -6.843 -8.576 -2.373 1.00 0.00 H new ATOM 0 HH22 ARG A 683 -7.658 -10.137 -2.520 1.00 0.00 H new ATOM 582 N VAL A 684 0.399 -9.250 -4.260 1.00 0.00 N ATOM 583 CA VAL A 684 1.275 -8.948 -5.419 1.00 0.00 C ATOM 584 C VAL A 684 2.714 -9.199 -4.996 1.00 0.00 C ATOM 585 O VAL A 684 3.571 -9.465 -5.808 1.00 0.00 O ATOM 586 CB VAL A 684 1.073 -7.466 -5.744 1.00 0.00 C ATOM 587 CG1 VAL A 684 -0.355 -7.235 -6.222 1.00 0.00 C ATOM 588 CG2 VAL A 684 1.323 -6.639 -4.498 1.00 0.00 C ATOM 0 H VAL A 684 -0.057 -8.444 -3.833 1.00 0.00 H new ATOM 0 HA VAL A 684 1.045 -9.564 -6.289 1.00 0.00 H new ATOM 0 HB VAL A 684 1.770 -7.171 -6.528 1.00 0.00 H new ATOM 0 HG11 VAL A 684 -0.495 -6.179 -6.452 1.00 0.00 H new ATOM 0 HG12 VAL A 684 -0.540 -7.829 -7.117 1.00 0.00 H new ATOM 0 HG13 VAL A 684 -1.053 -7.531 -5.439 1.00 0.00 H new ATOM 0 HG21 VAL A 684 1.180 -5.583 -4.727 1.00 0.00 H new ATOM 0 HG22 VAL A 684 0.625 -6.939 -3.716 1.00 0.00 H new ATOM 0 HG23 VAL A 684 2.344 -6.800 -4.153 1.00 0.00 H new ATOM 598 N LEU A 685 2.988 -9.107 -3.718 1.00 0.00 N ATOM 599 CA LEU A 685 4.379 -9.335 -3.261 1.00 0.00 C ATOM 600 C LEU A 685 4.835 -10.728 -3.667 1.00 0.00 C ATOM 601 O LEU A 685 5.845 -10.889 -4.305 1.00 0.00 O ATOM 602 CB LEU A 685 4.350 -9.221 -1.737 1.00 0.00 C ATOM 603 CG LEU A 685 5.376 -8.180 -1.291 1.00 0.00 C ATOM 604 CD1 LEU A 685 6.731 -8.495 -1.928 1.00 0.00 C ATOM 605 CD2 LEU A 685 4.914 -6.792 -1.736 1.00 0.00 C ATOM 0 H LEU A 685 2.313 -8.886 -2.985 1.00 0.00 H new ATOM 0 HA LEU A 685 5.068 -8.615 -3.703 1.00 0.00 H new ATOM 0 HB2 LEU A 685 3.354 -8.934 -1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 685 4.574 -10.187 -1.284 1.00 0.00 H new ATOM 0 HG LEU A 685 5.472 -8.202 -0.205 1.00 0.00 H new ATOM 0 HD11 LEU A 685 7.464 -7.753 -1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 685 7.059 -9.486 -1.614 1.00 0.00 H new ATOM 0 HD13 LEU A 685 6.637 -8.471 -3.014 1.00 0.00 H new ATOM 0 HD21 LEU A 685 5.644 -6.047 -1.419 1.00 0.00 H new ATOM 0 HD22 LEU A 685 4.821 -6.770 -2.822 1.00 0.00 H new ATOM 0 HD23 LEU A 685 3.948 -6.568 -1.284 1.00 0.00 H new ATOM 617 N LYS A 686 4.092 -11.741 -3.327 1.00 0.00 N ATOM 618 CA LYS A 686 4.519 -13.110 -3.718 1.00 0.00 C ATOM 619 C LYS A 686 4.565 -13.220 -5.231 1.00 0.00 C ATOM 620 O LYS A 686 5.498 -13.753 -5.797 1.00 0.00 O ATOM 621 CB LYS A 686 3.444 -14.046 -3.166 1.00 0.00 C ATOM 622 CG LYS A 686 3.464 -14.017 -1.640 1.00 0.00 C ATOM 623 CD LYS A 686 2.423 -15.003 -1.107 1.00 0.00 C ATOM 624 CE LYS A 686 2.457 -15.013 0.421 1.00 0.00 C ATOM 625 NZ LYS A 686 3.746 -15.669 0.773 1.00 0.00 N ATOM 0 H LYS A 686 3.219 -11.683 -2.802 1.00 0.00 H new ATOM 0 HA LYS A 686 5.509 -13.354 -3.334 1.00 0.00 H new ATOM 0 HB2 LYS A 686 2.463 -13.743 -3.531 1.00 0.00 H new ATOM 0 HB3 LYS A 686 3.616 -15.062 -3.521 1.00 0.00 H new ATOM 0 HG2 LYS A 686 4.455 -14.281 -1.272 1.00 0.00 H new ATOM 0 HG3 LYS A 686 3.248 -13.011 -1.280 1.00 0.00 H new ATOM 0 HD2 LYS A 686 1.430 -14.722 -1.456 1.00 0.00 H new ATOM 0 HD3 LYS A 686 2.625 -16.003 -1.491 1.00 0.00 H new ATOM 0 HE2 LYS A 686 2.406 -14.001 0.824 1.00 0.00 H new ATOM 0 HE3 LYS A 686 1.610 -15.562 0.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 686 3.690 -16.048 1.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 686 3.934 -16.445 0.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 686 4.516 -14.972 0.718 1.00 0.00 H new ATOM 639 N LYS A 687 3.572 -12.714 -5.898 1.00 0.00 N ATOM 640 CA LYS A 687 3.585 -12.801 -7.379 1.00 0.00 C ATOM 641 C LYS A 687 4.651 -11.872 -7.957 1.00 0.00 C ATOM 642 O LYS A 687 5.208 -12.130 -9.003 1.00 0.00 O ATOM 643 CB LYS A 687 2.203 -12.347 -7.832 1.00 0.00 C ATOM 644 CG LYS A 687 2.089 -12.571 -9.340 1.00 0.00 C ATOM 645 CD LYS A 687 1.852 -14.056 -9.610 1.00 0.00 C ATOM 646 CE LYS A 687 1.782 -14.285 -11.119 1.00 0.00 C ATOM 647 NZ LYS A 687 1.476 -15.736 -11.291 1.00 0.00 N ATOM 0 H LYS A 687 2.761 -12.249 -5.489 1.00 0.00 H new ATOM 0 HA LYS A 687 3.813 -13.812 -7.717 1.00 0.00 H new ATOM 0 HB2 LYS A 687 1.429 -12.907 -7.306 1.00 0.00 H new ATOM 0 HB3 LYS A 687 2.053 -11.294 -7.593 1.00 0.00 H new ATOM 0 HG2 LYS A 687 1.269 -11.980 -9.747 1.00 0.00 H new ATOM 0 HG3 LYS A 687 2.999 -12.239 -9.839 1.00 0.00 H new ATOM 0 HD2 LYS A 687 2.657 -14.650 -9.176 1.00 0.00 H new ATOM 0 HD3 LYS A 687 0.925 -14.381 -9.137 1.00 0.00 H new ATOM 0 HE2 LYS A 687 1.010 -13.665 -11.574 1.00 0.00 H new ATOM 0 HE3 LYS A 687 2.725 -14.024 -11.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 1.414 -15.960 -12.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 2.231 -16.304 -10.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 0.569 -15.956 -10.832 1.00 0.00 H new ATOM 661 N ASN A 688 4.906 -10.768 -7.308 1.00 0.00 N ATOM 662 CA ASN A 688 5.900 -9.799 -7.853 1.00 0.00 C ATOM 663 C ASN A 688 7.126 -9.642 -6.926 1.00 0.00 C ATOM 664 O ASN A 688 7.822 -8.646 -6.980 1.00 0.00 O ATOM 665 CB ASN A 688 5.094 -8.490 -7.988 1.00 0.00 C ATOM 666 CG ASN A 688 5.421 -7.509 -6.861 1.00 0.00 C ATOM 667 OD1 ASN A 688 5.630 -6.337 -7.101 1.00 0.00 O ATOM 668 ND2 ASN A 688 5.451 -7.941 -5.638 1.00 0.00 N ATOM 0 H ASN A 688 4.471 -10.496 -6.427 1.00 0.00 H new ATOM 0 HA ASN A 688 6.327 -10.123 -8.802 1.00 0.00 H new ATOM 0 HB2 ASN A 688 5.311 -8.026 -8.950 1.00 0.00 H new ATOM 0 HB3 ASN A 688 4.028 -8.716 -7.977 1.00 0.00 H new ATOM 0 HD21 ASN A 688 5.651 -7.296 -4.874 1.00 0.00 H new ATOM 0 HD22 ASN A 688 5.275 -8.926 -5.441 1.00 0.00 H new ATOM 675 N ASN A 689 7.414 -10.612 -6.089 1.00 0.00 N ATOM 676 CA ASN A 689 8.613 -10.482 -5.198 1.00 0.00 C ATOM 677 C ASN A 689 9.869 -10.927 -5.940 1.00 0.00 C ATOM 678 O ASN A 689 10.976 -10.716 -5.485 1.00 0.00 O ATOM 679 CB ASN A 689 8.375 -11.404 -4.000 1.00 0.00 C ATOM 680 CG ASN A 689 8.133 -12.827 -4.504 1.00 0.00 C ATOM 681 OD1 ASN A 689 8.340 -13.113 -5.667 1.00 0.00 O ATOM 682 ND2 ASN A 689 7.695 -13.735 -3.680 1.00 0.00 N ATOM 0 H ASN A 689 6.880 -11.475 -5.984 1.00 0.00 H new ATOM 0 HA ASN A 689 8.752 -9.448 -4.884 1.00 0.00 H new ATOM 0 HB2 ASN A 689 9.236 -11.383 -3.332 1.00 0.00 H new ATOM 0 HB3 ASN A 689 7.517 -11.058 -3.424 1.00 0.00 H new ATOM 0 HD21 ASN A 689 7.526 -14.685 -4.011 1.00 0.00 H new ATOM 0 HD22 ASN A 689 7.521 -13.496 -2.704 1.00 0.00 H new ATOM 689 N ARG A 690 9.715 -11.504 -7.099 1.00 0.00 N ATOM 690 CA ARG A 690 10.920 -11.913 -7.878 1.00 0.00 C ATOM 691 C ARG A 690 11.283 -10.816 -8.886 1.00 0.00 C ATOM 692 O ARG A 690 12.318 -10.864 -9.519 1.00 0.00 O ATOM 693 CB ARG A 690 10.559 -13.231 -8.579 1.00 0.00 C ATOM 694 CG ARG A 690 11.693 -13.623 -9.538 1.00 0.00 C ATOM 695 CD ARG A 690 11.738 -15.147 -9.715 1.00 0.00 C ATOM 696 NE ARG A 690 12.685 -15.633 -8.670 1.00 0.00 N ATOM 697 CZ ARG A 690 12.262 -15.872 -7.457 1.00 0.00 C ATOM 698 NH1 ARG A 690 11.273 -16.701 -7.260 1.00 0.00 N ATOM 699 NH2 ARG A 690 12.834 -15.287 -6.440 1.00 0.00 N ATOM 0 H ARG A 690 8.818 -11.709 -7.538 1.00 0.00 H new ATOM 0 HA ARG A 690 11.791 -12.055 -7.238 1.00 0.00 H new ATOM 0 HB2 ARG A 690 10.403 -14.018 -7.841 1.00 0.00 H new ATOM 0 HB3 ARG A 690 9.624 -13.120 -9.129 1.00 0.00 H new ATOM 0 HG2 ARG A 690 11.544 -13.142 -10.505 1.00 0.00 H new ATOM 0 HG3 ARG A 690 12.647 -13.267 -9.149 1.00 0.00 H new ATOM 0 HD2 ARG A 690 10.749 -15.588 -9.587 1.00 0.00 H new ATOM 0 HD3 ARG A 690 12.081 -15.418 -10.714 1.00 0.00 H new ATOM 0 HE ARG A 690 13.667 -15.779 -8.903 1.00 0.00 H new ATOM 0 HH11 ARG A 690 10.829 -17.163 -8.054 1.00 0.00 H new ATOM 0 HH12 ARG A 690 10.944 -16.886 -6.312 1.00 0.00 H new ATOM 0 HH21 ARG A 690 13.611 -14.644 -6.592 1.00 0.00 H new ATOM 0 HH22 ARG A 690 12.504 -15.473 -5.493 1.00 0.00 H new ATOM 713 N ASP A 691 10.455 -9.814 -9.023 1.00 0.00 N ATOM 714 CA ASP A 691 10.781 -8.710 -9.973 1.00 0.00 C ATOM 715 C ASP A 691 10.744 -7.364 -9.242 1.00 0.00 C ATOM 716 O ASP A 691 11.589 -6.509 -9.435 1.00 0.00 O ATOM 717 CB ASP A 691 9.689 -8.761 -11.039 1.00 0.00 C ATOM 718 CG ASP A 691 9.782 -10.086 -11.797 1.00 0.00 C ATOM 719 OD1 ASP A 691 10.871 -10.416 -12.243 1.00 0.00 O ATOM 720 OD2 ASP A 691 8.768 -10.750 -11.917 1.00 0.00 O ATOM 0 H ASP A 691 9.573 -9.712 -8.522 1.00 0.00 H new ATOM 0 HA ASP A 691 11.776 -8.820 -10.405 1.00 0.00 H new ATOM 0 HB2 ASP A 691 8.708 -8.663 -10.575 1.00 0.00 H new ATOM 0 HB3 ASP A 691 9.800 -7.925 -11.730 1.00 0.00 H new ATOM 725 N SER A 692 9.758 -7.174 -8.409 1.00 0.00 N ATOM 726 CA SER A 692 9.637 -5.886 -7.666 1.00 0.00 C ATOM 727 C SER A 692 10.244 -6.010 -6.262 1.00 0.00 C ATOM 728 O SER A 692 11.308 -6.573 -6.081 1.00 0.00 O ATOM 729 CB SER A 692 8.133 -5.637 -7.579 1.00 0.00 C ATOM 730 OG SER A 692 7.586 -5.607 -8.889 1.00 0.00 O ATOM 0 H SER A 692 9.028 -7.858 -8.210 1.00 0.00 H new ATOM 0 HA SER A 692 10.167 -5.072 -8.160 1.00 0.00 H new ATOM 0 HB2 SER A 692 7.656 -6.421 -6.991 1.00 0.00 H new ATOM 0 HB3 SER A 692 7.938 -4.694 -7.069 1.00 0.00 H new ATOM 0 HG SER A 692 6.631 -5.824 -8.850 1.00 0.00 H new ATOM 736 N ALA A 693 9.583 -5.475 -5.267 1.00 0.00 N ATOM 737 CA ALA A 693 10.113 -5.541 -3.874 1.00 0.00 C ATOM 738 C ALA A 693 9.692 -6.842 -3.174 1.00 0.00 C ATOM 739 O ALA A 693 8.879 -7.598 -3.670 1.00 0.00 O ATOM 740 CB ALA A 693 9.497 -4.335 -3.170 1.00 0.00 C ATOM 0 H ALA A 693 8.690 -4.991 -5.363 1.00 0.00 H new ATOM 0 HA ALA A 693 11.203 -5.528 -3.856 1.00 0.00 H new ATOM 0 HB1 ALA A 693 9.836 -4.306 -2.134 1.00 0.00 H new ATOM 0 HB2 ALA A 693 9.805 -3.421 -3.678 1.00 0.00 H new ATOM 0 HB3 ALA A 693 8.410 -4.415 -3.194 1.00 0.00 H new ATOM 746 N VAL A 694 10.257 -7.096 -2.022 1.00 0.00 N ATOM 747 CA VAL A 694 9.932 -8.335 -1.251 1.00 0.00 C ATOM 748 C VAL A 694 9.822 -7.994 0.240 1.00 0.00 C ATOM 749 O VAL A 694 10.219 -6.929 0.662 1.00 0.00 O ATOM 750 CB VAL A 694 11.126 -9.249 -1.496 1.00 0.00 C ATOM 751 CG1 VAL A 694 10.952 -10.555 -0.716 1.00 0.00 C ATOM 752 CG2 VAL A 694 11.233 -9.544 -2.992 1.00 0.00 C ATOM 0 H VAL A 694 10.942 -6.487 -1.575 1.00 0.00 H new ATOM 0 HA VAL A 694 8.989 -8.793 -1.551 1.00 0.00 H new ATOM 0 HB VAL A 694 12.038 -8.758 -1.156 1.00 0.00 H new ATOM 0 HG11 VAL A 694 11.809 -11.203 -0.896 1.00 0.00 H new ATOM 0 HG12 VAL A 694 10.880 -10.336 0.349 1.00 0.00 H new ATOM 0 HG13 VAL A 694 10.042 -11.057 -1.045 1.00 0.00 H new ATOM 0 HG21 VAL A 694 12.086 -10.198 -3.174 1.00 0.00 H new ATOM 0 HG22 VAL A 694 10.321 -10.034 -3.332 1.00 0.00 H new ATOM 0 HG23 VAL A 694 11.369 -8.610 -3.538 1.00 0.00 H new ATOM 762 N ALA A 695 9.285 -8.876 1.042 1.00 0.00 N ATOM 763 CA ALA A 695 9.155 -8.565 2.500 1.00 0.00 C ATOM 764 C ALA A 695 8.438 -7.221 2.666 1.00 0.00 C ATOM 765 O ALA A 695 9.006 -6.170 2.442 1.00 0.00 O ATOM 766 CB ALA A 695 10.590 -8.493 3.036 1.00 0.00 C ATOM 0 H ALA A 695 8.933 -9.790 0.756 1.00 0.00 H new ATOM 0 HA ALA A 695 8.575 -9.314 3.040 1.00 0.00 H new ATOM 0 HB1 ALA A 695 10.569 -8.268 4.102 1.00 0.00 H new ATOM 0 HB2 ALA A 695 11.086 -9.450 2.877 1.00 0.00 H new ATOM 0 HB3 ALA A 695 11.136 -7.710 2.510 1.00 0.00 H new ATOM 772 N SER A 696 7.186 -7.242 3.031 1.00 0.00 N ATOM 773 CA SER A 696 6.442 -5.957 3.170 1.00 0.00 C ATOM 774 C SER A 696 6.467 -5.441 4.608 1.00 0.00 C ATOM 775 O SER A 696 5.568 -4.748 5.037 1.00 0.00 O ATOM 776 CB SER A 696 5.004 -6.253 2.737 1.00 0.00 C ATOM 777 OG SER A 696 4.997 -6.688 1.385 1.00 0.00 O ATOM 0 H SER A 696 6.649 -8.084 3.238 1.00 0.00 H new ATOM 0 HA SER A 696 6.901 -5.180 2.558 1.00 0.00 H new ATOM 0 HB2 SER A 696 4.570 -7.019 3.379 1.00 0.00 H new ATOM 0 HB3 SER A 696 4.389 -5.360 2.846 1.00 0.00 H new ATOM 0 HG SER A 696 4.239 -7.292 1.240 1.00 0.00 H new ATOM 783 N GLU A 697 7.487 -5.754 5.354 1.00 0.00 N ATOM 784 CA GLU A 697 7.546 -5.257 6.751 1.00 0.00 C ATOM 785 C GLU A 697 7.929 -3.772 6.735 1.00 0.00 C ATOM 786 O GLU A 697 9.009 -3.395 7.142 1.00 0.00 O ATOM 787 CB GLU A 697 8.648 -6.093 7.406 1.00 0.00 C ATOM 788 CG GLU A 697 8.271 -7.575 7.332 1.00 0.00 C ATOM 789 CD GLU A 697 9.089 -8.372 8.350 1.00 0.00 C ATOM 790 OE1 GLU A 697 10.306 -8.346 8.254 1.00 0.00 O ATOM 791 OE2 GLU A 697 8.486 -9.002 9.204 1.00 0.00 O ATOM 0 H GLU A 697 8.276 -6.328 5.058 1.00 0.00 H new ATOM 0 HA GLU A 697 6.599 -5.346 7.284 1.00 0.00 H new ATOM 0 HB2 GLU A 697 9.599 -5.922 6.901 1.00 0.00 H new ATOM 0 HB3 GLU A 697 8.780 -5.791 8.445 1.00 0.00 H new ATOM 0 HG2 GLU A 697 7.206 -7.699 7.531 1.00 0.00 H new ATOM 0 HG3 GLU A 697 8.454 -7.956 6.327 1.00 0.00 H new ATOM 798 N PHE A 698 7.051 -2.928 6.251 1.00 0.00 N ATOM 799 CA PHE A 698 7.371 -1.468 6.186 1.00 0.00 C ATOM 800 C PHE A 698 6.254 -0.588 6.749 1.00 0.00 C ATOM 801 O PHE A 698 5.147 -1.026 6.999 1.00 0.00 O ATOM 802 CB PHE A 698 7.545 -1.149 4.700 1.00 0.00 C ATOM 803 CG PHE A 698 6.435 -1.772 3.901 1.00 0.00 C ATOM 804 CD1 PHE A 698 5.100 -1.451 4.146 1.00 0.00 C ATOM 805 CD2 PHE A 698 6.761 -2.683 2.898 1.00 0.00 C ATOM 806 CE1 PHE A 698 4.093 -2.045 3.382 1.00 0.00 C ATOM 807 CE2 PHE A 698 5.759 -3.273 2.131 1.00 0.00 C ATOM 808 CZ PHE A 698 4.420 -2.955 2.373 1.00 0.00 C ATOM 0 H PHE A 698 6.129 -3.186 5.899 1.00 0.00 H new ATOM 0 HA PHE A 698 8.259 -1.263 6.784 1.00 0.00 H new ATOM 0 HB2 PHE A 698 7.549 -0.069 4.551 1.00 0.00 H new ATOM 0 HB3 PHE A 698 8.508 -1.522 4.351 1.00 0.00 H new ATOM 0 HD1 PHE A 698 4.846 -0.746 4.924 1.00 0.00 H new ATOM 0 HD2 PHE A 698 7.796 -2.933 2.714 1.00 0.00 H new ATOM 0 HE1 PHE A 698 3.058 -1.800 3.572 1.00 0.00 H new ATOM 0 HE2 PHE A 698 6.016 -3.974 1.351 1.00 0.00 H new ATOM 0 HZ PHE A 698 3.640 -3.411 1.782 1.00 0.00 H new ATOM 818 N GLU A 699 6.550 0.676 6.895 1.00 0.00 N ATOM 819 CA GLU A 699 5.545 1.655 7.375 1.00 0.00 C ATOM 820 C GLU A 699 4.947 2.346 6.152 1.00 0.00 C ATOM 821 O GLU A 699 5.656 2.843 5.298 1.00 0.00 O ATOM 822 CB GLU A 699 6.338 2.640 8.231 1.00 0.00 C ATOM 823 CG GLU A 699 6.852 1.922 9.479 1.00 0.00 C ATOM 824 CD GLU A 699 8.047 2.678 10.061 1.00 0.00 C ATOM 825 OE1 GLU A 699 8.001 3.897 10.082 1.00 0.00 O ATOM 826 OE2 GLU A 699 8.990 2.023 10.478 1.00 0.00 O ATOM 0 H GLU A 699 7.468 1.075 6.696 1.00 0.00 H new ATOM 0 HA GLU A 699 4.729 1.212 7.946 1.00 0.00 H new ATOM 0 HB2 GLU A 699 7.173 3.045 7.660 1.00 0.00 H new ATOM 0 HB3 GLU A 699 5.708 3.482 8.515 1.00 0.00 H new ATOM 0 HG2 GLU A 699 6.058 1.853 10.222 1.00 0.00 H new ATOM 0 HG3 GLU A 699 7.143 0.902 9.228 1.00 0.00 H new ATOM 833 N LEU A 700 3.654 2.360 6.045 1.00 0.00 N ATOM 834 CA LEU A 700 3.019 2.991 4.864 1.00 0.00 C ATOM 835 C LEU A 700 2.445 4.352 5.248 1.00 0.00 C ATOM 836 O LEU A 700 1.642 4.463 6.149 1.00 0.00 O ATOM 837 CB LEU A 700 1.907 2.019 4.472 1.00 0.00 C ATOM 838 CG LEU A 700 2.515 0.645 4.192 1.00 0.00 C ATOM 839 CD1 LEU A 700 2.240 -0.293 5.367 1.00 0.00 C ATOM 840 CD2 LEU A 700 1.894 0.058 2.926 1.00 0.00 C ATOM 0 H LEU A 700 3.008 1.961 6.726 1.00 0.00 H new ATOM 0 HA LEU A 700 3.717 3.167 4.045 1.00 0.00 H new ATOM 0 HB2 LEU A 700 1.171 1.948 5.273 1.00 0.00 H new ATOM 0 HB3 LEU A 700 1.383 2.385 3.589 1.00 0.00 H new ATOM 0 HG LEU A 700 3.591 0.753 4.057 1.00 0.00 H new ATOM 0 HD11 LEU A 700 2.676 -1.271 5.162 1.00 0.00 H new ATOM 0 HD12 LEU A 700 2.684 0.119 6.273 1.00 0.00 H new ATOM 0 HD13 LEU A 700 1.164 -0.397 5.505 1.00 0.00 H new ATOM 0 HD21 LEU A 700 2.329 -0.922 2.728 1.00 0.00 H new ATOM 0 HD22 LEU A 700 0.817 -0.044 3.062 1.00 0.00 H new ATOM 0 HD23 LEU A 700 2.092 0.720 2.083 1.00 0.00 H new ATOM 852 N VAL A 701 2.846 5.387 4.564 1.00 0.00 N ATOM 853 CA VAL A 701 2.327 6.745 4.882 1.00 0.00 C ATOM 854 C VAL A 701 1.372 7.169 3.786 1.00 0.00 C ATOM 855 O VAL A 701 1.743 7.278 2.636 1.00 0.00 O ATOM 856 CB VAL A 701 3.560 7.641 4.912 1.00 0.00 C ATOM 857 CG1 VAL A 701 3.143 9.071 5.265 1.00 0.00 C ATOM 858 CG2 VAL A 701 4.534 7.106 5.967 1.00 0.00 C ATOM 0 H VAL A 701 3.514 5.350 3.794 1.00 0.00 H new ATOM 0 HA VAL A 701 1.785 6.791 5.826 1.00 0.00 H new ATOM 0 HB VAL A 701 4.044 7.644 3.935 1.00 0.00 H new ATOM 0 HG11 VAL A 701 4.024 9.712 5.287 1.00 0.00 H new ATOM 0 HG12 VAL A 701 2.443 9.441 4.516 1.00 0.00 H new ATOM 0 HG13 VAL A 701 2.664 9.079 6.244 1.00 0.00 H new ATOM 0 HG21 VAL A 701 5.421 7.739 5.998 1.00 0.00 H new ATOM 0 HG22 VAL A 701 4.051 7.111 6.944 1.00 0.00 H new ATOM 0 HG23 VAL A 701 4.824 6.087 5.711 1.00 0.00 H new ATOM 868 N GLN A 702 0.140 7.382 4.129 1.00 0.00 N ATOM 869 CA GLN A 702 -0.854 7.767 3.101 1.00 0.00 C ATOM 870 C GLN A 702 -0.993 9.273 2.991 1.00 0.00 C ATOM 871 O GLN A 702 -0.742 10.002 3.928 1.00 0.00 O ATOM 872 CB GLN A 702 -2.176 7.157 3.565 1.00 0.00 C ATOM 873 CG GLN A 702 -3.300 7.610 2.633 1.00 0.00 C ATOM 874 CD GLN A 702 -4.323 6.484 2.489 1.00 0.00 C ATOM 875 OE1 GLN A 702 -4.155 5.422 3.055 1.00 0.00 O ATOM 876 NE2 GLN A 702 -5.376 6.664 1.743 1.00 0.00 N ATOM 0 H GLN A 702 -0.223 7.306 5.079 1.00 0.00 H new ATOM 0 HA GLN A 702 -0.550 7.412 2.116 1.00 0.00 H new ATOM 0 HB2 GLN A 702 -2.106 6.069 3.567 1.00 0.00 H new ATOM 0 HB3 GLN A 702 -2.391 7.464 4.588 1.00 0.00 H new ATOM 0 HG2 GLN A 702 -3.780 8.504 3.031 1.00 0.00 H new ATOM 0 HG3 GLN A 702 -2.894 7.875 1.657 1.00 0.00 H new ATOM 0 HE21 GLN A 702 -5.518 7.555 1.268 1.00 0.00 H new ATOM 0 HE22 GLN A 702 -6.058 5.914 1.635 1.00 0.00 H new ATOM 885 N LEU A 703 -1.383 9.723 1.828 1.00 0.00 N ATOM 886 CA LEU A 703 -1.574 11.188 1.570 1.00 0.00 C ATOM 887 C LEU A 703 -0.234 11.829 1.232 1.00 0.00 C ATOM 888 O LEU A 703 0.717 11.751 1.984 1.00 0.00 O ATOM 889 CB LEU A 703 -2.211 11.801 2.838 1.00 0.00 C ATOM 890 CG LEU A 703 -3.639 12.259 2.530 1.00 0.00 C ATOM 891 CD1 LEU A 703 -3.609 13.435 1.552 1.00 0.00 C ATOM 892 CD2 LEU A 703 -4.434 11.103 1.917 1.00 0.00 C ATOM 