USER MOD reduce.3.24.130724 H: found=0, std=0, add=856, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 858 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 739 THR OG1 : rot 180:sc= 0.259 USER MOD Set 1.2: A 740 GLN : amide:sc= -0.494 K(o=-0.23,f=1.1) USER MOD Set 2.1: A 728 HIS : no HD1:sc= -0.301 X(o=-0.33,f=-0.28) USER MOD Set 2.2: A 730 SER OG : rot 180:sc= -0.0267 USER MOD Set 3.1: A 638 ASN : amide:sc= 0.806 K(o=-0.12,f=-2) USER MOD Set 3.2: A 660 ASN : amide:sc= -0.93! C(o=-0.12!,f=-7.6!) USER MOD Set 4.1: A 640 ASN : amide:sc= -2.09 K(o=-2.1,f=-1.3) USER MOD Set 4.2: A 658 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 651 HIS : no HD1:sc= -0.0891 K(o=-0.17,f=0.73) USER MOD Set 5.2: A 652 SER OG : rot 180:sc= -0.0841 USER MOD Single : A 629 SER OG : rot -38:sc= 0.142 USER MOD Single : A 642 LYS NZ :NH3+ -162:sc= 0.418 (180deg=-0.162) USER MOD Single : A 644 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 645 THR OG1 : rot 180:sc= 0 USER MOD Single : A 646 LYS NZ :NH3+ 175:sc= 1.23 (180deg=1.16) USER MOD Single : A 649 TYR OH : rot 180:sc= -1.85! USER MOD Single : A 657 TYR OH : rot -136:sc= 1.16 USER MOD Single : A 665 MET CE :methyl -159:sc= -1.03 (180deg=-1.95) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 669 ASN : amide:sc= -3.72! K(o=-3.7!,f=-1.5) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 672 GLN : amide:sc= -1.16 X(o=-1.2,f=-1.1) USER MOD Single : A 679 THR OG1 : rot 80:sc= 0.752 USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD Single : A 690 THR OG1 : rot -33:sc= 0.115 USER MOD Single : A 699 HIS : no HE2:sc= 1.07 K(o=1.1,f=-5.7!) USER MOD Single : A 703 GLN : amide:sc= -3.84! C(o=-3.8!,f=-2.6!) USER MOD Single : A 705 SER OG : rot 180:sc= 0 USER MOD Single : A 706 SER OG : rot -122:sc= 1.27 USER MOD Single : A 709 TYR OH : rot 37:sc= -0.784! USER MOD Single : A 710 TYR OH : rot 180:sc= 0 USER MOD Single : A 711 TYR OH : rot 180:sc= 0 USER MOD Single : A 714 SER OG : rot 180:sc= 0 USER MOD Single : A 718 ASN : amide:sc= -1.38! K(o=-1.4!,f=1.3) USER MOD Single : A 720 SER OG : rot -26:sc= -1.37 USER MOD Single : A 722 SER OG : rot -35:sc= 0.153 USER MOD Single : A 724 THR OG1 : rot 180:sc= 0 USER MOD Single : A 725 MET CE :methyl -179:sc= -3.7! (180deg=-3.8!) USER MOD Single : A 732 THR OG1 : rot 180:sc= 0 USER MOD Single : A 735 HIS : no HD1:sc= -1.3! K(o=-1.3!,f=0) USER MOD Single : A 743 GLN : amide:sc= -1.14! K(o=-1.1!,f=-0.033) USER MOD ----------------------------------------------------------------- ATOM 103 N SER A 629 28.570 -7.579 0.180 1.00 0.00 N ATOM 104 CA SER A 629 27.779 -8.124 1.252 1.00 0.00 C ATOM 105 C SER A 629 26.919 -7.032 1.835 1.00 0.00 C ATOM 106 O SER A 629 27.278 -5.842 1.763 1.00 0.00 O ATOM 107 CB SER A 629 28.680 -8.708 2.351 1.00 0.00 C ATOM 108 OG SER A 629 29.684 -7.780 2.759 1.00 0.00 O ATOM 0 HA SER A 629 27.153 -8.924 0.857 1.00 0.00 H new ATOM 0 HB2 SER A 629 28.071 -8.987 3.211 1.00 0.00 H new ATOM 0 HB3 SER A 629 29.154 -9.620 1.987 1.00 0.00 H new ATOM 0 HG SER A 629 30.012 -7.289 1.977 1.00 0.00 H new ATOM 114 N CYS A 630 25.809 -7.419 2.386 1.00 0.00 N ATOM 115 CA CYS A 630 24.900 -6.516 3.032 1.00 0.00 C ATOM 116 C CYS A 630 23.903 -7.350 3.775 1.00 0.00 C ATOM 117 O CYS A 630 23.685 -8.521 3.408 1.00 0.00 O ATOM 118 CB CYS A 630 24.186 -5.610 2.008 1.00 0.00 C ATOM 119 SG CYS A 630 23.214 -6.501 0.743 1.00 0.00 S ATOM 0 H CYS A 630 25.502 -8.391 2.400 1.00 0.00 H new ATOM 0 HA CYS A 630 25.444 -5.858 3.710 1.00 0.00 H new ATOM 0 HB2 CYS A 630 23.523 -4.932 2.545 1.00 0.00 H new ATOM 0 HB3 CYS A 630 24.932 -4.995 1.506 1.00 0.00 H new ATOM 124 N GLY A 631 23.354 -6.824 4.828 1.00 0.00 N ATOM 125 CA GLY A 631 22.373 -7.517 5.532 1.00 0.00 C ATOM 126 C GLY A 631 21.013 -6.971 5.252 1.00 0.00 C ATOM 127 O GLY A 631 20.700 -6.653 4.105 1.00 0.00 O ATOM 0 H GLY A 631 23.587 -5.905 5.205 1.00 0.00 H new ATOM 0 HA2 GLY A 631 22.406 -8.572 5.261 1.00 0.00 H new ATOM 0 HA3 GLY A 631 22.578 -7.456 6.601 1.00 0.00 H new ATOM 131 N PRO A 632 20.188 -6.850 6.283 1.00 0.00 N ATOM 132 CA PRO A 632 18.810 -6.360 6.167 1.00 0.00 C ATOM 133 C PRO A 632 18.719 -4.986 5.479 1.00 0.00 C ATOM 134 O PRO A 632 19.600 -4.136 5.657 1.00 0.00 O ATOM 135 CB PRO A 632 18.359 -6.260 7.622 1.00 0.00 C ATOM 136 CG PRO A 632 19.214 -7.227 8.354 1.00 0.00 C ATOM 137 CD PRO A 632 20.540 -7.176 7.677 1.00 0.00 C ATOM 0 HA PRO A 632 18.195 -7.016 5.551 1.00 0.00 H new ATOM 0 HB2 PRO A 632 18.488 -5.248 8.007 1.00 0.00 H new ATOM 0 HB3 PRO A 632 17.303 -6.509 7.726 1.00 0.00 H new ATOM 0 HG2 PRO A 632 19.300 -6.957 9.407 1.00 0.00 H new ATOM 0 HG3 PRO A 632 18.792 -8.231 8.316 1.00 0.00 H new ATOM 0 HD2 PRO A 632 21.189 -6.419 8.117 1.00 0.00 H new ATOM 0 HD3 PRO A 632 21.067 -8.128 7.748 1.00 0.00 H new ATOM 145 N PRO A 633 17.655 -4.762 4.683 1.00 0.00 N ATOM 146 CA PRO A 633 17.452 -3.508 3.941 1.00 0.00 C ATOM 147 C PRO A 633 17.321 -2.279 4.864 1.00 0.00 C ATOM 148 O PRO A 633 17.097 -2.414 6.082 1.00 0.00 O ATOM 149 CB PRO A 633 16.122 -3.751 3.193 1.00 0.00 C ATOM 150 CG PRO A 633 15.452 -4.828 3.954 1.00 0.00 C ATOM 151 CD PRO A 633 16.557 -5.712 4.441 1.00 0.00 C ATOM 0 HA PRO A 633 18.299 -3.285 3.292 1.00 0.00 H new ATOM 0 HB2 PRO A 633 15.513 -2.848 3.166 1.00 0.00 H new ATOM 0 HB3 PRO A 633 16.298 -4.048 2.159 1.00 0.00 H new ATOM 0 HG2 PRO A 633 14.877 -4.422 4.786 1.00 0.00 H new ATOM 0 HG3 PRO A 633 14.755 -5.380 3.324 1.00 0.00 H new ATOM 0 HD2 PRO A 633 16.277 -6.246 5.349 1.00 0.00 H new ATOM 0 HD3 PRO A 633 16.829 -6.464 3.700 1.00 0.00 H new ATOM 159 N PRO A 634 17.489 -1.072 4.314 1.00 0.00 N ATOM 160 CA PRO A 634 17.308 0.161 5.063 1.00 0.00 C ATOM 161 C PRO A 634 15.824 0.463 5.281 1.00 0.00 C ATOM 162 O PRO A 634 14.952 -0.417 5.117 1.00 0.00 O ATOM 163 CB PRO A 634 17.945 1.232 4.170 1.00 0.00 C ATOM 164 CG PRO A 634 17.958 0.669 2.795 1.00 0.00 C ATOM 165 CD PRO A 634 17.885 -0.825 2.917 1.00 0.00 C ATOM 0 HA PRO A 634 17.755 0.111 6.056 1.00 0.00 H new ATOM 0 HB2 PRO A 634 17.373 2.159 4.206 1.00 0.00 H new ATOM 0 HB3 PRO A 634 18.955 1.467 4.504 1.00 0.00 H new ATOM 0 HG2 PRO A 634 17.115 1.048 2.218 1.00 0.00 H new ATOM 0 HG3 PRO A 634 18.864 0.967 2.268 1.00 0.00 H new ATOM 0 HD2 PRO A 634 17.158 -1.243 2.220 1.00 0.00 H new ATOM 0 HD3 PRO A 634 18.846 -1.287 2.691 1.00 0.00 H new ATOM 173 N GLU A 635 15.529 1.654 5.669 1.00 0.00 N ATOM 174 CA GLU A 635 14.176 2.064 5.840 1.00 0.00 C ATOM 175 C GLU A 635 13.802 3.041 4.764 1.00 0.00 C ATOM 176 O GLU A 635 14.646 3.460 3.981 1.00 0.00 O ATOM 177 CB GLU A 635 13.942 2.707 7.182 1.00 0.00 C ATOM 178 CG GLU A 635 14.761 3.938 7.405 1.00 0.00 C ATOM 179 CD GLU A 635 16.173 3.641 7.834 1.00 0.00 C ATOM 180 OE1 GLU A 635 16.396 3.358 9.023 1.00 0.00 O ATOM 181 OE2 GLU A 635 17.079 3.622 6.969 1.00 0.00 O ATOM 0 H GLU A 635 16.220 2.375 5.878 1.00 0.00 H new ATOM 0 HA GLU A 635 13.558 1.169 5.779 1.00 0.00 H new ATOM 0 HB2 GLU A 635 12.886 2.961 7.275 1.00 0.00 H new ATOM 0 HB3 GLU A 635 14.166 1.984 7.966 1.00 0.00 H new ATOM 0 HG2 GLU A 635 14.783 4.523 6.486 1.00 0.00 H new ATOM 0 HG3 GLU A 635 14.279 4.554 8.164 1.00 0.00 H new ATOM 188 N LEU A 636 12.565 3.414 4.738 1.00 0.00 N ATOM 189 CA LEU A 636 12.096 4.367 3.791 1.00 0.00 C ATOM 190 C LEU A 636 11.772 5.678 4.497 1.00 0.00 C ATOM 191 O LEU A 636 11.365 5.661 5.665 1.00 0.00 O ATOM 192 CB LEU A 636 10.919 3.758 2.984 1.00 0.00 C ATOM 193 CG LEU A 636 10.013 4.663 2.137 1.00 0.00 C ATOM 194 CD1 LEU A 636 10.790 5.467 1.135 1.00 0.00 C ATOM 195 CD2 LEU A 636 8.956 3.828 1.436 1.00 0.00 C ATOM 0 H LEU A 636 11.850 3.064 5.376 1.00 0.00 H new ATOM 0 HA LEU A 636 12.867 4.610 3.060 1.00 0.00 H new ATOM 0 HB2 LEU A 636 11.340 3.006 2.316 1.00 0.00 H new ATOM 0 HB3 LEU A 636 10.279 3.232 3.693 1.00 0.00 H new ATOM 0 HG LEU A 636 9.531 5.370 2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 636 10.106 6.091 0.560 1.00 0.00 H new ATOM 0 HD12 LEU A 636 11.509 6.100 1.655 1.00 0.00 H new ATOM 0 HD13 LEU A 636 11.320 4.794 0.461 1.00 0.00 H new ATOM 0 HD21 LEU A 636 8.317 4.477 0.837 1.00 0.00 H new ATOM 0 HD22 LEU A 636 9.440 3.098 0.788 1.00 0.00 H new ATOM 0 HD23 LEU A 636 8.351 3.309 2.179 1.00 0.00 H new ATOM 207 N LEU A 637 12.043 6.795 3.785 1.00 0.00 N ATOM 208 CA LEU A 637 11.812 8.186 4.213 1.00 0.00 C ATOM 209 C LEU A 637 10.599 8.304 5.103 1.00 0.00 C ATOM 210 O LEU A 637 10.686 8.766 6.249 1.00 0.00 O ATOM 211 CB LEU A 637 11.612 9.054 2.934 1.00 0.00 C ATOM 212 CG LEU A 637 11.481 10.601 3.062 1.00 0.00 C ATOM 213 CD1 LEU A 637 10.196 11.078 3.729 1.00 0.00 C ATOM 214 CD2 LEU A 637 12.707 11.199 3.712 1.00 0.00 C ATOM 0 H LEU A 637 12.449 6.744 2.851 1.00 0.00 H new ATOM 0 HA LEU A 637 12.671 8.528 4.790 1.00 0.00 H new ATOM 0 HB2 LEU A 637 12.452 8.853 2.269 1.00 0.00 H new ATOM 0 HB3 LEU A 637 10.715 8.692 2.432 1.00 0.00 H new ATOM 0 HG LEU A 637 11.413 10.971 2.039 1.00 0.00 H new ATOM 0 HD11 LEU A 637 10.192 12.167 3.775 1.00 0.00 H new ATOM 0 HD12 LEU A 637 9.337 10.736 3.151 1.00 0.00 H new ATOM 0 HD13 LEU A 637 10.138 10.672 4.739 1.00 0.00 H new ATOM 0 HD21 LEU A 637 12.588 12.280 3.788 1.00 0.00 H new ATOM 0 HD22 LEU A 637 12.833 10.776 4.709 1.00 0.00 H new ATOM 0 HD23 LEU A 637 13.586 10.973 3.108 1.00 0.00 H new ATOM 226 N ASN A 638 9.471 7.924 4.586 1.00 0.00 N ATOM 227 CA ASN A 638 8.291 8.028 5.364 1.00 0.00 C ATOM 228 C ASN A 638 7.679 6.660 5.527 1.00 0.00 C ATOM 229 O ASN A 638 7.270 6.270 6.619 1.00 0.00 O ATOM 230 CB ASN A 638 7.281 8.986 4.735 1.00 0.00 C ATOM 231 CG ASN A 638 6.203 9.407 5.721 1.00 0.00 C ATOM 232 OD1 ASN A 638 6.346 10.420 6.401 1.00 0.00 O ATOM 233 ND2 ASN A 638 5.169 8.627 5.838 1.00 0.00 N ATOM 0 H ASN A 638 9.350 7.547 3.646 1.00 0.00 H new ATOM 0 HA ASN A 638 8.559 8.433 6.340 1.00 0.00 H new ATOM 0 HB2 ASN A 638 7.801 9.871 4.367 1.00 0.00 H new ATOM 0 HB3 ASN A 638 6.816 8.508 3.873 1.00 0.00 H new ATOM 0 HD21 ASN A 638 4.438 8.847 6.514 1.00 0.00 H new ATOM 0 HD22 ASN A 638 5.089 7.795 5.253 1.00 0.00 H new ATOM 240 N GLY A 639 7.630 5.931 4.413 1.00 0.00 N ATOM 241 CA GLY A 639 7.073 4.602 4.390 1.00 0.00 C ATOM 242 C GLY A 639 8.002 3.585 4.971 1.00 0.00 C ATOM 243 O GLY A 639 8.889 3.912 5.766 1.00 0.00 O ATOM 0 H GLY A 639 7.977 6.254 3.510 1.00 0.00 H new ATOM 0 HA2 GLY A 639 6.136 4.594 4.947 1.00 0.00 H new ATOM 0 HA3 GLY A 639 6.836 4.328 3.362 1.00 0.00 H new ATOM 247 N ASN A 640 7.888 2.373 4.543 1.00 0.00 N ATOM 248 CA ASN A 640 8.667 1.352 5.176 1.00 0.00 C ATOM 249 C ASN A 640 8.849 0.181 4.240 1.00 0.00 C ATOM 250 O ASN A 640 8.370 0.194 3.110 1.00 0.00 O ATOM 251 CB ASN A 640 7.947 0.869 6.432 1.00 0.00 C ATOM 252 CG ASN A 640 8.857 0.260 7.466 1.00 0.00 C ATOM 253 OD1 ASN A 640 8.512 -0.722 8.085 1.00 0.00 O ATOM 254 ND2 ASN A 640 9.987 0.870 7.694 1.00 0.00 N ATOM 0 H ASN A 640 7.283 2.066 3.781 1.00 0.00 H new ATOM 0 HA ASN A 640 9.642 1.764 5.436 1.00 0.00 H new ATOM 0 HB2 ASN A 640 7.417 1.709 6.880 1.00 0.00 H new ATOM 0 HB3 ASN A 640 7.195 0.133 6.147 1.00 0.00 H new ATOM 0 HD21 ASN A 640 10.617 0.522 8.417 1.00 0.00 H new ATOM 0 HD22 ASN A 640 10.240 1.695 7.150 1.00 0.00 H new ATOM 261 N VAL A 641 9.511 -0.818 4.725 1.00 0.00 N ATOM 262 CA VAL A 641 9.776 -2.033 4.017 1.00 0.00 C ATOM 263 C VAL A 641 8.805 -3.103 4.533 1.00 0.00 C ATOM 264 O VAL A 641 8.413 -3.067 5.698 1.00 0.00 O ATOM 265 CB VAL A 641 11.251 -2.461 4.265 1.00 0.00 C ATOM 266 CG1 VAL A 641 11.533 -2.556 5.742 1.00 0.00 C ATOM 267 CG2 VAL A 641 11.577 -3.770 3.597 1.00 0.00 C ATOM 0 H VAL A 641 9.900 -0.812 5.668 1.00 0.00 H new ATOM 0 HA VAL A 641 9.635 -1.899 2.944 1.00 0.00 H new ATOM 0 HB VAL A 641 11.887 -1.693 3.825 1.00 0.00 H new ATOM 0 HG11 VAL A 641 12.569 -2.857 5.896 1.00 0.00 H new ATOM 0 HG12 VAL A 641 11.364 -1.585 6.208 1.00 0.00 H new ATOM 0 HG13 VAL A 641 10.870 -3.295 6.192 1.00 0.00 H new ATOM 0 HG21 VAL A 641 12.616 -4.031 3.796 1.00 0.00 H new ATOM 0 HG22 VAL A 641 10.925 -4.551 3.989 1.00 0.00 H new ATOM 0 HG23 VAL A 641 11.426 -3.677 2.522 1.00 0.00 H new ATOM 277 N LYS A 642 8.387 -3.997 3.673 1.00 0.00 N ATOM 278 CA LYS A 642 7.443 -5.043 4.068 1.00 0.00 C ATOM 279 C LYS A 642 8.133 -6.395 4.063 1.00 0.00 C ATOM 280 O LYS A 642 7.622 -7.390 4.590 1.00 0.00 O ATOM 281 CB LYS A 642 6.298 -5.052 3.076 1.00 0.00 C ATOM 282 CG LYS A 642 6.692 -5.516 1.686 1.00 0.00 C ATOM 283 CD LYS A 642 5.687 -5.088 0.675 1.00 0.00 C ATOM 284 CE LYS A 642 5.752 -3.606 0.488 1.00 0.00 C ATOM 285 NZ LYS A 642 4.745 -3.150 -0.486 1.00 0.00 N ATOM 0 H LYS A 642 8.677 -4.032 2.696 1.00 0.00 H new ATOM 0 HA LYS A 642 7.070 -4.846 5.073 1.00 0.00 H new ATOM 0 HB2 LYS A 642 5.508 -5.700 3.454 1.00 0.00 H new ATOM 0 HB3 LYS A 642 5.881 -4.047 3.008 1.00 0.00 H new ATOM 0 HG2 LYS A 642 7.670 -5.109 1.427 1.00 0.00 H new ATOM 0 HG3 LYS A 642 6.785 -6.602 1.674 1.00 0.00 H new ATOM 0 HD2 LYS A 642 5.875 -5.591 -0.273 1.00 0.00 H new ATOM 0 HD3 LYS A 642 4.687 -5.379 0.997 1.00 0.00 H new ATOM 0 HE2 LYS A 642 5.589 -3.108 1.444 1.00 0.00 H new ATOM 0 HE3 LYS A 642 6.748 -3.323 0.