USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 694 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 711 THR OG1 : rot 180:sc= -2.47! USER MOD Set 1.2: A 714 HIS : no HD1:sc= -1.18 K(o=-3.6,f=-2.2) USER MOD Set 2.1: A 688 ASN : amide:sc= -11! C(o=-9.9!,f=-15!) USER MOD Set 2.2: A 692 SER OG : rot 148:sc= 1.1 USER MOD Single : A 650 CYS SG : rot 7:sc= 0.136 USER MOD Single : A 656 GLN : amide:sc= -1.05 K(o=-1,f=-0.23) USER MOD Single : A 657 MET CE :methyl -171:sc= -10.6! (180deg=-11.1!) USER MOD Single : A 664 SER OG : rot -17:sc= -0.681 USER MOD Single : A 666 TYR OH : rot 180:sc= 0 USER MOD Single : A 667 LYS NZ :NH3+ 175:sc= -6.18! (180deg=-6.49!) USER MOD Single : A 668 SER OG : rot -170:sc= 0.00357 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= -0.0737 X(o=-0.074,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+ 148:sc= -0.223 (180deg=-1.6!) USER MOD Single : A 687 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 ASN : amide:sc= -2.76! C(o=-2.8!,f=-10!) USER MOD Single : A 696 SER OG : rot 100:sc= -1.13 USER MOD Single : A 702 GLN : amide:sc= -10.3! C(o=-10!,f=-16!) USER MOD Single : A 715 SER OG : rot 180:sc= 0 USER MOD Single : A 717 ASN : amide:sc= -0.811 K(o=-0.81,f=-1.5) USER MOD Single : A 720 TYR OH : rot 180:sc= 0 USER MOD Single : A 722 MET CE :methyl 161:sc= -2.06 (180deg=-3.26!) USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 HIS : no HE2:sc= -21.4! C(o=-21!,f=-25!) USER MOD Single : A 733 GLN : amide:sc= -6.57! C(o=-6.6!,f=-17!) USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 649 -18.496 4.863 -5.677 1.00 0.00 N ATOM 33 CA ASP A 649 -17.580 5.135 -6.813 1.00 0.00 C ATOM 34 C ASP A 649 -16.287 4.367 -6.583 1.00 0.00 C ATOM 35 O ASP A 649 -15.992 3.970 -5.475 1.00 0.00 O ATOM 36 CB ASP A 649 -17.318 6.640 -6.768 1.00 0.00 C ATOM 37 CG ASP A 649 -18.557 7.396 -7.247 1.00 0.00 C ATOM 38 OD1 ASP A 649 -19.436 6.762 -7.807 1.00 0.00 O ATOM 39 OD2 ASP A 649 -18.601 8.600 -7.056 1.00 0.00 O ATOM 0 HA ASP A 649 -17.992 4.833 -7.776 1.00 0.00 H new ATOM 0 HB2 ASP A 649 -17.065 6.944 -5.752 1.00 0.00 H new ATOM 0 HB3 ASP A 649 -16.463 6.889 -7.397 1.00 0.00 H new ATOM 44 N CYS A 650 -15.486 4.186 -7.589 1.00 0.00 N ATOM 45 CA CYS A 650 -14.208 3.476 -7.342 1.00 0.00 C ATOM 46 C CYS A 650 -13.113 4.495 -7.109 1.00 0.00 C ATOM 47 O CYS A 650 -13.163 5.615 -7.581 1.00 0.00 O ATOM 48 CB CYS A 650 -13.895 2.638 -8.579 1.00 0.00 C ATOM 49 SG CYS A 650 -13.432 3.713 -9.960 1.00 0.00 S ATOM 0 H CYS A 650 -15.654 4.490 -8.548 1.00 0.00 H new ATOM 0 HA CYS A 650 -14.279 2.833 -6.465 1.00 0.00 H new ATOM 0 HB2 CYS A 650 -13.084 1.943 -8.361 1.00 0.00 H new ATOM 0 HB3 CYS A 650 -14.764 2.038 -8.851 1.00 0.00 H new ATOM 0 HG CYS A 650 -13.334 4.940 -9.541 1.00 0.00 H new ATOM 55 N ARG A 651 -12.127 4.105 -6.380 1.00 0.00 N ATOM 56 CA ARG A 651 -11.008 5.015 -6.090 1.00 0.00 C ATOM 57 C ARG A 651 -9.723 4.358 -6.556 1.00 0.00 C ATOM 58 O ARG A 651 -9.687 3.172 -6.779 1.00 0.00 O ATOM 59 CB ARG A 651 -11.030 5.168 -4.589 1.00 0.00 C ATOM 60 CG ARG A 651 -12.338 5.831 -4.191 1.00 0.00 C ATOM 61 CD ARG A 651 -12.429 5.915 -2.673 1.00 0.00 C ATOM 62 NE ARG A 651 -13.550 5.010 -2.333 1.00 0.00 N ATOM 63 CZ ARG A 651 -14.062 5.029 -1.140 1.00 0.00 C ATOM 64 NH1 ARG A 651 -14.640 6.110 -0.703 1.00 0.00 N ATOM 65 NH2 ARG A 651 -13.984 3.975 -0.381 1.00 0.00 N ATOM 0 H ARG A 651 -12.046 3.177 -5.964 1.00 0.00 H new ATOM 0 HA ARG A 651 -11.081 5.981 -6.589 1.00 0.00 H new ATOM 0 HB2 ARG A 651 -10.937 4.194 -4.108 1.00 0.00 H new ATOM 0 HB3 ARG A 651 -10.184 5.770 -4.257 1.00 0.00 H new ATOM 0 HG2 ARG A 651 -12.398 6.829 -4.624 1.00 0.00 H new ATOM 0 HG3 ARG A 651 -13.180 5.262 -4.585 1.00 0.00 H new ATOM 0 HD2 ARG A 651 -11.501 5.597 -2.199 1.00 0.00 H new ATOM 0 HD3 ARG A 651 -12.624 6.935 -2.340 1.00 0.00 H new ATOM 0 HE ARG A 651 -13.920 4.371 -3.036 1.00 0.00 H new ATOM 0 HH11 ARG A 651 -14.689 6.938 -1.297 1.00 0.00 H new ATOM 0 HH12 ARG A 651 -15.044 6.130 0.234 1.00 0.00 H new ATOM 0 HH21 ARG A 651 -13.520 3.133 -0.723 1.00 0.00 H new ATOM 0 HH22 ARG A 651 -14.386 3.990 0.556 1.00 0.00 H new ATOM 79 N ILE A 652 -8.676 5.094 -6.728 1.00 0.00 N ATOM 80 CA ILE A 652 -7.433 4.451 -7.201 1.00 0.00 C ATOM 81 C ILE A 652 -6.314 4.642 -6.170 1.00 0.00 C ATOM 82 O ILE A 652 -6.227 5.654 -5.503 1.00 0.00 O ATOM 83 CB ILE A 652 -7.153 5.147 -8.523 1.00 0.00 C ATOM 84 CG1 ILE A 652 -6.878 6.625 -8.261 1.00 0.00 C ATOM 85 CG2 ILE A 652 -8.393 5.008 -9.425 1.00 0.00 C ATOM 86 CD1 ILE A 652 -5.428 6.937 -8.618 1.00 0.00 C ATOM 0 H ILE A 652 -8.624 6.100 -6.565 1.00 0.00 H new ATOM 0 HA ILE A 652 -7.510 3.372 -7.331 1.00 0.00 H new ATOM 0 HB ILE A 652 -6.288 4.698 -9.010 1.00 0.00 H new ATOM 0 HG12 ILE A 652 -7.552 7.243 -8.854 1.00 0.00 H new ATOM 0 HG13 ILE A 652 -7.066 6.862 -7.214 1.00 0.00 H new ATOM 0 HG21 ILE A 652 -8.207 5.503 -10.378 1.00 0.00 H new ATOM 0 HG22 ILE A 652 -8.600 3.952 -9.599 1.00 0.00 H new ATOM 0 HG23 ILE A 652 -9.251 5.470 -8.937 1.00 0.00 H new ATOM 0 HD11 ILE A 652 -5.227 7.992 -8.433 1.00 0.00 H new ATOM 0 HD12 ILE A 652 -4.763 6.328 -8.006 1.00 0.00 H new ATOM 0 HD13 ILE A 652 -5.257 6.715 -9.671 1.00 0.00 H new ATOM 98 N ILE A 653 -5.492 3.644 -6.009 1.00 0.00 N ATOM 99 CA ILE A 653 -4.397 3.703 -4.991 1.00 0.00 C ATOM 100 C ILE A 653 -3.035 3.448 -5.638 1.00 0.00 C ATOM 101 O ILE A 653 -2.902 2.698 -6.586 1.00 0.00 O ATOM 102 CB ILE A 653 -4.741 2.600 -3.948 1.00 0.00 C ATOM 103 CG1 ILE A 653 -3.488 1.770 -3.574 1.00 0.00 C ATOM 104 CG2 ILE A 653 -5.816 1.665 -4.512 1.00 0.00 C ATOM 105 CD1 ILE A 653 -3.893 0.502 -2.810 1.00 0.00 C ATOM 0 H ILE A 653 -5.530 2.777 -6.545 1.00 0.00 H new ATOM 0 HA ILE A 653 -4.330 4.686 -4.525 1.00 0.00 H new ATOM 0 HB ILE A 653 -5.111 3.093 -3.049 1.00 0.00 H new ATOM 0 HG12 ILE A 653 -2.941 1.499 -4.477 1.00 0.00 H new ATOM 0 HG13 ILE A 653 -2.815 2.371 -2.962 1.00 0.00 H new ATOM 0 HG21 ILE A 653 -6.051 0.896 -3.776 1.00 0.00 H new ATOM 0 HG22 ILE A 653 -6.715 2.239 -4.738 1.00 0.00 H new ATOM 0 HG23 ILE A 653 -5.447 1.195 -5.424 1.00 0.00 H new ATOM 0 HD11 ILE A 653 -3.001 -0.070 -2.555 1.00 0.00 H new ATOM 0 HD12 ILE A 653 -4.419 0.780 -1.897 1.00 0.00 H new ATOM 0 HD13 ILE A 653 -4.547 -0.106 -3.435 1.00 0.00 H new ATOM 117 N ARG A 654 -2.030 4.065 -5.100 1.00 0.00 N ATOM 118 CA ARG A 654 -0.655 3.883 -5.619 1.00 0.00 C ATOM 119 C ARG A 654 0.326 3.878 -4.442 1.00 0.00 C ATOM 120 O ARG A 654 0.255 4.709 -3.568 1.00 0.00 O ATOM 121 CB ARG A 654 -0.431 5.091 -6.510 1.00 0.00 C ATOM 122 CG ARG A 654 0.992 5.065 -7.043 1.00 0.00 C ATOM 123 CD ARG A 654 1.265 6.361 -7.799 1.00 0.00 C ATOM 124 NE ARG A 654 1.549 5.933 -9.194 1.00 0.00 N ATOM 125 CZ ARG A 654 0.581 5.479 -9.942 1.00 0.00 C ATOM 126 NH1 ARG A 654 -0.593 6.043 -9.903 1.00 0.00 N ATOM 127 NH2 ARG A 654 0.788 4.449 -10.718 1.00 0.00 N ATOM 0 H ARG A 654 -2.105 4.701 -4.306 1.00 0.00 H new ATOM 0 HA ARG A 654 -0.511 2.949 -6.161 1.00 0.00 H new ATOM 0 HB2 ARG A 654 -1.141 5.084 -7.337 1.00 0.00 H new ATOM 0 HB3 ARG A 654 -0.604 6.009 -5.948 1.00 0.00 H new ATOM 0 HG2 ARG A 654 1.699 4.953 -6.221 1.00 0.00 H new ATOM 0 HG3 ARG A 654 1.131 4.208 -7.703 1.00 0.00 H new ATOM 0 HD2 ARG A 654 0.407 7.032 -7.758 1.00 0.00 H new ATOM 0 HD3 ARG A 654 2.111 6.899 -7.370 1.00 0.00 H new ATOM 0 HE ARG A 654 2.497 5.994 -9.565 1.00 0.00 H new ATOM 0 HH11 ARG A 654 -0.756 6.840 -9.288 1.00 0.00 H new ATOM 0 HH12 ARG A 654 -1.349 5.688 -10.488 1.00 0.00 H new ATOM 0 HH21 ARG A 654 1.704 4.002 -10.738 1.00 0.00 H new ATOM 0 HH22 ARG A 654 0.033 4.092 -11.304 1.00 0.00 H new ATOM 141 N VAL A 655 1.230 2.951 -4.396 1.00 0.00 N ATOM 142 CA VAL A 655 2.188 2.915 -3.251 1.00 0.00 C ATOM 143 C VAL A 655 3.589 2.625 -3.760 1.00 0.00 C ATOM 144 O VAL A 655 3.755 2.031 -4.798 1.00 0.00 O ATOM 145 CB VAL A 655 1.710 1.752 -2.396 1.00 0.00 C ATOM 146 CG1 VAL A 655 2.481 1.717 -1.074 1.00 0.00 C ATOM 147 CG2 VAL A 655 0.207 1.888 -2.146 1.00 0.00 C ATOM 0 H VAL A 655 1.353 2.217 -5.094 1.00 0.00 H new ATOM 0 HA VAL A 655 2.222 3.858 -2.705 1.00 0.00 H new ATOM 0 HB VAL A 655 1.896 0.815 -2.920 1.00 0.00 H new ATOM 0 HG11 VAL A 655 2.130 0.880 -0.470 1.00 0.00 H new ATOM 0 HG12 VAL A 655 3.545 1.597 -1.277 1.00 0.00 H new ATOM 0 HG13 VAL A 655 2.317 2.649 -0.533 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -0.137 1.055 -1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 655 0.008 2.826 -1.628 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -0.322 1.880 -3.099 1.00 0.00 H new ATOM 157 N GLN A 656 4.609 3.013 -3.053 1.00 0.00 N ATOM 158 CA GLN A 656 5.969 2.706 -3.565 1.00 0.00 C ATOM 159 C GLN A 656 6.790 1.949 -2.525 1.00 0.00 C ATOM 160 O GLN A 656 7.207 2.505 -1.528 1.00 0.00 O ATOM 161 CB GLN A 656 6.606 4.062 -3.857 1.00 0.00 C ATOM 162 CG GLN A 656 5.819 4.763 -4.965 1.00 0.00 C ATOM 163 CD GLN A 656 5.330 6.122 -4.465 1.00 0.00 C ATOM 164 OE1 GLN A 656 5.277 7.077 -5.215 1.00 0.00 O ATOM 165 NE2 GLN A 656 4.970 6.253 -3.217 1.00 0.00 N ATOM 0 H GLN A 656 4.565 3.516 -2.167 1.00 0.00 H new ATOM 0 HA GLN A 656 5.927 2.071 -4.450 1.00 0.00 H new ATOM 0 HB2 GLN A 656 6.612 4.675 -2.956 1.00 0.00 H new ATOM 0 HB3 GLN A 656 7.645 3.931 -4.160 1.00 0.00 H new ATOM 0 HG2 GLN A 656 6.448 4.893 -5.846 1.00 0.00 H new ATOM 0 HG3 GLN A 656 4.971 4.149 -5.267 1.00 0.00 H new ATOM 0 HE21 GLN A 656 5.014 5.452 -2.587 1.00 0.00 H new ATOM 0 HE22 GLN A 656 4.645 7.156 -2.872 1.00 0.00 H new ATOM 174 N MET A 657 7.071 0.698 -2.765 1.00 0.00 N ATOM 175 CA MET A 657 7.911 -0.051 -1.797 1.00 0.00 C ATOM 176 C MET A 657 9.363 0.032 -2.259 1.00 0.00 C ATOM 177 O MET A 657 9.783 -0.648 -3.171 1.00 0.00 O ATOM 178 CB MET A 657 7.396 -1.490 -1.794 1.00 0.00 C ATOM 179 CG MET A 657 8.260 -2.323 -0.851 1.00 0.00 C ATOM 180 SD MET A 657 7.962 -1.794 0.850 1.00 0.00 S ATOM 181 CE MET A 657 9.374 -0.675 0.995 1.00 0.00 C ATOM 0 H MET A 657 6.759 0.170 -3.580 