0 H LEU A 703 -1.583 9.126 1.026 1.00 0.00 H new ATOM 0 HA LEU A 703 -2.231 11.364 0.719 1.00 0.00 H new ATOM 0 HB2 LEU A 703 -2.220 11.066 3.643 1.00 0.00 H new ATOM 0 HB3 LEU A 703 -1.615 12.645 3.184 1.00 0.00 H new ATOM 0 HG LEU A 703 -4.118 12.575 3.457 1.00 0.00 H new ATOM 0 HD11 LEU A 703 -4.628 13.756 1.337 1.00 0.00 H new ATOM 0 HD12 LEU A 703 -3.054 14.262 1.995 1.00 0.00 H new ATOM 0 HD13 LEU A 703 -3.123 13.126 0.626 1.00 0.00 H new ATOM 0 HD21 LEU A 703 -5.449 11.435 1.700 1.00 0.00 H new ATOM 0 HD22 LEU A 703 -3.953 10.780 0.994 1.00 0.00 H new ATOM 0 HD23 LEU A 703 -4.467 10.271 2.620 1.00 0.00 H new ATOM 904 N LEU A 704 -0.154 12.442 0.082 1.00 0.00 N ATOM 905 CA LEU A 704 1.123 13.069 -0.351 1.00 0.00 C ATOM 906 C LEU A 704 1.567 14.154 0.650 1.00 0.00 C ATOM 907 O LEU A 704 2.734 14.222 0.988 1.00 0.00 O ATOM 908 CB LEU A 704 0.823 13.667 -1.737 1.00 0.00 C ATOM 909 CG LEU A 704 0.251 12.579 -2.659 1.00 0.00 C ATOM 910 CD1 LEU A 704 -1.261 12.790 -2.841 1.00 0.00 C ATOM 911 CD2 LEU A 704 0.929 12.662 -4.027 1.00 0.00 C ATOM 0 H LEU A 704 -0.925 12.535 -0.579 1.00 0.00 H new ATOM 0 HA LEU A 704 1.942 12.351 -0.394 1.00 0.00 H new ATOM 0 HB2 LEU A 704 0.112 14.488 -1.643 1.00 0.00 H new ATOM 0 HB3 LEU A 704 1.734 14.082 -2.169 1.00 0.00 H new ATOM 0 HG LEU A 704 0.433 11.602 -2.211 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -1.660 12.015 -3.496 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -1.755 12.736 -1.871 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -1.441 13.769 -3.285 1.00 0.00 H new ATOM 0 HD21 LEU A 704 0.524 11.890 -4.681 1.00 0.00 H new ATOM 0 HD22 LEU A 704 0.745 13.643 -4.465 1.00 0.00 H new ATOM 0 HD23 LEU A 704 2.002 12.512 -3.911 1.00 0.00 H new ATOM 923 N PRO A 705 0.640 14.971 1.107 1.00 0.00 N ATOM 924 CA PRO A 705 0.984 16.038 2.077 1.00 0.00 C ATOM 925 C PRO A 705 1.346 15.420 3.433 1.00 0.00 C ATOM 926 O PRO A 705 2.016 16.026 4.247 1.00 0.00 O ATOM 927 CB PRO A 705 -0.314 16.849 2.157 1.00 0.00 C ATOM 928 CG PRO A 705 -1.357 16.197 1.234 1.00 0.00 C ATOM 929 CD PRO A 705 -0.782 14.882 0.701 1.00 0.00 C ATOM 0 HA PRO A 705 1.844 16.643 1.789 1.00 0.00 H new ATOM 0 HB2 PRO A 705 -0.681 16.876 3.183 1.00 0.00 H new ATOM 0 HB3 PRO A 705 -0.135 17.881 1.856 1.00 0.00 H new ATOM 0 HG2 PRO A 705 -2.282 16.012 1.780 1.00 0.00 H new ATOM 0 HG3 PRO A 705 -1.602 16.865 0.408 1.00 0.00 H new ATOM 0 HD2 PRO A 705 -1.276 14.015 1.139 1.00 0.00 H new ATOM 0 HD3 PRO A 705 -0.892 14.799 -0.380 1.00 0.00 H new ATOM 937 N GLY A 706 0.896 14.215 3.676 1.00 0.00 N ATOM 938 CA GLY A 706 1.197 13.538 4.974 1.00 0.00 C ATOM 939 C GLY A 706 0.065 13.816 5.964 1.00 0.00 C ATOM 940 O GLY A 706 0.080 14.796 6.682 1.00 0.00 O ATOM 0 H GLY A 706 0.330 13.668 3.027 1.00 0.00 H new ATOM 0 HA2 GLY A 706 1.306 12.464 4.821 1.00 0.00 H new ATOM 0 HA3 GLY A 706 2.144 13.900 5.375 1.00 0.00 H new ATOM 944 N ASP A 707 -0.919 12.961 6.004 1.00 0.00 N ATOM 945 CA ASP A 707 -2.060 13.176 6.939 1.00 0.00 C ATOM 946 C ASP A 707 -2.457 11.859 7.596 1.00 0.00 C ATOM 947 O ASP A 707 -2.564 11.760 8.803 1.00 0.00 O ATOM 948 CB ASP A 707 -3.191 13.697 6.053 1.00 0.00 C ATOM 949 CG ASP A 707 -4.423 13.990 6.909 1.00 0.00 C ATOM 950 OD1 ASP A 707 -4.362 13.748 8.103 1.00 0.00 O ATOM 951 OD2 ASP A 707 -5.410 14.442 6.352 1.00 0.00 O ATOM 0 H ASP A 707 -0.983 12.121 5.429 1.00 0.00 H new ATOM 0 HA ASP A 707 -1.816 13.869 7.744 1.00 0.00 H new ATOM 0 HB2 ASP A 707 -2.873 14.602 5.535 1.00 0.00 H new ATOM 0 HB3 ASP A 707 -3.435 12.960 5.287 1.00 0.00 H new ATOM 956 N ARG A 708 -2.678 10.847 6.810 1.00 0.00 N ATOM 957 CA ARG A 708 -3.074 9.534 7.385 1.00 0.00 C ATOM 958 C ARG A 708 -1.936 8.528 7.206 1.00 0.00 C ATOM 959 O ARG A 708 -1.377 8.397 6.136 1.00 0.00 O ATOM 960 CB ARG A 708 -4.297 9.100 6.572 1.00 0.00 C ATOM 961 CG ARG A 708 -5.005 7.947 7.284 1.00 0.00 C ATOM 962 CD ARG A 708 -6.155 8.491 8.140 1.00 0.00 C ATOM 963 NE ARG A 708 -5.613 9.709 8.809 1.00 0.00 N ATOM 964 CZ ARG A 708 -5.756 9.870 10.094 1.00 0.00 C ATOM 965 NH1 ARG A 708 -6.891 10.300 10.575 1.00 0.00 N ATOM 966 NH2 ARG A 708 -4.763 9.607 10.897 1.00 0.00 N ATOM 0 H ARG A 708 -2.602 10.871 5.793 1.00 0.00 H new ATOM 0 HA ARG A 708 -3.292 9.594 8.451 1.00 0.00 H new ATOM 0 HB2 ARG A 708 -4.981 9.940 6.449 1.00 0.00 H new ATOM 0 HB3 ARG A 708 -3.991 8.790 5.573 1.00 0.00 H new ATOM 0 HG2 ARG A 708 -5.389 7.237 6.552 1.00 0.00 H new ATOM 0 HG3 ARG A 708 -4.297 7.406 7.912 1.00 0.00 H new ATOM 0 HD2 ARG A 708 -7.021 8.734 7.525 1.00 0.00 H new ATOM 0 HD3 ARG A 708 -6.482 7.753 8.873 1.00 0.00 H new ATOM 0 HE ARG A 708 -5.129 10.418 8.259 1.00 0.00 H new ATOM 0 HH11 ARG A 708 -7.665 10.510 9.945 1.00 0.00 H new ATOM 0 HH12 ARG A 708 -7.004 10.426 11.581 1.00 0.00 H new ATOM 0 HH21 ARG A 708 -3.875 9.276 10.519 1.00 0.00 H new ATOM 0 HH22 ARG A 708 -4.874 9.733 11.903 1.00 0.00 H new ATOM 980 N GLU A 709 -1.595 7.802 8.233 1.00 0.00 N ATOM 981 CA GLU A 709 -0.508 6.793 8.086 1.00 0.00 C ATOM 982 C GLU A 709 -1.153 5.418 7.892 1.00 0.00 C ATOM 983 O GLU A 709 -2.116 5.081 8.551 1.00 0.00 O ATOM 984 CB GLU A 709 0.302 6.860 9.381 1.00 0.00 C ATOM 985 CG GLU A 709 -0.554 6.394 10.555 1.00 0.00 C ATOM 986 CD GLU A 709 0.264 6.489 11.849 1.00 0.00 C ATOM 987 OE1 GLU A 709 1.454 6.749 11.757 1.00 0.00 O ATOM 988 OE2 GLU A 709 -0.311 6.297 12.908 1.00 0.00 O ATOM 0 H GLU A 709 -2.017 7.861 9.160 1.00 0.00 H new ATOM 0 HA GLU A 709 0.141 6.978 7.230 1.00 0.00 H new ATOM 0 HB2 GLU A 709 1.191 6.234 9.297 1.00 0.00 H new ATOM 0 HB3 GLU A 709 0.646 7.880 9.553 1.00 0.00 H new ATOM 0 HG2 GLU A 709 -1.451 7.009 10.632 1.00 0.00 H new ATOM 0 HG3 GLU A 709 -0.884 5.368 10.394 1.00 0.00 H new ATOM 995 N LEU A 710 -0.670 4.637 6.966 1.00 0.00 N ATOM 996 CA LEU A 710 -1.316 3.313 6.714 1.00 0.00 C ATOM 997 C LEU A 710 -0.373 2.144 