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 4.997 -2.200 -0.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 4.715 -3.810 -1.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 3.811 -3.117 -0.030 1.00 0.00 H new ATOM 299 N GLU A 643 9.294 -6.412 3.465 1.00 0.00 N ATOM 300 CA GLU A 643 10.034 -7.614 3.285 1.00 0.00 C ATOM 301 C GLU A 643 10.766 -8.002 4.529 1.00 0.00 C ATOM 302 O GLU A 643 11.370 -7.151 5.202 1.00 0.00 O ATOM 303 CB GLU A 643 10.971 -7.497 2.096 1.00 0.00 C ATOM 304 CG GLU A 643 10.229 -7.360 0.781 1.00 0.00 C ATOM 305 CD GLU A 643 9.352 -8.557 0.508 1.00 0.00 C ATOM 306 OE1 GLU A 643 9.830 -9.521 -0.107 1.00 0.00 O ATOM 307 OE2 GLU A 643 8.170 -8.564 0.909 1.00 0.00 O ATOM 0 H GLU A 643 9.749 -5.580 3.089 1.00 0.00 H new ATOM 0 HA GLU A 643 9.325 -8.414 3.073 1.00 0.00 H new ATOM 0 HB2 GLU A 643 11.621 -6.633 2.234 1.00 0.00 H new ATOM 0 HB3 GLU A 643 11.614 -8.376 2.057 1.00 0.00 H new ATOM 0 HG2 GLU A 643 9.618 -6.458 0.800 1.00 0.00 H new ATOM 0 HG3 GLU A 643 10.946 -7.242 -0.031 1.00 0.00 H new ATOM 314 N LYS A 644 10.676 -9.275 4.850 1.00 0.00 N ATOM 315 CA LYS A 644 11.339 -9.832 6.003 1.00 0.00 C ATOM 316 C LYS A 644 12.829 -9.789 5.776 1.00 0.00 C ATOM 317 O LYS A 644 13.292 -9.727 4.625 1.00 0.00 O ATOM 318 CB LYS A 644 10.898 -11.274 6.241 1.00 0.00 C ATOM 319 CG LYS A 644 9.386 -11.518 6.368 1.00 0.00 C ATOM 320 CD LYS A 644 8.703 -10.867 7.595 1.00 0.00 C ATOM 321 CE LYS A 644 8.529 -9.351 7.474 1.00 0.00 C ATOM 322 NZ LYS A 644 7.710 -8.804 8.576 1.00 0.00 N ATOM 0 H LYS A 644 10.137 -9.954 4.313 1.00 0.00 H new ATOM 0 HA LYS A 644 11.074 -9.245 6.883 1.00 0.00 H new ATOM 0 HB2 LYS A 644 11.274 -11.885 5.421 1.00 0.00 H new ATOM 0 HB3 LYS A 644 11.379 -11.632 7.152 1.00 0.00 H new ATOM 0 HG2 LYS A 644 8.900 -11.148 5.465 1.00 0.00 H new ATOM 0 HG3 LYS A 644 9.212 -12.593 6.406 1.00 0.00 H new ATOM 0 HD2 LYS A 644 7.725 -11.325 7.740 1.00 0.00 H new ATOM 0 HD3 LYS A 644 9.292 -11.086 8.486 1.00 0.00 H new ATOM 0 HE2 LYS A 644 9.508 -8.871 7.476 1.00 0.00 H new ATOM 0 HE3 LYS A 644 8.059 -9.114 6.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 7.614 -7.775 8.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 6.768 -9.243 8.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 8.171 -9.008 9.486 1.00 0.00 H new ATOM 336 N THR A 645 13.575 -9.836 6.820 1.00 0.00 N ATOM 337 CA THR A 645 14.988 -9.703 6.690 1.00 0.00 C ATOM 338 C THR A 645 15.705 -11.004 6.904 1.00 0.00 C ATOM 339 O THR A 645 15.219 -11.898 7.611 1.00 0.00 O ATOM 340 CB THR A 645 15.553 -8.649 7.648 1.00 0.00 C ATOM 341 OG1 THR A 645 15.203 -8.987 9.007 1.00 0.00 O ATOM 342 CG2 THR A 645 15.006 -7.268 7.306 1.00 0.00 C ATOM 0 H THR A 645 13.236 -9.965 7.773 1.00 0.00 H new ATOM 0 HA THR A 645 15.161 -9.378 5.664 1.00 0.00 H new ATOM 0 HB THR A 645 16.638 -8.631 7.545 1.00 0.00 H new ATOM 0 HG1 THR A 645 15.568 -8.312 9.616 1.00 0.00 H new ATOM 0 HG21 THR A 645 15.418 -6.532 7.997 1.00 0.00 H new ATOM 0 HG22 THR A 645 15.289 -7.007 6.286 1.00 0.00 H new ATOM 0 HG23 THR A 645 13.919 -7.276 7.390 1.00 0.00 H new ATOM 350 N LYS A 646 16.836 -11.133 6.265 1.00 0.00 N ATOM 351 CA LYS A 646 17.681 -12.256 6.473 1.00 0.00 C ATOM 352 C LYS A 646 18.790 -11.866 7.423 1.00 0.00 C ATOM 353 O LYS A 646 18.609 -11.932 8.627 1.00 0.00 O ATOM 354 CB LYS A 646 18.246 -12.828 5.151 1.00 0.00 C ATOM 355 CG LYS A 646 17.184 -13.391 4.224 1.00 0.00 C ATOM 356 CD LYS A 646 17.778 -14.048 2.975 1.00 0.00 C ATOM 357 CE LYS A 646 18.437 -13.034 2.050 1.00 0.00 C ATOM 358 NZ LYS A 646 18.974 -13.659 0.827 1.00 0.00 N ATOM 0 H LYS A 646 17.189 -10.457 5.587 1.00 0.00 H new ATOM 0 HA LYS A 646 17.086 -13.057 6.912 1.00 0.00 H new ATOM 0 HB2 LYS A 646 18.791 -12.041 4.629 1.00 0.00 H new ATOM 0 HB3 LYS A 646 18.965 -13.613 5.384 1.00 0.00 H new ATOM 0 HG2 LYS A 646 16.586 -14.124 4.766 1.00 0.00 H new ATOM 0 HG3 LYS A 646 16.509 -12.590 3.922 1.00 0.00 H new ATOM 0 HD2 LYS A 646 18.513 -14.795 3.274 1.00 0.00 H new ATOM 0 HD3 LYS A 646 16.991 -14.573 2.434 1.00 0.00 H new ATOM 0 HE2 LYS A 646 17.710 -12.270 1.776 1.00 0.00 H new ATOM 0 HE3 LYS A 646 19.244 -12.530 2.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 19.337 -12.921 0.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 19.746 -14.309 1.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 18.218 -14.189 0.347 1.00 0.00 H new ATOM 372 N GLU A 647 19.878 -11.337 6.850 1.00 0.00 N ATOM 373 CA GLU A 647 21.126 -10.954 7.552 1.00 0.00 C ATOM 374 C GLU A 647 22.242 -10.954 6.546 1.00 0.00 C ATOM 375 O GLU A 647 23.123 -10.138 6.593 1.00 0.00 O ATOM 376 CB GLU A 647 21.487 -11.913 8.706 1.00 0.00 C ATOM 377 CG GLU A 647 21.696 -13.377 8.297 1.00 0.00 C ATOM 378 CD GLU A 647 22.062 -14.260 9.452 1.00 0.00 C ATOM 379 OE1 GLU A 647 23.250 -14.404 9.738 1.00 0.00 O ATOM 380 OE2 GLU A 647 21.145 -14.843 10.087 1.00 0.00 O ATOM 0 H GLU A 647 19.923 -11.154 5.848 1.00 0.00 H new ATOM 0 HA GLU A 647 20.975 -9.969 7.995 1.00 0.00 H new ATOM 0 HB2 GLU A 647 22.397 -11.553 9.185 1.00 0.00 H new ATOM 0 HB3 GLU A 647 20.695 -11.871 9.454 1.00 0.00 H new ATOM 0 HG2 GLU A 647 20.784 -13.753 7.834 1.00 0.00 H new ATOM 0 HG3 GLU A 647 22.481 -13.430 7.543 1.00 0.00 H new ATOM 387 N GLU A 648 22.177 -11.874 5.636 1.00 0.00 N ATOM 388 CA GLU A 648 23.148 -11.978 4.598 1.00 0.00 C ATOM 389 C GLU A 648 22.444 -11.978 3.284 1.00 0.00 C ATOM 390 O GLU A 648 21.694 -12.903 2.962 1.00 0.00 O ATOM 391 CB GLU A 648 24.006 -13.230 4.763 1.00 0.00 C ATOM 392 CG GLU A 648 24.949 -13.190 5.959 1.00 0.00 C ATOM 393 CD GLU A 648 25.973 -12.071 5.859 1.00 0.00 C ATOM 394 OE1 GLU A 648 26.721 -12.022 4.853 1.00 0.00 O ATOM 395 OE2 GLU A 648 26.094 -11.261 6.799 1.00 0.00 O ATOM 0 H GLU A 648 21.441 -12.579 5.594 1.00 0.00 H new ATOM 0 HA GLU A 648 23.824 -11.124 4.649 1.00 0.00 H new ATOM 0 HB2 GLU A 648 23.350 -14.095 4.861 1.00 0.00 H new ATOM 0 HB3 GLU A 648 24.593 -13.376 3.857 1.00 0.00 H new ATOM 0 HG2 GLU A 648 24.367 -13.064 6.872 1.00 0.00 H new ATOM 0 HG3 GLU A 648 25.467 -14.145 6.041 1.00 0.00 H new ATOM 402 N TYR A 649 22.578 -10.902 2.600 1.00 0.00 N ATOM 403 CA TYR A 649 22.003 -10.744 1.308 1.00 0.00 C ATOM 404 C TYR A 649 23.075 -10.934 0.240 1.00 0.00 C ATOM 405 O TYR A 649 23.092 -11.957 -0.451 1.00 0.00 O ATOM 406 CB TYR A 649 21.286 -9.387 1.207 1.00 0.00 C ATOM 407 CG TYR A 649 19.956 -9.330 1.954 1.00 0.00 C ATOM 408 CD1 TYR A 649 19.873 -9.562 3.323 1.00 0.00 C ATOM 409 CD2 TYR A 649 18.781 -9.045 1.279 1.00 0.00 C ATOM 410 CE1 TYR A 649 18.673 -9.512 3.979 1.00 0.00 C ATOM 411 CE2 TYR A 649 17.573 -8.992 1.938 1.00 0.00 C ATOM 412 CZ TYR A 649 17.531 -9.229 3.288 1.00 0.00 C ATOM 413 OH TYR A 649 16.345 -9.176 3.957 1.00 0.00 O ATOM 0 H TYR A 649 23.100 -10.088 2.925 1.00 0.00 H new ATOM 0 HA TYR A 649 21.245 -11.509 1.140 1.00 0.00 H new ATOM 0 HB2 TYR A 649 21.944 -8.610 1.597 1.00 0.00 H new ATOM 0 HB3 TYR A 649 21.111 -9.158 0.156 1.00 0.00 H new ATOM 0 HD1 TYR A 649 20.772 -9.786 3.878 1.00 0.00 H new ATOM 0 HD2 TYR A 649 18.813 -8.861 0.215 1.00 0.00 H new ATOM 0 HE1 TYR A 649 18.630 -9.696 5.042 1.00 0.00 H new ATOM 0 HE2 TYR A 649 16.667 -8.766 1.396 1.00 0.00 H new ATOM 0 HH TYR A 649 15.624 -8.963 3.328 1.00 0.00 H new ATOM 423 N GLY A 650 23.963 -9.981 0.108 1.00 0.00 N ATOM 424 CA GLY A 650 25.066 -10.137 -0.814 1.00 0.00 C ATOM 425 C GLY A 650 25.012 -9.152 -1.950 1.00 0.00 C ATOM 426 O GLY A 650 25.317 -7.984 -1.772 1.00 0.00 O ATOM 0 H GLY A 650 23.948 -9.098 0.619 1.00 0.00 H new ATOM 0 HA2 GLY A 650 26.006 -10.014 -0.275 1.00 0.00 H new ATOM 0 HA3 GLY A 650 25.059 -11.150 -1.216 1.00 0.00 H new ATOM 430 N HIS A 651 24.644 -9.621 -3.118 1.00 0.00 N ATOM 431 CA HIS A 651 24.538 -8.774 -4.284 1.00 0.00 C ATOM 432 C HIS A 651 23.288 -9.126 -5.089 1.00 0.00 C ATOM 433 O HIS A 651 22.906 -10.286 -5.154 1.00 0.00 O ATOM 434 CB HIS A 651 25.823 -8.868 -5.165 1.00 0.00 C ATOM 435 CG HIS A 651 25.790 -8.055 -6.423 1.00 0.00 C ATOM 436 ND1 HIS A 651 25.691 -6.688 -6.445 1.00 0.00 N ATOM 437 CD2 HIS A 651 25.858 -8.442 -7.710 1.00 0.00 C ATOM 438 CE1 HIS A 651 25.701 -6.282 -7.702 1.00 0.00 C ATOM 439 NE2 HIS A 651 25.806 -7.323 -8.480 1.00 0.00 N ATOM 0 H HIS A 651 24.410 -10.599 -3.288 1.00 0.00 H new ATOM 0 HA HIS A 651 24.446 -7.741 -3.949 1.00 0.00 H new ATOM 0 HB2 HIS A 651 26.678 -8.551 -4.568 1.00 0.00 H new ATOM 0 HB3 HIS A 651 25.988 -9.912 -5.430 1.00 0.00 H new ATOM 0 HD2 HIS A 651 25.939 -9.458 -8.067 1.00 0.00 H new ATOM 0 HE1 HIS A 651 25.633 -5.256 -8.031 1.00 0.00 H new ATOM 0 HE2 HIS A 651 25.843 -7.301 -9.499 1.00 0.00 H new ATOM 448 N SER A 652 22.629 -8.084 -5.613 1.00 0.00 N ATOM 449 CA SER A 652 21.476 -8.184 -6.503 1.00 0.00 C ATOM 450 C SER A 652 20.198 -8.626 -5.780 1.00 0.00 C ATOM 451 O SER A 652 19.183 -8.961 -6.394 1.00 0.00 O ATOM 452 CB SER A 652 21.810 -9.022 -7.728 1.00 0.00 C ATOM 453 OG SER A 652 22.922 -8.460 -8.397 1.00 0.00 O ATOM 0 H SER A 652 22.896 -7.119 -5.420 1.00 0.00 H new ATOM 0 HA SER A 652 21.247 -7.181 -6.862 1.00 0.00 H new ATOM 0 HB2 SER A 652 22.031 -10.047 -7.431 1.00 0.00 H new ATOM 0 HB3 SER A 652 20.952 -9.063 -8.399 1.00 0.00 H new ATOM 0 HG SER A 652 23.138 -9.001 -9.185 1.00 0.00 H new ATOM 459 N GLU A 653 20.244 -8.530 -4.482 1.00 0.00 N ATOM 460 CA GLU A 653 19.118 -8.818 -3.628 1.00 0.00 C ATOM 461 C GLU A 653 18.150 -7.661 -3.737 1.00 0.00 C ATOM 462 O GLU A 653 18.574 -6.524 -3.686 1.00 0.00 O ATOM 463 CB GLU A 653 19.622 -8.940 -2.212 1.00 0.00 C ATOM 464 CG GLU A 653 20.617 -10.060 -2.025 1.00 0.00 C ATOM 465 CD GLU A 653 19.983 -11.419 -2.076 1.00 0.00 C ATOM 466 OE1 GLU A 653 19.497 -11.888 -1.039 1.00 0.00 O ATOM 467 OE2 GLU A 653 19.973 -12.055 -3.145 1.00 0.00 O ATOM 0 H GLU A 653 21.081 -8.244 -3.974 1.00 0.00 H new ATOM 0 HA GLU A 653 18.620 -9.744 -3.916 1.00 0.00 H new ATOM 0 HB2 GLU A 653 20.086 -7.999 -1.917 1.00 0.00 H new ATOM 0 HB3 GLU A 653 18.775 -9.101 -1.545 1.00 0.00 H new ATOM 0 HG2 GLU A 653 21.382 -9.992 -2.798 1.00 0.00 H new ATOM 0 HG3 GLU A 653 21.121 -9.935 -1.066 1.00 0.00 H new ATOM 474 N VAL A 654 16.890 -7.937 -3.897 1.00 0.00 N ATOM 475 CA VAL A 654 15.911 -6.892 -4.121 1.00 0.00 C ATOM 476 C VAL A 654 14.744 -6.939 -3.128 1.00 0.00 C ATOM 477 O VAL A 654 14.201 -8.004 -2.825 1.00 0.00 O ATOM 478 CB VAL A 654 15.493 -6.772 -5.646 1.00 0.00 C ATOM 479 CG1 VAL A 654 15.427 -8.120 -6.339 1.00 0.00 C ATOM 480 CG2 VAL A 654 14.181 -6.014 -5.841 1.00 0.00 C ATOM 0 H VAL A 654 16.505 -8.881 -3.878 1.00 0.00 H new ATOM 0 HA VAL A 654 16.401 -5.944 -3.898 1.00 0.00 H new ATOM 0 HB VAL A 654 16.287 -6.190 -6.115 1.00 0.00 H new ATOM 0 HG11 VAL A 654 15.136 -7.980 -7.380 1.00 0.00 H new ATOM 0 HG12 VAL A 654 16.405 -8.599 -6.296 1.00 0.00 H new ATOM 0 HG13 VAL A 654 14.692 -8.751 -5.839 1.00 0.00 H new ATOM 0 HG21 VAL A 654 13.945 -5.963 -6.904 1.00 0.00 H new ATOM 0 HG22 VAL A 654 13.379 -6.533 -5.316 1.00 0.00 H new ATOM 0 HG23 VAL A 654 14.281 -5.004 -5.443 1.00 0.00 H new ATOM 490 N VAL A 655 14.400 -5.774 -2.601 1.00 0.00 N ATOM 491 CA VAL A 655 13.425 -5.617 -1.518 1.00 0.00 C ATOM 492 C VAL A 655 12.314 -4.643 -1.910 1.00 0.00 C ATOM 493 O VAL A 655 12.586 -3.641 -2.564 1.00 0.00 O ATOM 494 CB VAL A 655 14.164 -5.081 -0.261 1.00 0.00 C ATOM 495 CG1 VAL A 655 13.205 -4.668 0.825 1.00 0.00 C ATOM 496 CG2 VAL A 655 15.133 -6.121 0.266 1.00 0.00 C ATOM 0 H VAL A 655 14.796 -4.889 -2.917 1.00 0.00 H new ATOM 0 HA VAL A 655 12.967 -6.585 -1.312 1.00 0.00 H new ATOM 0 HB VAL A 655 14.719 -4.193 -0.565 1.00 0.00 H new ATOM 0 HG11 VAL A 655 13.765 -4.300 1.684 1.00 0.00 H new ATOM 0 HG12 VAL A 655 12.552 -3.879 0.453 1.00 0.00 H new ATOM 0 HG13 VAL A 655 12.603 -5.526 1.125 1.00 0.00 H new ATOM 0 HG21 VAL A 655 15.643 -5.730 1.147 1.00 0.00 H new ATOM 0 HG22 VAL A 655 14.586 -7.025 0.535 1.00 0.00 H new ATOM 0 HG23 VAL A 655 15.868 -6.357 -0.504 1.00 0.00 H new ATOM 506 N GLU A 656 11.071 -4.923 -1.474 1.00 0.00 N ATOM 507 CA GLU A 656 9.958 -4.085 -1.797 1.00 0.00 C ATOM 508 C GLU A 656 9.534 -3.226 -0.596 1.00 0.00 C ATOM 509 O GLU A 656 9.403 -3.711 0.549 1.00 0.00 O ATOM 510 CB GLU A 656 8.768 -4.901 -2.285 1.00 0.00 C ATOM 511 CG GLU A 656 7.693 -4.012 -2.881 1.00 0.00 C ATOM 512 CD GLU A 656 6.425 -4.714 -3.293 1.00 0.00 C ATOM 513 OE1 GLU A 656 6.403 -5.398 -4.312 1.00 0.00 O ATOM 514 OE2 GLU A 656 5.400 -4.540 -2.607 1.00 0.00 O ATOM 0 H GLU A 656 10.838 -5.731 -0.897 1.00 0.00 H new ATOM 0 HA GLU A 656 10.285 -3.426 -2.602 1.00 0.00 H new ATOM 0 HB2 GLU A 656 9.101 -5.622 -3.032 1.00 0.00 H new ATOM 0 HB3 GLU A 656 8.351 -5.471 -1.455 1.00 0.00 H new ATOM 0 HG2 GLU A 656 7.440 -3.240 -2.154 1.00 0.00 H new ATOM 0 HG3 GLU A 656 8.107 -3.506 -3.753 1.00 0.00 H new ATOM 521 N TYR A 657 9.332 -1.977 -0.872 1.00 0.00 N ATOM 522 CA TYR A 657 8.898 -0.990 0.078 1.00 0.00 C ATOM 523 C TYR A 657 7.430 -0.621 -0.132 1.00 0.00 C ATOM 524 O TYR A 657 6.825 -0.992 -1.144 1.00 0.00 O ATOM 525 CB TYR A 657 9.777 0.243 -0.065 1.00 0.00 C ATOM 526 CG TYR A 657 11.127 0.092 0.587 1.00 0.00 C ATOM 527 CD1 TYR A 657 12.156 -0.579 -0.039 1.00 0.00 C ATOM 528 CD2 TYR A 657 11.356 0.594 1.851 1.00 0.00 C ATOM 529 CE1 TYR A 657 13.361 -0.743 0.578 1.00 0.00 C ATOM 530 CE2 TYR A 657 12.566 0.440 2.469 1.00 0.00 C ATOM 531 CZ TYR A 657 13.561 -0.234 1.827 1.00 0.00 C ATOM 532 OH TYR A 657 14.764 -0.403 2.429 1.00 0.00 O ATOM 0 H TYR A 657 9.470 -1.595 -1.808 1.00 0.00 H new ATOM 0 HA TYR A 657 8.989 -1.401 1.083 1.00 0.00 H new ATOM 0 HB2 TYR A 657 9.915 0.461 -1.124 1.00 0.00 H new ATOM 0 HB3 TYR A 657 9.264 1.099 0.373 1.00 0.00 H new ATOM 0 HD1 TYR A 657 12.006 -0.980 -1.031 1.00 0.00 H new ATOM 0 HD2 TYR A 657 10.563 1.119 2.363 1.00 0.00 H new ATOM 0 HE1 TYR A 657 14.156 -1.276 0.078 1.00 0.00 H new ATOM 0 HE2 TYR A 657 12.731 0.848 3.455 1.00 0.00 H new ATOM 0 HH TYR A 657 14.628 -0.667 3.363 1.00 0.00 H new ATOM 542 N TYR A 658 6.857 0.060 0.841 1.00 0.00 N ATOM 543 CA TYR A 658 5.497 0.543 0.768 1.00 0.00 C ATOM 544 C TYR A 658 5.437 1.946 1.348 1.00 0.00 C ATOM 545 O TYR A 658 6.182 2.257 2.290 1.00 0.00 O ATOM 546 CB TYR A 658 4.503 -0.383 1.531 1.00 0.00 C ATOM 547 CG TYR A 658 4.680 -0.490 3.050 1.00 0.00 C ATOM 548 CD1 TYR A 658 4.074 0.427 3.916 1.00 0.00 C ATOM 549 CD2 TYR A 658 5.419 -1.522 3.613 1.00 0.00 C ATOM 550 CE1 TYR A 658 4.209 0.312 5.289 1.00 0.00 C ATOM 551 CE2 TYR A 658 5.560 -1.642 4.982 1.00 0.00 C ATOM 552 CZ TYR A 658 4.957 -0.728 5.817 1.00 0.00 C ATOM 553 OH TYR A 658 5.100 -0.854 7.194 1.00 0.00 O ATOM 0 H TYR A 658 7.330 0.295 1.713 1.00 0.00 H new ATOM 0 HA TYR A 658 5.197 0.549 -0.280 1.00 0.00 H new ATOM 0 HB2 TYR A 658 3.491 -0.031 1.332 1.00 0.00 H new ATOM 0 HB3 TYR A 658 4.581 -1.385 1.109 1.00 0.00 H new ATOM 0 HD1 TYR A 658 3.491 1.238 3.506 1.00 0.00 H new ATOM 0 HD2 TYR A 658 5.893 -2.246 2.967 1.00 0.00 H new ATOM 0 HE1 TYR A 658 3.735 1.028 5.944 1.00 0.00 H new ATOM 0 HE2 TYR A 658 6.142 -2.451 5.397 1.00 0.00 H new ATOM 0 HH TYR A 658 5.654 -1.637 7.395 1.00 0.00 H new ATOM 563 N CYS A 659 4.612 2.788 0.792 1.00 0.00 N ATOM 564 CA CYS A 659 4.397 4.100 1.365 1.00 0.00 C ATOM 565 C CYS A 659 3.092 4.132 2.114 1.00 0.00 C ATOM 566 O CYS A 659 2.159 3.374 1.809 1.00 0.00 O ATOM 567 CB CYS A 659 4.478 5.250 0.343 1.00 0.00 C ATOM 568 SG CYS A 659 6.169 5.691 -0.252 1.00 0.00 S ATOM 0 H CYS A 659 4.076 2.597 -0.054 1.00 0.00 H new ATOM 0 HA CYS A 659 5.220 4.271 2.059 1.00 0.00 H new ATOM 0 HB2 CYS A 659 3.869 4.985 -0.521 1.00 0.00 H new ATOM 0 HB3 CYS A 659 4.029 6.137 0.789 1.00 0.00 H new ATOM 573 N ASN A 660 3.073 4.977 3.108 1.00 0.00 N ATOM 574 CA ASN A 660 1.971 5.191 4.036 1.00 0.00 C ATOM 575 C ASN A 660 0.625 5.471 3.375 1.00 0.00 C ATOM 576 O ASN A 660 0.563 5.936 2.258 1.00 0.00 O ATOM 577 CB ASN A 660 2.372 6.353 4.903 1.00 0.00 C ATOM 578 CG ASN A 660 3.555 5.990 5.724 1.00 0.00 C ATOM 579 OD1 ASN A 660 4.657 6.110 5.250 1.00 0.00 O ATOM 580 ND2 ASN A 660 3.361 5.582 6.935 1.00 0.00 N ATOM 0 H ASN A 660 3.872 5.577 3.313 1.00 0.00 H new ATOM 0 HA ASN A 660 1.811 4.271 4.598 1.00 0.00 H new ATOM 0 HB2 ASN A 660 2.602 7.219 4.282 1.00 0.00 H new ATOM 0 HB3 ASN A 660 1.543 6.637 5.551 1.00 0.00 H new ATOM 0 HD21 ASN A 660 4.157 5.348 7.528 1.00 0.00 H new ATOM 0 HD22 ASN A 660 2.412 5.494 7.298 1.00 0.00 H new ATOM 587 N PRO A 661 -0.479 5.265 4.129 1.00 0.00 N ATOM 588 CA PRO A 661 -1.878 5.449 3.632 1.00 0.00 C ATOM 589 C PRO A 661 -2.247 6.926 3.339 1.00 0.00 C ATOM 590 O PRO A 661 -3.400 7.267 3.111 1.00 0.00 O ATOM 591 CB PRO A 661 -2.719 4.915 4.795 1.00 0.00 C ATOM 592 CG PRO A 661 -1.862 5.096 5.996 1.00 0.00 C ATOM 593 CD PRO A 661 -0.469 4.808 5.537 1.00 0.00 C ATOM 0 HA PRO A 661 -2.034 4.942 2.680 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -3.656 5.464 4.891 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -2.978 3.866 4.648 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -1.945 6.110 6.388 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -2.160 4.419 6.797 1.00 0.00 H new ATOM 0 HD2 PRO A 661 0.270 5.346 6.130 1.00 0.00 H new ATOM 0 HD3 PRO A 661 -0.230 3.747 5.615 1.00 0.00 H new ATOM 601 N ARG A 662 -1.280 7.782 3.423 1.00 0.00 N ATOM 602 CA ARG A 662 -1.450 9.187 3.081 1.00 0.00 C ATOM 603 C ARG A 662 -0.246 9.729 2.353 1.00 0.00 C ATOM 604 O ARG A 662 -0.205 10.887 1.950 1.00 0.00 O ATOM 605 CB ARG A 662 -1.722 9.991 4.314 1.00 0.00 C ATOM 606 CG ARG A 662 -0.759 9.749 5.428 1.00 0.00 C ATOM 607 CD ARG A 662 -1.210 10.512 6.600 1.00 0.00 C ATOM 608 NE ARG A 662 -0.504 10.163 7.820 1.00 0.00 N ATOM 609 CZ ARG A 662 -1.011 10.315 9.047 1.00 0.00 C ATOM 610 NH1 ARG A 662 -2.190 10.928 9.213 1.00 0.00 N ATOM 611 NH2 ARG A 662 -0.329 9.888 10.105 1.00 0.00 N ATOM 0 H ARG A 662 -0.338 7.540 3.731 1.00 0.00 H new ATOM 0 HA ARG A 662 -2.305 9.267 2.410 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -1.702 11.050 4.055 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -2.729 9.767 4.665 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -0.709 8.686 5.663 1.00 0.00 H new ATOM 0 HG3 ARG A 662 0.245 10.058 5.137 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -1.079 11.576 6.404 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -2.277 10.344 6.745 1.00 0.00 H new ATOM 0 HE ARG A 662 0.437 9.778 7.735 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -2.701 11.279 8.403 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -2.577 11.044 10.150 1.00 0.00 H new ATOM 0 HH21 ARG A 662 0.581 9.445 9.980 1.00 0.00 H new ATOM 0 HH22 ARG A 662 -0.716 10.004 11.042 1.00 0.00 H new ATOM 625 N PHE A 663 0.729 8.894 2.196 1.00 0.00 N ATOM 626 CA PHE A 663 1.914 9.257 1.504 1.00 0.00 C ATOM 627 C PHE A 663 2.073 8.431 0.282 1.00 0.00 C ATOM 628 O PHE A 663 2.156 7.221 0.356 1.00 0.00 O ATOM 629 CB PHE A 663 3.157 9.148 2.345 1.00 0.00 C ATOM 630 CG PHE A 663 3.347 10.248 3.334 1.00 0.00 C ATOM 631 CD1 PHE A 663 2.681 10.254 4.544 1.00 0.00 C ATOM 632 CD2 PHE A 663 4.218 11.278 3.049 1.00 0.00 C ATOM 633 CE1 PHE A 663 2.882 11.272 5.454 1.00 0.00 C ATOM 634 CE2 PHE A 663 4.424 12.297 3.945 1.00 0.00 C ATOM 635 CZ PHE A 663 3.756 12.296 5.154 1.00 0.00 C ATOM 0 H PHE A 663 0.722 7.937 2.548 1.00 0.00 H new ATOM 0 HA PHE A 663 1.797 10.308 1.240 1.00 0.00 H new ATOM 0 HB2 PHE A 663 3.133 8.199 2.880 1.00 0.00 H new ATOM 0 HB3 PHE A 663 4.023 9.120 1.684 1.00 0.00 H new ATOM 0 HD1 PHE A 663 1.996 9.454 4.781 1.00 0.00 H new ATOM 0 HD2 PHE A 663 4.746 11.283 2.107 1.00 0.00 H new ATOM 0 HE1 PHE A 663 2.357 11.267 6.398 1.00 0.00 H new ATOM 0 HE2 PHE A 663 5.107 13.098 3.705 1.00 0.00 H new ATOM 0 HZ PHE A 663 3.918 13.095 5.863 1.00 0.00 H new ATOM 645 N LEU A 664 2.165 9.081 -0.815 1.00 0.00 N ATOM 646 CA LEU A 664 2.247 8.413 -2.069 1.00 0.00 C ATOM 647 C LEU A 664 3.655 8.067 -2.353 1.00 0.00 C ATOM 648 O LEU A 664 4.577 8.833 -2.037 1.00 0.00 O ATOM 649 CB LEU A 664 1.753 9.283 -3.216 1.00 0.00 C ATOM 650 CG LEU A 664 0.478 10.048 -3.003 1.00 0.00 C ATOM 651 CD1 LEU A 664 -0.018 10.637 -4.307 1.00 0.00 C ATOM 652 CD2 LEU A 664 -0.571 9.217 -2.348 1.00 0.00 C ATOM 0 H LEU A 664 2.186 10.099 -0.876 1.00 0.00 H new ATOM 0 HA LEU A 664 1.619 7.525 -1.998 1.00 0.00 H new ATOM 0 HB2 LEU A 664 2.539 9.998 -3.459 1.00 0.00 H new ATOM 0 HB3 LEU A 664 1.621 8.645 -4.090 1.00 0.00 H new ATOM 0 HG LEU A 664 0.699 10.869 -2.321 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -0.942 11.187 -4.130 1.00 0.00 H new ATOM 0 HD12 LEU A 664 0.735 11.314 -4.710 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -0.204 9.835 -5.021 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -1.475 9.811 -2.214 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -0.794 8.353 -2.974 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -0.212 8.878 -1.376 1.00 0.00 H new ATOM 664 N MET A 665 3.826 6.946 -2.915 1.00 0.00 N ATOM 665 CA MET A 665 5.094 6.510 -3.358 1.00 0.00 C ATOM 666 C MET A 665 5.427 7.200 -4.661 1.00 0.00 C ATOM 667 O MET A 665 4.785 6.969 -5.691 1.00 0.00 O ATOM 668 CB MET A 665 5.070 5.018 -3.491 1.00 0.00 C ATOM 669 CG MET A 665 6.299 4.416 -4.074 1.00 0.00 C ATOM 670 SD MET A 665 6.336 2.665 -3.722 1.00 0.00 S ATOM 671 CE MET A 665 6.629 2.710 -1.958 1.00 0.00 C ATOM 0 H MET A 665 3.073 6.281 -3.089 1.00 0.00 H new ATOM 0 HA MET A 665 5.874 6.769 -2.642 1.00 0.00 H new ATOM 0 HB2 MET A 665 4.904 4.584 -2.505 1.00 0.00 H new ATOM 0 HB3 MET A 665 4.218 4.738 -4.110 1.00 0.00 H new ATOM 0 HG2 MET A 665 6.321 4.581 -5.151 1.00 0.00 H new ATOM 0 HG3 MET A 665 7.184 4.899 -3.660 1.00 0.00 H new ATOM 0 HE1 MET A 665 7.044 1.756 -1.634 1.00 0.00 H new ATOM 0 HE2 MET A 665 7.333 3.510 -1.726 1.00 0.00 H new ATOM 0 HE3 MET A 665 5.689 2.892 -1.438 1.00 0.00 H new ATOM 681 N LYS A 666 6.384 8.080 -4.604 1.00 0.00 N ATOM 682 CA LYS A 666 6.729 8.876 -5.750 1.00 0.00 C ATOM 683 C LYS A 666 7.940 8.290 -6.442 1.00 0.00 C ATOM 684 O LYS A 666 8.007 8.245 -7.673 1.00 0.00 O ATOM 685 CB LYS A 666 6.991 10.328 -5.332 1.00 0.00 C ATOM 686 CG LYS A 666 7.035 11.318 -6.485 1.00 0.00 C ATOM 687 CD LYS A 666 7.393 12.717 -6.011 1.00 0.00 C ATOM 688 CE LYS A 666 7.134 13.768 -7.089 1.00 0.00 C ATOM 689 NZ LYS A 666 7.926 13.561 -8.325 1.00 0.00 N ATOM 0 H LYS A 666 6.943 8.267 -3.772 1.00 0.00 H new ATOM 0 HA LYS A 666 5.893 8.869 -6.450 1.00 0.00 H new ATOM 0 HB2 LYS A 666 6.214 10.638 -4.633 1.00 0.00 H new ATOM 0 HB3 LYS A 666 7.938 10.373 -4.795 1.00 0.00 H new ATOM 0 HG2 LYS A 666 7.766 10.986 -7.222 1.00 0.00 H new ATOM 0 HG3 LYS A 666 6.066 11.339 -6.983 1.00 0.00 H new ATOM 0 HD2 LYS A 666 6.811 12.959 -5.121 1.00 0.00 H new ATOM 0 HD3 LYS A 666 8.444 12.745 -5.722 1.00 0.00 H new ATOM 0 HE2 LYS A 666 6.074 13.763 -7.342 1.00 0.00 H new ATOM 0 HE3 LYS A 666 7.360 14.754 -6.