1.00 0.00 H new ATOM 0 HA MET A 657 7.859 0.355 -0.787 1.00 0.00 H new ATOM 0 HB2 MET A 657 6.355 -1.517 -1.473 1.00 0.00 H new ATOM 0 HB3 MET A 657 7.430 -1.905 -2.801 1.00 0.00 H new ATOM 0 HG2 MET A 657 8.024 -3.381 -0.962 1.00 0.00 H new ATOM 0 HG3 MET A 657 9.314 -2.203 -1.103 1.00 0.00 H new ATOM 0 HE1 MET A 657 9.478 -0.353 2.031 1.00 0.00 H new ATOM 0 HE2 MET A 657 10.281 -1.192 0.683 1.00 0.00 H new ATOM 0 HE3 MET A 657 9.215 0.195 0.358 1.00 0.00 H new ATOM 191 N GLU A 658 10.106 0.902 -1.642 1.00 0.00 N ATOM 192 CA GLU A 658 11.527 1.125 -2.030 1.00 0.00 C ATOM 193 C GLU A 658 12.495 0.132 -1.385 1.00 0.00 C ATOM 194 O GLU A 658 13.674 0.402 -1.286 1.00 0.00 O ATOM 195 CB GLU A 658 11.800 2.543 -1.538 1.00 0.00 C ATOM 196 CG GLU A 658 11.062 3.531 -2.450 1.00 0.00 C ATOM 197 CD GLU A 658 11.470 4.968 -2.115 1.00 0.00 C ATOM 198 OE1 GLU A 658 12.284 5.144 -1.222 1.00 0.00 O ATOM 199 OE2 GLU A 658 10.961 5.869 -2.761 1.00 0.00 O ATOM 0 H GLU A 658 9.783 1.482 -0.868 1.00 0.00 H new ATOM 0 HA GLU A 658 11.678 0.986 -3.100 1.00 0.00 H new ATOM 0 HB2 GLU A 658 11.464 2.657 -0.507 1.00 0.00 H new ATOM 0 HB3 GLU A 658 12.871 2.747 -1.548 1.00 0.00 H new ATOM 0 HG2 GLU A 658 11.291 3.314 -3.493 1.00 0.00 H new ATOM 0 HG3 GLU A 658 9.985 3.414 -2.329 1.00 0.00 H new ATOM 206 N LEU A 659 12.038 -0.987 -0.903 1.00 0.00 N ATOM 207 CA LEU A 659 13.005 -1.902 -0.237 1.00 0.00 C ATOM 208 C LEU A 659 12.607 -3.370 -0.402 1.00 0.00 C ATOM 209 O LEU A 659 11.513 -3.695 -0.821 1.00 0.00 O ATOM 210 CB LEU A 659 12.970 -1.491 1.237 1.00 0.00 C ATOM 211 CG LEU A 659 14.092 -2.222 1.997 1.00 0.00 C ATOM 212 CD1 LEU A 659 15.442 -1.918 1.336 1.00 0.00 C ATOM 213 CD2 LEU A 659 14.147 -1.749 3.458 1.00 0.00 C ATOM 0 H LEU A 659 11.069 -1.302 -0.938 1.00 0.00 H new ATOM 0 HA LEU A 659 14.001 -1.820 -0.672 1.00 0.00 H new ATOM 0 HB2 LEU A 659 13.096 -0.412 1.329 1.00 0.00 H new ATOM 0 HB3 LEU A 659 12.001 -1.736 1.672 1.00 0.00 H new ATOM 0 HG LEU A 659 13.888 -3.292 1.968 1.00 0.00 H new ATOM 0 HD11 LEU A 659 16.236 -2.436 1.875 1.00 0.00 H new ATOM 0 HD12 LEU A 659 15.425 -2.258 0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 659 15.626 -0.844 1.362 1.00 0.00 H new ATOM 0 HD21 LEU A 659 14.945 -2.275 3.981 1.00 0.00 H new ATOM 0 HD22 LEU A 659 14.340 -0.677 3.486 1.00 0.00 H new ATOM 0 HD23 LEU A 659 13.194 -1.959 3.945 1.00 0.00 H new ATOM 225 N GLY A 660 13.504 -4.253 -0.077 1.00 0.00 N ATOM 226 CA GLY A 660 13.237 -5.706 -0.202 1.00 0.00 C ATOM 227 C GLY A 660 14.517 -6.350 -0.704 1.00 0.00 C ATOM 228 O GLY A 660 15.429 -5.660 -1.120 1.00 0.00 O ATOM 0 H GLY A 660 14.432 -4.022 0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 660 12.944 -6.128 0.759 1.00 0.00 H new ATOM 0 HA3 GLY A 660 12.416 -5.889 -0.895 1.00 0.00 H new ATOM 232 N GLU A 661 14.623 -7.643 -0.714 1.00 0.00 N ATOM 233 CA GLU A 661 15.883 -8.210 -1.249 1.00 0.00 C ATOM 234 C GLU A 661 16.012 -7.688 -2.673 1.00 0.00 C ATOM 235 O GLU A 661 17.085 -7.377 -3.147 1.00 0.00 O ATOM 236 CB GLU A 661 15.724 -9.727 -1.237 1.00 0.00 C ATOM 237 CG GLU A 661 14.496 -10.117 -2.053 1.00 0.00 C ATOM 238 CD GLU A 661 14.425 -11.638 -2.153 1.00 0.00 C ATOM 239 OE1 GLU A 661 14.552 -12.287 -1.126 1.00 0.00 O ATOM 240 OE2 GLU A 661 14.252 -12.131 -3.254 1.00 0.00 O ATOM 0 H GLU A 661 13.923 -8.310 -0.389 1.00 0.00 H new ATOM 0 HA GLU A 661 16.767 -7.937 -0.673 1.00 0.00 H new ATOM 0 HB2 GLU A 661 16.614 -10.200 -1.652 1.00 0.00 H new ATOM 0 HB3 GLU A 661 15.621 -10.084 -0.212 1.00 0.00 H new ATOM 0 HG2 GLU A 661 13.593 -9.729 -1.582 1.00 0.00 H new ATOM 0 HG3 GLU A 661 14.551 -9.677 -3.049 1.00 0.00 H new ATOM 247 N ASP A 662 14.891 -7.547 -3.331 1.00 0.00 N ATOM 248 CA ASP A 662 14.878 -6.991 -4.710 1.00 0.00 C ATOM 249 C ASP A 662 14.461 -5.516 -4.648 1.00 0.00 C ATOM 250 O ASP A 662 14.982 -4.677 -5.357 1.00 0.00 O ATOM 251 CB ASP A 662 13.843 -7.827 -5.463 1.00 0.00 C ATOM 252 CG ASP A 662 14.409 -9.224 -5.721 1.00 0.00 C ATOM 253 OD1 ASP A 662 15.620 -9.366 -5.675 1.00 0.00 O ATOM 254 OD2 ASP A 662 13.626 -10.125 -5.966 1.00 0.00 O ATOM 0 H ASP A 662 13.973 -7.798 -2.963 1.00 0.00 H new ATOM 0 HA ASP A 662 15.850 -7.033 -5.201 1.00 0.00 H new ATOM 0 HB2 ASP A 662 12.923 -7.897 -4.882 1.00 0.00 H new ATOM 0 HB3 ASP A 662 13.588 -7.346 -6.407 1.00 0.00 H new ATOM 259 N GLY A 663 13.531 -5.204 -3.777 1.00 0.00 N ATOM 260 CA GLY A 663 13.067 -3.800 -3.611 1.00 0.00 C ATOM 261 C GLY A 663 12.395 -3.284 -4.883 1.00 0.00 C ATOM 262 O GLY A 663 12.759 -3.630 -5.991 1.00 0.00 O ATOM 0 H GLY A 663 13.070 -5.878 -3.166 1.00 0.00 H new ATOM 0 HA2 GLY A 663 12.367 -3.742 -2.778 1.00 0.00 H new ATOM 0 HA3 GLY A 663 13.914 -3.162 -3.360 1.00 0.00 H new ATOM 266 N SER A 664 11.425 -2.434 -4.706 1.00 0.00 N ATOM 267 CA SER A 664 10.695 -1.835 -5.857 1.00 0.00 C ATOM 268 C SER A 664 10.601 -0.334 -5.635 1.00 0.00 C ATOM 269 O SER A 664 11.214 0.195 -4.744 1.00 0.00 O ATOM 270 CB SER A 664 9.305 -2.456 -5.824 1.00 0.00 C ATOM 271 OG SER A 664 8.644 -2.062 -4.633 1.00 0.00 O ATOM 0 H SER A 664 11.100 -2.122 -3.791 1.00 0.00 H new ATOM 0 HA SER A 664 11.187 -2.015 -6.813 1.00 0.00 H new ATOM 0 HB2 SER A 664 8.731 -2.138 -6.694 1.00 0.00 H new ATOM 0 HB3 SER A 664 9.378 -3.543 -5.870 1.00 0.00 H new ATOM 0 HG SER A 664 9.302 -1.726 -3.990 1.00 0.00 H new ATOM 277 N VAL A 665 9.860 0.365 -6.436 1.00 0.00 N ATOM 278 CA VAL A 665 9.767 1.833 -6.232 1.00 0.00 C ATOM 279 C VAL A 665 8.368 2.348 -6.559 1.00 0.00 C ATOM 280 O VAL A 665 8.146 3.539 -6.616 1.00 0.00 O ATOM 281 CB VAL A 665 10.782 2.416 -7.205 1.00 0.00 C ATOM 282 CG1 VAL A 665 12.181 1.954 -6.805 1.00 0.00 C ATOM 283 CG2 VAL A 665 10.466 1.910 -8.612 1.00 0.00 C ATOM 0 H VAL A 665 9.319 -0.008 -7.216 1.00 0.00 H new ATOM 0 HA VAL A 665 9.963 2.113 -5.197 1.00 0.00 H new ATOM 0 HB VAL A 665 10.736 3.505 -7.184 1.00 0.00 H new ATOM 0 HG11 VAL A 665 12.913 2.368 -7.498 1.00 0.00 H new ATOM 0 HG12 VAL A 665 12.403 2.298 -5.795 1.00 0.00 H new ATOM 0 HG13 VAL A 665 12.227 0.865 -6.836 1.00 0.00 H new ATOM 0 HG21 VAL A 665 11.188 2.322 -9.317 1.00 0.00 H new ATOM 0 HG22 VAL A 665 10.523 0.822 -8.629 1.00 0.00 H new ATOM 0 HG23 VAL A 665 9.462 2.225 -8.895 1.00 0.00 H new ATOM 293 N TYR A 666 7.421 1.481 -6.798 1.00 0.00 N ATOM 294 CA TYR A 666 6.067 1.997 -7.139 1.00 0.00 C ATOM 295 C TYR A 666 4.990 0.906 -7.029 1.00 0.00 C ATOM 296 O TYR A 666 5.278 -0.272 -6.961 1.00 0.00 O ATOM 297 CB TYR A 666 6.198 2.430 -8.595 1.00 0.00 C ATOM 298 CG TYR A 666 6.238 1.200 -9.460 1.00 0.00 C ATOM 299 CD1 TYR A 666 7.427 0.482 -9.621 1.00 0.00 C ATOM 300 CD2 TYR A 666 5.067 0.770 -10.088 1.00 0.00 C ATOM 301 CE1 TYR A 666 7.437 -0.666 -10.417 1.00 0.00 C ATOM 302 CE2 TYR A 666 5.076 -0.373 -10.882 1.00 0.00 C ATOM 303 CZ TYR A 666 6.264 -1.094 -11.049 1.00 0.00 C ATOM 304 OH TYR A 666 6.280 -2.230 -11.825 1.00 0.00 O ATOM 0 H TYR A 666 7.521 0.466 -6.773 1.00 0.00 H new ATOM 0 HA TYR A 666 5.762 2.796 -6.463 1.00 0.00 H new ATOM 0 HB2 TYR A 666 5.358 3.064 -8.878 1.00 0.00 H new ATOM 0 HB3 TYR A 666 7.104 3.020 -8.734 1.00 0.00 H new ATOM 0 HD1 TYR A 666 8.332 0.813 -9.133 1.00 0.00 H new ATOM 0 HD2 TYR A 666 4.151 1.327 -9.957 1.00 0.00 H new ATOM 0 HE1 TYR A 666 8.352 -1.225 -10.545 1.00 0.00 H new ATOM 0 HE2 TYR A 666 4.169 -0.703 -11.368 1.00 0.00 H new ATOM 0 HH TYR A 666 5.385 -2.389 -12.191 1.00 0.00 H new ATOM 314 N LYS A 667 3.749 1.309 -7.063 1.00 0.00 N ATOM 315 CA LYS A 667 2.619 0.334 -7.023 1.00 0.00 C ATOM 316 C LYS A 667 1.349 1.042 -7.507 1.00 0.00 C ATOM 317 O LYS A 667 1.096 2.177 -7.153 1.00 0.00 O ATOM 318 CB LYS A 667 2.481 -0.108 -5.564 1.00 0.00 C ATOM 319 CG LYS A 667 1.540 -1.315 -5.490 1.00 0.00 C ATOM 320 CD LYS A 667 0.088 -0.835 -5.439 1.00 0.00 C ATOM 321 CE LYS A 667 -0.483 -1.090 -4.043 1.00 0.00 C ATOM 322 NZ LYS A 667 -0.617 -2.568 -3.946 1.00 0.00 N ATOM 0 H LYS A 667 3.465 2.287 -7.118 1.00 0.00 H new ATOM 0 HA LYS A 667 2.789 -0.532 -7.663 1.00 0.00 H new ATOM 0 HB2 LYS A 667 3.458 -0.368 -5.156 1.00 0.00 H new ATOM 0 HB3 LYS A 667 2.091 0.710 -4.959 1.00 0.00 H new ATOM 0 HG2 LYS A 667 1.690 -1.959 -6.357 1.00 0.00 H new ATOM 0 HG3 LYS A 667 1.767 -1.912 -4.607 1.00 0.00 H new ATOM 0 HD2 LYS A 667 0.036 0.228 -5.677 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -0.506 -1.358 -6.188 1.00 0.00 H new ATOM 0 HE2 LYS A 667 0.179 -0.702 -3.269 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -1.447 -0.597 -3.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -0.923 -2.827 -2.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -1.322 -2.899 -4.