7.051 1.00 0.00 C ATOM 998 O LEU A 710 -0.354 1.132 6.379 1.00 0.00 O ATOM 999 CB LEU A 710 -1.650 3.349 5.217 1.00 0.00 C ATOM 1000 CG LEU A 710 -2.449 2.110 4.833 1.00 0.00 C ATOM 1001 CD1 LEU A 710 -3.709 2.046 5.684 1.00 0.00 C ATOM 1002 CD2 LEU A 710 -2.848 2.200 3.359 1.00 0.00 C ATOM 0 H LEU A 710 0.135 4.852 6.377 1.00 0.00 H new ATOM 0 HA LEU A 710 -2.195 3.154 7.339 1.00 0.00 H new ATOM 0 HB2 LEU A 710 -2.222 4.247 4.985 1.00 0.00 H new ATOM 0 HB3 LEU A 710 -0.732 3.396 4.632 1.00 0.00 H new ATOM 0 HG LEU A 710 -1.843 1.219 4.997 1.00 0.00 H new ATOM 0 HD11 LEU A 710 -4.286 1.161 5.414 1.00 0.00 H new ATOM 0 HD12 LEU A 710 -3.434 1.993 6.737 1.00 0.00 H new ATOM 0 HD13 LEU A 710 -4.311 2.938 5.511 1.00 0.00 H new ATOM 0 HD21 LEU A 710 -3.420 1.314 3.082 1.00 0.00 H new ATOM 0 HD22 LEU A 710 -3.458 3.090 3.201 1.00 0.00 H new ATOM 0 HD23 LEU A 710 -1.951 2.260 2.742 1.00 0.00 H new ATOM 1014 N THR A 711 0.397 2.270 8.100 1.00 0.00 N ATOM 1015 CA THR A 711 1.333 1.169 8.492 1.00 0.00 C ATOM 1016 C THR A 711 0.556 -0.105 8.875 1.00 0.00 C ATOM 1017 O THR A 711 -0.643 -0.184 8.706 1.00 0.00 O ATOM 1018 CB THR A 711 2.128 1.727 9.677 1.00 0.00 C ATOM 1019 OG1 THR A 711 1.246 1.966 10.764 1.00 0.00 O ATOM 1020 CG2 THR A 711 2.799 3.044 9.274 1.00 0.00 C ATOM 0 H THR A 711 0.420 3.090 8.706 1.00 0.00 H new ATOM 0 HA THR A 711 1.990 0.876 7.674 1.00 0.00 H new ATOM 0 HB THR A 711 2.891 1.006 9.971 1.00 0.00 H new ATOM 0 HG1 THR A 711 1.767 2.168 11.569 1.00 0.00 H new ATOM 0 HG21 THR A 711 3.364 3.438 10.119 1.00 0.00 H new ATOM 0 HG22 THR A 711 3.475 2.867 8.437 1.00 0.00 H new ATOM 0 HG23 THR A 711 2.037 3.765 8.979 1.00 0.00 H new ATOM 1028 N ILE A 712 1.250 -1.125 9.330 1.00 0.00 N ATOM 1029 CA ILE A 712 0.579 -2.429 9.660 1.00 0.00 C ATOM 1030 C ILE A 712 -0.411 -2.387 10.859 1.00 0.00 C ATOM 1031 O ILE A 712 -1.369 -3.136 10.838 1.00 0.00 O ATOM 1032 CB ILE A 712 1.713 -3.440 9.916 1.00 0.00 C ATOM 1033 CG1 ILE A 712 2.453 -3.138 11.235 1.00 0.00 C ATOM 1034 CG2 ILE A 712 2.696 -3.410 8.746 1.00 0.00 C ATOM 1035 CD1 ILE A 712 3.535 -2.060 11.038 1.00 0.00 C ATOM 0 H ILE A 712 2.258 -1.111 9.488 1.00 0.00 H new ATOM 0 HA ILE A 712 -0.059 -2.708 8.821 1.00 0.00 H new ATOM 0 HB ILE A 712 1.272 -4.433 10.003 1.00 0.00 H new ATOM 0 HG12 ILE A 712 1.738 -2.805 11.987 1.00 0.00 H new ATOM 0 HG13 ILE A 712 2.912 -4.051 11.614 1.00 0.00 H new ATOM 0 HG21 ILE A 712 3.499 -4.125 8.927 1.00 0.00 H new ATOM 0 HG22 ILE A 712 2.175 -3.674 7.826 1.00 0.00 H new ATOM 0 HG23 ILE A 712 3.117 -2.409 8.650 1.00 0.00 H new ATOM 0 HD11 ILE A 712 4.037 -1.871 11.987 1.00 0.00 H new ATOM 0 HD12 ILE A 712 4.263 -2.405 10.304 1.00 0.00 H new ATOM 0 HD13 ILE A 712 3.071 -1.140 10.683 1.00 0.00 H new ATOM 1047 N PRO A 713 -0.210 -1.557 11.870 1.00 0.00 N ATOM 1048 CA PRO A 713 -1.177 -1.544 13.003 1.00 0.00 C ATOM 1049 C PRO A 713 -2.625 -1.366 12.509 1.00 0.00 C ATOM 1050 O PRO A 713 -3.570 -1.600 13.237 1.00 0.00 O ATOM 1051 CB PRO A 713 -0.727 -0.327 13.817 1.00 0.00 C ATOM 1052 CG PRO A 713 0.481 0.314 13.115 1.00 0.00 C ATOM 1053 CD PRO A 713 0.932 -0.609 11.976 1.00 0.00 C ATOM 0 HA PRO A 713 -1.180 -2.475 13.571 1.00 0.00 H new ATOM 0 HB2 PRO A 713 -1.541 0.393 13.902 1.00 0.00 H new ATOM 0 HB3 PRO A 713 -0.460 -0.627 14.830 1.00 0.00 H new ATOM 0 HG2 PRO A 713 0.214 1.295 12.723 1.00 0.00 H new ATOM 0 HG3 PRO A 713 1.295 0.465 13.824 1.00 0.00 H new ATOM 0 HD2 PRO A 713 1.094 -0.061 11.048 1.00 0.00 H new ATOM 0 HD3 PRO A 713 1.865 -1.120 12.211 1.00 0.00 H new ATOM 1061 N HIS A 714 -2.806 -0.937 11.290 1.00 0.00 N ATOM 1062 CA HIS A 714 -4.191 -0.717 10.765 1.00 0.00 C ATOM 1063 C HIS A 714 -4.921 -2.035 10.462 1.00 0.00 C ATOM 1064 O HIS A 714 -4.321 -3.077 10.285 1.00 0.00 O ATOM 1065 CB HIS A 714 -3.993 0.099 9.490 1.00 0.00 C ATOM 1066 CG HIS A 714 -3.538 1.479 9.862 1.00 0.00 C ATOM 1067 ND1 HIS A 714 -4.432 2.495 10.158 1.00 0.00 N ATOM 1068 CD2 HIS A 714 -2.286 2.025 10.010 1.00 0.00 C ATOM 1069 CE1 HIS A 714 -3.716 3.590 10.468 1.00 0.00 C ATOM 1070 NE2 HIS A 714 -2.402 3.360 10.393 1.00 0.00 N ATOM 0 H HIS A 714 -2.056 -0.728 10.631 1.00 0.00 H new ATOM 0 HA HIS A 714 -4.816 -0.210 11.500 1.00 0.00 H new ATOM 0 HB2 HIS A 714 -3.255 -0.380 8.846 1.00 0.00 H new ATOM 0 HB3 HIS A 714 -4.924 0.148 8.926 1.00 0.00 H new ATOM 0 HD1 HIS A 714 -5.449 2.425 10.143 1.00 0.00 H new ATOM 0 HD2 HIS A 714 -1.355 1.500 9.854 1.00 0.00 H new ATOM 0 HE1 HIS A 714 -4.150 4.540 10.744 1.00 0.00 H new ATOM 1078 N SER A 715 -6.233 -1.976 10.412 1.00 0.00 N ATOM 1079 CA SER A 715 -7.054 -3.194 10.134 1.00 0.00 C ATOM 1080 C SER A 715 -7.347 -3.337 8.637 1.00 0.00 C ATOM 1081 O SER A 715 -7.061 -2.460 7.848 1.00 0.00 O ATOM 1082 CB SER A 715 -8.350 -2.981 10.916 1.00 0.00 C ATOM 1083 OG SER A 715 -8.049 -2.916 12.304 1.00 0.00 O ATOM 0 H SER A 715 -6.774 -1.123 10.554 1.00 0.00 H new ATOM 0 HA SER A 715 -6.535 -4.106 10.430 1.00 0.00 H new ATOM 0 HB2 SER A 715 -8.837 -2.061 10.593 1.00 0.00 H new ATOM 0 HB3 SER A 715 -9.046 -3.796 10.720 1.00 0.00 H new ATOM 0 HG SER A 715 -8.876 -2.778 12.812 1.00 0.00 H new ATOM 1089 N ALA A 716 -7.902 -4.456 8.245 1.00 0.00 N ATOM 1090 CA ALA A 716 -8.203 -4.694 6.802 1.00 0.00 C ATOM 1091 C ALA A 716 -9.158 -3.632 6.239 1.00 0.00 C ATOM 1092 O ALA A 716 -8.937 -3.097 5.167 1.00 0.00 O ATOM 1093 CB ALA A 716 -8.877 -6.066 6.774 1.00 0.00 C ATOM 0 H ALA A 716 -8.161 -5.220 8.869 1.00 0.00 H new ATOM 0 HA ALA A 716 -7.300 -4.646 6.193 1.00 0.00 H new ATOM 0 HB1 ALA A 716 -9.135 -6.324 5.747 1.00 0.00 H new ATOM 0 HB2 ALA A 716 -8.195 -6.815 7.176 1.00 0.00 H new ATOM 0 HB3 ALA A 716 -9.783 -6.039 7.379 1.00 0.00 H new ATOM 1099 N ASN A 717 -10.218 -3.310 6.936 1.00 0.00 N ATOM 1100 CA ASN A 717 -11.163 -2.281 6.400 1.00 0.00 C ATOM 1101 C ASN A 717 -10.522 -0.905 6.521 1.00 0.00 C ATOM 