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 7.700 14.309 -9.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 8.940 13.595 -8.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 7.694 12.634 -8.735 1.00 0.00 H new ATOM 703 N GLY A 667 8.877 7.816 -5.639 1.00 0.00 N ATOM 704 CA GLY A 667 10.092 7.234 -6.165 1.00 0.00 C ATOM 705 C GLY A 667 9.883 5.814 -6.612 1.00 0.00 C ATOM 706 O GLY A 667 8.765 5.439 -6.992 1.00 0.00 O ATOM 0 H GLY A 667 8.816 7.824 -4.621 1.00 0.00 H new ATOM 0 HA2 GLY A 667 10.447 7.831 -7.005 1.00 0.00 H new ATOM 0 HA3 GLY A 667 10.869 7.264 -5.402 1.00 0.00 H new ATOM 710 N PRO A 668 10.939 4.995 -6.605 1.00 0.00 N ATOM 711 CA PRO A 668 10.819 3.564 -6.889 1.00 0.00 C ATOM 712 C PRO A 668 10.089 2.849 -5.732 1.00 0.00 C ATOM 713 O PRO A 668 9.257 3.439 -5.049 1.00 0.00 O ATOM 714 CB PRO A 668 12.286 3.103 -6.979 1.00 0.00 C ATOM 715 CG PRO A 668 13.054 4.100 -6.192 1.00 0.00 C ATOM 716 CD PRO A 668 12.341 5.402 -6.374 1.00 0.00 C ATOM 0 HA PRO A 668 10.247 3.345 -7.791 1.00 0.00 H new ATOM 0 HB2 PRO A 668 12.410 2.100 -6.572 1.00 0.00 H new ATOM 0 HB3 PRO A 668 12.626 3.071 -8.014 1.00 0.00 H new ATOM 0 HG2 PRO A 668 13.094 3.820 -5.139 1.00 0.00 H new ATOM 0 HG3 PRO A 668 14.084 4.166 -6.543 1.00 0.00 H new ATOM 0 HD2 PRO A 668 12.435 6.038 -5.494 1.00 0.00 H new ATOM 0 HD3 PRO A 668 12.740 5.964 -7.218 1.00 0.00 H new ATOM 724 N ASN A 669 10.419 1.619 -5.497 1.00 0.00 N ATOM 725 CA ASN A 669 9.771 0.849 -4.449 1.00 0.00 C ATOM 726 C ASN A 669 10.552 -0.404 -4.171 1.00 0.00 C ATOM 727 O ASN A 669 10.506 -0.934 -3.079 1.00 0.00 O ATOM 728 CB ASN A 669 8.310 0.507 -4.807 1.00 0.00 C ATOM 729 CG ASN A 669 8.121 -0.657 -5.734 1.00 0.00 C ATOM 730 OD1 ASN A 669 8.211 -0.539 -6.954 1.00 0.00 O ATOM 731 ND2 ASN A 669 7.791 -1.775 -5.165 1.00 0.00 N ATOM 0 H ASN A 669 11.137 1.111 -6.013 1.00 0.00 H new ATOM 0 HA ASN A 669 9.749 1.464 -3.550 1.00 0.00 H new ATOM 0 HB2 ASN A 669 7.767 0.304 -3.884 1.00 0.00 H new ATOM 0 HB3 ASN A 669 7.851 1.386 -5.260 1.00 0.00 H new ATOM 0 HD21 ASN A 669 7.595 -2.598 -5.734 1.00 0.00 H new ATOM 0 HD22 ASN A 669 7.728 -1.831 -4.148 1.00 0.00 H new ATOM 738 N LYS A 670 11.243 -0.895 -5.165 1.00 0.00 N ATOM 739 CA LYS A 670 12.085 -2.036 -4.982 1.00 0.00 C ATOM 740 C LYS A 670 13.518 -1.648 -5.136 1.00 0.00 C ATOM 741 O LYS A 670 13.912 -1.064 -6.152 1.00 0.00 O ATOM 742 CB LYS A 670 11.723 -3.176 -5.922 1.00 0.00 C ATOM 743 CG LYS A 670 10.426 -3.869 -5.573 1.00 0.00 C ATOM 744 CD LYS A 670 10.086 -4.933 -6.606 1.00 0.00 C ATOM 745 CE LYS A 670 8.781 -5.631 -6.286 1.00 0.00 C ATOM 746 NZ LYS A 670 8.451 -6.697 -7.260 1.00 0.00 N ATOM 0 H LYS A 670 11.236 -0.517 -6.112 1.00 0.00 H new ATOM 0 HA LYS A 670 11.926 -2.404 -3.969 1.00 0.00 H new ATOM 0 HB2 LYS A 670 11.654 -2.788 -6.938 1.00 0.00 H new ATOM 0 HB3 LYS A 670 12.529 -3.910 -5.915 1.00 0.00 H new ATOM 0 HG2 LYS A 670 10.507 -4.326 -4.587 1.00 0.00 H new ATOM 0 HG3 LYS A 670 9.620 -3.137 -5.520 1.00 0.00 H new ATOM 0 HD2 LYS A 670 10.020 -4.474 -7.592 1.00 0.00 H new ATOM 0 HD3 LYS A 670 10.890 -5.668 -6.649 1.00 0.00 H new ATOM 0 HE2 LYS A 670 8.840 -6.063 -5.287 1.00 0.00 H new ATOM 0 HE3 LYS A 670 7.975 -4.897 -6.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 7.549 -7.142 -6.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 8.367 -6.284 -8.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 9.205 -7.414 -7.259 1.00 0.00 H new ATOM 760 N ILE A 671 14.283 -1.935 -4.131 1.00 0.00 N ATOM 761 CA ILE A 671 15.677 -1.610 -4.131 1.00 0.00 C ATOM 762 C ILE A 671 16.488 -2.866 -4.255 1.00 0.00 C ATOM 763 O ILE A 671 15.976 -3.952 -4.046 1.00 0.00 O ATOM 764 CB ILE A 671 16.110 -0.855 -2.862 1.00 0.00 C ATOM 765 CG1 ILE A 671 15.948 -1.735 -1.622 1.00 0.00 C ATOM 766 CG2 ILE A 671 15.297 0.418 -2.728 1.00 0.00 C ATOM 767 CD1 ILE A 671 16.535 -1.131 -0.374 1.00 0.00 C ATOM 0 H ILE A 671 13.959 -2.403 -3.284 1.00 0.00 H new ATOM 0 HA ILE A 671 15.851 -0.952 -4.982 1.00 0.00 H new ATOM 0 HB ILE A 671 17.165 -0.596 -2.947 1.00 0.00 H new ATOM 0 HG12 ILE A 671 14.887 -1.927 -1.459 1.00 0.00 H new ATOM 0 HG13 ILE A 671 16.422 -2.699 -1.807 1.00 0.00 H new ATOM 0 HG21 ILE A 671 15.604 0.953 -1.829 1.00 0.00 H new ATOM 0 HG22 ILE A 671 15.464 1.050 -3.601 1.00 0.00 H new ATOM 0 HG23 ILE A 671 14.238 0.168 -2.658 1.00 0.00 H new ATOM 0 HD11 ILE A 671 16.383 -1.810 0.465 1.00 0.00 H new ATOM 0 HD12 ILE A 671 17.603 -0.965 -0.518 1.00 0.00 H new ATOM 0 HD13 ILE A 671 16.045 -0.180 -0.165 1.00 0.00 H new ATOM 779 N GLN A 672 17.737 -2.712 -4.532 1.00 0.00 N ATOM 780 CA GLN A 672 18.621 -3.802 -4.759 1.00 0.00 C ATOM 781 C GLN A 672 19.937 -3.563 -4.082 1.00 0.00 C ATOM 782 O GLN A 672 20.401 -2.438 -4.008 1.00 0.00 O ATOM 783 CB GLN A 672 18.807 -4.047 -6.263 1.00 0.00 C ATOM 784 CG GLN A 672 19.943 -4.988 -6.605 1.00 0.00 C ATOM 785 CD GLN A 672 19.965 -5.370 -8.047 1.00 0.00 C ATOM 786 OE1 GLN A 672 20.593 -4.718 -8.872 1.00 0.00 O ATOM 787 NE2 GLN A 672 19.300 -6.447 -8.344 1.00 0.00 N ATOM 0 H GLN A 672 18.184 -1.798 -4.609 1.00 0.00 H new ATOM 0 HA GLN A 672 18.179 -4.700 -4.327 1.00 0.00 H new ATOM 0 HB2 GLN A 672 17.881 -4.451 -6.671 1.00 0.00 H new ATOM 0 HB3 GLN A 672 18.982 -3.091 -6.756 1.00 0.00 H new ATOM 0 HG2 GLN A 672 20.890 -4.516 -6.345 1.00 0.00 H new ATOM 0 HG3 GLN A 672 19.858 -5.889 -5.997 1.00 0.00 H new ATOM 0 HE21 GLN A 672 18.794 -6.951 -7.616 1.00 0.00 H new ATOM 0 HE22 GLN A 672 19.284 -6.788 -9.305 1.00 0.00 H new ATOM 796 N CYS A 673 20.497 -4.610 -3.534 1.00 0.00 N ATOM 797 CA CYS A 673 21.782 -4.533 -2.931 1.00 0.00 C ATOM 798 C CYS A 673 22.820 -4.579 -4.017 1.00 0.00 C ATOM 799 O CYS A 673 23.191 -5.653 -4.540 1.00 0.00 O ATOM 800 CB CYS A 673 22.012 -5.643 -1.906 1.00 0.00 C ATOM 801 SG CYS A 673 23.555 -5.449 -0.958 1.00 0.00 S ATOM 0 H CYS A 673 20.068 -5.534 -3.498 1.00 0.00 H new ATOM 0 HA CYS A 673 21.855 -3.595 -2.380 1.00 0.00 H new ATOM 0 HB2 CYS A 673 21.170 -5.667 -1.214 1.00 0.00 H new ATOM 0 HB3 CYS A 673 22.029 -6.604 -2.421 1.00 0.00 H new ATOM 806 N VAL A 674 23.198 -3.429 -4.424 1.00 0.00 N ATOM 807 CA VAL A 674 24.194 -3.233 -5.402 1.00 0.00 C ATOM 808 C VAL A 674 25.545 -3.474 -4.758 1.00 0.00 C ATOM 809 O VAL A 674 25.630 -3.558 -3.531 1.00 0.00 O ATOM 810 CB VAL A 674 24.000 -1.811 -6.020 1.00 0.00 C ATOM 811 CG1 VAL A 674 25.298 -1.126 -6.435 1.00 0.00 C ATOM 812 CG2 VAL A 674 23.075 -1.956 -7.216 1.00 0.00 C ATOM 0 H VAL A 674 22.803 -2.559 -4.068 1.00 0.00 H new ATOM 0 HA VAL A 674 24.125 -3.936 -6.232 1.00 0.00 H new ATOM 0 HB VAL A 674 23.576 -1.166 -5.250 1.00 0.00 H new ATOM 0 HG11 VAL A 674 25.074 -0.145 -6.854 1.00 0.00 H new ATOM 0 HG12 VAL A 674 25.943 -1.010 -5.564 1.00 0.00 H new ATOM 0 HG13 VAL A 674 25.806 -1.733 -7.184 1.00 0.00 H new ATOM 0 HG21 VAL A 674 22.917 -0.980 -7.674 1.00 0.00 H new ATOM 0 HG22 VAL A 674 23.525 -2.630 -7.945 1.00 0.00 H new ATOM 0 HG23 VAL A 674 22.118 -2.363 -6.889 1.00 0.00 H new ATOM 822 N ASP A 675 26.575 -3.677 -5.551 1.00 0.00 N ATOM 823 CA ASP A 675 27.875 -3.938 -4.993 1.00 0.00 C ATOM 824 C ASP A 675 28.461 -2.690 -4.330 1.00 0.00 C ATOM 825 O ASP A 675 29.081 -1.839 -4.949 1.00 0.00 O ATOM 826 CB ASP A 675 28.852 -4.649 -5.976 1.00 0.00 C ATOM 827 CG ASP A 675 29.334 -3.826 -7.159 1.00 0.00 C ATOM 828 OD1 ASP A 675 28.588 -3.666 -8.142 1.00 0.00 O ATOM 829 OD2 ASP A 675 30.481 -3.402 -7.155 1.00 0.00 O ATOM 0 H ASP A 675 26.535 -3.666 -6.570 1.00 0.00 H new ATOM 0 HA ASP A 675 27.731 -4.671 -4.199 1.00 0.00 H new ATOM 0 HB2 ASP A 675 29.724 -4.980 -5.412 1.00 0.00 H new ATOM 0 HB3 ASP A 675 28.361 -5.544 -6.359 1.00 0.00 H new ATOM 834 N GLY A 676 28.089 -2.551 -3.087 1.00 0.00 N ATOM 835 CA GLY A 676 28.599 -1.572 -2.215 1.00 0.00 C ATOM 836 C GLY A 676 27.553 -1.175 -1.203 1.00 0.00 C ATOM 837 O GLY A 676 27.808 -1.172 0.002 1.00 0.00 O ATOM 0 H GLY A 676 27.390 -3.153 -2.651 1.00 0.00 H new ATOM 0 HA2 GLY A 676 29.482 -1.955 -1.704 1.00 0.00 H new ATOM 0 HA3 GLY A 676 28.914 -0.697 -2.784 1.00 0.00 H new ATOM 841 N GLU A 677 26.360 -0.905 -1.689 1.00 0.00 N ATOM 842 CA GLU A 677 25.248 -0.475 -0.864 1.00 0.00 C ATOM 843 C GLU A 677 23.958 -0.767 -1.600 1.00 0.00 C ATOM 844 O GLU A 677 23.985 -1.271 -2.725 1.00 0.00 O ATOM 845 CB GLU A 677 25.349 1.035 -0.568 1.00 0.00 C ATOM 846 CG GLU A 677 25.325 1.918 -1.814 1.00 0.00 C ATOM 847 CD GLU A 677 25.480 3.378 -1.501 1.00 0.00 C ATOM 848 OE1 GLU A 677 24.498 4.018 -1.039 1.00 0.00 O ATOM 849 OE2 GLU A 677 26.592 3.920 -1.698 1.00 0.00 O ATOM 0 H GLU A 677 26.131 -0.978 -2.680 1.00 0.00 H new ATOM 0 HA GLU A 677 25.270 -1.013 0.084 1.00 0.00 H new ATOM 0 HB2 GLU A 677 24.524 1.322 0.084 1.00 0.00 H new ATOM 0 HB3 GLU A 677 26.271 1.226 -0.018 1.00 0.00 H new ATOM 0 HG2 GLU A 677 26.125 1.609 -2.487 1.00 0.00 H new ATOM 0 HG3 GLU A 677 24.385 1.763 -2.344 1.00 0.00 H new ATOM 856 N TRP A 678 22.848 -0.436 -0.997 1.00 0.00 N ATOM 857 CA TRP A 678 21.570 -0.623 -1.634 1.00 0.00 C ATOM 858 C TRP A 678 21.342 0.496 -2.641 1.00 0.00 C ATOM 859 O TRP A 678 22.065 1.493 -2.643 1.00 0.00 O ATOM 860 CB TRP A 678 20.429 -0.672 -0.605 1.00 0.00 C ATOM 861 CG TRP A 678 20.450 -1.885 0.287 1.00 0.00 C ATOM 862 CD1 TRP A 678 21.126 -2.050 1.463 1.00 0.00 C ATOM 863 CD2 TRP A 678 19.746 -3.097 0.060 1.00 0.00 C ATOM 864 NE1 TRP A 678 20.873 -3.303 1.972 1.00 0.00 N ATOM 865 CE2 TRP A 678 20.030 -3.964 1.123 1.00 0.00 C ATOM 866 CE3 TRP A 678 18.900 -3.525 -0.946 1.00 0.00 C ATOM 867 CZ2 TRP A 678 19.490 -5.247 1.198 1.00 0.00 C ATOM 868 CZ3 TRP A 678 18.366 -4.778 -0.887 1.00 0.00 C ATOM 869 CH2 TRP A 678 18.659 -5.636 0.180 1.00 0.00 C ATOM 0 H TRP A 678 22.802 -0.033 -0.061 1.00 0.00 H new ATOM 0 HA TRP A 678 21.575 -1.582 -2.152 1.00 0.00 H new ATOM 0 HB2 TRP A 678 20.477 0.222 0.016 1.00 0.00 H new ATOM 0 HB3 