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 0.300 -3.014 -4.149 1.00 0.00 H new ATOM 336 N SER A 668 0.553 0.402 -8.319 1.00 0.00 N ATOM 337 CA SER A 668 -0.685 1.069 -8.814 1.00 0.00 C ATOM 338 C SER A 668 -1.853 0.078 -8.892 1.00 0.00 C ATOM 339 O SER A 668 -1.789 -0.904 -9.605 1.00 0.00 O ATOM 340 CB SER A 668 -0.321 1.571 -10.212 1.00 0.00 C ATOM 341 OG SER A 668 -1.418 2.302 -10.746 1.00 0.00 O ATOM 0 H SER A 668 0.704 -0.548 -8.659 1.00 0.00 H new ATOM 0 HA SER A 668 -1.007 1.872 -8.150 1.00 0.00 H new ATOM 0 HB2 SER A 668 0.565 2.204 -10.165 1.00 0.00 H new ATOM 0 HB3 SER A 668 -0.078 0.730 -10.862 1.00 0.00 H new ATOM 0 HG SER A 668 -1.255 2.490 -11.694 1.00 0.00 H new ATOM 347 N ILE A 669 -2.924 0.324 -8.179 1.00 0.00 N ATOM 348 CA ILE A 669 -4.083 -0.617 -8.244 1.00 0.00 C ATOM 349 C ILE A 669 -5.412 0.160 -8.180 1.00 0.00 C ATOM 350 O ILE A 669 -5.484 1.230 -7.609 1.00 0.00 O ATOM 351 CB ILE A 669 -3.925 -1.542 -7.035 1.00 0.00 C ATOM 352 CG1 ILE A 669 -4.851 -2.742 -7.219 1.00 0.00 C ATOM 353 CG2 ILE A 669 -4.297 -0.808 -5.740 1.00 0.00 C ATOM 354 CD1 ILE A 669 -4.398 -3.874 -6.301 1.00 0.00 C ATOM 0 H ILE A 669 -3.045 1.127 -7.561 1.00 0.00 H new ATOM 0 HA ILE A 669 -4.100 -1.181 -9.176 1.00 0.00 H new ATOM 0 HB ILE A 669 -2.887 -1.866 -6.963 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -5.879 -2.461 -6.989 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -4.835 -3.072 -8.258 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -4.178 -1.483 -4.892 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.644 0.055 -5.611 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -5.333 -0.475 -5.796 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -5.057 -4.733 -6.430 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -3.377 -4.160 -6.552 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -4.436 -3.539 -5.264 1.00 0.00 H new ATOM 366 N LEU A 670 -6.461 -0.369 -8.767 1.00 0.00 N ATOM 367 CA LEU A 670 -7.783 0.344 -8.746 1.00 0.00 C ATOM 368 C LEU A 670 -8.608 -0.111 -7.528 1.00 0.00 C ATOM 369 O LEU A 670 -8.747 -1.290 -7.271 1.00 0.00 O ATOM 370 CB LEU A 670 -8.475 -0.079 -10.052 1.00 0.00 C ATOM 371 CG LEU A 670 -9.701 0.805 -10.319 1.00 0.00 C ATOM 372 CD1 LEU A 670 -10.798 0.498 -9.300 1.00 0.00 C ATOM 373 CD2 LEU A 670 -9.307 2.278 -10.204 1.00 0.00 C ATOM 0 H LEU A 670 -6.460 -1.262 -9.259 1.00 0.00 H new ATOM 0 HA LEU A 670 -7.673 1.426 -8.671 1.00 0.00 H new ATOM 0 HB2 LEU A 670 -7.775 -0.001 -10.884 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -8.779 -1.124 -9.988 1.00 0.00 H new ATOM 0 HG LEU A 670 -10.072 0.601 -11.323 1.00 0.00 H new ATOM 0 HD11 LEU A 670 -11.664 1.130 -9.497 1.00 0.00 H new ATOM 0 HD12 LEU A 670 -11.087 -0.550 -9.381 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -10.426 0.695 -8.295 1.00 0.00 H new ATOM 0 HD21 LEU A 670 -10.179 2.904 -10.394 1.00 0.00 H new ATOM 0 HD22 LEU A 670 -8.930 2.476 -9.201 1.00 0.00 H new ATOM 0 HD23 LEU A 670 -8.531 2.505 -10.935 1.00 0.00 H new ATOM 385 N VAL A 671 -9.157 0.808 -6.775 1.00 0.00 N ATOM 386 CA VAL A 671 -9.973 0.414 -5.579 1.00 0.00 C ATOM 387 C VAL A 671 -11.454 0.705 -5.822 1.00 0.00 C ATOM 388 O VAL A 671 -11.816 1.634 -6.516 1.00 0.00 O ATOM 389 CB VAL A 671 -9.449 1.281 -4.411 1.00 0.00 C ATOM 390 CG1 VAL A 671 -10.565 1.526 -3.375 1.00 0.00 C ATOM 391 CG2 VAL A 671 -8.300 0.563 -3.702 1.00 0.00 C ATOM 0 H VAL A 671 -9.078 1.813 -6.933 1.00 0.00 H new ATOM 0 HA VAL A 671 -9.883 -0.652 -5.368 1.00 0.00 H new ATOM 0 HB VAL A 671 -9.110 2.231 -4.825 1.00 0.00 H new ATOM 0 HG11 VAL A 671 -10.177 2.138 -2.561 1.00 0.00 H new ATOM 0 HG12 VAL A 671 -11.398 2.043 -3.852 1.00 0.00 H new ATOM 0 HG13 VAL A 671 -10.910 0.571 -2.979 1.00 0.00 H new ATOM 0 HG21 VAL A 671 -7.937 1.181 -2.881 1.00 0.00 H new ATOM 0 HG22 VAL A 671 -8.654 -0.391 -3.310 1.00 0.00 H new ATOM 0 HG23 VAL A 671 -7.490 0.387 -4.409 1.00 0.00 H new ATOM 401 N THR A 672 -12.308 -0.049 -5.200 1.00 0.00 N ATOM 402 CA THR A 672 -13.753 0.216 -5.327 1.00 0.00 C ATOM 403 C THR A 672 -14.149 0.987 -4.071 1.00 0.00 C ATOM 404 O THR A 672 -13.332 1.207 -3.198 1.00 0.00 O ATOM 405 CB THR A 672 -14.443 -1.156 -5.446 1.00 0.00 C ATOM 406 OG1 THR A 672 -15.582 -1.026 -6.287 1.00 0.00 O ATOM 407 CG2 THR A 672 -14.897 -1.664 -4.079 1.00 0.00 C ATOM 0 H THR A 672 -12.062 -0.841 -4.607 1.00 0.00 H new ATOM 0 HA THR A 672 -14.038 0.807 -6.197 1.00 0.00 H new ATOM 0 HB THR A 672 -13.730 -1.868 -5.863 1.00 0.00 H new ATOM 0 HG1 THR A 672 -16.028 -1.895 -6.371 1.00 0.00 H new ATOM 0 HG21 THR A 672 -15.381 -2.634 -4.194 1.00 0.00 H new ATOM 0 HG22 THR A 672 -14.033 -1.765 -3.423 1.00 0.00 H new ATOM 0 HG23 THR A 672 -15.602 -0.956 -3.644 1.00 0.00 H new ATOM 415 N SER A 673 -15.349 1.435 -3.974 1.00 0.00 N ATOM 416 CA SER A 673 -15.726 2.228 -2.776 1.00 0.00 C ATOM 417 C SER A 673 -15.571 1.420 -1.475 1.00 0.00 C ATOM 418 O SER A 673 -15.308 1.974 -0.426 1.00 0.00 O ATOM 419 CB SER A 673 -17.181 2.631 -3.019 1.00 0.00 C ATOM 420 OG SER A 673 -17.636 3.449 -1.949 1.00 0.00 O ATOM 0 H SER A 673 -16.089 1.294 -4.662 1.00 0.00 H new ATOM 0 HA SER A 673 -15.076 3.093 -2.645 1.00 0.00 H new ATOM 0 HB2 SER A 673 -17.267 3.169 -3.963 1.00 0.00 H new ATOM 0 HB3 SER A 673 -17.806 1.742 -3.101 1.00 0.00 H new ATOM 0 HG SER A 673 -18.568 3.707 -2.108 1.00 0.00 H new ATOM 426 N GLN A 674 -15.768 0.133 -1.514 1.00 0.00 N ATOM 427 CA GLN A 674 -15.664 -0.673 -0.254 1.00 0.00 C ATOM 428 C GLN A 674 -14.489 -1.672 -0.292 1.00 0.00 C ATOM 429 O GLN A 674 -14.458 -2.621 0.464 1.00 0.00 O ATOM 430 CB GLN A 674 -16.991 -1.425 -0.209 1.00 0.00 C ATOM 431 CG GLN A 674 -18.137 -0.411 -0.219 1.00 0.00 C ATOM 432 CD GLN A 674 -19.176 -0.803 -1.272 1.00 0.00 C ATOM 433 OE1 GLN A 674 -20.269 -1.230 -0.945 1.00 0.00 O ATOM 434 NE2 GLN A 674 -18.880 -0.664 -2.535 1.00 0.00 N ATOM 0 H GLN A 674 -15.995 -0.398 -2.355 1.00 0.00 H new ATOM 0 HA GLN A 674 -15.479 -0.044 0.617 1.00 0.00 H new ATOM 0 HB2 GLN A 674 -17.073 -2.095 -1.065 1.00 0.00 H new ATOM 0 HB3 GLN A 674 -17.043 -2.044 0.687 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -18.604 -0.368 0.765 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -17.750 0.585 -0.432 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -17.965 -0.306 -2.808 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -19.564 -0.913 -3.250 1.00 0.00 H new ATOM 443 N ASP A 675 -13.546 -1.488 -1.176 1.00 0.00 N ATOM 444 CA ASP A 675 -12.403 -2.465 -1.279 1.00 0.00 C ATOM 445 C ASP A 675 -11.134 -1.986 -0.548 1.00 0.00 C ATOM 446 O ASP A 675 -10.562 -0.970 -0.885 1.00 0.00 O ATOM 447 CB ASP A 675 -12.119 -2.546 -2.780 1.00 0.00 C ATOM 448 CG ASP A 675 -11.156 -3.694 -3.071 1.00 0.00 C ATOM 449 OD1 ASP A 675 -11.462 -4.806 -2.680 1.00 0.00 O ATOM 450 OD2 ASP A 675 -10.136 -3.445 -3.694 1.00 0.00 O ATOM 0 H ASP A 675 -13.510 -0.709 -1.833 1.00 0.00 H new ATOM 0 HA ASP A 675 -12.667 -3.417 -0.818 1.00 0.00 H new ATOM 0 HB2 ASP A 675 -13.050 -2.695 -3.327 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -11.692 -1.606 -3.128 1.00 0.00 H new ATOM 455 N LYS A 676 -10.663 -2.739 0.422 1.00 0.00 N ATOM 456 CA LYS A 676 -9.405 -2.357 1.135 1.00 0.00 C ATOM 457 C LYS A 676 -8.224 -3.034 0.425 1.00 0.00 C ATOM 458 O LYS A 676 -7.907 -4.178 0.682 1.00 0.00 O ATOM 459 CB LYS A 676 -9.578 -2.906 2.552 1.00 0.00 C ATOM 460 CG LYS A 676 -10.905 -2.402 3.127 1.00 0.00 C ATOM 461 CD LYS A 676 -11.718 -3.590 3.648 1.00 0.00 C ATOM 462 CE LYS A 676 -13.164 -3.471 3.159 1.00 0.00 C ATOM 463 NZ LYS A 676 -13.885 -4.621 3.775 1.00 0.00 N ATOM 0 H LYS A 676 -11.098 -3.602 0.748 1.00 0.00 H new ATOM 0 HA LYS A 676 -9.217 -1.283 1.148 1.00 0.00 H new ATOM 0 HB2 LYS A 676 -9.565 -3.996 2.537 1.00 0.00 H new ATOM 0 HB3 LYS A 676 -8.749 -2.586 3.183 1.00 0.00 H new ATOM 0 HG2 LYS A 676 -10.718 -1.693 3.934 1.00 0.00 H new ATOM 0 HG3 LYS A 676 -11.468 -1.871 2.360 1.00 0.00 H new ATOM 0 HD2 LYS A 676 -11.280 -4.525 3.299 1.00 0.00 H new ATOM 0 HD3 LYS A 676 -11.692 -3.613 4.737 1.00 0.00 H new ATOM 0 HE2 LYS A 676 -13.605 -2.522 3.464 1.00 0.00 H new ATOM 0 HE3 LYS A 676 -13.216 -3.512 2.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 -14.883 -4.602 3.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 -13.449 -5.512 3.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 -13.827 -4.553 4.811 1.00 0.00 H new ATOM 477 N ALA A 677 -7.582 -2.339 -0.482 1.00 0.00 N ATOM 478 CA ALA A 677 -6.438 -2.950 -1.227 1.00 0.00 C ATOM 479 C ALA A 677 -5.045 -2.384 -0.838 1.00 0.00 C ATOM 480 O ALA A 677 -4.111 -2.570 -1.593 1.00 0.00 O ATOM 481 CB ALA A 677 -6.740 -2.618 -2.691 1.00 0.00 C ATOM 0 H ALA A 677 -7.801 -1.376 -0.738 1.00 0.00 H new ATOM 0 HA ALA A 677 -6.368 -4.015 -1.004 1.00 0.00 H new ATOM 0 HB1 ALA A 677 -5.953 -3.025 -3.326 1.00 0.00 H new ATOM 0 HB2 ALA A 677 -7.698 -3.056 -2.973 1.00 0.00 H new ATOM 0 HB3 ALA A 677 -6.784 -1.536 -2.817 1.00 0.00 H new ATOM 487 N PRO A 678 -4.902 -1.729 0.302 1.00 0.00 N ATOM 488 CA PRO A 678 -3.568 -1.205 0.671 1.00 0.00 C ATOM 489 C PRO A 678 -2.625 -2.391 0.851 1.00 0.00 C ATOM 490 O PRO A 678 -1.444 -2.325 0.574 1.00 0.00 O ATOM 491 CB PRO A 678 -3.824 -0.521 2.017 1.00 0.00 C ATOM 492 CG PRO A 678 -5.300 -0.723 2.391 1.00 0.00 C ATOM 493 CD PRO A 678 -5.997 -1.488 1.265 1.00 0.00 C ATOM 0 HA PRO A 678 -3.125 -0.532 -0.064 1.00 0.00 H new ATOM 0 HB2 PRO A 678 -3.177 -0.943 2.786 1.00 0.00 H new ATOM 0 HB3 PRO A 678 -3.591 0.542 1.953 1.00 0.00 H new ATOM 0 HG2 PRO A 678 -5.379 -1.276 3.327 1.00 0.00 H new ATOM 0 HG3 PRO A 678 -5.784 0.241 2.548 1.00 0.00 H new ATOM 0 HD2 PRO A 678 -6.434 -2.421 1.621 1.00 0.00 H new ATOM 0 HD3 PRO A 678 -6.805 -0.906 0.821 1.00 0.00 H new ATOM 501 N SER A 679 -3.167 -3.477 1.334 1.00 0.00 N ATOM 502 CA SER A 679 -2.349 -4.703 1.576 1.00 0.00 C ATOM 503 C SER A 679 -2.209 -5.558 0.311 1.00 0.00 C ATOM 504 O SER A 679 -1.480 -6.530 0.296 1.00 0.00 O ATOM 505 CB SER A 679 -3.132 -5.473 2.636 1.00 0.00 C ATOM 506 OG SER A 679 -3.172 -4.712 3.836 1.00 0.00 O ATOM 0 H SER A 679 -4.154 -3.569 1.574 1.00 0.00 H new ATOM 0 HA SER A 679 -1.334 -4.450 1.882 1.00 0.00 H new ATOM 0 HB2 SER A 679 -4.144 -5.672 2.284 1.00 0.00 H new ATOM 0 HB3 SER A 679 -2.663 -6.440 2.820 1.00 0.00 H new ATOM 0 HG SER A 679 -3.676 -5.203 4.518 1.00 0.00 H new ATOM 512 N VAL A 680 -2.896 -5.229 -0.744 1.00 0.00 N ATOM 513 CA VAL A 680 -2.777 -6.061 -1.977 1.00 0.00 C ATOM 514 C VAL A 680 -1.325 -6.065 -2.457 1.00 0.00 C ATOM 515 O VAL A 680 -0.869 -7.014 -3.058 1.00 0.00 O ATOM 516 CB VAL A 680 -3.721 -5.416 -2.997 1.00 0.00 C ATOM 517 CG1 VAL A 680 -3.044 -4.206 -3.637 1.00 0.00 C ATOM 518 CG2 VAL A 680 -4.097 -6.437 -4.079 1.00 0.00 C ATOM 0 H VAL A 680 -3.528 -4.431 -0.810 1.00 0.00 H new ATOM 0 HA VAL A 680 -3.048 -7.104 -1.813 1.00 0.00 H new ATOM 0 HB VAL A 680 -4.627 -5.089 -2.487 1.00 0.00 H new ATOM 0 HG11 VAL A 680 -3.720 -3.752 -4.361 1.00 0.00 H new ATOM 0 HG12 VAL A 680 -2.796 -3.477 -2.865 1.00 0.00 H new ATOM 0 HG13 VAL A 680 -2.132 -4.524 -4.142 1.00 0.00 H new ATOM 0 HG21 VAL A 680 -4.768 -5.972 -4.801 1.00 0.00 H new ATOM 0 HG22 VAL A 680 -3.195 -6.776 -4.588 1.00 0.00 H new ATOM 0 HG23 VAL A 680 -4.595 -7.290 -3.617 1.00 0.00 H new ATOM 528 N ILE A 681 -0.570 -5.038 -2.180 1.00 0.00 N ATOM 529 CA ILE A 681 0.851 -5.080 -2.615 1.00 0.00 C ATOM 530 C ILE A 681 1.515 -6.275 -1.933 1.00 0.00 C ATOM 531 O ILE A 681 2.445 -6.867 -2.436 1.00 0.00 O ATOM 532 CB ILE A 681 1.508 -3.779 -2.146 1.00 0.00 C ATOM 533 CG1 ILE A 681 2.885 -3.664 -2.806 1.00 0.00 C ATOM 534 CG2 ILE A 681 1.682 -3.810 -0.629 1.00 0.00 C ATOM 535 CD1 ILE A 681 3.446 -2.255 -2.603 1.00 0.00 C ATOM 0 H ILE A 681 -0.865 -4.196 -1.686 1.00 0.00 H new ATOM 0 HA ILE A 681 0.946 -5.179 -3.696 1.00 0.00 H new ATOM 0 HB ILE A 681 0.883 -2.929 -2.420 1.00 0.00 H new ATOM 0 HG12 ILE A 681 3.565 -4.400 -2.378 1.00 0.00 H new ATOM 0 HG13 ILE A 681 2.807 -3.883 -3.871 1.00 0.00 H new ATOM 0 HG21 ILE A 681 2.150 -2.883 -0.297 1.00 0.00 H new ATOM 0 HG22 ILE A 681 0.707 -3.915 -0.153 1.00 0.00 H new ATOM 0 HG23 ILE A 681 2.314 -4.654 -0.352 1.00 0.00 H new ATOM 0 HD11 ILE A 681 4.426 -2.182 -3.075 1.00 0.00 H new ATOM 0 HD12 ILE A 681 2.771 -1.526 -3.052 1.00 0.00 H new ATOM 0 HD13 ILE A 681 3.542 -2.052 -1.536 1.00 0.00 H new ATOM 547 N SER A 682 1.037 -6.614 -0.771 1.00 0.00 N ATOM 548 CA SER A 682 1.616 -7.759 -0.025 1.00 0.00 C ATOM 549 C SER A 682 1.481 -9.071 -0.814 1.00 0.00 C ATOM 550 O SER A 682 2.425 -9.828 -0.929 1.00 0.00 O ATOM 551 CB SER A 682 0.784 -7.822 1.249 1.00 0.00 C ATOM 552 OG SER A 682 1.361 -8.763 2.142 1.00 0.00 O ATOM 0 H SER A 682 0.263 -6.142 -0.303 1.00 0.00 H new ATOM 0 HA SER A 682 2.682 -7.630 0.162 1.00 0.00 H new ATOM 0 HB2 SER A 682 0.741 -6.839 1.717 1.00 0.00 H new ATOM 0 HB3 SER A 682 -0.241 -8.108 1.014 1.00 0.00 H new ATOM 0 HG SER A 682 0.828 -8.804 2.963 1.00 0.00 H new ATOM 558 N ARG A 683 0.314 -9.358 -1.355 1.00 0.00 N ATOM 559 CA ARG A 683 0.152 -10.638 -2.118 1.00 0.00 C ATOM 560 C ARG A 683 0.943 -10.579 -3.433 1.00 0.00 C ATOM 561 O ARG A 683 1.490 -11.569 -3.892 1.00 0.00 O ATOM 562 CB ARG A 683 -1.355 -10.818 -2.364 1.00 0.00 C ATOM 563 CG ARG A 683 -1.879 -9.734 -3.305 1.00 0.00 C ATOM 564 CD ARG A 683 -3.327 -10.054 -3.697 1.00 0.00 C ATOM 565 NE ARG A 683 -4.088 -9.948 -2.421 1.00 0.00 N ATOM 566 CZ ARG A 683 -5.352 -9.616 -2.428 1.00 0.00 C ATOM 567 NH1 ARG A 683 -6.236 -10.401 -2.979 1.00 0.00 N ATOM 568 NH2 ARG A 683 -5.730 -8.496 -1.875 1.00 0.00 N ATOM 0 H ARG A 683 -0.518 -8.771 -1.301 1.00 0.00 H new ATOM 0 HA ARG A 683 0.544 -11.489 -1.561 1.00 0.00 H new ATOM 0 HB2 ARG A 683 -1.544 -11.802 -2.793 1.00 0.00 H new ATOM 0 HB3 ARG A 683 -1.892 -10.775 -1.416 1.00 0.00 H new ATOM 0 HG2 ARG A 683 -1.829 -8.760 -2.818 1.00 0.00 H new ATOM 0 HG3 ARG A 683 -1.254 -9.677 -4.196 1.00 0.00 H new ATOM 0 HD2 ARG A 683 -3.701 -9.352 -4.442 1.00 0.00 H new ATOM 0 HD3 ARG A 683 -3.411 -11.052 -4.128 1.00 0.00 H new ATOM 0 HE ARG A 683 -3.619 -10.136 -1.535 1.00 0.00 H new ATOM 0 HH11 ARG A 683 -5.942 -11.279 -3.407 1.00 0.00 H new ATOM 0 HH12 ARG A 683 -7.221 -10.137 -2.982 1.00 0.00 H new ATOM 0 HH21 ARG A 683 -5.040 -7.884 -1.440 1.00 0.00 H new ATOM 0 HH22 ARG A 683 -6.715 -8.233 -1.878 1.00 0.00 H new ATOM 582 N VAL A 684 1.047 -9.424 -4.027 1.00 0.00 N ATOM 583 CA VAL A 684 1.842 -9.316 -5.280 1.00 0.00 C ATOM 584 C VAL A 684 3.304 -9.355 -4.903 1.00 0.00 C ATOM 585 O VAL A 684 4.149 -9.721 -5.688 1.00 0.00 O ATOM 586 CB VAL A 684 1.492 -7.969 -5.898 1.00 0.00 C ATOM 587 CG1 VAL A 684 0.025 -7.960 -6.280 1.00 0.00 C ATOM 588 CG2 VAL A 684 1.763 -6.870 -4.892 1.00 0.00 C ATOM 0 H VAL A 684 0.620 -8.557 -3.702 1.00 0.00 H new ATOM 0 HA VAL A 684 1.633 -10.122 -5.983 1.00 0.00 H new ATOM 0 HB VAL A 684 2.100 -7.803 -6.788 1.00 0.00 H new ATOM 0 HG11 VAL A 684 -0.230 -6.997 -6.723 1.00 0.00 H new ATOM 0 HG12 VAL A 684 -0.168 -8.754 -7.002 1.00 0.00 H new ATOM 0 HG13 VAL A 684 -0.584 -8.123 -5.390 1.00 0.00 H new ATOM 0 HG21 VAL A 684 1.513 -5.904 -5.332 1.00 0.00 H new ATOM 0 HG22 VAL A 684 1.154 -7.032 -4.003 1.00 0.00 H new ATOM 0 HG23 VAL A 684 2.817 -6.881 -4.616 1.00 0.00 H new ATOM 598 N LEU A 685 3.613 -8.981 -3.691 1.00 0.00 N ATOM 599 CA LEU A 685 5.031 -9.010 -3.282 1.00 0.00 C ATOM 600 C LEU A 685 5.587 -10.394 -3.534 1.00 0.00 C ATOM 601 O LEU A 685 6.572 -10.546 -4.203 1.00 0.00 O ATOM 602 CB LEU A 685 5.059 -8.709 -1.781 1.00 0.00 C ATOM 603 CG LEU A 685 5.817 -7.409 -1.527 1.00 0.00 C ATOM 604 CD1 LEU A 685 7.098 -7.373 -2.367 1.00 0.00 C ATOM 605 CD2 LEU A 685 4.920 -6.241 -1.913 1.00 0.00 C ATOM 0 H LEU A 685 2.952 -8.663 -2.982 1.00 0.00 H new ATOM 0 HA LEU A 685 5.627 -8.286 -3.838 1.00 0.00 H new ATOM 0 HB2 LEU A 685 4.042 -8.628 -1.398 1.00 0.00 H new ATOM 0 HB3 LEU A 685 5.537 -9.529 -1.245 1.00 0.00 H new ATOM 0 HG LEU A 685 6.089 -7.342 -0.474 1.00 0.00 H new ATOM 0 HD11 LEU A 685 7.631 -6.441 -2.178 1.00 0.00 H new ATOM 0 HD12 LEU A 685 7.734 -8.216 -2.097 1.00 0.00 H new ATOM 0 HD13 LEU A 685 6.842 -7.436 -3.425 1.00 0.00 H new ATOM 0 HD21 LEU A 685 5.448 -5.304 -1.737 1.00 0.00 H new ATOM 0 HD22 LEU A 685 4.657 -6.317 -2.968 1.00 0.00 H new ATOM 0 HD23 LEU A 685 4.012 -6.265 -1.310 1.00 0.00 H new ATOM 617 N LYS A 686 4.948 -11.406 -3.016 1.00 0.00 N ATOM 618 CA LYS A 686 5.450 -12.792 -3.233 1.00 0.00 C ATOM 619 C LYS A 686 5.331 -13.176 -4.697 1.00 0.00 C ATOM 620 O LYS A 686 6.234 -13.743 -5.276 1.00 0.00 O ATOM 621 CB LYS A 686 4.535 -13.667 -2.387 1.00 0.00 C ATOM 622 CG LYS A 686 4.713 -13.287 -0.926 1.00 0.00 C ATOM 623 CD LYS A 686 6.068 -13.779 -0.435 1.00 0.00 C ATOM 624 CE LYS A 686 6.117 -13.630 1.080 1.00 0.00 C ATOM 625 NZ LYS A 686 5.122 -14.619 1.582 1.00 0.00 N ATOM 0 H LYS A 686 4.101 -11.334 -2.452 1.00 0.00 H new ATOM 0 HA LYS A 686 6.500 -12.898 -2.961 1.00 0.00 H new ATOM 0 HB2 LYS A 686 3.497 -13.531 -2.689 1.00 0.00 H new ATOM 0 HB3 LYS A 686 4.775 -14.720 -2.536 1.00 0.00 H new ATOM 0 HG2 LYS A 686 4.643 -12.206 -0.809 1.00 0.00 H new ATOM 0 HG3 LYS A 686 3.916 -13.725 -0.325 1.00 0.00 H new ATOM 0 HD2 LYS A 686 6.218 -14.821 -0.718 1.00 0.00 H new ATOM 0 HD3 LYS A 686 6.870 -13.204 -0.898 1.00 0.00 H new ATOM 0 HE2 LYS A 686 7.114 -13.838 1.468 1.00 0.00 H new ATOM 0 HE3 LYS A 686 5.860 -12.617 1.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 686 5.432 -14.986 2.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 686 4.196 -14.157 1.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 686 5.042 -15.405 0.906 1.00 0.00 H new ATOM 639 N LYS A 687 4.232 -12.864 -5.311 1.00 0.00 N ATOM 640 CA LYS A 687 4.081 -13.208 -6.744 1.00 0.00 C ATOM 641 C LYS A 687 5.076 -12.401 -7.559 1.00 0.00 C ATOM 642 O LYS A 687 5.618 -12.863 -8.542 1.00 0.00 O ATOM 643 CB LYS A 687 2.640 -12.834 -7.079 1.00 0.00 C ATOM 644 CG LYS A 687 2.361 -13.100 -8.556 1.00 0.00 C ATOM 645 CD LYS A 687 2.116 -14.592 -8.773 1.00 0.00 C ATOM 646 CE LYS A 687 1.155 -14.780 -9.947 1.00 0.00 C ATOM 647 NZ LYS A 687 1.285 -16.215 -10.318 1.00 0.00 N ATOM 0 H LYS A 687 3.436 -12.389 -4.886 1.00 0.00 H new ATOM 0 HA LYS A 687 4.276 -14.258 -6.964 1.00 0.00 H new ATOM 0 HB2 LYS A 687 1.953 -13.412 -6.461 1.00 0.00 H new ATOM 0 HB3 LYS A 687 2.466 -11.782 -6.851 1.00 0.00 H new ATOM 0 HG2 LYS A 687 1.492 -12.528 -8.881 1.00 0.00 H new ATOM 0 HG3 LYS A 687 3.205 -12.768 -9.161 1.00 0.00 H new ATOM 0 HD2 LYS A 687 3.058 -15.102 -8.974 1.00 0.00 H new ATOM 0 HD3 LYS A 687 1.698 -15.039 -7.871 1.00 0.00 H new ATOM 0 HE2 LYS A 687 0.131 -14.536 -9.663 1.00 0.00 H new ATOM 0 HE3 LYS A 687 1.418 -14.130 -10.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 0.655 -16.425 -11.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 2.269 -16.416 -10.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 1.022 -16.809 -9.506 1.00 0.00 H new ATOM 661 N ASN A 688 5.326 -11.202 -7.148 1.00 0.00 N ATOM 662 CA ASN A 688 6.289 -10.363 -7.883 1.00 0.00 C ATOM 663 C ASN A 688 7.529 -10.131 -6.999 1.00 0.00 C ATOM 664 O ASN A 688 8.221 -9.142 -7.129 1.00 0.00 O ATOM 665 CB ASN A 688 5.491 -9.082 -8.195 1.00 0.00 C ATOM 666 CG ASN A 688 5.842 -7.951 -7.233 1.00 0.00 C ATOM 667 OD1 ASN A 688 5.972 -6.814 -7.642 1.00 0.00 O ATOM 668 ND2 ASN A 688 5.985 -8.210 -5.968 1.00 0.00 N ATOM 0 H ASN A 688 4.902 -10.765 -6.330 1.00 0.00 H new ATOM 0 HA ASN A 688 6.677 -10.799 -8.804 1.00 0.00 H new ATOM 0 HB2 ASN A 688 5.695 -8.766 -9.218 1.00 0.00 H new ATOM 0 HB3 ASN A 688 4.424 -9.294 -8.134 1.00 0.00 H new ATOM 0 HD21 ASN A 688 6.207 -7.458 -5.315 1.00 0.00 H new ATOM 0 HD22 ASN A 688 5.875 -9.165 -5.627 1.00 0.00 H new ATOM 675 N ASN A 689 7.815 -11.053 -6.097 1.00 0.00 N ATOM 676 CA ASN A 689 9.013 -10.891 -5.212 1.00 0.00 C ATOM 677 C ASN A 689 10.277 -11.223 -5.995 1.00 0.00 C ATOM 678 O ASN A 689 11.379 -11.082 -5.504 1.00 0.00 O ATOM 679 CB ASN A 689 8.860 -11.899 -4.067 1.00 0.00 C ATOM 680 CG ASN A 689 8.946 -13.313 -4.633 1.00 0.00 C ATOM 681 OD1 ASN A 689 8.909 -13.500 -5.834 1.00 0.00 O ATOM 682 ND2 ASN A 689 9.059 -14.323 -3.818 1.00 0.00 N ATOM 0 H ASN A 689 7.272 -11.902 -5.941 1.00 0.00 H new ATOM 0 HA ASN A 689 9.085 -9.869 -4.840 1.00 0.00 H new ATOM 0 HB2 ASN A 689 9.641 -11.744 -3.322 1.00 0.00 H new ATOM 0 HB3 ASN A 689 7.905 -11.753 -3.563 1.00 0.00 H new ATOM 0 HD21 ASN A 689 9.117 -15.272 -4.187 1.00 0.00 H new ATOM 0 HD22 ASN A 689 9.090 -14.165 -2.811 1.00 0.00 H new ATOM 689 N ARG A 690 10.127 -11.623 -7.223 1.00 0.00 N ATOM 690 CA ARG A 690 11.331 -11.920 -8.046 1.00 0.00 C ATOM 691 C ARG A 690 11.708 -10.682 -8.857 1.00 0.00 C ATOM 692 O ARG A 690 12.840 -10.519 -9.266 1.00 0.00 O ATOM 693 CB ARG A 690 10.945 -13.089 -8.957 1.00 0.00 C ATOM 694 CG ARG A 690 12.187 -13.589 -9.702 1.00 0.00 C ATOM 695 CD ARG A 690 11.787 -14.663 -10.721 1.00 0.00 C ATOM 696 NE ARG A 690 13.074 -15.171 -11.285 1.00 0.00 N ATOM 697 CZ ARG A 690 13.685 -14.524 -12.244 1.00 0.00 C ATOM 698 NH1 ARG A 690 13.170 -13.431 -12.743 1.00 0.00 N ATOM 699 NH2 ARG A 690 14.827 -14.969 -12.697 1.00 0.00 N ATOM 0 H ARG A 690 9.231 -11.757 -7.691 1.00 0.00 H new ATOM 0 HA ARG A 690 12.196 -12.182 -7.437 1.00 0.00 H new ATOM 0 HB2 ARG A 690 10.513 -13.897 -8.366 1.00 0.00 H new ATOM 0 HB3 ARG A 690 10.183 -12.772 -9.670 1.00 0.00 H new ATOM 0 HG2 ARG A 690 12.676 -12.758 -10.210 1.00 0.00 H new ATOM 0 HG3 ARG A 690 12.907 -13.998 -8.993 1.00 0.00 H new ATOM 0 HD2 ARG A 690 11.222 -15.465 -10.246 1.00 0.00 H new ATOM 0 HD3 ARG A 690 11.152 -14.246 -11.503 1.00 0.00 H new ATOM 0 HE ARG A 690 13.481 -16.032 -10.918 1.00 0.00 H new ATOM 0 HH11 ARG A 690 12.284 -13.075 -12.385 1.00 0.00 H new ATOM 0 HH12 ARG A 690 13.654 -12.934 -13.491 1.00 0.00 H new ATOM 0 HH21 ARG A 690 15.237 -15.816 -12.303 1.00 0.00 H new ATOM 0 HH22 ARG A 690 15.309 -14.469 -13.445 1.00 0.00 H new ATOM 713 N ASP A 691 10.778 -9.798 -9.091 1.00 0.00 N ATOM 714 CA ASP A 691 11.118 -8.578 -9.871 1.00 0.00 C ATOM 715 C ASP A 691 10.997 -7.315 -8.998 1.00 0.00 C ATOM 716 O ASP A 691 11.807 -6.414 -9.097 1.00 0.00 O ATOM 717 CB ASP A 691 10.121 -8.576 -11.026 1.00 0.00 C ATOM 718 CG ASP A 691 10.428 -9.769 -11.933 1.00 0.00 C ATOM 719 OD1 ASP A 691 11.554 -10.237 -11.899 1.00 0.00 O ATOM 720 OD2 ASP A 691 9.532 -10.197 -12.642 1.00 0.00 O ATOM 0 H ASP A 691 9.809 -9.866 -8.780 1.00 0.00 H new ATOM 0 HA ASP A 691 12.147 -8.579 -10.229 1.00 0.00 H new ATOM 0 HB2 ASP A 691 9.101 -8.641 -10.646 1.00 0.00 H new ATOM 0 HB3 ASP A 691 10.193 -7.645 -11.587 1.00 0.00 H new ATOM 725 N SER A 692 9.992 -7.222 -8.167 1.00 0.00 N ATOM 726 CA SER A 692 9.834 -5.993 -7.322 1.00 0.00 C ATOM 727 C SER A 692 10.421 -6.204 -5.912 1.00 0.00 C ATOM 728 O SER A 692 11.518 -6.690 -5.757 1.00 0.00 O ATOM 729 CB SER A 692 8.335 -5.752 -7.245 1.00 0.00 C ATOM 730 OG SER A 692 7.823 -5.552 -8.561 1.00 0.00 O ATOM 0 H SER A 692 9.276 -7.937 -8.035 1.00 0.00 H new ATOM 0 HA SER A 692 10.366 -5.144 -7.750 1.00 0.00 H new ATOM 0 HB2 SER A 692 7.842 -6.603 -6.776 1.00 0.00 H new ATOM 0 HB3 SER A 692 8.126 -4.880 -6.625 1.00 0.00 H new ATOM 0 HG SER A 692 6.905 -5.890 -8.610 1.00 0.00 H new ATOM 736 N ALA A 693 9.691 -5.823 -4.884 1.00 0.00 N ATOM 737 CA ALA A 693 10.206 -5.991 -3.491 1.00 0.00 C ATOM 738 C ALA A 693 9.827 -7.365 -2.950 1.00 0.00 C ATOM 739 O ALA A 693 9.491 -8.255 -3.698 1.00 0.00 O ATOM 740 CB ALA A 693 9.537 -4.889 -2.676 1.00 0.00 C ATOM 0 H ALA A 693 8.764 -5.404 -4.954 1.00 0.00 H new ATOM 0 HA ALA A 693 11.293 -5.921 -3.446 1.00 0.00 H new ATOM 0 HB1 ALA A 693 9.869 -4.951 -1.640 1.00 0.00 H new ATOM 0 HB2 ALA A 693 9.809 -3.917 -3.087 1.00 0.00 H new ATOM 0 HB3 ALA A 693 8.455 -5.011 -2.718 1.00 0.00 H new ATOM 746 N VAL A 694 9.902 -7.569 -1.665 1.00 0.00 N ATOM 747 CA VAL A 694 9.573 -8.919 -1.135 1.00 0.00 C ATOM 748 C VAL A 694 8.836 -8.866 0.211 1.00 0.00 C ATOM 749 O VAL A 694 7.621 -8.921 0.259 1.00 0.00 O ATOM 750 CB VAL A 694 10.948 -9.563 -1.013 1.00 0.00 C ATOM 751 CG1 VAL A 694 10.844 -10.856 -0.214 1.00 0.00 C ATOM 752 CG2 VAL A 694 11.465 -9.873 -2.422 1.00 0.00 C ATOM 0 H VAL A 694 10.172 -6.873 -0.970 1.00 0.00 H new ATOM 0 HA VAL A 694 8.886 -9.473 -1.775 1.00 0.00 H new ATOM 0 HB VAL A 694 11.631 -8.886 -0.501 1.00 0.00 H new ATOM 0 HG11 VAL A 694 11.830 -11.312 -0.130 1.00 0.00 H new ATOM 0 HG12 VAL A 694 10.459 -10.638 0.782 1.00 0.00 H new ATOM 0 HG13 VAL A 694 10.168 -11.544 -0.722 1.00 0.00 H new ATOM 0 HG21 VAL A 694 12.450 -10.335 -2.355 1.00 0.00 H new ATOM 0 HG22 VAL A 694 10.777 -10.556 -2.920 1.00 0.00 H new ATOM 0 HG23 VAL A 694 11.537 -8.948 -2.995 1.00 0.00 H new ATOM 762 N ALA A 695 9.546 -8.777 1.300 1.00 0.00 N ATOM 763 CA ALA A 695 8.868 -8.732 2.631 1.00 0.00 C ATOM 764 C ALA A 695 8.129 -7.409 2.777 1.00 0.00 C ATOM 765 O ALA A 695 8.719 -6.356 2.691 1.00 0.00 O ATOM 766 CB ALA A 695 10.000 -8.811 3.650 1.00 0.00 C ATOM 0 H ALA A 695 10.565 -8.733 1.329 1.00 0.00 H new ATOM 0 HA ALA A 695 8.143 -9.535 2.760 1.00 0.00 H new ATOM 0 HB1 ALA A 695 9.585 -8.784 4.658 1.00 0.00 H new ATOM 0 HB2 ALA A 695 10.552 -9.741 3.510 1.00 0.00 H new ATOM 0 HB3 ALA A 695 10.674 -7.965 3.512 1.00 0.00 H new ATOM 772 N SER A 696 6.845 -7.441 2.976 1.00 0.00 N ATOM 773 CA SER A 696 6.105 -6.151 3.094 1.00 0.00 C ATOM 774 C SER A 696 6.081 -5.635 4.536 1.00 0.00 C ATOM 775 O SER A 696 5.186 -4.912 4.926 1.00 0.00 O ATOM 776 CB SER A 696 4.687 -6.427 2.593 1.00 0.00 C ATOM 777 OG SER A 696 4.751 -6.937 1.267 1.00 0.00 O ATOM 0 H SER A 696 6.280 -8.286 3.061 1.00 0.00 H new ATOM 0 HA SER A 696 6.595 -5.374 2.508 1.00 0.00 H new ATOM 0 HB2 SER A 696 4.190 -7.143 3.247 1.00 0.00 H new ATOM 0 HB3 SER A 696 4.096 -5.511 2.615 1.00 0.00 H new ATOM 0 HG SER A 696 4.656 -7.912 1.287 1.00 0.00 H new ATOM 783 N GLU A 697 7.064 -5.970 5.323 1.00 0.00 N ATOM 784 CA GLU A 697 7.091 -5.454 6.721 1.00 0.00 C ATOM 785 C GLU A 697 7.624 -4.020 6.691 1.00 0.00 C ATOM 786 O GLU A 697 8.807 -3.775 6.827 1.00 0.00 O ATOM 787 CB GLU A 697 8.027 -6.397 7.482 1.00 0.00 C ATOM 788 CG GLU A 697 7.354 -7.765 7.574 1.00 0.00 C ATOM 789 CD GLU A 697 8.203 -8.735 8.399 1.00 0.00 C ATOM 790 OE1 GLU A 697 9.312 -9.026 7.981 1.00 0.00 O ATOM 791 OE2 GLU A 697 7.723 -9.183 9.427 1.00 0.00 O ATOM 0 H GLU A 697 7.844 -6.573 5.063 1.00 0.00 H new ATOM 0 HA GLU A 697 6.112 -5.428 7.200 1.00 0.00 H new ATOM 0 HB2 GLU A 697 8.985 -6.478 6.968 1.00 0.00 H new ATOM 0 HB3 GLU A 697 8.232 -6.006 8.479 1.00 0.00 H new ATOM 0 HG2 GLU A 697 6.369 -7.661 8.028 1.00 0.00 H new ATOM 0 HG3 GLU A 697 7.202 -8.169 6.573 1.00 0.00 H new ATOM 798 N PHE A 698 6.751 -3.076 6.469 1.00 0.00 N ATOM 799 CA PHE A 698 7.184 -1.658 6.376 1.00 0.00 C ATOM 800 C PHE A 698 6.154 -0.696 6.978 1.00 0.00 C ATOM 801 O PHE A 698 5.028 -1.051 7.263 1.00 0.00 O ATOM 802 CB PHE A 698 7.334 -1.400 4.877 1.00 0.00 C ATOM 803 CG PHE A 698 6.167 -1.982 4.117 1.00 0.00 C ATOM 804 CD1 PHE A 698 4.843 -1.621 4.407 1.00 0.00 C ATOM 805 CD2 PHE A 698 6.433 -2.897 3.102 1.00 0.00 C ATOM 806 CE1 PHE A 698 3.796 -2.191 3.666 1.00 0.00 C ATOM 807 CE2 PHE A 698 5.392 -3.456 2.366 1.00 0.00 C ATOM 808 CZ PHE A 698 4.073 -3.103 2.648 1.00 0.00 C ATOM 0 H PHE A 698 5.750 -3.230 6.348 1.00 0.00 H new ATOM 0 HA PHE A 698 8.105 -1.490 6.935 1.00 0.00 H new ATOM 0 HB2 PHE A 698 7.397 -0.328 4.692 1.00 0.00 H new ATOM 0 HB3 PHE A 698 8.264 -1.840 4.518 1.00 0.00 H new ATOM 0 HD1 PHE A 698 4.631 -0.911 5.193 1.00 0.00 H new ATOM 0 HD2 PHE A 698 7.454 -3.175 2.884 1.00 0.00 H new ATOM 0 HE1 PHE A 698 2.773 -1.923 3.885 1.00 0.00 H new ATOM 0 HE2 PHE A 698 5.606 -4.162 1.577 1.00 0.00 H new ATOM 0 HZ PHE A 698 3.265 -3.536 2.077 1.00 0.00 H new ATOM 818 N GLU A 699 6.546 0.543 7.113 1.00 0.00 N ATOM 819 CA GLU A 699 5.638 1.594 7.628 1.00 0.00 C ATOM 820 C GLU A 699 5.041 2.299 6.421 1.00 0.00 C ATOM 821 O GLU A 699 5.751 2.747 5.543 1.00 0.00 O ATOM 822 CB GLU A 699 6.532 2.550 8.412 1.00 0.00 C ATOM 823 CG GLU A 699 5.674 3.539 9.193 1.00 0.00 C ATOM 824 CD GLU A 699 6.584 4.549 9.890 1.00 0.00 C ATOM 825 OE1 GLU A 699 7.790 4.422 9.754 1.00 0.00 O ATOM 826 OE2 GLU A 699 6.061 5.433 10.546 1.00 0.00 O ATOM 0 H GLU A 699 7.483 0.873 6.880 1.00 0.00 H new ATOM 0 HA GLU A 699 4.832 1.213 8.256 1.00 0.00 H new ATOM 0 HB2 GLU A 699 7.169 1.988 9.096 1.00 0.00 H new ATOM 0 HB3 GLU A 699 7.192 3.087 7.730 1.00 0.00 H new ATOM 0 HG2 GLU A 699 4.987 4.053 8.521 1.00 0.00 H new ATOM 0 HG3 GLU A 699 5.066 3.011 9.928 1.00 0.00 H new ATOM 833 N LEU A 700 3.754 2.375 6.345 1.00 0.00 N ATOM 834 CA LEU A 700 3.141 3.018 5.163 1.00 0.00 C ATOM 835 C LEU A 700 2.590 4.398 5.528 1.00 0.00 C ATOM 836 O LEU A 700 1.867 4.559 6.490 1.00 0.00 O ATOM 837 CB LEU A 700 2.010 2.071 4.768 1.00 0.00 C ATOM 838 CG LEU A 700 2.568 0.686 4.451 1.00 0.00 C ATOM 839 CD1 LEU A 700 2.345 -0.216 5.668 1.00 0.00 C ATOM 840 CD2 LEU A 700 1.843 0.110 3.225 1.00 0.00 C ATOM 0 H LEU A 700 3.101 2.023 7.045 1.00 0.00 H new ATOM 0 HA LEU A 700 3.854 3.177 4.354 1.00 0.00 H new ATOM 0 HB2 LEU A 700 1.284 2.002 5.578 1.00 0.00 H new ATOM 0 HB3 LEU A 700 1.482 2.466 3.900 1.00 0.00 H new ATOM 0 HG LEU A 700 3.633 0.747 4.229 1.00 0.00 H new ATOM 0 HD11 LEU A 700 2.738 -1.211 5.460 1.00 0.00 H new ATOM 0 HD12 LEU A 700 2.860 0.204 6.532 1.00 0.00 H new ATOM 0 HD13 LEU A 700 1.278 -0.284 5.880 1.00 0.00 H new ATOM 0 HD21 LEU A 700 2.241 -0.879 2.998 1.00 0.00 H new ATOM 0 HD22 LEU A 700 0.777 0.032 3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 700 1.996 0.768 2.369 1.00 0.00 H new ATOM 852 N VAL A 701 2.907 5.386 4.741 1.00 0.00 N ATOM 853 CA VAL A 701 2.387 6.756 5.005 1.00 0.00 C ATOM 854 C VAL A 701 1.488 7.147 3.837 1.00 0.00 C ATOM 855 O VAL A 701 1.909 7.132 2.696 1.00 0.00 O ATOM 856 CB VAL A 701 3.617 7.665 5.068 1.00 0.00 C ATOM 857 CG1 VAL A 701 3.166 9.119 5.235 1.00 0.00 C ATOM 858 CG2 VAL A 701 4.498 7.262 6.256 1.00 0.00 C ATOM 0 H VAL A 701 3.508 5.303 3.921 1.00 0.00 H new ATOM 0 HA VAL A 701 1.811 6.827 5.928 1.00 0.00 H new ATOM 0 HB VAL A 701 4.189 7.564 4.146 1.00 0.00 H new ATOM 0 HG11 VAL A 701 4.040 9.768 5.280 1.00 0.00 H new ATOM 0 HG12 VAL A 701 2.544 9.407 4.387 1.00 0.00 H new ATOM 0 HG13 VAL A 701 2.592 9.218 6.156 1.00 0.00 H new ATOM 0 HG21 VAL A 701 5.372 7.911 6.297 1.00 0.00 H new ATOM 0 HG22 VAL A 701 3.929 7.360 7.181 1.00 0.00 H new ATOM 0 HG23 VAL A 701 4.820 6.227 6.136 1.00 0.00 H new ATOM 868 N GLN A 702 0.249 7.464 4.091 1.00 0.00 N ATOM 869 CA GLN A 702 -0.657 7.810 2.955 1.00 0.00 C ATOM 870 C GLN A 702 -0.689 9.314 2.662 1.00 0.00 C ATOM 871 O GLN A 702 -0.425 10.142 3.515 1.00 0.00 O ATOM 872 CB GLN A 702 -2.055 7.315 3.344 1.00 0.00 C ATOM 873 CG GLN A 702 -3.052 7.705 2.241 1.00 0.00 C ATOM 874 CD GLN A 702 -4.257 6.756 2.269 1.00 0.00 C ATOM 875 OE1 GLN A 702 -4.279 5.816 3.036 1.00 0.00 O ATOM 876 NE2 GLN A 702 -5.259 6.946 1.445 1.00 0.00 N ATOM 0 H GLN A 702 -0.172 7.499 5.019 1.00 0.00 H new ATOM 0 HA GLN A 702 -0.295 7.337 2.042 1.00 0.00 H new ATOM 0 HB2 GLN A 702 -2.047 6.233 3.478 1.00 0.00 H new ATOM 0 HB3 GLN A 702 -2.357 7.752 4.296 1.00 0.00 H new ATOM 0 HG2 GLN A 702 -3.384 8.733 2.385 1.00 0.00 H new ATOM 0 HG3 GLN A 702 -2.566 7.661 1.267 1.00 0.00 H new ATOM 0 HE21 GLN A 702 -5.245 7.735 0.798 1.00 0.00 H new ATOM 0 HE22 GLN A 702 -6.052 6.305 1.451 1.00 0.00 H new ATOM 885 N LEU A 703 -1.017 9.646 1.433 1.00 0.00 N ATOM 886 CA LEU A 703 -1.097 11.079 0.982 1.00 0.00 C ATOM 887 C LEU A 703 0.293 11.584 0.592 1.00 0.00 C ATOM 888 O LEU A 703 1.246 11.459 1.336 1.00 0.00 O ATOM 889 CB LEU A 703 -1.682 11.881 2.154 1.00 0.00 C ATOM 890 CG LEU A 703 -2.672 12.944 1.628 1.00 0.00 C ATOM 891 CD1 LEU A 703 -3.941 12.289 1.084 1.00 0.00 C ATOM 892 CD2 LEU A 703 -3.076 13.879 2.762 1.00 0.00 C ATOM 0 H LEU A 703 -1.238 8.967 0.705 1.00 0.00 H new ATOM 0 HA LEU A 703 -1.730 11.188 0.102 1.00 0.00 H new ATOM 0 HB2 LEU A 703 -2.191 11.210 2.846 1.00 0.00 H new ATOM 0 HB3 LEU A 703 -0.879 12.364 2.711 1.00 0.00 H new ATOM 0 HG LEU A 703 -2.174 13.495 0.830 1.00 0.00 H new ATOM 0 HD11 LEU A 703 -4.621 13.059 0.720 1.00 0.00 H new ATOM 0 HD12 LEU A 703 -3.682 11.618 0.265 1.00 0.00 H new ATOM 0 HD13 LEU A 703 -4.427 11.722 1.878 1.00 0.00 H new ATOM 0 HD21 LEU A 703 -3.774 14.627 2.386 1.00 0.00 H new ATOM 0 HD22 LEU A 703 -3.553 13.304 3.555 1.00 0.00 H new ATOM 0 HD23 LEU A 703 -2.190 14.376 3.157 1.00 0.00 H new ATOM 904 N LEU A 704 0.415 12.139 -0.587 1.00 0.00 N ATOM 905 CA LEU A 704 1.744 12.635 -1.041 1.00 0.00 C ATOM 906 C LEU A 704 2.333 13.627 -0.027 1.00 0.00 C ATOM 907 O LEU A 704 3.493 13.521 0.318 1.00 0.00 O ATOM 908 CB LEU A 704 1.486 13.341 -2.381 1.00 0.00 C ATOM 909 CG LEU A 704 1.332 12.324 -3.516 1.00 0.00 C ATOM 910 CD1 LEU A 704 0.571 11.087 -3.033 1.00 0.00 C ATOM 911 CD2 LEU A 704 0.544 12.973 -4.656 1.00 0.00 C ATOM 0 H LEU A 704 -0.348 12.269 -1.252 1.00 0.00 H new ATOM 0 HA LEU A 704 2.459 11.819 -1.139 1.00 0.00 H new ATOM 0 HB2 LEU A 704 0.584 13.949 -2.308 1.00 0.00 H new ATOM 0 HB3 LEU A 704 2.310 14.018 -2.604 1.00 0.00 H new ATOM 0 HG LEU A 704 2.322 12.020 -3.855 1.00 0.00 H new ATOM 0 HD11 LEU A 704 0.472 10.377 -3.854 1.00 0.00 H new ATOM 0 HD12 LEU A 704 1.118 10.620 -2.214 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -0.420 11.381 -2.687 1.00 0.00 H new ATOM 0 HD21 LEU A 704 0.428 12.258 -5.471 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -0.439 13.274 -4.294 1.00 0.00 H new ATOM 0 HD23 LEU A 704 1.081 13.850 -5.017 1.00 0.00 H new ATOM 923 N PRO A 705 1.527 14.559 0.433 1.00 0.00 N ATOM 924 CA PRO A 705 2.005 15.553 1.423 1.00 0.00 C ATOM 925 C PRO A 705 2.341 14.871 2.750 1.00 0.00 C ATOM 926 O PRO A 705 3.065 15.403 3.569 1.00 0.00 O ATOM 927 CB PRO A 705 0.795 16.474 1.584 1.00 0.00 C ATOM 928 CG PRO A 705 -0.332 15.981 0.662 1.00 0.00 C ATOM 929 CD PRO A 705 0.114 14.678 0.000 1.00 0.00 C ATOM 0 HA PRO A 705 2.911 16.074 1.114 1.00 0.00 H new ATOM 0 HB2 PRO A 705 0.459 16.478 2.621 1.00 0.00 H new ATOM 0 HB3 PRO A 705 1.066 17.500 1.333 1.00 0.00 H new ATOM 0 HG2 PRO A 705 -1.246 15.821 1.234 1.00 0.00 H new ATOM 0 HG3 PRO A 705 -0.557 16.732 -0.095 1.00 0.00 H new ATOM 0 HD2 PRO A 705 -0.484 13.830 0.332 1.00 0.00 H new ATOM 0 HD3 PRO A 705 0.026 14.724 -1.085 1.00 0.00 H new ATOM 937 N GLY A 706 1.808 13.702 2.970 1.00 0.00 N ATOM 938 CA GLY A 706 2.078 12.983 4.242 1.00 0.00 C ATOM 939 C GLY A 706 1.111 13.473 5.313 1.00 0.00 C ATOM 940 O GLY A 706 1.435 14.322 6.119 1.00 0.00 O ATOM 0 H GLY A 706 1.194 13.213 2.319 1.00 0.00 H new ATOM 0 HA2 GLY A 706 1.964 11.909 4.097 1.00 0.00 H new ATOM 0 HA3 GLY A 706 3.107 13.155 4.559 1.00 0.00 H new ATOM 944 N ASP A 707 -0.074 12.941 5.336 1.00 0.00 N ATOM 945 CA ASP A 707 -1.053 13.377 6.365 1.00 0.00 C ATOM 946 C ASP A 707 -1.654 12.155 7.055 1.00 0.00 C ATOM 947 O ASP A 707 -1.708 12.077 8.265 1.00 0.00 O ATOM 948 CB ASP A 707 -2.128 14.136 5.603 1.00 0.00 C ATOM 949 CG ASP A 707 -3.119 14.737 6.600 1.00 0.00 C ATOM 950 OD1 ASP A 707 -3.023 14.404 7.770 1.00 0.00 O ATOM 951 OD2 ASP A 707 -3.954 15.519 6.179 1.00 0.00 O ATOM 0 H ASP A 707 -0.407 12.226 4.690 1.00 0.00 H new ATOM 0 HA ASP A 707 -0.594 13.995 7.136 1.00 0.00 H new ATOM 0 HB2 ASP A 707 -1.676 14.924 5.001 1.00 0.00 H new ATOM 0 HB3 ASP A 707 -2.645 13.466 4.916 1.00 0.00 H new ATOM 956 N ARG A 708 -2.098 11.192 6.290 1.00 0.00 N ATOM 957 CA ARG A 708 -2.687 9.966 6.901 1.00 0.00 C ATOM 958 C ARG A 708 -1.667 8.841 6.813 1.00 0.00 C ATOM 959 O ARG A 708 -1.119 8.569 5.764 1.00 0.00 O ATOM 960 CB ARG A 708 -3.917 9.637 6.042 1.00 0.00 C ATOM 961 CG ARG A 708 -4.632 8.388 6.576 1.00 0.00 C ATOM 962 CD ARG A 708 -5.616 8.779 7.681 1.00 0.00 C ATOM 963 NE ARG A 708 -4.778 9.170 8.842 1.00 0.00 N ATOM 964 CZ ARG A 708 -5.267 9.985 9.731 1.00 0.00 C ATOM 965 NH1 ARG A 708 -6.479 9.801 10.175 1.00 0.00 N ATOM 966 NH2 ARG A 708 -4.549 10.982 10.173 1.00 0.00 N ATOM 0 H ARG A 708 -2.078 11.202 5.270 1.00 0.00 H new ATOM 0 HA ARG A 708 -2.957 10.100 7.948 1.00 0.00 H new ATOM 0 HB2 ARG A 708 -4.604 10.483 6.042 1.00 0.00 H new ATOM 0 HB3 ARG A 708 -3.612 9.474 5.008 1.00 0.00 H new ATOM 0 HG2 ARG A 708 -5.163 7.889 5.765 1.00 0.00 H new ATOM 0 HG3 ARG A 708 -3.901 7.678 6.963 1.00 0.00 H new ATOM 0 HD2 ARG A 708 -6.255 9.603 7.363 1.00 0.00 H new ATOM 0 HD3 ARG A 708 -6.272 7.946 7.934 1.00 0.00 H new ATOM 0 HE ARG A 708 -3.831 8.805 8.942 1.00 0.00 H new ATOM 0 HH11 ARG A 708 -7.037 9.022 9.826 1.00 0.00 H new ATOM 0 HH12 ARG A 708 -6.869 10.436 10.872 1.00 0.00 H new ATOM 0 HH21 ARG A 708 -3.602 11.124 9.821 1.00 0.00 H new ATOM 0 HH22 ARG A 708 -4.935 11.619 10.870 1.00 0.00 H new ATOM 980 N GLU A 709 -1.404 8.181 7.896 1.00 0.00 N ATOM 981 CA GLU A 709 -0.421 7.076 7.843 1.00 0.00 C ATOM 982 C GLU A 709 -1.177 5.756 7.867 1.00 0.00 C ATOM 983 O GLU A 709 -1.974 5.501 8.747 1.00 0.00 O ATOM 984 CB GLU A 709 0.442 7.242 9.090 1.00 0.00 C ATOM 985 CG GLU A 709 -0.359 6.815 10.318 1.00 0.00 C ATOM 986 CD GLU A 709 0.382 7.239 11.585 1.00 0.00 C ATOM 987 OE1 GLU A 709 1.497 6.785 11.778 1.00 0.00 O ATOM 988 OE2 GLU A 709 -0.180 8.014 12.342 1.00 0.00 O ATOM 0 H GLU A 709 -1.823 8.356 8.809 1.00 0.00 H new ATOM 0 HA GLU A 709 0.195 7.089 6.944 1.00 0.00 H new ATOM 0 HB2 GLU A 709 1.346 6.639 9.004 1.00 0.00 H new ATOM 0 HB3 GLU A 709 0.759 8.280 9.191 1.00 0.00 H new ATOM 0 HG2 GLU A 709 -1.350 7.269 10.295 1.00 0.00 H new ATOM 0 HG3 GLU A 709 -0.503 5.735 10.313 1.00 0.00 H new ATOM 995 N LEU A 710 -0.958 4.930 6.897 1.00 0.00 N ATOM 996 CA LEU A 710 -1.697 3.648 6.854 1.00 0.00 C ATOM 997 C LEU A 710 -0.742 2.470 6.952 1.00 0.00 C ATOM 998 O LEU A 710 -0.592 1.708 6.020 1.00 0.00 O ATOM 999 CB LEU A 710 -2.370 3.672 5.489 1.00 0.00 C ATOM 1000 CG LEU A 710 -3.655 2.854 5.528 1.00 0.00 C ATOM 1001 CD1 LEU A 710 -4.143 2.628 4.099 1.00 0.00 C ATOM 1002 CD2 LEU A 710 -3.371 1.504 6.185 1.00 0.00 C ATOM 0 H LEU A 710 -0.301 5.084 6.132 1.00 0.00 H new ATOM 0 HA LEU A 710 -2.401 3.539 7.679 1.00 0.00 H new ATOM 0 HB2 LEU A 710 -2.592 4.700 5.202 1.00 0.00 H new ATOM 0 HB3 LEU A 710 -1.695 3.269 4.734 1.00 0.00 H new ATOM 0 HG LEU A 710 -4.417 3.385 6.099 1.00 0.00 H new ATOM 0 HD11 LEU A 710 -5.063 2.043 4.117 1.00 0.00 H new ATOM 0 HD12 LEU A 710 -4.334 3.590 3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 710 -3.381 2.089 3.535 1.00 0.00 H new ATOM 0 HD21 LEU A 710 -4.287 0.914 6.216 1.00 0.00 H new ATOM 0 HD22 LEU A 710 -2.615 0.971 5.608 1.00 0.00 H new ATOM 0 HD23 LEU A 710 -3.008 1.663 7.200 1.00 0.00 H new ATOM 1014 N THR A 711 -0.114 2.298 8.076 1.00 0.00 N ATOM 1015 CA THR A 711 0.822 1.156 8.221 1.00 0.00 C ATOM 1016 C THR A 711 0.028 -0.144 8.382 1.00 0.00 C ATOM 1017 O THR A 711 -1.185 -0.154 8.305 1.00 0.00 O ATOM 1018 CB THR A 711 1.652 1.474 9.455 1.00 0.00 C ATOM 1019 OG1 THR A 711 0.804 1.501 10.595 1.00 0.00 O ATOM 1020 CG2 THR A 711 2.306 2.839 9.275 1.00 0.00 C ATOM 0 H THR A 711 -0.207 2.896 8.897 1.00 0.00 H new ATOM 0 HA THR A 711 1.463 1.018 7.351 1.00 0.00 H new ATOM 0 HB THR A 711 2.421 0.714 9.592 1.00 0.00 H new ATOM 0 HG1 THR A 711 1.335 1.704 11.393 1.00 0.00 H new ATOM 0 HG21 THR A 711 2.903 3.075 10.156 1.00 0.00 H new ATOM 0 HG22 THR A 711 2.949 2.821 8.395 1.00 0.00 H new ATOM 0 HG23 THR A 711 1.534 3.598 9.146 1.00 0.00 H new ATOM 1028 N ILE A 712 0.703 -1.247 8.543 1.00 0.00 N ATOM 1029 CA ILE A 712 -0.018 -2.553 8.640 1.00 0.00 C ATOM 1030 C ILE A 712 -0.849 -2.758 9.932 1.00 0.00 C ATOM 1031 O ILE A 712 -1.849 -3.443 9.876 1.00 0.00 O ATOM 1032 CB ILE A 712 1.061 -3.644 8.469 1.00 0.00 C ATOM 1033 CG1 ILE A 712 0.393 -5.018 8.329 1.00 0.00 C ATOM 1034 CG2 ILE A 712 2.013 -3.682 9.665 1.00 0.00 C ATOM 1035 CD1 ILE A 712 -0.887 -4.900 7.500 1.00 0.00 C ATOM 0 H ILE A 712 1.719 -1.304 8.612 1.00 0.00 H new ATOM 0 HA ILE A 712 -0.780 -2.594 7.862 1.00 0.00 H new ATOM 0 HB ILE A 712 1.633 -3.405 7.573 1.00 0.00 H new ATOM 0 HG12 ILE A 712 1.080 -5.718 7.853 1.00 0.00 H new ATOM 0 HG13 ILE A 712 0.161 -5.420 9.315 1.00 0.00 H new ATOM 0 HG21 ILE A 712 2.760 -4.461 9.511 1.00 0.00 H new ATOM 0 HG22 ILE A 712 2.511 -2.717 9.765 1.00 0.00 H new ATOM 0 HG23 ILE A 712 1.448 -3.895 10.573 1.00 0.00 H new ATOM 0 HD11 ILE A 712 -1.352 -5.881 7.407 1.00 0.00 H new ATOM 0 HD12 ILE A 712 -1.578 -4.216 7.993 1.00 0.00 H new ATOM 0 HD13 ILE A 712 -0.644 -4.519 6.508 1.00 0.00 H new ATOM 1047 N PRO A 713 -0.463 -2.204 11.057 1.00 0.00 N ATOM 1048 CA PRO A 713 -1.264 -2.432 12.285 1.00 0.00 C ATOM 1049 C PRO A 713 -2.718 -1.959 12.138 1.00 0.00 C ATOM 1050 O PRO A 713 -3.554 -2.273 12.959 1.00 0.00 O ATOM 1051 CB PRO A 713 -0.518 -1.622 13.341 1.00 0.00 C ATOM 1052 CG PRO A 713 0.719 -0.980 12.688 1.00 0.00 C ATOM 1053 CD PRO A 713 0.735 -1.342 11.192 1.00 0.00 C ATOM 0 HA PRO A 713 -1.352 -3.490 12.531 1.00 0.00 H new ATOM 0 HB2 PRO A 713 -1.169 -0.852 13.756 1.00 0.00 H new ATOM 0 HB3 PRO A 713 -0.218 -2.265 14.168 1.00 0.00 H new ATOM 0 HG2 PRO A 713 0.693 0.102 12.814 1.00 0.00 H new ATOM 0 HG3 PRO A 713 1.629 -1.336 13.172 1.00 0.00 H new ATOM 0 HD2 PRO A 713 0.671 -0.456 10.560 1.00 0.00 H new ATOM 0 HD3 PRO A 