1102 O ASN A 717 -10.924 -0.075 7.310 1.00 0.00 O ATOM 1103 CB ASN A 717 -12.405 -2.374 7.280 1.00 0.00 C ATOM 1104 CG ASN A 717 -12.068 -1.883 8.689 1.00 0.00 C ATOM 1105 OD1 ASN A 717 -11.425 -2.575 9.454 1.00 0.00 O ATOM 1106 ND2 ASN A 717 -12.462 -0.692 9.053 1.00 0.00 N ATOM 0 H ASN A 717 -10.469 -3.708 7.841 1.00 0.00 H new ATOM 0 HA ASN A 717 -11.409 -2.441 5.350 1.00 0.00 H new ATOM 0 HB2 ASN A 717 -13.210 -1.773 6.857 1.00 0.00 H new ATOM 0 HB3 ASN A 717 -12.761 -3.403 7.317 1.00 0.00 H new ATOM 0 HD21 ASN A 717 -12.230 -0.340 9.982 1.00 0.00 H new ATOM 0 HD22 ASN A 717 -13.001 -0.114 8.408 1.00 0.00 H new ATOM 1113 N VAL A 718 -9.482 -0.682 5.787 1.00 0.00 N ATOM 1114 CA VAL A 718 -8.774 0.613 5.910 1.00 0.00 C ATOM 1115 C VAL A 718 -9.170 1.598 4.799 1.00 0.00 C ATOM 1116 O VAL A 718 -9.454 2.749 5.053 1.00 0.00 O ATOM 1117 CB VAL A 718 -7.303 0.197 5.832 1.00 0.00 C ATOM 1118 CG1 VAL A 718 -6.686 0.625 4.495 1.00 0.00 C ATOM 1119 CG2 VAL A 718 -6.546 0.843 6.989 1.00 0.00 C ATOM 0 H VAL A 718 -9.090 -1.335 5.109 1.00 0.00 H new ATOM 0 HA VAL A 718 -9.015 1.153 6.826 1.00 0.00 H new ATOM 0 HB VAL A 718 -7.233 -0.889 5.902 1.00 0.00 H new ATOM 0 HG11 VAL A 718 -5.640 0.319 4.462 1.00 0.00 H new ATOM 0 HG12 VAL A 718 -7.228 0.152 3.676 1.00 0.00 H new ATOM 0 HG13 VAL A 718 -6.750 1.709 4.395 1.00 0.00 H new ATOM 0 HG21 VAL A 718 -5.496 0.553 6.944 1.00 0.00 H new ATOM 0 HG22 VAL A 718 -6.627 1.928 6.916 1.00 0.00 H new ATOM 0 HG23 VAL A 718 -6.974 0.510 7.935 1.00 0.00 H new ATOM 1129 N PHE A 719 -9.189 1.166 3.570 1.00 0.00 N ATOM 1130 CA PHE A 719 -9.555 2.103 2.477 1.00 0.00 C ATOM 1131 C PHE A 719 -10.928 2.676 2.704 1.00 0.00 C ATOM 1132 O PHE A 719 -11.112 3.863 2.581 1.00 0.00 O ATOM 1133 CB PHE A 719 -9.436 1.292 1.191 1.00 0.00 C ATOM 1134 CG PHE A 719 -7.996 1.359 0.719 1.00 0.00 C ATOM 1135 CD1 PHE A 719 -7.001 1.922 1.545 1.00 0.00 C ATOM 1136 CD2 PHE A 719 -7.660 0.900 -0.557 1.00 0.00 C ATOM 1137 CE1 PHE A 719 -5.695 2.025 1.092 1.00 0.00 C ATOM 1138 CE2 PHE A 719 -6.340 0.994 -1.002 1.00 0.00 C ATOM 1139 CZ PHE A 719 -5.363 1.562 -0.176 1.00 0.00 C ATOM 0 H PHE A 719 -8.969 0.214 3.278 1.00 0.00 H new ATOM 0 HA PHE A 719 -8.901 2.973 2.429 1.00 0.00 H new ATOM 0 HB2 PHE A 719 -9.731 0.257 1.366 1.00 0.00 H new ATOM 0 HB3 PHE A 719 -10.105 1.690 0.428 1.00 0.00 H new ATOM 0 HD1 PHE A 719 -7.257 2.274 2.533 1.00 0.00 H new ATOM 0 HD2 PHE A 719 -8.419 0.474 -1.197 1.00 0.00 H new ATOM 0 HE1 PHE A 719 -4.937 2.464 1.723 1.00 0.00 H new ATOM 0 HE2 PHE A 719 -6.073 0.629 -1.983 1.00 0.00 H new ATOM 0 HZ PHE A 719 -4.344 1.641 -0.526 1.00 0.00 H new ATOM 1149 N TYR A 720 -11.879 1.902 3.131 1.00 0.00 N ATOM 1150 CA TYR A 720 -13.193 2.523 3.425 1.00 0.00 C ATOM 1151 C TYR A 720 -12.922 3.742 4.308 1.00 0.00 C ATOM 1152 O TYR A 720 -13.696 4.674 4.365 1.00 0.00 O ATOM 1153 CB TYR A 720 -13.998 1.458 4.169 1.00 0.00 C ATOM 1154 CG TYR A 720 -15.346 2.019 4.553 1.00 0.00 C ATOM 1155 CD1 TYR A 720 -16.263 2.387 3.562 1.00 0.00 C ATOM 1156 CD2 TYR A 720 -15.681 2.160 5.902 1.00 0.00 C ATOM 1157 CE1 TYR A 720 -17.517 2.893 3.924 1.00 0.00 C ATOM 1158 CE2 TYR A 720 -16.933 2.668 6.263 1.00 0.00 C ATOM 1159 CZ TYR A 720 -17.852 3.033 5.274 1.00 0.00 C ATOM 1160 OH TYR A 720 -19.089 3.530 5.631 1.00 0.00 O ATOM 0 H TYR A 720 -11.810 0.896 3.286 1.00 0.00 H new ATOM 0 HA TYR A 720 -13.741 2.848 2.541 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -14.125 0.578 3.539 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -13.459 1.137 5.060 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -16.003 2.281 2.519 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -14.973 1.877 6.666 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -18.226 3.175 3.160 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -17.190 2.778 7.306 1.00 0.00 H new ATOM 0 HH TYR A 720 -19.159 3.561 6.608 1.00 0.00 H new ATOM 1170 N ALA A 721 -11.791 3.734 4.984 1.00 0.00 N ATOM 1171 CA ALA A 721 -11.413 4.879 5.855 1.00 0.00 C ATOM 1172 C ALA A 721 -10.265 5.721 5.242 1.00 0.00 C ATOM 1173 O ALA A 721 -10.190 6.915 5.457 1.00 0.00 O ATOM 1174 CB ALA A 721 -10.933 4.232 7.153 1.00 0.00 C ATOM 0 H ALA A 721 -11.114 2.972 4.963 1.00 0.00 H new ATOM 0 HA ALA A 721 -12.252 5.561 5.993 1.00 0.00 H new ATOM 0 HB1 ALA A 721 -10.633 5.008 7.857 1.00 0.00 H new ATOM 0 HB2 ALA A 721 -11.741 3.642 7.586 1.00 0.00 H new ATOM 0 HB3 ALA A 721 -10.082 3.583 6.943 1.00 0.00 H new ATOM 1180 N MET A 722 -9.352 5.116 4.509 1.00 0.00 N ATOM 1181 CA MET A 722 -8.207 5.908 3.943 1.00 0.00 C ATOM 1182 C MET A 722 -8.437 6.318 2.494 1.00 0.00 C ATOM 1183 O MET A 722 -7.718 7.136 1.957 1.00 0.00 O ATOM 1184 CB MET A 722 -6.988 4.979 4.014 1.00 0.00 C ATOM 1185 CG MET A 722 -6.449 4.954 5.447 1.00 0.00 C ATOM 1186 SD MET A 722 -7.584 4.035 6.519 1.00 0.00 S ATOM 1187 CE MET A 722 -6.551 4.002 8.006 1.00 0.00 C ATOM 0 H MET A 722 -9.350 4.122 4.281 1.00 0.00 H new ATOM 0 HA MET A 722 -8.080 6.831 4.508 1.00 0.00 H new ATOM 0 HB2 MET A 722 -7.266 3.973 3.701 1.00 0.00 H new ATOM 0 HB3 MET A 722 -6.214 5.324 3.329 1.00 0.00 H new ATOM 0 HG2 MET A 722 -5.463 4.491 5.465 1.00 0.00 H new ATOM 0 HG3 MET A 722 -6.330 5.972 5.817 1.00 0.00 H new ATOM 0 HE1 MET A 722 -7.000 3.340 8.746 1.00 0.00 H new ATOM 0 HE2 MET A 722 -5.556 3.638 7.750 1.00 0.00 H new ATOM 0 HE3 MET A 722 -6.474 5.008 8.418 1.00 0.00 H new ATOM 1197 N ASP A 723 -9.389 5.739 1.835 1.00 0.00 N ATOM 1198 CA ASP A 723 -9.590 6.090 0.402 1.00 0.00 C ATOM 1199 C ASP A 723 -10.537 7.277 0.201 1.00 0.00 C ATOM 1200 O ASP A 723 -10.934 7.551 -0.912 1.00 0.00 O ATOM 1201 CB ASP A 723 -10.176 4.838 -0.229 1.00 0.00 C ATOM 1202 CG ASP A 723 -11.559 4.542 0.336 1.00 0.00 C ATOM 1203 OD1 ASP A 723 -12.203 5.465 0.806 1.00 0.00 O ATOM 1204 OD2 ASP A 723 -11.954 3.390 0.291 1.00 0.00 O