TRP A 678 19.477 -0.641 -1.134 1.00 0.00 H new ATOM 0 HD1 TRP A 678 21.763 -1.309 1.923 1.00 0.00 H new ATOM 0 HE1 TRP A 678 21.253 -3.678 2.841 1.00 0.00 H new ATOM 0 HE3 TRP A 678 18.664 -2.871 -1.773 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 19.717 -5.906 2.023 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 17.708 -5.114 -1.675 1.00 0.00 H new ATOM 0 HH2 TRP A 678 18.222 -6.623 0.201 1.00 0.00 H new ATOM 880 N THR A 679 20.369 0.338 -3.486 1.00 0.00 N ATOM 881 CA THR A 679 20.072 1.317 -4.497 1.00 0.00 C ATOM 882 C THR A 679 19.339 2.515 -3.916 1.00 0.00 C ATOM 883 O THR A 679 19.159 2.624 -2.684 1.00 0.00 O ATOM 884 CB THR A 679 19.266 0.691 -5.645 1.00 0.00 C ATOM 885 OG1 THR A 679 18.168 -0.042 -5.106 1.00 0.00 O ATOM 886 CG2 THR A 679 20.122 -0.234 -6.485 1.00 0.00 C ATOM 0 H THR A 679 19.754 -0.476 -3.497 1.00 0.00 H new ATOM 0 HA THR A 679 21.021 1.673 -4.898 1.00 0.00 H new ATOM 0 HB THR A 679 18.907 1.496 -6.286 1.00 0.00 H new ATOM 0 HG1 THR A 679 17.444 0.576 -4.875 1.00 0.00 H new ATOM 0 HG21 THR A 679 19.519 -0.659 -7.288 1.00 0.00 H new ATOM 0 HG22 THR A 679 20.952 0.328 -6.913 1.00 0.00 H new ATOM 0 HG23 THR A 679 20.511 -1.037 -5.860 1.00 0.00 H new ATOM 894 N THR A 680 18.938 3.407 -4.777 1.00 0.00 N ATOM 895 CA THR A 680 18.286 4.596 -4.369 1.00 0.00 C ATOM 896 C THR A 680 16.901 4.307 -3.838 1.00 0.00 C ATOM 897 O THR A 680 16.053 3.711 -4.513 1.00 0.00 O ATOM 898 CB THR A 680 18.248 5.613 -5.511 1.00 0.00 C ATOM 899 OG1 THR A 680 19.590 5.791 -6.013 1.00 0.00 O ATOM 900 CG2 THR A 680 17.721 6.946 -5.018 1.00 0.00 C ATOM 0 H THR A 680 19.060 3.319 -5.786 1.00 0.00 H new ATOM 0 HA THR A 680 18.861 5.033 -3.553 1.00 0.00 H new ATOM 0 HB THR A 680 17.589 5.246 -6.298 1.00 0.00 H new ATOM 0 HG1 THR A 680 19.581 6.440 -6.748 1.00 0.00 H new ATOM 0 HG21 THR A 680 17.701 7.657 -5.844 1.00 0.00 H new ATOM 0 HG22 THR A 680 16.712 6.816 -4.626 1.00 0.00 H new ATOM 0 HG23 THR A 680 18.370 7.325 -4.229 1.00 0.00 H new ATOM 908 N LEU A 681 16.729 4.674 -2.607 1.00 0.00 N ATOM 909 CA LEU A 681 15.491 4.521 -1.907 1.00 0.00 C ATOM 910 C LEU A 681 14.394 5.408 -2.480 1.00 0.00 C ATOM 911 O LEU A 681 14.665 6.503 -3.008 1.00 0.00 O ATOM 912 CB LEU A 681 15.693 4.816 -0.439 1.00 0.00 C ATOM 913 CG LEU A 681 16.679 3.903 0.260 1.00 0.00 C ATOM 914 CD1 LEU A 681 16.771 4.256 1.707 1.00 0.00 C ATOM 915 CD2 LEU A 681 16.275 2.453 0.082 1.00 0.00 C ATOM 0 H LEU A 681 17.466 5.100 -2.045 1.00 0.00 H new ATOM 0 HA LEU A 681 15.166 3.488 -2.031 1.00 0.00 H new ATOM 0 HB2 LEU A 681 16.034 5.846 -0.333 1.00 0.00 H new ATOM 0 HB3 LEU A 681 14.731 4.745 0.068 1.00 0.00 H new ATOM 0 HG LEU A 681 17.663 4.038 -0.189 1.00 0.00 H new ATOM 0 HD11 LEU A 681 17.483 3.593 2.199 1.00 0.00 H new ATOM 0 HD12 LEU A 681 17.106 5.288 1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 681 15.791 4.145 2.172 1.00 0.00 H new ATOM 0 HD21 LEU A 681 16.994 1.810 0.590 1.00 0.00 H new ATOM 0 HD22 LEU A 681 15.284 2.297 0.508 1.00 0.00 H new ATOM 0 HD23 LEU A 681 16.257 2.208 -0.980 1.00 0.00 H new ATOM 927 N PRO A 682 13.149 4.921 -2.438 1.00 0.00 N ATOM 928 CA PRO A 682 11.987 5.671 -2.894 1.00 0.00 C ATOM 929 C PRO A 682 11.662 6.891 -2.013 1.00 0.00 C ATOM 930 O PRO A 682 12.386 7.216 -1.064 1.00 0.00 O ATOM 931 CB PRO A 682 10.852 4.646 -2.840 1.00 0.00 C ATOM 932 CG PRO A 682 11.308 3.612 -1.875 1.00 0.00 C ATOM 933 CD PRO A 682 12.791 3.560 -2.000 1.00 0.00 C ATOM 0 HA PRO A 682 12.154 6.093 -3.885 1.00 0.00 H new ATOM 0 HB2 PRO A 682 9.920 5.107 -2.512 1.00 0.00 H new ATOM 0 HB3 PRO A 682 10.665 4.213 -3.823 1.00 0.00 H new ATOM 0 HG2 PRO A 682 11.011 3.869 -0.858 1.00 0.00 H new ATOM 0 HG3 PRO A 682 10.863 2.643 -2.102 1.00 0.00 H new ATOM 0 HD2 PRO A 682 13.265 3.306 -1.052 1.00 0.00 H new ATOM 0 HD3 PRO A 682 13.106 2.809 -2.725 1.00 0.00 H new ATOM 941 N VAL A 683 10.549 7.527 -2.310 1.00 0.00 N ATOM 942 CA VAL A 683 10.128 8.751 -1.660 1.00 0.00 C ATOM 943 C VAL A 683 8.637 8.667 -1.449 1.00 0.00 C ATOM 944 O VAL A 683 7.918 8.202 -2.339 1.00 0.00 O ATOM 945 CB VAL A 683 10.430 10.012 -2.553 1.00 0.00 C ATOM 946 CG1 VAL A 683 9.965 11.301 -1.884 1.00 0.00 C ATOM 947 CG2 VAL A 683 11.908 10.114 -2.903 1.00 0.00 C ATOM 0 H VAL A 683 9.898 7.202 -3.024 1.00 0.00 H new ATOM 0 HA VAL A 683 10.671 8.858 -0.721 1.00 0.00 H new ATOM 0 HB VAL A 683 9.866 9.879 -3.476 1.00 0.00 H new ATOM 0 HG11 VAL A 683 10.191 12.149 -2.531 1.00 0.00 H new ATOM 0 HG12 VAL A 683 8.890 11.253 -1.710 1.00 0.00 H new ATOM 0 HG13 VAL A 683 10.481 11.424 -0.932 1.00 0.00 H new ATOM 0 HG21 VAL A 683 12.076 10.997 -3.520 1.00 0.00 H new ATOM 0 HG22 VAL A 683 12.494 10.194 -1.987 1.00 0.00 H new ATOM 0 HG23 VAL A 683 12.214 9.224 -3.453 1.00 0.00 H new ATOM 957 N CYS A 684 8.183 9.079 -0.296 1.00 0.00 N ATOM 958 CA CYS A 684 6.777 9.106 0.004 1.00 0.00 C ATOM 959 C CYS A 684 6.387 10.564 0.211 1.00 0.00 C ATOM 960 O CYS A 684 7.092 11.298 0.917 1.00 0.00 O ATOM 961 CB CYS A 684 6.469 8.324 1.275 1.00 0.00 C ATOM 962 SG CYS A 684 7.049 6.590 1.344 1.00 0.00 S ATOM 0 H CYS A 684 8.780 9.406 0.464 1.00 0.00 H new ATOM 0 HA CYS A 684 6.219 8.650 -0.814 1.00 0.00 H new ATOM 0 HB2 CYS A 684 6.905 8.861 2.117 1.00 0.00 H new ATOM 0 HB3 CYS A 684 5.389 8.326 1.421 1.00 0.00 H new ATOM 967 N ILE A 685 5.307 10.979 -0.390 1.00 0.00 N ATOM 968 CA ILE A 685 4.859 12.363 -0.345 1.00 0.00 C ATOM 969 C ILE A 685 3.390 12.425 0.041 1.00 0.00 C ATOM 970 O ILE A 685 2.596 11.632 -0.427 1.00 0.00 O ATOM 971 CB ILE A 685 5.041 13.049 -1.722 1.00 0.00 C ATOM 972 CG1 ILE A 685 4.312 12.246 -2.812 1.00 0.00 C ATOM 973 CG2 ILE A 685 6.522 13.198 -2.059 1.00 0.00 C ATOM 974 CD1 ILE A 685 4.283 12.913 -4.148 1.00 0.00 C ATOM 0 H ILE A 685 4.699 10.367 -0.934 1.00 0.00 H new ATOM 0 HA ILE A 685 5.463 12.884 0.398 1.00 0.00 H new ATOM 0 HB ILE A 685 4.605 14.047 -1.675 1.00 0.00 H new ATOM 0 HG12 ILE A 685 4.794 11.274 -2.914 1.00 0.00 H new ATOM 0 HG13 ILE A 685 3.288 12.062 -2.488 1.00 0.00 H new ATOM 0 HG21 ILE A 685 6.627 13.682 -3.030 1.00 0.00 H new ATOM 0 HG22 ILE A 685 7.009 13.805 -1.296 1.00 0.00 H new ATOM 0 HG23 ILE A 685 6.989 12.213 -2.092 1.00 0.00 H new ATOM 0 HD11 ILE A 685 3.751 12.281 -4.859 1.00 0.00 H new ATOM 0 HD12 ILE A 685 3.774 13.873 -4.064 1.00 0.00 H new ATOM 0 HD13 ILE A 685 5.303 13.072 -4.497 1.00 0.00 H new ATOM 986 N VAL A 686 3.033 13.318 0.902 1.00 0.00 N ATOM 987 CA VAL A 686 1.652 13.429 1.287 1.00 0.00 C ATOM 988 C VAL A 686 0.898 14.263 0.261 1.00 0.00 C ATOM 989 O VAL A 686 1.131 15.465 0.110 1.00 0.00 O ATOM 990 CB VAL A 686 1.456 13.958 2.752 1.00 0.00 C ATOM 991 CG1 VAL A 686 2.109 15.304 2.969 1.00 0.00 C ATOM 992 CG2 VAL A 686 -0.015 14.004 3.136 1.00 0.00 C ATOM 0 H VAL A 686 3.665 13.979 1.353 1.00 0.00 H new ATOM 0 HA VAL A 686 1.229 12.425 1.298 1.00 0.00 H new ATOM 0 HB VAL A 686 1.957 13.246 3.408 1.00 0.00 H new ATOM 0 HG11 VAL A 686 1.945 15.626 3.997 1.00 0.00 H new ATOM 0 HG12 VAL A 686 3.180 15.224 2.780 1.00 0.00 H new ATOM 0 HG13 VAL A 686 1.674 16.034 2.286 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -0.113 14.375 4.156 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -0.548 14.668 2.456 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -0.439 13.002 3.072 1.00 0.00 H new ATOM 1043 N THR A 690 -8.260 14.215 0.175 1.00 0.00 N ATOM 1044 CA THR A 690 -9.033 13.196 0.787 1.00 0.00 C ATOM 1045 C THR A 690 -9.970 12.531 -0.177 1.00 0.00 C ATOM 1046 O THR A 690 -10.317 13.085 -1.219 1.00 0.00 O ATOM 1047 CB THR A 690 -9.760 13.697 2.045 1.00 0.00 C ATOM 1048 OG1 THR A 690 -10.508 14.891 1.755 1.00 0.00 O ATOM 1049 CG2 THR A 690 -8.751 13.970 3.135 1.00 0.00 C ATOM 0 HA THR A 690 -8.329 12.430 1.113 1.00 0.00 H new ATOM 0 HB THR A 690 -10.457 12.929 2.380 1.00 0.00 H new ATOM 0 HG1 THR A 690 -10.037 15.415 1.074 1.00 0.00 H new ATOM 0 HG21 THR A 690 -9.266 14.325 4.027 1.00 0.00 H new ATOM 0 HG22 THR A 690 -8.211 13.053 3.369 1.00 0.00 H new ATOM 0 HG23 THR A 690 -8.046 14.729 2.796 1.00 0.00 H new ATOM 1057 N CYS A 691 -10.326 11.338 0.142 1.00 0.00 N ATOM 1058 CA CYS A 691 -11.177 10.539 -0.682 1.00 0.00 C ATOM 1059 C CYS A 691 -12.595 10.573 -0.165 1.00 0.00 C ATOM 1060 O CYS A 691 -13.537 10.197 -0.850 1.00 0.00 O ATOM 1061 CB CYS A 691 -10.607 9.155 -0.669 1.00 0.00 C ATOM 1062 SG CYS A 691 -8.831 9.204 -1.023 1.00 0.00 S ATOM 0 H CYS A 691 -10.030 10.875 1.001 1.00 0.00 H new ATOM 0 HA CYS A 691 -11.218 10.917 -1.704 1.00 0.00 H new ATOM 0 HB2 CYS A 691 -10.778 8.693 0.303 1.00 0.00 H new ATOM 0 HB3 CYS A 691 -11.116 8.538 -1.410 1.00 0.00 H new ATOM 1067 N GLY A 692 -12.731 11.006 1.055 1.00 0.00 N ATOM 1068 CA GLY A 692 -14.025 11.186 1.628 1.00 0.00 C ATOM 1069 C GLY A 692 -14.324 10.179 2.686 1.00 0.00 C ATOM 1070 O GLY A 692 -14.195 10.471 3.879 1.00 0.00 O ATOM 0 H GLY A 692 -11.954 11.241 1.672 1.00 0.00 H new ATOM 0 HA2 GLY A 692 -14.095 12.187 2.053 1.00 0.00 H new ATOM 0 HA3 GLY A 692 -14.779 11.120 0.844 1.00 0.00 H new ATOM 1074 N ASP A 693 -14.705 9.000 2.255 1.00 0.00 N ATOM 1075 CA ASP A 693 -15.076 7.897 3.133 1.00 0.00 C ATOM 1076 C ASP A 693 -15.292 6.686 2.243 1.00 0.00 C ATOM 1077 O ASP A 693 -14.935 6.722 1.046 1.00 0.00 O ATOM 1078 CB ASP A 693 -16.381 8.259 3.917 1.00 0.00 C ATOM 1079 CG ASP A 693 -16.725 7.307 5.060 1.00 0.00 C ATOM 1080 OD1 ASP A 693 -16.277 7.537 6.203 1.00 0.00 O ATOM 1081 OD2 ASP A 693 -17.449 6.328 4.832 1.00 0.00 O ATOM 0 H ASP A 693 -14.770 8.768 1.264 1.00 0.00 H new ATOM 0 HA ASP A 693 -14.301 7.693 3.871 1.00 0.00 H new ATOM 0 HB2 ASP A 693 -16.278 9.266 4.320 1.00 0.00 H new ATOM 0 HB3 ASP A 693 -17.216 8.280 3.216 1.00 0.00 H new ATOM 1086 N ILE A 694 -15.833 5.655 2.787 1.00 0.00 N ATOM 1087 CA ILE A 694 -16.162 4.466 2.087 1.00 0.00 C ATOM 1088 C ILE A 694 -17.307 4.730 1.090 1.00 0.00 C ATOM 1089 O ILE A 694 -18.227 5.495 1.378 1.00 0.00 O ATOM 1090 CB ILE A 694 -16.530 3.333 3.108 1.00 0.00 C ATOM 1091 CG1 ILE A 694 -15.306 2.606 3.610 1.00 0.00 C ATOM 1092 CG2 ILE A 694 -17.574 2.371 2.642 1.00 0.00 C ATOM 1093 CD1 ILE A 694 -14.735 3.124 4.896 1.00 0.00 C ATOM 0 H ILE A 694 -16.069 5.616 3.779 1.00 0.00 H new ATOM 0 HA ILE A 694 -15.298 4.133 1.511 1.00 0.00 H new ATOM 0 HB ILE A 694 -16.988 3.866 3.941 1.00 0.00 H new ATOM 0 HG12 ILE A 694 -15.557 1.553 3.741 1.00 0.00 H new ATOM 0 HG13 ILE A 694 -14.534 2.656 2.842 1.00 0.00 H new ATOM 0 HG21 ILE A 694 -17.757 1.628 3.418 1.00 0.00 H new ATOM 0 HG22 ILE A 694 -18.498 2.910 2.431 1.00 0.00 H new ATOM 0 HG23 ILE A 694 -17.230 1.872 1.736 1.00 0.00 H new ATOM 0 HD11 ILE A 694 -13.860 2.534 5.169 1.00 0.00 H new ATOM 0 HD12 ILE A 694 -14.445 4.167 4.771 1.00 0.00 H new ATOM 0 HD13 ILE A 694 -15.484 3.047 5.684 1.00 0.00 H new ATOM 1105 N PRO A 695 -17.202 4.166 -0.111 1.00 0.00 N ATOM 1106 CA PRO A 695 -18.245 4.256 -1.142 1.00 0.00 C ATOM 1107 C PRO A 695 -19.436 3.334 -0.827 1.00 0.00 C ATOM 1108 O PRO A 695 -19.571 2.817 0.286 1.00 0.00 O ATOM 1109 CB PRO A 695 -17.526 3.754 -2.395 1.00 0.00 C ATOM 1110 CG PRO A 695 -16.476 2.841 -1.879 1.00 0.00 C ATOM 1111 CD PRO A 695 -16.036 3.415 -0.570 1.00 0.00 C ATOM 0 HA PRO A 695 -18.658 5.261 -1.231 1.00 0.00 H new ATOM 0 HB2 PRO A 695 -18.211 3.233 -3.064 1.00 0.00 H new ATOM 0 HB3 PRO A 695 -17.092 4.578 -2.961 1.00 0.00 H new ATOM 0 HG2 PRO A 695 -16.866 1.831 -1.751 1.00 0.00 H new ATOM 0 HG3 PRO A 695 -15.641 2.774 -2.576 1.00 0.00 H new