713 1.647 -1.869 10.912 1.00 0.00 H new ATOM 1061 N HIS A 714 -3.047 -1.228 11.107 1.00 0.00 N ATOM 1062 CA HIS A 714 -4.466 -0.773 10.963 1.00 0.00 C ATOM 1063 C HIS A 714 -5.391 -1.958 10.645 1.00 0.00 C ATOM 1064 O HIS A 714 -4.947 -3.059 10.377 1.00 0.00 O ATOM 1065 CB HIS A 714 -4.476 0.246 9.822 1.00 0.00 C ATOM 1066 CG HIS A 714 -3.754 1.494 10.249 1.00 0.00 C ATOM 1067 ND1 HIS A 714 -4.407 2.556 10.862 1.00 0.00 N ATOM 1068 CD2 HIS A 714 -2.440 1.870 10.149 1.00 0.00 C ATOM 1069 CE1 HIS A 714 -3.490 3.511 11.100 1.00 0.00 C ATOM 1070 NE2 HIS A 714 -2.274 3.144 10.686 1.00 0.00 N ATOM 0 H HIS A 714 -2.410 -0.929 10.369 1.00 0.00 H new ATOM 0 HA HIS A 714 -4.833 -0.331 11.889 1.00 0.00 H new ATOM 0 HB2 HIS A 714 -3.998 -0.178 8.939 1.00 0.00 H new ATOM 0 HB3 HIS A 714 -5.503 0.485 9.545 1.00 0.00 H new ATOM 0 HD2 HIS A 714 -1.652 1.269 9.719 1.00 0.00 H new ATOM 0 HE1 HIS A 714 -3.710 4.459 11.569 1.00 0.00 H new ATOM 0 HE2 HIS A 714 -1.410 3.682 10.750 1.00 0.00 H new ATOM 1078 N SER A 715 -6.681 -1.727 10.697 1.00 0.00 N ATOM 1079 CA SER A 715 -7.675 -2.814 10.425 1.00 0.00 C ATOM 1080 C SER A 715 -7.895 -3.007 8.924 1.00 0.00 C ATOM 1081 O SER A 715 -7.500 -2.195 8.111 1.00 0.00 O ATOM 1082 CB SER A 715 -8.971 -2.358 11.097 1.00 0.00 C ATOM 1083 OG SER A 715 -8.790 -2.330 12.507 1.00 0.00 O ATOM 0 H SER A 715 -7.092 -0.820 10.919 1.00 0.00 H new ATOM 0 HA SER A 715 -7.325 -3.772 10.810 1.00 0.00 H new ATOM 0 HB2 SER A 715 -9.252 -1.369 10.736 1.00 0.00 H new ATOM 0 HB3 SER A 715 -9.785 -3.035 10.838 1.00 0.00 H new ATOM 0 HG SER A 715 -9.620 -2.036 12.938 1.00 0.00 H new ATOM 1089 N ALA A 716 -8.517 -4.096 8.564 1.00 0.00 N ATOM 1090 CA ALA A 716 -8.770 -4.392 7.125 1.00 0.00 C ATOM 1091 C ALA A 716 -9.608 -3.290 6.459 1.00 0.00 C ATOM 1092 O ALA A 716 -9.346 -2.906 5.338 1.00 0.00 O ATOM 1093 CB ALA A 716 -9.540 -5.712 7.138 1.00 0.00 C ATOM 0 H ALA A 716 -8.865 -4.802 9.213 1.00 0.00 H new ATOM 0 HA ALA A 716 -7.842 -4.447 6.555 1.00 0.00 H new ATOM 0 HB1 ALA A 716 -9.770 -6.009 6.115 1.00 0.00 H new ATOM 0 HB2 ALA A 716 -8.932 -6.483 7.612 1.00 0.00 H new ATOM 0 HB3 ALA A 716 -10.467 -5.587 7.697 1.00 0.00 H new ATOM 1099 N ASN A 717 -10.609 -2.772 7.126 1.00 0.00 N ATOM 1100 CA ASN A 717 -11.425 -1.695 6.492 1.00 0.00 C ATOM 1101 C ASN A 717 -10.663 -0.381 6.567 1.00 0.00 C ATOM 1102 O ASN A 717 -11.037 0.523 7.285 1.00 0.00 O ATOM 1103 CB ASN A 717 -12.703 -1.599 7.323 1.00 0.00 C ATOM 1104 CG ASN A 717 -13.718 -0.716 6.592 1.00 0.00 C ATOM 1105 OD1 ASN A 717 -14.170 -1.051 5.516 1.00 0.00 O ATOM 1106 ND2 ASN A 717 -14.086 0.413 7.130 1.00 0.00 N ATOM 0 H ASN A 717 -10.892 -3.044 8.067 1.00 0.00 H new ATOM 0 HA ASN A 717 -11.642 -1.906 5.445 1.00 0.00 H new ATOM 0 HB2 ASN A 717 -13.120 -2.593 7.486 1.00 0.00 H new ATOM 0 HB3 ASN A 717 -12.481 -1.181 8.305 1.00 0.00 H new ATOM 0 HD21 ASN A 717 -14.753 1.014 6.647 1.00 0.00 H new ATOM 0 HD22 ASN A 717 -13.707 0.695 8.034 1.00 0.00 H new ATOM 1113 N VAL A 718 -9.571 -0.274 5.872 1.00 0.00 N ATOM 1114 CA VAL A 718 -8.788 0.981 5.970 1.00 0.00 C ATOM 1115 C VAL A 718 -9.127 1.951 4.837 1.00 0.00 C ATOM 1116 O VAL A 718 -9.299 3.132 5.061 1.00 0.00 O ATOM 1117 CB VAL A 718 -7.326 0.511 5.944 1.00 0.00 C ATOM 1118 CG1 VAL A 718 -6.751 0.605 4.536 1.00 0.00 C ATOM 1119 CG2 VAL A 718 -6.498 1.389 6.887 1.00 0.00 C ATOM 0 H VAL A 718 -9.192 -0.988 5.250 1.00 0.00 H new ATOM 0 HA VAL A 718 -9.010 1.549 6.873 1.00 0.00 H new ATOM 0 HB VAL A 718 -7.289 -0.530 6.266 1.00 0.00 H new ATOM 0 HG11 VAL A 718 -5.715 0.267 4.543 1.00 0.00 H new ATOM 0 HG12 VAL A 718 -7.333 -0.024 3.862 1.00 0.00 H new ATOM 0 HG13 VAL A 718 -6.793 1.639 4.194 1.00 0.00 H new ATOM 0 HG21 VAL A 718 -5.459 1.060 6.872 1.00 0.00 H new ATOM 0 HG22 VAL A 718 -6.554 2.427 6.560 1.00 0.00 H new ATOM 0 HG23 VAL A 718 -6.891 1.306 7.900 1.00 0.00 H new ATOM 1129 N PHE A 719 -9.231 1.476 3.629 1.00 0.00 N ATOM 1130 CA PHE A 719 -9.566 2.402 2.512 1.00 0.00 C ATOM 1131 C PHE A 719 -10.929 3.041 2.721 1.00 0.00 C ATOM 1132 O PHE A 719 -11.075 4.230 2.559 1.00 0.00 O ATOM 1133 CB PHE A 719 -9.481 1.560 1.243 1.00 0.00 C ATOM 1134 CG PHE A 719 -8.045 1.639 0.754 1.00 0.00 C ATOM 1135 CD1 PHE A 719 -7.027 1.977 1.657 1.00 0.00 C ATOM 1136 CD2 PHE A 719 -7.727 1.411 -0.589 1.00 0.00 C ATOM 1137 CE1 PHE A 719 -5.708 2.085 1.230 1.00 0.00 C ATOM 1138 CE2 PHE A 719 -6.396 1.525 -1.018 1.00 0.00 C ATOM 1139 CZ PHE A 719 -5.390 1.859 -0.101 1.00 0.00 C ATOM 0 H PHE A 719 -9.101 0.499 3.367 1.00 0.00 H new ATOM 0 HA PHE A 719 -8.877 3.244 2.450 1.00 0.00 H new ATOM 0 HB2 PHE A 719 -9.763 0.527 1.446 1.00 0.00 H new ATOM 0 HB3 PHE A 719 -10.168 1.935 0.484 1.00 0.00 H new ATOM 0 HD1 PHE A 719 -7.270 2.155 2.694 1.00 0.00 H new ATOM 0 HD2 PHE A 719 -8.503 1.148 -1.293 1.00 0.00 H new ATOM 0 HE1 PHE A 719 -4.932 2.345 1.934 1.00 0.00 H new ATOM 0 HE2 PHE A 719 -6.147 1.355 -2.055 1.00 0.00 H new ATOM 0 HZ PHE A 719 -4.365 1.941 -0.432 1.00 0.00 H new ATOM 1149 N TYR A 720 -11.914 2.307 3.157 1.00 0.00 N ATOM 1150 CA TYR A 720 -13.218 2.975 3.412 1.00 0.00 C ATOM 1151 C TYR A 720 -12.933 4.222 4.254 1.00 0.00 C ATOM 1152 O TYR A 720 -13.668 5.190 4.231 1.00 0.00 O ATOM 1153 CB TYR A 720 -14.063 1.956 4.189 1.00 0.00 C ATOM 1154 CG TYR A 720 -15.457 2.504 4.410 1.00 0.00 C ATOM 1155 CD1 TYR A 720 -15.688 3.451 5.414 1.00 0.00 C ATOM 1156 CD2 TYR A 720 -16.522 2.061 3.611 1.00 0.00 C ATOM 1157 CE1 TYR A 720 -16.979 3.957 5.618 1.00 0.00 C ATOM 1158 CE2 TYR A 720 -17.813 2.566 3.816 1.00 0.00 C ATOM 1159 CZ TYR A 720 -18.041 3.515 4.822 1.00 0.00 C ATOM 1160 OH TYR A 720 -19.311 4.023 5.024 1.00 0.00 O ATOM 0 H TYR A 720 -11.877 1.305 3.343 1.00 0.00 H new ATOM 0 HA TYR A 720 -13.742 3.281 2.507 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -14.115 1.018 3.637 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -13.593 1.736 5.148 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -14.871 3.792 6.032 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -16.346 1.329 2.836 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -17.154 4.690 6.392 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -18.631 2.224 3.200 1.00 0.00 H new ATOM 0 HH TYR A 720 -19.933 3.612 4.387 1.00 0.00 H new ATOM 1170 N ALA A 721 -11.835 4.215 4.973 1.00 0.00 N ATOM 1171 CA ALA A 721 -11.465 5.404 5.788 1.00 0.00 C ATOM 1172 C ALA A 721 -10.309 6.191 5.126 1.00 0.00 C ATOM 1173 O ALA A 721 -10.195 7.387 5.305 1.00 0.00 O ATOM 1174 CB ALA A 721 -11.021 4.834 7.140 1.00 0.00 C ATOM 0 H ALA A 721 -11.182 3.433 5.027 1.00 0.00 H new ATOM 0 HA ALA A 721 -12.296 6.102 5.887 1.00 0.00 H new ATOM 0 HB1 ALA A 721 -10.731 5.650 7.801 1.00 0.00 H new ATOM 0 HB2 ALA A 721 -11.845 4.279 7.589 1.00 0.00 H new ATOM 0 HB3 ALA A 721 -10.172 4.167 6.992 1.00 0.00 H new ATOM 1180 N MET A 722 -9.427 5.529 4.396 1.00 0.00 N ATOM 1181 CA MET A 722 -8.257 6.255 3.776 1.00 0.00 C ATOM 1182 C MET A 722 -8.463 6.564 2.292 1.00 0.00 C ATOM 1183 O MET A 722 -7.750 7.362 1.715 1.00 0.00 O ATOM 1184 CB MET A 722 -7.074 5.282 3.884 1.00 0.00 C ATOM 1185 CG MET A 722 -6.422 5.426 5.256 1.00 0.00 C ATOM 1186 SD MET A 722 -7.409 4.540 6.486 1.00 0.00 S ATOM 1187 CE MET A 722 -7.718 5.939 7.589 1.00 0.00 C ATOM 0 H MET A 722 -9.466 4.528 4.205 1.00 0.00 H new ATOM 0 HA MET A 722 -8.112 7.207 4.286 1.00 0.00 H new ATOM 0 HB2 MET A 722 -7.417 4.258 3.738 1.00 0.00 H new ATOM 0 HB3 MET A 722 -6.346 5.489 3.100 1.00 0.00 H new ATOM 0 HG2 MET A 722 -5.408 5.028 5.232 1.00 0.00 H new ATOM 0 HG3 MET A 722 -6.345 6.479 5.526 1.00 0.00 H new ATOM 0 HE1 MET A 722 -8.571 5.716 8.229 1.00 0.00 H new ATOM 0 HE2 MET A 722 -6.838 6.117 8.207 1.00 0.00 H new ATOM 0 HE3 MET A 722 -7.932 6.829 6.997 1.00 0.00 H new ATOM 1197 N ASP A 723 -9.366 5.893 1.653 1.00 0.00 N ATOM 1198 CA ASP A 723 -9.524 6.101 0.192 1.00 0.00 C ATOM 1199 C ASP A 723 -10.503 7.217 -0.182 1.00 0.00 C ATOM 1200 O ASP A 723 -10.796 7.398 -1.347 1.00 0.00 O ATOM 1201 CB ASP A 723 -10.002 4.756 -0.332 1.00 0.00 C ATOM 1202 CG ASP A 723 -11.416 4.452 0.153 1.00 0.00 C ATOM 1203 OD1 ASP A 723 -12.120 5.382 0.506 1.00 0.00 O ATOM 1204 OD2 ASP A 723 -11.766 3.282 0.179 1.00 0.00 O ATOM 0 H ASP A 723 -10.000 5.213 2.072 1.00 0.00 H new ATOM 0 HA ASP A 723 -8.582 6.430 -0.248 1.00 0.00 H new ATOM 0 HB2 ASP A 723 -9.980 4.757 -1.422 1.00 0.00 H new ATOM 0 HB3 ASP A 723 -9.323 3.970 -0.000 1.00 0.00 H new ATOM 1209 N GLY A 724 -10.997 7.984 0.746 1.00 0.00 N ATOM 1210 CA GLY A 724 -11.922 9.078 0.335 1.00 0.00 C ATOM 1211 C GLY A 724 -11.248 9.843 -0.810 1.00 0.00 C ATOM 1212 O GLY A 724 -11.794 9.995 -1.884 1.00 0.00 O ATOM 0 H GLY A 724 -10.809 7.907 1.746 1.00 0.00 H new ATOM 0 HA2 GLY A 724 -12.880 8.670 0.012 1.00 0.00 H new ATOM 0 HA3 GLY A 724 -12.126 9.744 1.174 1.00 0.00 H new ATOM 1216 N ALA A 725 -10.039 10.283 -0.590 1.00 0.00 N ATOM 1217 CA ALA A 725 -9.277 10.999 -1.656 1.00 0.00 C ATOM 1218 C ALA A 725 -8.429 9.968 -2.399 1.00 0.00 C ATOM 1219 O ALA A 725 -8.588 8.782 -2.185 1.00 0.00 O ATOM 1220 CB ALA A 725 -8.390 11.991 -0.906 1.00 0.00 C ATOM 0 H ALA A 725 -9.540 10.176 0.293 1.00 0.00 H new ATOM 0 HA ALA A 725 -9.909 11.509 -2.382 1.00 0.00 H new ATOM 0 HB1 ALA A 725 -7.795 12.560 -1.621 1.00 0.00 H new ATOM 0 HB2 ALA A 725 -9.014 12.674 -0.329 1.00 0.00 H new ATOM 0 HB3 ALA A 725 -7.727 11.449 -0.232 1.00 0.00 H new ATOM 1226 N SER A 726 -7.511 10.364 -3.241 1.00 0.00 N ATOM 1227 CA SER A 726 -6.698 9.319 -3.905 1.00 0.00 C ATOM 1228 C SER A 726 -5.800 8.690 -2.844 1.00 0.00 C ATOM 1229 O SER A 726 -5.439 9.328 -1.873 1.00 0.00 O ATOM 1230 CB SER A 726 -5.900 10.034 -4.991 1.00 0.00 C ATOM 1231 OG SER A 726 -4.950 10.904 -4.390 1.00 0.00 O ATOM 0 H SER A 726 -7.298 11.330 -3.488 1.00 0.00 H new ATOM 0 HA SER A 726 -7.287 8.521 -4.357 1.00 0.00 H new ATOM 0 HB2 SER A 726 -5.392 9.305 -5.623 1.00 0.00 H new ATOM 0 HB3 SER A 726 -6.571 10.602 -5.636 1.00 0.00 