ATOM 0 H ASP A 723 -10.033 5.045 2.215 1.00 0.00 H new ATOM 0 HA ASP A 723 -8.647 6.399 -0.049 1.00 0.00 H new ATOM 0 HB2 ASP A 723 -10.240 4.966 -1.310 1.00 0.00 H new ATOM 0 HB3 ASP A 723 -9.515 3.991 -0.047 1.00 0.00 H new ATOM 1209 N GLY A 724 -10.902 7.990 1.236 1.00 0.00 N ATOM 1210 CA GLY A 724 -11.819 9.154 1.025 1.00 0.00 C ATOM 1211 C GLY A 724 -11.316 9.931 -0.192 1.00 0.00 C ATOM 1212 O GLY A 724 -12.010 10.089 -1.176 1.00 0.00 O ATOM 0 H GLY A 724 -10.613 7.823 2.200 1.00 0.00 H new ATOM 0 HA2 GLY A 724 -12.841 8.811 0.863 1.00 0.00 H new ATOM 0 HA3 GLY A 724 -11.833 9.794 1.907 1.00 0.00 H new ATOM 1216 N ALA A 725 -10.099 10.388 -0.132 1.00 0.00 N ATOM 1217 CA ALA A 725 -9.511 11.133 -1.283 1.00 0.00 C ATOM 1218 C ALA A 725 -8.718 10.150 -2.141 1.00 0.00 C ATOM 1219 O ALA A 725 -8.791 8.956 -1.933 1.00 0.00 O ATOM 1220 CB ALA A 725 -8.570 12.159 -0.654 1.00 0.00 C ATOM 0 H ALA A 725 -9.479 10.278 0.671 1.00 0.00 H new ATOM 0 HA ALA A 725 -10.262 11.611 -1.912 1.00 0.00 H new ATOM 0 HB1 ALA A 725 -8.097 12.749 -1.439 1.00 0.00 H new ATOM 0 HB2 ALA A 725 -9.137 12.818 0.003 1.00 0.00 H new ATOM 0 HB3 ALA A 725 -7.803 11.643 -0.076 1.00 0.00 H new ATOM 1226 N SER A 726 -7.922 10.613 -3.069 1.00 0.00 N ATOM 1227 CA SER A 726 -7.117 9.640 -3.849 1.00 0.00 C ATOM 1228 C SER A 726 -6.089 9.079 -2.873 1.00 0.00 C ATOM 1229 O SER A 726 -5.726 9.747 -1.927 1.00 0.00 O ATOM 1230 CB SER A 726 -6.451 10.451 -4.957 1.00 0.00 C ATOM 1231 OG SER A 726 -5.457 11.294 -4.387 1.00 0.00 O ATOM 0 H SER A 726 -7.799 11.596 -3.313 1.00 0.00 H new ATOM 0 HA SER A 726 -7.686 8.821 -4.289 1.00 0.00 H new ATOM 0 HB2 SER A 726 -6.001 9.784 -5.692 1.00 0.00 H new ATOM 0 HB3 SER A 726 -7.195 11.050 -5.483 1.00 0.00 H new ATOM 0 HG SER A 726 -5.025 11.816 -5.095 1.00 0.00 H new ATOM 1237 N HIS A 727 -5.628 7.874 -3.039 1.00 0.00 N ATOM 1238 CA HIS A 727 -4.666 7.366 -2.041 1.00 0.00 C ATOM 1239 C HIS A 727 -3.275 7.274 -2.647 1.00 0.00 C ATOM 1240 O HIS A 727 -3.062 6.641 -3.659 1.00 0.00 O ATOM 1241 CB HIS A 727 -5.141 5.971 -1.578 1.00 0.00 C ATOM 1242 CG HIS A 727 -6.570 5.631 -1.965 1.00 0.00 C ATOM 1243 ND1 HIS A 727 -7.043 4.352 -1.762 1.00 0.00 N ATOM 1244 CD2 HIS A 727 -7.622 6.324 -2.541 1.00 0.00 C ATOM 1245 CE1 HIS A 727 -8.303 4.301 -2.206 1.00 0.00 C ATOM 1246 NE2 HIS A 727 -8.708 5.474 -2.694 1.00 0.00 N ATOM 0 H HIS A 727 -5.869 7.239 -3.800 1.00 0.00 H new ATOM 0 HA HIS A 727 -4.618 8.046 -1.190 1.00 0.00 H new ATOM 0 HB2 HIS A 727 -4.475 5.217 -1.998 1.00 0.00 H new ATOM 0 HB3 HIS A 727 -5.048 5.911 -0.494 1.00 0.00 H new ATOM 0 HD1 HIS A 727 -6.523 3.580 -1.346 1.00 0.00 H new ATOM 0 HD2 HIS A 727 -7.600 7.365 -2.827 1.00 0.00 H new ATOM 0 HE1 HIS A 727 -8.920 3.415 -2.173 1.00 0.00 H new ATOM 1254 N ASP A 728 -2.327 7.889 -2.007 1.00 0.00 N ATOM 1255 CA ASP A 728 -0.924 7.831 -2.495 1.00 0.00 C ATOM 1256 C ASP A 728 -0.008 7.639 -1.290 1.00 0.00 C ATOM 1257 O ASP A 728 0.135 8.531 -0.473 1.00 0.00 O ATOM 1258 CB ASP A 728 -0.665 9.180 -3.169 1.00 0.00 C ATOM 1259 CG ASP A 728 -1.569 9.323 -4.392 1.00 0.00 C ATOM 1260 OD1 ASP A 728 -1.864 8.314 -5.012 1.00 0.00 O ATOM 1261 OD2 ASP A 728 -1.955 10.443 -4.687 1.00 0.00 O ATOM 0 H ASP A 728 -2.464 8.436 -1.157 1.00 0.00 H new ATOM 0 HA ASP A 728 -0.745 7.013 -3.192 1.00 0.00 H new ATOM 0 HB2 ASP A 728 -0.855 9.991 -2.467 1.00 0.00 H new ATOM 0 HB3 ASP A 728 0.381 9.255 -3.466 1.00 0.00 H new ATOM 1266 N PHE A 729 0.603 6.490 -1.136 1.00 0.00 N ATOM 1267 CA PHE A 729 1.475 6.307 0.052 1.00 0.00 C ATOM 1268 C PHE A 729 2.872 5.866 -0.356 1.00 0.00 C ATOM 1269 O PHE A 729 3.116 5.399 -1.449 1.00 0.00 O ATOM 1270 CB PHE A 729 0.888 5.184 0.929 1.00 0.00 C ATOM 1271 CG PHE A 729 -0.577 4.923 0.670 1.00 0.00 C ATOM 1272 CD1 PHE A 729 -1.480 5.972 0.481 1.00 0.00 C ATOM 1273 CD2 PHE A 729 -1.032 3.599 0.652 1.00 0.00 C ATOM 1274 CE1 PHE A 729 -2.835 5.695 0.269 1.00 0.00 C ATOM 1275 CE2 PHE A 729 -2.384 3.322 0.441 1.00 0.00 C ATOM 1276 CZ PHE A 729 -3.289 4.368 0.251 1.00 0.00 C ATOM 0 H PHE A 729 0.536 5.692 -1.768 1.00 0.00 H new ATOM 0 HA PHE A 729 1.528 7.258 0.582 1.00 0.00 H new ATOM 0 HB2 PHE A 729 1.449 4.266 0.754 1.00 0.00 H new ATOM 0 HB3 PHE A 729 1.023 5.445 1.979 1.00 0.00 H new ATOM 0 HD1 PHE A 729 -1.133 6.995 0.498 1.00 0.00 H new ATOM 0 HD2 PHE A 729 -0.334 2.789 0.802 1.00 0.00 H new ATOM 0 HE1 PHE A 729 -3.533 6.505 0.119 1.00 0.00 H new ATOM 0 HE2 PHE A 729 -2.730 2.299 0.425 1.00 0.00 H new ATOM 0 HZ PHE A 729 -4.336 4.156 0.091 1.00 0.00 H new ATOM 1286 N LEU A 730 3.778 5.967 0.556 1.00 0.00 N ATOM 1287 CA LEU A 730 5.165 5.499 0.283 1.00 0.00 C ATOM 1288 C LEU A 730 5.518 4.422 1.318 1.00 0.00 C ATOM 1289 O LEU A 730 5.148 4.527 2.469 1.00 0.00 O ATOM 1290 CB LEU A 730 6.055 6.726 0.431 1.00 0.00 C ATOM 1291 CG LEU A 730 7.463 6.358 -0.020 1.00 0.00 C ATOM 1292 CD1 LEU A 730 7.418 5.979 -1.496 1.00 0.00 C ATOM 1293 CD2 LEU A 730 8.395 7.550 0.177 1.00 0.00 C ATOM 0 H LEU A 730 3.626 6.354 1.487 1.00 0.00 H new ATOM 0 HA LEU A 730 5.287 5.064 -0.709 1.00 0.00 H new ATOM 0 HB2 LEU A 730 5.668 7.549 -0.169 1.00 0.00 H new ATOM 0 HB3 LEU A 730 6.065 7.064 1.467 1.00 0.00 H new ATOM 0 HG LEU A 730 7.835 5.519 0.568 1.00 0.00 H new ATOM 0 HD11 LEU A 730 8.419 5.713 -1.834 1.00 0.00 H new ATOM 0 HD12 LEU A 730 6.751 5.128 -1.633 1.00 0.00 H new ATOM 0 HD13 LEU A 730 7.052 6.825 -2.078 1.00 0.00 H new ATOM 0 HD21 LEU A 730 9.401 7.283 -0.147 1.00 0.00 H new ATOM 0 HD22 LEU A 730 8.036 8.394 -0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 730 8.415 7.826 1.231 1.00 0.00 H new ATOM 1305 N LEU A 731 6.191 3.368 0.930 1.00 0.00 N ATOM 1306 CA LEU A 731 6.496 2.293 1.928 1.00 0.00 C ATOM 1307 C LEU A 731 7.973 2.282 2.324 1.00 0.00 C ATOM 1308 O LEU A 731 8.851 2.304 1.485 1.00 0.00 O ATOM 1309 CB LEU A 731 6.143 0.987 1.214 1.00 0.00 