ATOM 0 HD2 PRO A 695 -15.760 2.633 0.137 1.00 0.00 H new ATOM 0 HD3 PRO A 695 -15.165 4.060 -0.688 1.00 0.00 H new ATOM 1119 N GLU A 696 -20.276 3.112 -1.788 1.00 0.00 N ATOM 1120 CA GLU A 696 -21.398 2.257 -1.579 1.00 0.00 C ATOM 1121 C GLU A 696 -21.393 1.138 -2.595 1.00 0.00 C ATOM 1122 O GLU A 696 -21.357 1.374 -3.815 1.00 0.00 O ATOM 1123 CB GLU A 696 -22.726 3.036 -1.587 1.00 0.00 C ATOM 1124 CG GLU A 696 -23.061 3.737 -2.893 1.00 0.00 C ATOM 1125 CD GLU A 696 -24.364 4.485 -2.823 1.00 0.00 C ATOM 1126 OE1 GLU A 696 -25.437 3.844 -2.924 1.00 0.00 O ATOM 1127 OE2 GLU A 696 -24.352 5.716 -2.664 1.00 0.00 O ATOM 0 H GLU A 696 -20.205 3.511 -2.724 1.00 0.00 H new ATOM 0 HA GLU A 696 -21.311 1.817 -0.586 1.00 0.00 H new ATOM 0 HB2 GLU A 696 -23.534 2.345 -1.347 1.00 0.00 H new ATOM 0 HB3 GLU A 696 -22.696 3.781 -0.792 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -22.260 4.431 -3.146 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -23.110 3.001 -3.695 1.00 0.00 H new ATOM 1134 N LEU A 697 -21.372 -0.062 -2.110 1.00 0.00 N ATOM 1135 CA LEU A 697 -21.405 -1.204 -2.963 1.00 0.00 C ATOM 1136 C LEU A 697 -22.852 -1.666 -3.010 1.00 0.00 C ATOM 1137 O LEU A 697 -23.614 -1.358 -2.090 1.00 0.00 O ATOM 1138 CB LEU A 697 -20.487 -2.321 -2.389 1.00 0.00 C ATOM 1139 CG LEU A 697 -20.226 -3.546 -3.286 1.00 0.00 C ATOM 1140 CD1 LEU A 697 -19.484 -3.124 -4.535 1.00 0.00 C ATOM 1141 CD2 LEU A 697 -19.431 -4.626 -2.541 1.00 0.00 C ATOM 0 H LEU A 697 -21.332 -0.277 -1.114 1.00 0.00 H new ATOM 0 HA LEU A 697 -21.043 -0.968 -3.964 1.00 0.00 H new ATOM 0 HB2 LEU A 697 -19.525 -1.873 -2.140 1.00 0.00 H new ATOM 0 HB3 LEU A 697 -20.926 -2.673 -1.455 1.00 0.00 H new ATOM 0 HG LEU A 697 -21.190 -3.971 -3.564 1.00 0.00 H new ATOM 0 HD11 LEU A 697 -19.304 -3.996 -5.163 1.00 0.00 H new ATOM 0 HD12 LEU A 697 -20.082 -2.398 -5.085 1.00 0.00 H new ATOM 0 HD13 LEU A 697 -18.531 -2.674 -4.257 1.00 0.00 H new ATOM 0 HD21 LEU A 697 -19.264 -5.476 -3.202 1.00 0.00 H new ATOM 0 HD22 LEU A 697 -18.471 -4.218 -2.225 1.00 0.00 H new ATOM 0 HD23 LEU A 697 -19.992 -4.952 -1.665 1.00 0.00 H new ATOM 1153 N GLU A 698 -23.228 -2.355 -4.078 1.00 0.00 N ATOM 1154 CA GLU A 698 -24.578 -2.944 -4.268 1.00 0.00 C ATOM 1155 C GLU A 698 -25.096 -3.630 -2.995 1.00 0.00 C ATOM 1156 O GLU A 698 -26.254 -3.525 -2.631 1.00 0.00 O ATOM 1157 CB GLU A 698 -24.513 -4.017 -5.375 1.00 0.00 C ATOM 1158 CG GLU A 698 -23.478 -5.105 -5.072 1.00 0.00 C ATOM 1159 CD GLU A 698 -23.581 -6.313 -5.929 1.00 0.00 C ATOM 1160 OE1 GLU A 698 -22.979 -6.350 -6.994 1.00 0.00 O ATOM 1161 OE2 GLU A 698 -24.237 -7.274 -5.494 1.00 0.00 O ATOM 0 H GLU A 698 -22.601 -2.533 -4.863 1.00 0.00 H new ATOM 0 HA GLU A 698 -25.251 -2.127 -4.530 1.00 0.00 H new ATOM 0 HB2 GLU A 698 -25.495 -4.475 -5.491 1.00 0.00 H new ATOM 0 HB3 GLU A 698 -24.269 -3.541 -6.325 1.00 0.00 H new ATOM 0 HG2 GLU A 698 -22.480 -4.680 -5.184 1.00 0.00 H new ATOM 0 HG3 GLU A 698 -23.581 -5.406 -4.029 1.00 0.00 H new ATOM 1168 N HIS A 699 -24.208 -4.318 -2.345 1.00 0.00 N ATOM 1169 CA HIS A 699 -24.522 -5.130 -1.228 1.00 0.00 C ATOM 1170 C HIS A 699 -23.516 -4.945 -0.134 1.00 0.00 C ATOM 1171 O HIS A 699 -23.875 -4.843 1.031 1.00 0.00 O ATOM 1172 CB HIS A 699 -24.615 -6.609 -1.665 1.00 0.00 C ATOM 1173 CG HIS A 699 -25.926 -6.968 -2.293 1.00 0.00 C ATOM 1174 ND1 HIS A 699 -26.086 -7.258 -3.630 1.00 0.00 N ATOM 1175 CD2 HIS A 699 -27.150 -7.077 -1.748 1.00 0.00 C ATOM 1176 CE1 HIS A 699 -27.353 -7.519 -3.870 1.00 0.00 C ATOM 1177 NE2 HIS A 699 -28.014 -7.417 -2.744 1.00 0.00 N ATOM 0 H HIS A 699 -23.218 -4.325 -2.591 1.00 0.00 H new ATOM 0 HA HIS A 699 -25.491 -4.827 -0.831 1.00 0.00 H new ATOM 0 HB2 HIS A 699 -23.813 -6.821 -2.372 1.00 0.00 H new ATOM 0 HB3 HIS A 699 -24.451 -7.247 -0.796 1.00 0.00 H new ATOM 0 HD1 HIS A 699 -25.339 -7.269 -4.325 1.00 0.00 H new ATOM 0 HD2 HIS A 699 -27.402 -6.923 -0.709 1.00 0.00 H new ATOM 0 HE1 HIS A 699 -27.775 -7.774 -4.831 1.00 0.00 H new ATOM 1186 N GLY A 700 -22.266 -4.855 -0.521 1.00 0.00 N ATOM 1187 CA GLY A 700 -21.207 -4.740 0.431 1.00 0.00 C ATOM 1188 C GLY A 700 -21.078 -3.373 1.062 1.00 0.00 C ATOM 1189 O GLY A 700 -21.668 -2.382 0.604 1.00 0.00 O ATOM 0 H GLY A 700 -21.965 -4.860 -1.495 1.00 0.00 H new ATOM 0 HA2 GLY A 700 -21.362 -5.477 1.219 1.00 0.00 H new ATOM 0 HA3 GLY A 700 -20.266 -4.990 -0.059 1.00 0.00 H new ATOM 1193 N TRP A 701 -20.287 -3.352 2.078 1.00 0.00 N ATOM 1194 CA TRP A 701 -20.001 -2.238 2.913 1.00 0.00 C ATOM 1195 C TRP A 701 -18.609 -2.466 3.408 1.00 0.00 C ATOM 1196 O TRP A 701 -17.848 -3.125 2.729 1.00 0.00 O ATOM 1197 CB TRP A 701 -21.039 -2.131 4.052 1.00 0.00 C ATOM 1198 CG TRP A 701 -21.555 -3.455 4.519 1.00 0.00 C ATOM 1199 CD1 TRP A 701 -22.618 -4.098 4.015 1.00 0.00 C ATOM 1200 CD2 TRP A 701 -21.033 -4.294 5.542 1.00 0.00 C ATOM 1201 NE1 TRP A 701 -22.805 -5.285 4.644 1.00 0.00 N ATOM 1202 CE2 TRP A 701 -21.849 -5.433 5.593 1.00 0.00 C ATOM 1203 CE3 TRP A 701 -19.968 -4.197 6.416 1.00 0.00 C ATOM 1204 CZ2 TRP A 701 -21.629 -6.464 6.481 1.00 0.00 C ATOM 1205 CZ3 TRP A 701 -19.742 -5.217 7.296 1.00 0.00 C ATOM 1206 CH2 TRP A 701 -20.574 -6.343 7.324 1.00 0.00 C ATOM 0 H TRP A 701 -19.780 -4.187 2.371 1.00 0.00 H new ATOM 0 HA TRP A 701 -20.065 -1.286 2.385 1.00 0.00 H new ATOM 0 HB2 TRP A 701 -20.588 -1.608 4.895 1.00 0.00 H new ATOM 0 HB3 TRP A 701 -21.878 -1.523 3.712 1.00 0.00 H new ATOM 0 HD1 TRP A 701 -23.241 -3.722 3.217 1.00 0.00 H new ATOM 0 HE1 TRP A 701 -23.544 -5.956 4.437 1.00 0.00 H new ATOM 0 HE3 TRP A 701 -19.325 -3.329 6.404 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 -22.271 -7.332 6.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 -18.909 -5.154 7.981 1.00 0.00 H new ATOM 0 HH2 TRP A 701 -20.371 -7.132 8.033 1.00 0.00 H new ATOM 1217 N ALA A 702 -18.278 -2.046 4.565 1.00 0.00 N ATOM 1218 CA ALA A 702 -16.907 -2.056 4.934 1.00 0.00 C ATOM 1219 C ALA A 702 -16.712 -2.553 6.332 1.00 0.00 C ATOM 1220 O ALA A 702 -17.593 -2.417 7.161 1.00 0.00 O ATOM 1221 CB ALA A 702 -16.386 -0.670 4.765 1.00 0.00 C ATOM 0 H ALA A 702 -18.924 -1.693 5.272 1.00 0.00 H new ATOM 0 HA ALA A 702 -16.354 -2.745 4.295 1.00 0.00 H new ATOM 0 HB1 ALA A 702 -15.332 -0.641 5.041 1.00 0.00 H new ATOM 0 HB2 ALA A 702 -16.498 -0.364 3.725 1.00 0.00 H new ATOM 0 HB3 ALA A 702 -16.947 0.010 5.406 1.00 0.00 H new ATOM 1227 N GLN A 703 -15.543 -3.090 6.598 1.00 0.00 N ATOM 1228 CA GLN A 703 -15.251 -3.647 7.930 1.00 0.00 C ATOM 1229 C GLN A 703 -14.653 -2.589 8.789 1.00 0.00 C ATOM 1230 O GLN A 703 -15.029 -2.405 9.942 1.00 0.00 O ATOM 1231 CB GLN A 703 -14.282 -4.860 7.902 1.00 0.00 C ATOM 1232 CG GLN A 703 -14.882 -6.189 7.463 1.00 0.00 C ATOM 1233 CD GLN A 703 -14.435 -6.663 6.092 1.00 0.00 C ATOM 1234 OE1 GLN A 703 -14.347 -7.858 5.839 1.00 0.00 O ATOM 1235 NE2 GLN A 703 -14.174 -5.757 5.204 1.00 0.00 N ATOM 0 H GLN A 703 -14.777 -3.160 5.928 1.00 0.00 H new ATOM 0 HA GLN A 703 -16.203 -4.001 8.327 1.00 0.00 H new ATOM 0 HB2 GLN A 703 -13.453 -4.621 7.235 1.00 0.00 H new ATOM 0 HB3 GLN A 703 -13.862 -4.986 8.900 1.00 0.00 H new ATOM 0 HG2 GLN A 703 -14.622 -6.950 8.199 1.00 0.00 H new ATOM 0 HG3 GLN A 703 -15.968 -6.101 7.466 1.00 0.00 H new ATOM 0 HE21 GLN A 703 -14.256 -4.769 5.444 1.00 0.00 H new ATOM 0 HE22 GLN A 703 -13.886 -6.031 4.265 1.00 0.00 H new ATOM 1244 N LEU A 704 -13.750 -1.871 8.204 1.00 0.00 N ATOM 1245 CA LEU A 704 -13.014 -0.868 8.876 1.00 0.00 C ATOM 1246 C LEU A 704 -12.887 0.335 7.991 1.00 0.00 C ATOM 1247 O LEU A 704 -12.895 0.210 6.754 1.00 0.00 O ATOM 1248 CB LEU A 704 -11.641 -1.441 9.321 1.00 0.00 C ATOM 1249 CG LEU A 704 -10.824 -2.245 8.269 1.00 0.00 C ATOM 1250 CD1 LEU A 704 -10.159 -1.363 7.216 1.00 0.00 C ATOM 1251 CD2 LEU A 704 -9.811 -3.149 8.949 1.00 0.00 C ATOM 0 H LEU A 704 -13.503 -1.974 7.220 1.00 0.00 H new ATOM 0 HA LEU A 704 -13.534 -0.548 9.779 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -11.024 -0.610 9.662 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -11.809 -2.088 10.182 1.00 0.00 H new ATOM 0 HG LEU A 704 -11.541 -2.865 7.730 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -9.606 -1.988 6.515 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -10.922 -0.801 6.678 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -9.473 -0.670 7.703 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -9.252 -3.701 8.194 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -9.123 -2.545 9.540 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -10.330 -3.851 9.602 1.00 0.00 H new ATOM 1263 N SER A 705 -12.825 1.462 8.593 1.00 0.00 N ATOM 1264 CA SER A 705 -12.666 2.688 7.907 1.00 0.00 C ATOM 1265 C SER A 705 -11.345 3.312 8.334 1.00 0.00 C ATOM 1266 O SER A 705 -10.919 3.125 9.478 1.00 0.00 O ATOM 1267 CB SER A 705 -13.871 3.570 8.221 1.00 0.00 C ATOM 1268 OG SER A 705 -14.291 3.407 9.569 1.00 0.00 O ATOM 0 H SER A 705 -12.885 1.561 9.606 1.00 0.00 H new ATOM 0 HA SER A 705 -12.628 2.554 6.826 1.00 0.00 H new ATOM 0 HB2 SER A 705 -13.617 4.615 8.040 1.00 0.00 H new ATOM 0 HB3 SER A 705 -14.692 3.321 7.549 1.00 0.00 H new ATOM 0 HG SER A 705 -15.063 3.985 9.743 1.00 0.00 H new ATOM 1274 N SER A 706 -10.678 4.004 7.453 1.00 0.00 N ATOM 1275 CA SER A 706 -9.389 4.551 7.795 1.00 0.00 C ATOM 1276 C SER A 706 -9.282 6.037 7.427 1.00 0.00 C ATOM 1277 O SER A 706 -8.923 6.397 6.322 1.00 0.00 O ATOM 1278 CB SER A 706 -8.280 3.695 7.162 1.00 0.00 C ATOM 1279 OG SER A 706 -6.986 4.161 7.473 1.00 0.00 O ATOM 0 H SER A 706 -10.997 4.202 6.505 1.00 0.00 H new ATOM 0 HA SER A 706 -9.263 4.512 8.877 1.00 0.00 H new ATOM 0 HB2 SER A 706 -8.382 2.665 7.504 1.00 0.00 H new ATOM 0 HB3 SER A 706 -8.408 3.686 6.080 1.00 0.00 H new ATOM 0 HG SER A 706 -6.502 4.361 6.644 1.00 0.00 H new ATOM 1285 N PRO A 707 -9.717 6.912 8.335 1.00 0.00 N ATOM 1286 CA PRO A 707 -9.598 8.333 8.167 1.00 0.00 C ATOM 1287 C PRO A 707 -8.305 8.884 8.805 1.00 0.00 C ATOM 1288 O PRO A 707 -7.829 8.373 9.833 1.00 0.00 O ATOM 1289 CB PRO A 707 -10.842 8.875 8.868 1.00 0.00 C ATOM 1290 CG PRO A 707 -11.451 7.687 9.586 1.00 0.00 C ATOM 1291 CD PRO A 707 -10.423 6.602 9.560 1.00 0.00 C ATOM 0 HA PRO A 707 -9.535 8.627 7.119 1.00 0.00 H new ATOM 0 HB2 PRO A 707 -10.583 9.668 9.570 1.00 0.00 H new ATOM 0 HB3 PRO A 707 -11.543 9.301 8.150 1.00 0.00 H new ATOM 0 HG2 PRO A 707 -11.715 7.947 10.611 1.00 0.00 H new ATOM 0 HG3 PRO A 707 -12.368 7.364 9.093 1.00 0.00 H new ATOM 0 HD2 PRO A 707 -9.769 6.634 10.431 1.00 0.00 H new ATOM 0 HD3 PRO A 707 -10.873 5.609 9.536 1.00 0.00 H new ATOM 1299 N PRO A 708 -7.728 9.933 8.218 1.00 0.00 N ATOM 1300 CA PRO A 708 -8.278 10.567 7.035 1.00 0.00 C ATOM 1301 C PRO A 708 -7.992 9.742 5.785 1.00 0.00 C ATOM 1302 O PRO A 708 -6.857 9.289 5.559 1.00 0.00 O ATOM 1303 CB PRO A 708 -7.561 11.911 6.993 1.00 0.00 C ATOM 1304 CG PRO A 708 -6.240 11.639 7.608 1.00 0.00 C ATOM 1305 CD PRO A 708 -6.468 10.569 8.647 1.00 0.00 C ATOM 0 HA PRO A 708 -9.363 10.668 7.068 1.00 0.00 H new ATOM 0 HB2 PRO A 708 -7.457 12.275 5.971 1.00 0.00 H new ATOM 0 HB3 PRO A 708 -8.109 12.672 7.548 1.00 0.00 H new ATOM 0 HG2 PRO A 708 -5.523 11.306 6.858 1.00 0.00 H new ATOM 0 HG3 PRO A 708 -5.830 12.541 8.062 1.00 0.00 H new ATOM 0 HD2 PRO A 708 -5.646 9.854 8.673 1.00 0.00 H new ATOM 0 HD3 PRO A 708 -6.553 10.993 9.648 1.00 0.00 H new ATOM 1313 N TYR A 709 -9.021 9.526 5.010 1.00 0.00 N ATOM 1314 CA TYR A 709 -8.914 8.733 3.805 1.00 