H new ATOM 0 HG SER A 726 -4.437 11.361 -5.089 1.00 0.00 H new ATOM 1237 N HIS A 727 -5.468 7.443 -2.988 1.00 0.00 N ATOM 1238 CA HIS A 727 -4.634 6.783 -1.941 1.00 0.00 C ATOM 1239 C HIS A 727 -3.227 6.540 -2.459 1.00 0.00 C ATOM 1240 O HIS A 727 -2.963 5.575 -3.147 1.00 0.00 O ATOM 1241 CB HIS A 727 -5.304 5.434 -1.622 1.00 0.00 C ATOM 1242 CG HIS A 727 -6.679 5.366 -2.223 1.00 0.00 C ATOM 1243 ND1 HIS A 727 -7.571 6.413 -2.116 1.00 0.00 N ATOM 1244 CD2 HIS A 727 -7.320 4.397 -2.955 1.00 0.00 C ATOM 1245 CE1 HIS A 727 -8.682 6.059 -2.766 1.00 0.00 C ATOM 1246 NE2 HIS A 727 -8.586 4.838 -3.295 1.00 0.00 N ATOM 0 H HIS A 727 -5.733 6.852 -3.776 1.00 0.00 H new ATOM 0 HA HIS A 727 -4.562 7.413 -1.055 1.00 0.00 H new ATOM 0 HB2 HIS A 727 -4.693 4.619 -2.009 1.00 0.00 H new ATOM 0 HB3 HIS A 727 -5.367 5.301 -0.542 1.00 0.00 H new ATOM 0 HD1 HIS A 727 -7.411 7.295 -1.630 1.00 0.00 H new ATOM 0 HD2 HIS A 727 -6.900 3.439 -3.224 1.00 0.00 H new ATOM 0 HE1 HIS A 727 -9.556 6.687 -2.853 1.00 0.00 H new ATOM 1254 N ASP A 728 -2.319 7.393 -2.113 1.00 0.00 N ATOM 1255 CA ASP A 728 -0.922 7.197 -2.559 1.00 0.00 C ATOM 1256 C ASP A 728 -0.020 7.167 -1.330 1.00 0.00 C ATOM 1257 O ASP A 728 0.044 8.123 -0.581 1.00 0.00 O ATOM 1258 CB ASP A 728 -0.616 8.400 -3.443 1.00 0.00 C ATOM 1259 CG ASP A 728 -1.381 8.271 -4.760 1.00 0.00 C ATOM 1260 OD1 ASP A 728 -1.914 7.204 -5.010 1.00 0.00 O ATOM 1261 OD2 ASP A 728 -1.424 9.243 -5.496 1.00 0.00 O ATOM 0 H ASP A 728 -2.482 8.220 -1.539 1.00 0.00 H new ATOM 0 HA ASP A 728 -0.765 6.266 -3.103 1.00 0.00 H new ATOM 0 HB2 ASP A 728 -0.900 9.321 -2.934 1.00 0.00 H new ATOM 0 HB3 ASP A 728 0.455 8.460 -3.636 1.00 0.00 H new ATOM 1266 N PHE A 729 0.658 6.080 -1.087 1.00 0.00 N ATOM 1267 CA PHE A 729 1.523 6.022 0.125 1.00 0.00 C ATOM 1268 C PHE A 729 2.908 5.516 -0.239 1.00 0.00 C ATOM 1269 O PHE A 729 3.115 4.902 -1.261 1.00 0.00 O ATOM 1270 CB PHE A 729 0.894 4.998 1.097 1.00 0.00 C ATOM 1271 CG PHE A 729 -0.554 4.699 0.764 1.00 0.00 C ATOM 1272 CD1 PHE A 729 -1.457 5.740 0.567 1.00 0.00 C ATOM 1273 CD2 PHE A 729 -0.989 3.369 0.670 1.00 0.00 C ATOM 1274 CE1 PHE A 729 -2.792 5.465 0.271 1.00 0.00 C ATOM 1275 CE2 PHE A 729 -2.327 3.092 0.373 1.00 0.00 C ATOM 1276 CZ PHE A 729 -3.230 4.141 0.175 1.00 0.00 C ATOM 0 H PHE A 729 0.652 5.240 -1.666 1.00 0.00 H new ATOM 0 HA PHE A 729 1.601 7.016 0.566 1.00 0.00 H new ATOM 0 HB2 PHE A 729 1.469 4.073 1.068 1.00 0.00 H new ATOM 0 HB3 PHE A 729 0.958 5.381 2.115 1.00 0.00 H new ATOM 0 HD1 PHE A 729 -1.123 6.764 0.644 1.00 0.00 H new ATOM 0 HD2 PHE A 729 -0.291 2.560 0.827 1.00 0.00 H new ATOM 0 HE1 PHE A 729 -3.488 6.276 0.116 1.00 0.00 H new ATOM 0 HE2 PHE A 729 -2.663 2.068 0.297 1.00 0.00 H new ATOM 0 HZ PHE A 729 -4.264 3.929 -0.052 1.00 0.00 H new ATOM 1286 N LEU A 730 3.849 5.722 0.624 1.00 0.00 N ATOM 1287 CA LEU A 730 5.215 5.194 0.361 1.00 0.00 C ATOM 1288 C LEU A 730 5.535 4.169 1.435 1.00 0.00 C ATOM 1289 O LEU A 730 5.089 4.280 2.562 1.00 0.00 O ATOM 1290 CB LEU A 730 6.169 6.380 0.447 1.00 0.00 C ATOM 1291 CG LEU A 730 5.942 7.129 1.761 1.00 0.00 C ATOM 1292 CD1 LEU A 730 7.274 7.279 2.501 1.00 0.00 C ATOM 1293 CD2 LEU A 730 5.359 8.514 1.467 1.00 0.00 C ATOM 0 H LEU A 730 3.738 6.232 1.501 1.00 0.00 H new ATOM 0 HA LEU A 730 5.300 4.718 -0.616 1.00 0.00 H new ATOM 0 HB2 LEU A 730 7.201 6.034 0.388 1.00 0.00 H new ATOM 0 HB3 LEU A 730 6.009 7.050 -0.397 1.00 0.00 H new ATOM 0 HG LEU A 730 5.244 6.568 2.382 1.00 0.00 H new ATOM 0 HD11 LEU A 730 7.112 7.813 3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 730 7.686 6.292 2.712 1.00 0.00 H new ATOM 0 HD13 LEU A 730 7.974 7.839 1.881 1.00 0.00 H new ATOM 0 HD21 LEU A 730 5.197 9.047 2.404 1.00 0.00 H new ATOM 0 HD22 LEU A 730 6.054 9.077 0.844 1.00 0.00 H new ATOM 0 HD23 LEU A 730 4.409 8.405 0.943 1.00 0.00 H new ATOM 1305 N LEU A 731 6.260 3.147 1.098 1.00 0.00 N ATOM 1306 CA LEU A 731 6.542 2.101 2.112 1.00 0.00 C ATOM 1307 C LEU A 731 8.024 2.090 2.525 1.00 0.00 C ATOM 1308 O LEU A 731 8.917 2.157 1.705 1.00 0.00 O ATOM 1309 CB LEU A 731 6.178 0.790 1.414 1.00 0.00 C ATOM 1310 CG LEU A 731 4.845 0.929 0.665 1.00 0.00 C ATOM 1311 CD1 LEU A 731 4.384 -0.455 0.213 1.00 0.00 C ATOM 1312 CD2 LEU A 731 3.782 1.528 1.582 1.00 0.00 C ATOM 0 H LEU A 731 6.666 2.990 0.176 1.00 0.00 H new ATOM 0 HA LEU A 731 5.978 2.269 3.030 1.00 0.00 H new ATOM 0 HB2 LEU A 731 6.967 0.513 0.715 1.00 0.00 H new ATOM 0 HB3 LEU A 731 6.107 -0.012 2.149 1.00 0.00 H new ATOM 0 HG LEU A 731 4.986 1.584 -0.195 1.00 0.00 H new ATOM 0 HD11 LEU A 731 3.437 -0.367 -0.320 1.00 0.00 H new ATOM 0 HD12 LEU A 731 5.134 -0.890 -0.448 1.00 0.00 H new ATOM 0 HD13 LEU A 731 4.251 -1.097 1.084 1.00 0.00 H new ATOM 0 HD21 LEU A 731 2.842 1.621 1.038 1.00 0.00 H new ATOM 0 HD22 LEU A 731 3.639 0.879 2.446 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.105 2.513 1.919 1.00 0.00 H new ATOM 1324 N ARG A 732 8.277 1.973 3.803 1.00 0.00 N ATOM 1325 CA ARG A 732 9.682 1.913 4.311 1.00 0.00 C ATOM 1326 C ARG A 732 9.852 0.602 5.087 1.00 0.00 C ATOM 1327 O ARG A 732 9.492 0.517 6.243 1.00 0.00 O ATOM 1328 CB ARG A 732 9.809 3.098 5.268 1.00 0.00 C ATOM 1329 CG ARG A 732 9.615 4.403 4.504 1.00 0.00 C ATOM 1330 CD ARG A 732 9.836 5.581 5.449 1.00 0.00 C ATOM 1331 NE ARG A 732 11.169 6.116 5.054 1.00 0.00 N ATOM 1332 CZ ARG A 732 12.256 5.628 5.590 1.00 0.00 C ATOM 1333 NH1 ARG A 732 12.413 5.653 6.885 1.00 0.00 N ATOM 1334 NH2 ARG A 732 13.188 5.115 4.829 1.00 0.00 N ATOM 0 H ARG A 732 7.560 1.916 4.526 1.00 0.00 H new ATOM 0 HA ARG A 732 10.428 1.953 3.518 1.00 0.00 H new ATOM 0 HB2 ARG A 732 9.066 3.017 6.062 1.00 0.00 H new ATOM 0 HB3 ARG A 732 10.789 3.088 5.746 1.00 0.00 H new ATOM 0 HG2 ARG A 732 10.314 4.456 3.669 1.00 0.00 H new ATOM 0 HG3 ARG A 732 8.611 4.444 4.082 1.00 0.00 H new ATOM 0 HD2 ARG A 732 9.055 6.333 5.338 1.00 0.00 H new ATOM 0 HD3 ARG A 732 9.827 5.263 6.492 1.00 0.00 H new ATOM 0 HE ARG A 732 11.233 6.864 4.364 1.00 0.00 H new ATOM 0 HH11 ARG A 732 11.687 6.054 7.479 1.00 0.00 H new ATOM 0 HH12 ARG A 732 13.262 5.272 7.303 1.00 0.00 H new ATOM 0 HH21 ARG A 732 13.066 5.096 3.816 1.00 0.00 H new ATOM 0 HH22 ARG A 732 14.036 4.734 5.248 1.00 0.00 H new ATOM 1348 N GLN A 733 10.364 -0.430 4.474 1.00 0.00 N ATOM 1349 CA GLN A 733 10.504 -1.718 5.217 1.00 0.00 C ATOM 1350 C GLN A 733 11.404 -1.577 6.427 1.00 0.00 C ATOM 1351 O GLN A 733 12.541 -1.161 6.354 1.00 0.00 O ATOM 1352 CB GLN A 733 11.058 -2.725 4.215 1.00 0.00 C ATOM 1353 CG GLN A 733 9.962 -3.084 3.215 1.00 0.00 C ATOM 1354 CD GLN A 733 10.531 -3.993 2.130 1.00 0.00 C ATOM 1355 OE1 GLN A 733 11.731 -4.111 1.986 1.00 0.00 O ATOM 1356 NE2 GLN A 733 9.713 -4.644 1.354 1.00 0.00 N ATOM 0 H GLN A 733 10.687 -0.441 3.507 1.00 0.00 H new ATOM 0 HA GLN A 733 9.543 -2.046 5.613 1.00 0.00 H new ATOM 0 HB2 GLN A 733 11.919 -2.305 3.695 1.00 0.00 H new ATOM 0 HB3 GLN A 733 11.404 -3.620 4.732 1.00 0.00 H new ATOM 0 HG2 GLN A 733 9.139 -3.584 3.727 1.00 0.00 H new ATOM 0 HG3 GLN A 733 9.555 -2.178 2.767 1.00 0.00 H new ATOM 0 HE21 GLN A 733 8.705 -4.544 1.476 1.00 0.00 H new ATOM 0 HE22 GLN A 733 10.080 -5.254 0.624 1.00 0.00 H new ATOM 1365 N ARG A 734 10.861 -1.946 7.544 1.00 0.00 N ATOM 1366 CA ARG A 734 11.599 -1.884 8.825 1.00 0.00 C ATOM 1367 C ARG A 734 12.301 -3.215 9.065 1.00 0.00 C ATOM 1368 O ARG A 734 13.379 -3.275 9.625 1.00 0.00 O ATOM 1369 CB ARG A 734 10.496 -1.654 9.854 1.00 0.00 C ATOM 1370 CG ARG A 734 11.076 -1.606 11.266 1.00 0.00 C ATOM 1371 CD ARG A 734 10.117 -0.824 12.168 1.00 0.00 C ATOM 1372 NE ARG A 734 9.923 0.478 11.473 1.00 0.00 N ATOM 1373 CZ ARG A 734 8.891 1.224 11.760 1.00 0.00 C ATOM 1374 NH1 ARG A 734 7.748 1.035 11.153 1.00 0.00 N ATOM 1375 NH2 ARG A 734 9.001 2.152 12.664 1.00 0.00 N ATOM 0 H ARG A 734 9.907 -2.299 7.624 1.00 0.00 H new ATOM 0 HA ARG A 734 12.367 -1.112 8.859 1.00 0.00 H new ATOM 0 HB2 ARG A 734 9.978 -0.720 9.636 1.00 0.00 H new ATOM 0 HB3 ARG A 734 9.757 -2.452 9.786 1.00 0.00 H new ATOM 0 HG2 ARG A 734 11.216 -2.616 11.651 1.00 0.00 H new ATOM 0 HG3 ARG A 734 12.056 -1.130 11.255 1.00 0.00 H new ATOM 0 HD2 ARG A 734 9.171 -1.351 12.292 1.00 0.00 H new ATOM 0 HD3 ARG A 734 10.536 -0.683 13.164 1.00 0.00 H new ATOM 0 HE ARG A 734 10.597 0.787 10.772 1.00 0.00 H new ATOM 0 HH11 ARG A 734 7.659 0.301 10.450 1.00 0.00 H new ATOM 0 HH12 ARG A 734 6.946 1.622 11.382 1.00 0.00 H new ATOM 0 HH21 ARG A 734 9.890 2.294 13.144 1.00 0.00 H new ATOM 0 HH22 ARG A 734 8.199 2.738 12.893 1.00 0.00 H new ATOM 1389 N ARG A 735 11.687 -4.286 8.641 1.00 0.00 N ATOM 1390 CA ARG A 735 12.308 -5.626 8.839 1.00 0.00 C ATOM 1391 C ARG A 735 12.046 -6.507 7.617 1.00 0.00 C ATOM 1392 O ARG A 735 12.017 -5.972 6.522 1.00 0.00 O ATOM 1393 CB ARG A 735 11.604 -6.202 10.068 1.00 0.00 C ATOM 1394 CG ARG A 735 10.115 -6.341 9.752 1.00 0.00 C ATOM 1395 CD ARG A 735 9.428 -7.185 10.827 1.00 0.00 C ATOM 1396 NE ARG A 735 9.902 -6.620 12.116 1.00 0.00 N ATOM 1397 CZ ARG A 735 9.174 -5.750 12.765 1.00 0.00 C ATOM 1398 NH1 ARG A 735 8.622 -4.746 12.140 1.00 0.00 N ATOM 1399 NH2 ARG A 735 8.993 -5.888 14.045 1.00 0.00 N ATOM 1400 OXT ARG A 735 11.875 -7.702 7.798 1.00 0.00 O ATOM 0 H ARG A 735 10.784 -4.291 8.167 1.00 0.00 H new ATOM 0 HA ARG A 735 13.389 -5.571 8.971 1.00 0.00 H new ATOM 0 HB2 ARG A 735 12.028 -7.172 10.328 1.00 0.00 H new ATOM 0 HB3 ARG A 735 11.749 -5.549 10.929 1.00 0.00 H new ATOM 0 HG2 ARG A 735 9.652 -5.355 9.701 1.00 0.00 H new ATOM 0 HG3 ARG A 735 9.984 -6.806 8.775 1.00 0.00 H new ATOM 0 HD2 ARG A 735 8.343 -7.124 10.744 1.00 0.00 H new ATOM 0 HD3 ARG A 735 9.696 -8.237 10.734 1.00 0.00 H new ATOM 0 HE ARG A 735 10.802 -6.913 12.497 1.00 0.00 H new ATOM 0 HH11 ARG A 735 8.757 -4.634 11.135 1.00 0.00 H new ATOM 0 HH12 ARG A 735 8.056 -4.073 12.656 1.00 0.00 H new ATOM 0 HH21 ARG A 735 9.418 -6.673 14.539 1.00 0.00 H new ATOM 0 HH22 ARG A 735 8.426 -5.211 14.556 1.00 0.00 H new