C ATOM 1310 CG LEU A 731 4.789 1.136 0.527 1.00 0.00 C ATOM 1311 CD1 LEU A 731 4.288 -0.230 0.059 1.00 0.00 C ATOM 1312 CD2 LEU A 731 3.789 1.731 1.505 1.00 0.00 C ATOM 0 H LEU A 731 6.538 3.205 -0.015 1.00 0.00 H new ATOM 0 HA LEU A 731 5.935 2.444 2.850 1.00 0.00 H new ATOM 0 HB2 LEU A 731 6.911 0.742 0.480 1.00 0.00 H new ATOM 0 HB3 LEU A 731 6.112 0.165 1.929 1.00 0.00 H new ATOM 0 HG LEU A 731 4.897 1.793 -0.336 1.00 0.00 H new ATOM 0 HD11 LEU A 731 3.321 -0.115 -0.430 1.00 0.00 H new ATOM 0 HD12 LEU A 731 5.002 -0.658 -0.645 1.00 0.00 H new ATOM 0 HD13 LEU A 731 4.183 -0.893 0.918 1.00 0.00 H new ATOM 0 HD21 LEU A 731 2.821 1.838 1.016 1.00 0.00 H new ATOM 0 HD22 LEU A 731 3.688 1.073 2.368 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.140 2.709 1.834 1.00 0.00 H new ATOM 1324 N ARG A 732 8.248 2.224 3.604 1.00 0.00 N ATOM 1325 CA ARG A 732 9.666 2.185 4.067 1.00 0.00 C ATOM 1326 C ARG A 732 9.928 0.861 4.789 1.00 0.00 C ATOM 1327 O ARG A 732 9.530 0.673 5.923 1.00 0.00 O ATOM 1328 CB ARG A 732 9.806 3.353 5.042 1.00 0.00 C ATOM 1329 CG ARG A 732 9.420 4.645 4.328 1.00 0.00 C ATOM 1330 CD ARG A 732 9.177 5.761 5.349 1.00 0.00 C ATOM 1331 NE ARG A 732 8.810 6.953 4.530 1.00 0.00 N ATOM 1332 CZ ARG A 732 9.738 7.779 4.108 1.00 0.00 C ATOM 1333 NH1 ARG A 732 10.636 7.385 3.242 1.00 0.00 N ATOM 1334 NH2 ARG A 732 9.757 9.011 4.542 1.00 0.00 N ATOM 0 H ARG A 732 7.550 2.202 4.347 1.00 0.00 H new ATOM 0 HA ARG A 732 10.375 2.262 3.243 1.00 0.00 H new ATOM 0 HB2 ARG A 732 9.166 3.197 5.911 1.00 0.00 H new ATOM 0 HB3 ARG A 732 10.831 3.417 5.408 1.00 0.00 H new ATOM 0 HG2 ARG A 732 10.212 4.939 3.639 1.00 0.00 H new ATOM 0 HG3 ARG A 732 8.521 4.485 3.732 1.00 0.00 H new ATOM 0 HD2 ARG A 732 8.379 5.496 6.042 1.00 0.00 H new ATOM 0 HD3 ARG A 732 10.068 5.951 5.947 1.00 0.00 H new ATOM 0 HE ARG A 732 7.832 7.127 4.297 1.00 0.00 H new ATOM 0 HH11 ARG A 732 10.619 6.428 2.889 1.00 0.00 H new ATOM 0 HH12 ARG A 732 11.353 8.035 2.920 1.00 0.00 H new ATOM 0 HH21 ARG A 732 9.052 9.328 5.207 1.00 0.00 H new ATOM 0 HH22 ARG A 732 10.477 9.656 4.216 1.00 0.00 H new ATOM 1348 N GLN A 733 10.585 -0.061 4.149 1.00 0.00 N ATOM 1349 CA GLN A 733 10.848 -1.367 4.818 1.00 0.00 C ATOM 1350 C GLN A 733 11.757 -1.195 6.018 1.00 0.00 C ATOM 1351 O GLN A 733 12.904 -0.810 5.911 1.00 0.00 O ATOM 1352 CB GLN A 733 11.502 -2.239 3.757 1.00 0.00 C ATOM 1353 CG GLN A 733 10.428 -2.949 2.941 1.00 0.00 C ATOM 1354 CD GLN A 733 9.932 -4.158 3.730 1.00 0.00 C ATOM 1355 OE1 GLN A 733 8.747 -4.355 3.878 1.00 0.00 O ATOM 1356 NE2 GLN A 733 10.799 -4.983 4.247 1.00 0.00 N ATOM 0 H GLN A 733 10.949 0.028 3.201 1.00 0.00 H new ATOM 0 HA GLN A 733 9.930 -1.815 5.199 1.00 0.00 H new ATOM 0 HB2 GLN A 733 12.124 -1.628 3.103 1.00 0.00 H new ATOM 0 HB3 GLN A 733 12.158 -2.971 4.228 1.00 0.00 H new ATOM 0 HG2 GLN A 733 9.602 -2.270 2.732 1.00 0.00 H new ATOM 0 HG3 GLN A 733 10.832 -3.265 1.979 1.00 0.00 H new ATOM 0 HE21 GLN A 733 11.798 -4.817 4.122 1.00 0.00 H new ATOM 0 HE22 GLN A 733 10.479 -5.794 4.776 1.00 0.00 H new ATOM 1365 N ARG A 734 11.235 -1.507 7.165 1.00 0.00 N ATOM 1366 CA ARG A 734 12.031 -1.401 8.408 1.00 0.00 C ATOM 1367 C ARG A 734 12.715 -2.733 8.670 1.00 0.00 C ATOM 1368 O ARG A 734 13.819 -2.799 9.176 1.00 0.00 O ATOM 1369 CB ARG A 734 11.013 -1.114 9.502 1.00 0.00 C ATOM 1370 CG ARG A 734 11.754 -0.813 10.802 1.00 0.00 C ATOM 1371 CD ARG A 734 10.740 -0.571 11.912 1.00 0.00 C ATOM 1372 NE ARG A 734 11.318 -1.242 13.106 1.00 0.00 N ATOM 1373 CZ ARG A 734 10.578 -1.441 14.158 1.00 0.00 C ATOM 1374 NH1 ARG A 734 9.429 -0.828 14.270 1.00 0.00 N ATOM 1375 NH2 ARG A 734 10.981 -2.254 15.095 1.00 0.00 N ATOM 0 H ARG A 734 10.278 -1.835 7.294 1.00 0.00 H new ATOM 0 HA ARG A 734 12.800 -0.630 8.356 1.00 0.00 H new ATOM 0 HB2 ARG A 734 10.386 -0.268 9.221 1.00 0.00 H new ATOM 0 HB3 ARG A 734 10.351 -1.970 9.635 1.00 0.00 H new ATOM 0 HG2 ARG A 734 12.406 -1.646 11.064 1.00 0.00 H new ATOM 0 HG3 ARG A 734 12.391 0.063 10.677 1.00 0.00 H new ATOM 0 HD2 ARG A 734 10.594 0.495 12.089 1.00 0.00 H new ATOM 0 HD3 ARG A 734 9.766 -0.988 11.656 1.00 0.00 H new ATOM 0 HE ARG A 734 12.292 -1.546 13.101 1.00 0.00 H new ATOM 0 HH11 ARG A 734 9.114 -0.196 13.534 1.00 0.00 H new ATOM 0 HH12 ARG A 734 8.847 -0.982 15.093 1.00 0.00 H new ATOM 0 HH21 ARG A 734 11.876 -2.734 15.003 1.00 0.00 H new ATOM 0 HH22 ARG A 734 10.401 -2.410 15.919 1.00 0.00 H new ATOM 1389 N ARG A 735 12.055 -3.800 8.319 1.00 0.00 N ATOM 1390 CA ARG A 735 12.648 -5.145 8.533 1.00 0.00 C ATOM 1391 C ARG A 735 12.632 -5.935 7.220 1.00 0.00 C ATOM 1392 O ARG A 735 13.290 -6.961 7.158 1.00 0.00 O ATOM 1393 CB ARG A 735 11.747 -5.805 9.578 1.00 0.00 C ATOM 1394 CG ARG A 735 11.766 -4.969 10.862 1.00 0.00 C ATOM 1395 CD ARG A 735 10.671 -5.456 11.820 1.00 0.00 C ATOM 1396 NE ARG A 735 9.407 -4.854 11.307 1.00 0.00 N ATOM 1397 CZ ARG A 735 8.340 -4.843 12.064 1.00 0.00 C ATOM 1398 NH1 ARG A 735 8.095 -5.850 12.858 1.00 0.00 N ATOM 1399 NH2 ARG A 735 7.521 -3.823 12.034 1.00 0.00 N ATOM 1400 OXT ARG A 735 11.964 -5.497 6.299 1.00 0.00 O ATOM 0 H ARG A 735 11.129 -3.797 7.892 1.00 0.00 H new ATOM 0 HA ARG A 735 13.686 -5.102 8.863 1.00 0.00 H new ATOM 0 HB2 ARG A 735 10.729 -5.886 9.198 1.00 0.00 H new ATOM 0 HB3 ARG A 735 12.092 -6.818 9.785 1.00 0.00 H new ATOM 0 HG2 ARG A 735 12.742 -5.046 11.342 1.00 0.00 H new ATOM 0 HG3 ARG A 735 11.611 -3.917 10.623 1.00 0.00 H new ATOM 0 HD2 ARG A 735 10.613 -6.544 11.831 1.00 0.00 H new ATOM 0 HD3 ARG A 735 10.872 -5.137 12.843 1.00 0.00 H new ATOM 0 HE ARG A 735 9.374 -4.452 10.370 1.00 0.00 H new ATOM 0 HH11 ARG A 735 8.735 -6.644 12.887 1.00 0.00 H new ATOM 0 HH12 ARG A 735 7.264 -5.843 13.449 1.00 0.00 H new ATOM 0 HH21 ARG A 735 7.713 -3.032 11.419 1.00 0.00 H new ATOM 0 HH22 ARG A 735 6.690 -3.818 12.626 1.00 0.00 H new