0.00 C ATOM 1315 C TYR A 709 -8.187 9.547 2.764 1.00 0.00 C ATOM 1316 O TYR A 709 -8.790 10.396 2.113 1.00 0.00 O ATOM 1317 CB TYR A 709 -10.299 8.366 3.245 1.00 0.00 C ATOM 1318 CG TYR A 709 -11.271 7.785 4.236 1.00 0.00 C ATOM 1319 CD1 TYR A 709 -12.018 8.620 5.038 1.00 0.00 C ATOM 1320 CD2 TYR A 709 -11.470 6.418 4.351 1.00 0.00 C ATOM 1321 CE1 TYR A 709 -12.931 8.135 5.926 1.00 0.00 C ATOM 1322 CE2 TYR A 709 -12.389 5.916 5.249 1.00 0.00 C ATOM 1323 CZ TYR A 709 -13.117 6.785 6.033 1.00 0.00 C ATOM 1324 OH TYR A 709 -14.042 6.304 6.916 1.00 0.00 O ATOM 0 H TYR A 709 -9.956 9.891 5.191 1.00 0.00 H new ATOM 0 HA TYR A 709 -8.381 7.813 4.045 1.00 0.00 H new ATOM 0 HB2 TYR A 709 -10.743 9.261 2.810 1.00 0.00 H new ATOM 0 HB3 TYR A 709 -10.165 7.651 2.434 1.00 0.00 H new ATOM 0 HD1 TYR A 709 -11.876 9.688 4.961 1.00 0.00 H new ATOM 0 HD2 TYR A 709 -10.901 5.740 3.732 1.00 0.00 H new ATOM 0 HE1 TYR A 709 -13.504 8.813 6.541 1.00 0.00 H new ATOM 0 HE2 TYR A 709 -12.537 4.850 5.337 1.00 0.00 H new ATOM 0 HH TYR A 709 -14.822 6.897 6.929 1.00 0.00 H new ATOM 1334 N TYR A 710 -6.916 9.353 2.678 1.00 0.00 N ATOM 1335 CA TYR A 710 -6.085 10.015 1.705 1.00 0.00 C ATOM 1336 C TYR A 710 -5.841 9.090 0.542 1.00 0.00 C ATOM 1337 O TYR A 710 -6.229 7.905 0.577 1.00 0.00 O ATOM 1338 CB TYR A 710 -4.734 10.410 2.321 1.00 0.00 C ATOM 1339 CG TYR A 710 -4.689 11.752 3.032 1.00 0.00 C ATOM 1340 CD1 TYR A 710 -5.730 12.208 3.820 1.00 0.00 C ATOM 1341 CD2 TYR A 710 -3.587 12.573 2.885 1.00 0.00 C ATOM 1342 CE1 TYR A 710 -5.663 13.444 4.441 1.00 0.00 C ATOM 1343 CE2 TYR A 710 -3.518 13.798 3.498 1.00 0.00 C ATOM 1344 CZ TYR A 710 -4.552 14.232 4.273 1.00 0.00 C ATOM 1345 OH TYR A 710 -4.482 15.475 4.877 1.00 0.00 O ATOM 0 H TYR A 710 -6.405 8.718 3.291 1.00 0.00 H new ATOM 0 HA TYR A 710 -6.598 10.916 1.369 1.00 0.00 H new ATOM 0 HB2 TYR A 710 -4.441 9.636 3.031 1.00 0.00 H new ATOM 0 HB3 TYR A 710 -3.985 10.416 1.529 1.00 0.00 H new ATOM 0 HD1 TYR A 710 -6.607 11.592 3.953 1.00 0.00 H new ATOM 0 HD2 TYR A 710 -2.761 12.242 2.273 1.00 0.00 H new ATOM 0 HE1 TYR A 710 -6.482 13.787 5.055 1.00 0.00 H new ATOM 0 HE2 TYR A 710 -2.644 14.419 3.367 1.00 0.00 H new ATOM 0 HH TYR A 710 -3.627 15.899 4.655 1.00 0.00 H new ATOM 1355 N TYR A 711 -5.229 9.604 -0.493 1.00 0.00 N ATOM 1356 CA TYR A 711 -4.839 8.761 -1.621 1.00 0.00 C ATOM 1357 C TYR A 711 -3.778 7.809 -1.089 1.00 0.00 C ATOM 1358 O TYR A 711 -2.913 8.210 -0.308 1.00 0.00 O ATOM 1359 CB TYR A 711 -4.254 9.627 -2.750 1.00 0.00 C ATOM 1360 CG TYR A 711 -3.830 8.962 -4.084 1.00 0.00 C ATOM 1361 CD1 TYR A 711 -2.873 7.942 -4.153 1.00 0.00 C ATOM 1362 CD2 TYR A 711 -4.336 9.429 -5.273 1.00 0.00 C ATOM 1363 CE1 TYR A 711 -2.456 7.422 -5.356 1.00 0.00 C ATOM 1364 CE2 TYR A 711 -3.929 8.899 -6.489 1.00 0.00 C ATOM 1365 CZ TYR A 711 -2.991 7.902 -6.523 1.00 0.00 C ATOM 1366 OH TYR A 711 -2.582 7.390 -7.736 1.00 0.00 O ATOM 0 H TYR A 711 -4.987 10.590 -0.590 1.00 0.00 H new ATOM 0 HA TYR A 711 -5.692 8.220 -2.029 1.00 0.00 H new ATOM 0 HB2 TYR A 711 -4.991 10.394 -2.988 1.00 0.00 H new ATOM 0 HB3 TYR A 711 -3.379 10.139 -2.348 1.00 0.00 H new ATOM 0 HD1 TYR A 711 -2.451 7.554 -3.238 1.00 0.00 H new ATOM 0 HD2 TYR A 711 -5.066 10.225 -5.261 1.00 0.00 H new ATOM 0 HE1 TYR A 711 -1.711 6.640 -5.381 1.00 0.00 H new ATOM 0 HE2 TYR A 711 -4.352 9.273 -7.409 1.00 0.00 H new ATOM 0 HH TYR A 711 -3.063 7.842 -8.461 1.00 0.00 H new ATOM 1376 N GLY A 712 -3.853 6.573 -1.473 1.00 0.00 N ATOM 1377 CA GLY A 712 -2.898 5.631 -0.984 1.00 0.00 C ATOM 1378 C GLY A 712 -3.402 4.875 0.251 1.00 0.00 C ATOM 1379 O GLY A 712 -2.801 3.867 0.652 1.00 0.00 O ATOM 0 H GLY A 712 -4.553 6.198 -2.113 1.00 0.00 H new ATOM 0 HA2 GLY A 712 -2.660 4.916 -1.772 1.00 0.00 H new ATOM 0 HA3 GLY A 712 -1.973 6.151 -0.736 1.00 0.00 H new ATOM 1383 N ASP A 713 -4.511 5.354 0.855 1.00 0.00 N ATOM 1384 CA ASP A 713 -5.116 4.671 2.021 1.00 0.00 C ATOM 1385 C ASP A 713 -5.867 3.445 1.539 1.00 0.00 C ATOM 1386 O ASP A 713 -6.131 3.301 0.333 1.00 0.00 O ATOM 1387 CB ASP A 713 -6.056 5.611 2.827 1.00 0.00 C ATOM 1388 CG ASP A 713 -6.606 4.988 4.110 1.00 0.00 C ATOM 1389 OD1 ASP A 713 -5.904 5.006 5.163 1.00 0.00 O ATOM 1390 OD2 ASP A 713 -7.690 4.425 4.077 1.00 0.00 O ATOM 0 H ASP A 713 -5.001 6.199 0.560 1.00 0.00 H new ATOM 0 HA ASP A 713 -4.317 4.373 2.700 1.00 0.00 H new ATOM 0 HB2 ASP A 713 -5.512 6.521 3.081 1.00 0.00 H new ATOM 0 HB3 ASP A 713 -6.891 5.905 2.191 1.00 0.00 H new ATOM 1395 N SER A 714 -6.215 2.578 2.438 1.00 0.00 N ATOM 1396 CA SER A 714 -6.841 1.337 2.092 1.00 0.00 C ATOM 1397 C SER A 714 -8.017 1.082 2.989 1.00 0.00 C ATOM 1398 O SER A 714 -7.993 1.399 4.184 1.00 0.00 O ATOM 1399 CB SER A 714 -5.895 0.192 2.286 1.00 0.00 C ATOM 1400 OG SER A 714 -4.566 0.559 1.909 1.00 0.00 O ATOM 0 H SER A 714 -6.073 2.711 3.439 1.00 0.00 H new ATOM 0 HA SER A 714 -7.148 1.410 1.049 1.00 0.00 H new ATOM 0 HB2 SER A 714 -5.908 -0.122 3.330 1.00 0.00 H new ATOM 0 HB3 SER A 714 -6.223 -0.661 1.692 1.00 0.00 H new ATOM 0 HG SER A 714 -3.965 -0.203 2.045 1.00 0.00 H new ATOM 1406 N VAL A 715 -8.999 0.471 2.434 1.00 0.00 N ATOM 1407 CA VAL A 715 -10.173 0.121 3.137 1.00 0.00 C ATOM 1408 C VAL A 715 -10.545 -1.291 2.770 1.00 0.00 C ATOM 1409 O VAL A 715 -10.256 -1.732 1.675 1.00 0.00 O ATOM 1410 CB VAL A 715 -11.343 1.101 2.828 1.00 0.00 C ATOM 1411 CG1 VAL A 715 -12.623 0.537 3.314 1.00 0.00 C ATOM 1412 CG2 VAL A 715 -11.128 2.414 3.525 1.00 0.00 C ATOM 0 H VAL A 715 -9.006 0.194 1.452 1.00 0.00 H new ATOM 0 HA VAL A 715 -9.982 0.190 4.208 1.00 0.00 H new ATOM 0 HB VAL A 715 -11.376 1.249 1.749 1.00 0.00 H new ATOM 0 HG11 VAL A 715 -13.434 1.231 3.092 1.00 0.00 H new ATOM 0 HG12 VAL A 715 -12.813 -0.414 2.817 1.00 0.00 H new ATOM 0 HG13 VAL A 715 -12.565 0.379 4.391 1.00 0.00 H new ATOM 0 HG21 VAL A 715 -11.955 3.086 3.298 1.00 0.00 H new ATOM 0 HG22 VAL A 715 -11.078 2.251 4.602 1.00 0.00 H new ATOM 0 HG23 VAL A 715 -10.194 2.859 3.182 1.00 0.00 H new ATOM 1422 N GLU A 716 -11.129 -2.007 3.686 1.00 0.00 N ATOM 1423 CA GLU A 716 -11.573 -3.326 3.390 1.00 0.00 C ATOM 1424 C GLU A 716 -13.077 -3.393 3.382 1.00 0.00 C ATOM 1425 O GLU A 716 -13.752 -2.994 4.363 1.00 0.00 O ATOM 1426 CB GLU A 716 -10.991 -4.342 4.334 1.00 0.00 C ATOM 1427 CG GLU A 716 -9.482 -4.359 4.312 1.00 0.00 C ATOM 1428 CD GLU A 716 -8.918 -5.577 4.946 1.00 0.00 C ATOM 1429 OE1 GLU A 716 -8.810 -6.605 4.267 1.00 0.00 O ATOM 1430 OE2 GLU A 716 -8.554 -5.536 6.125 1.00 0.00 O ATOM 0 H GLU A 716 -11.306 -1.695 4.641 1.00 0.00 H new ATOM 0 HA GLU A 716 -11.212 -3.575 2.392 1.00 0.00 H new ATOM 0 HB2 GLU A 716 -11.333 -4.129 5.347 1.00 0.00 H new ATOM 0 HB3 GLU A 716 -11.365 -5.332 4.072 1.00 0.00 H new ATOM 0 HG2 GLU A 716 -9.136 -4.297 3.280 1.00 0.00 H new ATOM 0 HG3 GLU A 716 -9.104 -3.476 4.828 1.00 0.00 H new ATOM 1437 N PHE A 717 -13.586 -3.906 2.307 1.00 0.00 N ATOM 1438 CA PHE A 717 -14.986 -4.064 2.079 1.00 0.00 C ATOM 1439 C PHE A 717 -15.431 -5.444 2.454 1.00 0.00 C ATOM 1440 O PHE A 717 -14.671 -6.405 2.365 1.00 0.00 O ATOM 1441 CB PHE A 717 -15.339 -3.765 0.617 1.00 0.00 C ATOM 1442 CG PHE A 717 -15.925 -2.416 0.421 1.00 0.00 C ATOM 1443 CD1 PHE A 717 -15.282 -1.292 0.895 1.00 0.00 C ATOM 1444 CD2 PHE A 717 -17.139 -2.271 -0.226 1.00 0.00 C ATOM 1445 CE1 PHE A 717 -15.840 -0.051 0.727 1.00 0.00 C ATOM 1446 CE2 PHE A 717 -17.700 -1.031 -0.398 1.00 0.00 C ATOM 1447 CZ PHE A 717 -17.054 0.077 0.079 1.00 0.00 C ATOM 0 H PHE A 717 -13.013 -4.240 1.532 1.00 0.00 H new ATOM 0 HA PHE A 717 -15.513 -3.349 2.710 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -14.440 -3.856 0.007 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -16.044 -4.516 0.259 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -14.333 -1.390 1.402 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -17.652 -3.145 -0.600 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -15.331 0.826 1.101 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -18.647 -0.930 -0.907 1.00 0.00 H new ATOM 0 HZ PHE A 717 -17.494 1.055 -0.051 1.00 0.00 H new ATOM 1457 N ASN A 718 -16.621 -5.533 2.929 1.00 0.00 N ATOM 1458 CA ASN A 718 -17.199 -6.781 3.311 1.00 0.00 C ATOM 1459 C ASN A 718 -18.482 -6.930 2.566 1.00 0.00 C ATOM 1460 O ASN A 718 -19.250 -5.975 2.462 1.00 0.00 O ATOM 1461 CB ASN A 718 -17.494 -6.831 4.810 1.00 0.00 C ATOM 1462 CG ASN A 718 -17.789 -8.247 5.298 1.00 0.00 C ATOM 1463 OD1 ASN A 718 -18.606 -8.459 6.182 1.00 0.00 O ATOM 1464 ND2 ASN A 718 -17.069 -9.210 4.784 1.00 0.00 N ATOM 0 H ASN A 718 -17.235 -4.730 3.067 1.00 0.00 H new ATOM 0 HA ASN A 718 -16.498 -7.583 3.080 1.00 0.00 H new ATOM 0 HB2 ASN A 718 -16.642 -6.431 5.359 1.00 0.00 H new ATOM 0 HB3 ASN A 718 -18.346 -6.188 5.032 1.00 0.00 H new ATOM 0 HD21 ASN A 718 -17.182 -10.166 5.120 1.00 0.00 H new ATOM 0 HD22 ASN A 718 -16.394 -9.005 4.047 1.00 0.00 H new ATOM 1471 N CYS A 719 -18.684 -8.069 2.009 1.00 0.00 N ATOM 1472 CA CYS A 719 -19.884 -8.371 1.300 1.00 0.00 C ATOM 1473 C CYS A 719 -20.962 -8.795 2.294 1.00 0.00 C ATOM 1474 O CYS A 719 -20.661 -9.092 3.459 1.00 0.00 O ATOM 1475 CB CYS A 719 -19.594 -9.489 0.304 1.00 0.00 C ATOM 1476 SG CYS A 719 -20.989 -9.981 -0.741 1.00 0.00 S ATOM 0 H CYS A 719 -18.010 -8.835 2.031 1.00 0.00 H new ATOM 0 HA CYS A 719 -20.240 -7.495 0.757 1.00 0.00 H new ATOM 0 HB2 CYS A 719 -18.773 -9.175 -0.340 1.00 0.00 H new ATOM 0 HB3 CYS A 719 -19.249 -10.364 0.856 1.00 0.00 H new ATOM 1481 N SER A 720 -22.192 -8.808 1.848 1.00 0.00 N ATOM 1482 CA SER A 720 -23.310 -9.199 2.650 1.00 0.00 C ATOM 1483 C SER A 720 -23.245 -10.685 2.911 1.00 0.00 C ATOM 1484 O SER A 720 -22.667 -11.438 2.111 1.00 0.00 O ATOM 1485 CB SER A 720 -24.573 -8.892 1.871 1.00 0.00 C ATOM 1486 OG SER A 720 -24.515 -7.582 1.349 1.00 0.00 O ATOM 0 H SER A 720 -22.444 -8.540 0.896 1.00 0.00 H new ATOM 0 HA SER A 720 -23.301 -8.664 3.600 1.00 0.00 H new ATOM 0 HB2 SER A 720 -24.693 -9.610 1.060 1.00 0.00 H new ATOM 0 HB3 SER A 720 -25.443 -8.995 2.519 1.00 0.00 H new ATOM 0 HG SER A 720 -23.929 -7.032 1.910 1.00 0.00 H new ATOM 1492 N GLU A 721 -23.811 -11.119 4.006 1.00 0.00 N ATOM 1493 CA GLU A 721 -23.859 -12.518 4.262 1.00 0.00 C ATOM 1494 C GLU A 721 -24.879 -13.131 3.313 1.00 0.00 C ATOM 1495 O GLU A 721 -25.853 -12.458 2.936 1.00 0.00 O ATOM 1496 CB GLU A 721 -24.178 -12.830 5.725 1.00 0.00 C ATOM 1497 CG GLU A 721 -24.061 -14.312 6.060 1.00 0.00 C ATOM 1498 CD GLU A 721 -22.703 -14.871 5.699 1.00 0.00 C ATOM 1499 OE1 GLU A 721 -22.474 -15.208 4.513 1.00 0.00 O ATOM 1500 OE2 GLU A 721 -21.833 -14.977 6.587 1.00 0.00 O ATOM 0 H GLU A 721 -24.237 -10.528 4.720 1.00 0.00 H new ATOM 0 HA GLU A 721 -22.877 -12.956 4.084 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -23.502 -12.264 6.366 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -25.189 -12.492 5.950 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -24.241 -14.458 7.125 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -24.834 -14.866 5.527 1.00 0.00 H new ATOM 1507 N SER A 722 -24.597 -14.362 2.895 1.00 0.00 N ATOM 1508 CA SER A 722 -25.364 -15.131 1.922 1.00 0.00 C ATOM 1509 C SER A 722 -24.941 -14.734 0.498 1.00 0.00 C ATOM 1510 O SER A 722 -25.411 -15.288 -0.503 1.00 0.00 O ATOM 1511 CB SER A 722 -26.898 -15.025 2.157 1.00 0.00 C ATOM 1512 OG SER A 722 -27.634 -15.878 1.300 1.00 0.00 O ATOM 0 H SER A 722 -23.787 -14.875 3.244 1.00 0.00 H new ATOM 0 HA SER A 722 -25.135 -16.188 2.055 1.00 0.00 H new ATOM 0 HB2 SER A 722 -27.122 -15.274 3.194 1.00 0.00 H new ATOM 0 HB3 SER A 722 -27.217 -13.994 2.001 1.00 0.00 H new ATOM 0 HG SER A 722 -27.190 -15.928 0.428 1.00 0.00 H new ATOM 1518 N PHE A 723 -24.038 -13.783 0.416 1.00 0.00 N ATOM 1519 CA PHE A 723 -23.476 -13.375 -0.823 1.00 0.00 C ATOM 1520 C PHE A 723 -21.998 -13.568 -0.746 1.00 0.00 C ATOM 1521 O PHE A 723 -21.417 -13.486 0.329 1.00 0.00 O ATOM 1522 CB PHE A 723 -23.774 -11.910 -1.119 1.00 0.00 C ATOM 1523 CG PHE A 723 -25.214 -11.591 -1.361 1.00 0.00 C ATOM 1524 CD1 PHE A 723 -26.111 -11.485 -0.309 1.00 0.00 C ATOM 1525 CD2 PHE A 723 -25.665 -11.379 -2.647 1.00 0.00 C ATOM 1526 CE1 PHE A 723 -27.434 -11.175 -0.543 1.00 0.00 C ATOM 1527 CE2 PHE A 723 -26.984 -11.074 -2.891 1.00 0.00 C ATOM 1528 CZ PHE A 723 -27.873 -10.971 -1.838 1.00 0.00 C ATOM 0 H PHE A 723 -23.679 -13.274 1.224 1.00 0.00 H new ATOM 0 HA PHE A 723 -23.914 -13.972 -1.623 1.00 0.00 H new ATOM 0 HB2 PHE A 723 -23.420 -11.307 -0.282 1.00 0.00 H new ATOM 0 HB3 PHE A 723 -23.199 -11.608 -1.995 1.00 0.00 H new ATOM 0 HD1 PHE A 723 -25.770 -11.647 0.703 1.00 0.00 H new ATOM 0 HD2 PHE A 723 -24.974 -11.453 -3.473 1.00 0.00 H new ATOM 0 HE1 PHE A 723 -28.125 -11.092 0.283 1.00 0.00 H new ATOM 0 HE2 PHE A 723 -27.324 -10.915 -3.904 1.00 0.00 H new ATOM 0 HZ PHE A 723 -28.909 -10.732 -2.026 1.00 0.00 H new ATOM 1538 N THR A 724 -21.404 -13.855 -1.837 1.00 0.00 N ATOM 1539 CA THR A 724 -19.999 -14.009 -1.884 1.00 0.00 C ATOM 1540 C THR A 724 -19.439 -12.895 -2.749 1.00 0.00 C ATOM 1541 O THR A 724 -20.043 -12.524 -3.776 1.00 0.00 O ATOM 1542 CB THR A 724 -19.600 -15.430 -2.389 1.00 0.00 C ATOM 1543 OG1 THR A 724 -18.178 -15.608 -2.380 1.00 0.00 O ATOM 1544 CG2 THR A 724 -20.160 -15.721 -3.771 1.00 0.00 C ATOM 0 H THR A 724 -21.878 -13.991 -2.730 1.00 0.00 H new ATOM 0 HA THR A 724 -19.571 -13.930 -0.885 1.00 0.00 H new ATOM 0 HB THR A 724 -20.041 -16.144 -1.694 1.00 0.00 H new ATOM 0 HG1 THR A 724 -17.959 -16.508 -2.700 1.00 0.00 H new ATOM 0 HG21 THR A 724 -19.858 -16.721 -4.083 1.00 0.00 H new ATOM 0 HG22 THR A 724 -21.248 -15.663 -3.742 1.00 0.00 H new ATOM 0 HG23 THR A 724 -19.777 -14.988 -4.481 1.00 0.00 H new ATOM 1552 N MET A 725 -18.357 -12.305 -2.309 1.00 0.00 N ATOM 1553 CA MET A 725 -17.788 -11.208 -3.007 1.00 0.00 C ATOM 1554 C MET A 725 -16.743 -11.702 -3.979 1.00 0.00 C ATOM 1555 O MET A 725 -16.023 -12.663 -3.708 1.00 0.00 O ATOM 1556 CB MET A 725 -17.187 -10.213 -2.023 1.00 0.00 C ATOM 1557 CG MET A 725 -15.855 -10.626 -1.440 1.00 0.00 C ATOM 1558 SD MET A 725 -15.464 -9.754 0.102 1.00 0.00 S ATOM 1559 CE MET A 725 -15.580 -8.057 -0.414 1.00 0.00 C ATOM 0 H MET A 725 -17.858 -12.577 -1.462 1.00 0.00 H new ATOM 0 HA MET A 725 -18.570 -10.699 -3.571 1.00 0.00 H new ATOM 0 HB2 MET A 725 -17.066 -9.254 -2.526 1.00 0.00 H new ATOM 0 HB3 MET A 725 -17.893 -10.058 -1.207 1.00 0.00 H new ATOM 0 HG2 MET A 725 -15.862 -11.700 -1.253 1.00 0.00 H new ATOM 0 HG3 MET A 725 -15.069 -10.435 -2.170 1.00 0.00 H new ATOM 0 HE1 MET A 725 -15.347 -7.404 0.427 1.00 0.00 H new ATOM 0 HE2 MET A 725 -14.873 -7.873 -1.223 1.00 0.00 H new ATOM 0 HE3 MET A 725 -16.592 -7.851 -0.763 1.00 0.00 H new ATOM 1569 N ILE A 726 -16.702 -11.093 -5.098 1.00 0.00 N ATOM 1570 CA ILE A 726 -15.747 -11.428 -6.112 1.00 0.00 C ATOM 1571 C ILE A 726 -14.899 -10.212 -6.379 1.00 0.00 C ATOM 1572 O ILE A 726 -15.434 -9.156 -6.721 1.00 0.00 O ATOM 1573 CB ILE A 726 -16.438 -11.837 -7.425 1.00 0.00 C ATOM 1574 CG1 ILE A 726 -17.561 -12.851 -7.157 1.00 0.00 C ATOM 1575 CG2 ILE A 726 -15.399 -12.433 -8.364 1.00 0.00 C ATOM 1576 CD1 ILE A 726 -18.351 -13.223 -8.391 1.00 0.00 C ATOM 0 H ILE A 726 -17.334 -10.334 -5.353 1.00 0.00 H new ATOM 0 HA ILE A 726 -15.148 -12.269 -5.762 1.00 0.00 H new ATOM 0 HB ILE A 726 -16.887 -10.957 -7.885 1.00 0.00 H new ATOM 0 HG12 ILE A 726 -17.128 -13.754 -6.728 1.00 0.00 H new ATOM 0 HG13 ILE A 726 -18.241 -12.438 -6.412 1.00 0.00 H new ATOM 0 HG21 ILE A 726 -15.878 -12.726 -9.298 1.00 0.00 H new ATOM 0 HG22 ILE A 726 -14.627 -11.692 -8.570 1.00 0.00 H new ATOM 0 HG23 ILE A 726 -14.947 -13.308 -7.898 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -19.126 -13.942 -8.124 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -18.814 -12.329 -8.810 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -17.684 -13.666 -9.130 1.00 0.00 H new ATOM 1588 N GLY A 727 -13.621 -10.340 -6.186 1.00 0.00 N ATOM 1589 CA GLY A 727 -12.720 -9.252 -6.411 1.00 0.00 C ATOM 1590 C GLY A 727 -11.823 -9.060 -5.260 1.00 0.00 C ATOM 1591 O GLY A 727 -11.486 -10.018 -4.560 1.00 0.00 O ATOM 0 H GLY A 727 -13.175 -11.200 -5.869 1.00 0.00 H new ATOM 0 HA2 GLY A 727 -12.130 -9.444 -7.307 1.00 0.00 H new ATOM 0 HA3 GLY A 727 -13.286 -8.338 -6.591 1.00 0.00 H new ATOM 1595 N HIS A 728 -11.456 -7.843 -5.023 1.00 0.00 N ATOM 1596 CA HIS A 728 -10.550 -7.571 -3.970 1.00 0.00 C ATOM 1597 C HIS A 728 -11.308 -7.122 -2.768 1.00 0.00 C ATOM 1598 O HIS A 728 -12.161 -6.242 -2.856 1.00 0.00 O ATOM 1599 CB HIS A 728 -9.528 -6.522 -4.387 1.00 0.00 C ATOM 1600 CG HIS A 728 -8.292 -6.521 -3.561 1.00 0.00 C ATOM 1601 ND1 HIS A 728 -7.418 -5.465 -3.496 1.00 0.00 N ATOM 1602 CD2 HIS A 728 -7.756 -7.500 -2.830 1.00 0.00 C ATOM 1603 CE1 HIS A 728 -6.388 -5.803 -2.758 1.00 0.00 C ATOM 1604 NE2 HIS A 728 -6.567 -7.036 -2.336 1.00 0.00 N ATOM 0 H HIS A 728 -11.772 -7.027 -5.546 1.00 0.00 H new ATOM 0 HA HIS A 728 -10.004 -8.483 -3.729 1.00 0.00 H new ATOM 0 HB2 HIS A 728 -9.256 -6.689 -5.429 1.00 0.00 H new ATOM 0 HB3 HIS A 728 -9.991 -5.537 -4.332 1.00 0.00 H new ATOM 0 HD2 HIS A 728 -8.182 -8.478 -2.660 1.00 0.00 H new ATOM 0 HE1 HIS A 728 -5.538 -5.176 -2.535 1.00 0.00 H new ATOM 0 HE2 HIS A 728 -5.926 -7.559 -1.740 1.00 0.00 H new ATOM 1613 N ARG A 729 -11.013 -7.747 -1.669 1.00 0.00 N ATOM 1614 CA ARG A 729 -11.621 -7.404 -0.389 1.00 0.00 C ATOM 1615 C ARG A 729 -11.207 -6.011 0.064 1.00 0.00 C ATOM 1616 O ARG A 729 -11.943 -5.337 0.759 1.00 0.00 O ATOM 1617 CB ARG A 729 -11.281 -8.437 0.699 1.00 0.00 C ATOM 1618 CG ARG A 729 -9.792 -8.683 0.901 1.00 0.00 C ATOM 1619 CD ARG A 729 -9.528 -9.594 2.092 1.00 0.00 C ATOM 1620 NE ARG A 729 -9.795 -8.927 3.376 1.00 0.00 N ATOM 1621 CZ ARG A 729 -10.390 -9.471 4.439 1.00 0.00 C ATOM 1622 NH1 ARG A 729 -10.835 -10.724 4.397 1.00 0.00 N ATOM 1623 NH2 ARG A 729 -10.511 -8.755 5.550 1.00 0.00 N ATOM 0 H ARG A 729 -10.343 -8.514 -1.619 1.00 0.00 H new ATOM 0 HA ARG A 729 -12.701 -7.414 -0.540 1.00 0.00 H new ATOM 0 HB2 ARG A 729 -11.712 -8.105 1.644 1.00 0.00 H new ATOM 0 HB3 ARG A 729 -11.760 -9.383 0.445 1.00 0.00 H new ATOM 0 HG2 ARG A 729 -9.372 -9.131 0.000 1.00 0.00 H new ATOM 0 HG3 ARG A 729 -9.283 -7.731 1.051 1.00 0.00 H new ATOM 0 HD2 ARG A 729 -10.152 -10.484 2.011 1.00 0.00 H new ATOM 0 HD3 ARG A 729 -8.491 -9.928 2.068 1.00 0.00 H new ATOM 0 HE ARG A 729 -9.497 -7.955 3.462 1.00 0.00 H new ATOM 0 HH11 ARG A 729 -10.722 -11.277 3.547 1.00 0.00 H new ATOM 0 HH12 ARG A 729 -11.289 -11.132 5.215 1.00 0.00 H new ATOM 0 HH21 ARG A 729 -10.151 -7.801 5.584 1.00 0.00 H new ATOM 0 HH22 ARG A 729 -10.964 -9.159 6.370 1.00 0.00 H new ATOM 1637 N SER A 730 -10.052 -5.577 -0.349 1.00 0.00 N ATOM 1638 CA SER A 730 -9.571 -4.300 0.055 1.00 0.00 C ATOM 1639 C SER A 730 -9.451 -3.364 -1.129 1.00 0.00 C ATOM 1640 O SER A 730 -9.409 -3.801 -2.288 1.00 0.00 O ATOM 1641 CB SER A 730 -8.255 -4.451 0.809 1.00 0.00 C ATOM 1642 OG SER A 730 -7.337 -5.253 0.086 1.00 0.00 O ATOM 0 H SER A 730 -9.428 -6.095 -0.968 1.00 0.00 H new ATOM 0 HA SER A 730 -10.292 -3.849 0.736 1.00 0.00 H new ATOM 0 HB2 SER A 730 -7.820 -3.467 0.987 1.00 0.00 H new ATOM 0 HB3 SER A 730 -8.442 -4.898 1.785 1.00 0.00 H new ATOM 0 HG SER A 730 -6.502 -5.331 0.592 1.00 0.00 H new ATOM 1648 N ILE A 731 -9.469 -2.102 -0.850 1.00 0.00 N ATOM 1649 CA ILE A 731 -9.345 -1.086 -1.847 1.00 0.00 C ATOM 1650 C ILE A 731 -8.309 -0.099 -1.445 1.00 0.00 C ATOM 1651 O ILE A 731 -7.883 -0.071 -0.300 1.00 0.00 O ATOM 1652 CB ILE A 731 -10.670 -0.352 -2.063 1.00 0.00 C ATOM 1653 CG1 ILE A 731 -11.244 0.112 -0.702 1.00 0.00 C ATOM 1654 CG2 ILE A 731 -11.626 -1.225 -2.833 1.00 0.00 C ATOM 1655 CD1 ILE A 731 -12.617 0.699 -0.746 1.00 0.00 C ATOM 0 H ILE A 731 -9.573 -1.739 0.098 1.00 0.00 H new ATOM 0 HA ILE A 731 -9.057 -1.573 -2.778 1.00 0.00 H new ATOM 0 HB ILE A 731 -10.506 0.543 -2.663 1.00 0.00 H new ATOM 0 HG12 ILE A 731 -11.255 -0.741 -0.023 1.00 0.00 H new ATOM 0 HG13 ILE A 731 -10.566 0.851 -0.275 1.00 0.00 H new ATOM 0 HG21 ILE A 731 -12.566 -0.693 -2.981 1.00 0.00 H new ATOM 0 HG22 ILE A 731 -11.193 -1.473 -3.802 1.00 0.00 H new ATOM 0 HG23 ILE A 731 -11.812 -2.142 -2.274 1.00 0.00 H new ATOM 0 HD11 ILE A 731 -12.921 0.990 0.260 1.00 0.00 H new ATOM 0 HD12 ILE A 731 -12.617 1.576 -1.393 1.00 0.00 H new ATOM 0 HD13 ILE A 731 -13.316 -0.040 -1.137 1.00 0.00 H new ATOM 1667 N THR A 732 -7.925 0.703 -2.367 1.00 0.00 N ATOM 1668 CA THR A 732 -6.955 1.715 -2.153 1.00 0.00 C ATOM 1669 C THR A 732 -7.458 2.968 -2.826 1.00 0.00 C ATOM 1670 O THR A 732 -8.042 2.889 -3.899 1.00 0.00 O ATOM 1671 CB THR A 732 -5.595 1.298 -2.747 1.00 0.00 C ATOM 1672 OG1 THR A 732 -5.169 0.064 -2.137 1.00 0.00 O ATOM 1673 CG2 THR A 732 -4.553 2.372 -2.510 1.00 0.00 C ATOM 0 H THR A 732 -8.286 0.674 -3.320 1.00 0.00 H new ATOM 0 HA THR A 732 -6.808 1.882 -1.086 1.00 0.00 H new ATOM 0 HB THR A 732 -5.708 1.161 -3.822 1.00 0.00 H new ATOM 0 HG1 THR A 732 -4.305 -0.206 -2.513 1.00 0.00 H new ATOM 0 HG21 THR A 732 -3.601 2.056 -2.938 1.00 0.00 H new ATOM 0 HG22 THR A 732 -4.873 3.300 -2.983 1.00 0.00 H new ATOM 0 HG23 THR A 732 -4.434 2.533 -1.439 1.00 0.00 H new ATOM 1681 N CYS A 733 -7.330 4.083 -2.180 1.00 0.00 N ATOM 1682 CA CYS A 733 -7.788 5.309 -2.760 1.00 0.00 C ATOM 1683 C CYS A 733 -6.866 5.797 -3.831 1.00 0.00 C ATOM 1684 O CYS A 733 -5.683 6.064 -3.587 1.00 0.00 O ATOM 1685 CB CYS A 733 -8.002 6.396 -1.756 1.00 0.00 C ATOM 1686 SG CYS A 733 -8.604 7.908 -2.556 1.00 0.00 S ATOM 0 H CYS A 733 -6.914 4.172 -1.253 1.00 0.00 H new ATOM 0 HA CYS A 733 -8.756 5.069 -3.200 1.00 0.00 H new ATOM 0 HB2 CYS A 733 -8.720 6.067 -1.005 1.00 0.00 H new ATOM 0 HB3 CYS A 733 -7.068 6.603 -1.234 1.00 0.00 H new ATOM 1691 N ILE A 734 -7.413 5.905 -5.000 1.00 0.00 N ATOM 1692 CA ILE A 734 -6.740 6.342 -6.168 1.00 0.00 C ATOM 1693 C ILE A 734 -7.551 7.486 -6.803 1.00 0.00 C ATOM 1694 O ILE A 734 -8.666 7.278 -7.267 1.00 0.00 O ATOM 1695 CB ILE A 734 -6.599 5.167 -7.175 1.00 0.00 C ATOM 1696 CG1 ILE A 734 -5.844 3.987 -6.534 1.00 0.00 C ATOM 1697 CG2 ILE A 734 -5.917 5.622 -8.444 1.00 0.00 C ATOM 1698 CD1 ILE A 734 -4.487 4.357 -6.005 1.00 0.00 C ATOM 0 H ILE A 734 -8.393 5.677 -5.167 1.00 0.00 H new ATOM 0 HA ILE A 734 -5.742 6.694 -5.909 1.00 0.00 H new ATOM 0 HB ILE A 734 -7.600 4.824 -7.439 1.00 0.00 H new ATOM 0 HG12 ILE A 734 -6.444 3.582 -5.719 1.00 0.00 H new ATOM 0 HG13 ILE A 734 -5.733 3.193 -7.273 1.00 0.00 H new ATOM 0 HG21 ILE A 734 -5.830 4.781 -9.132 1.00 0.00 H new ATOM 0 HG22 ILE A 734 -6.505 6.413 -8.910 1.00 0.00 H new ATOM 0 HG23 ILE A 734 -4.923 6.001 -8.207 1.00 0.00 H new ATOM 0 HD11 ILE A 734 -4.014 3.477 -5.568 1.00 0.00 H new ATOM 0 HD12 ILE A 734 -3.869 4.734 -6.820 1.00 0.00 H new ATOM 0 HD13 ILE A 734 -4.592 5.129 -5.242 1.00 0.00 H new ATOM 1710 N HIS A 735 -7.001 8.694 -6.732 1.00 0.00 N ATOM 1711 CA HIS A 735 -7.595 9.918 -7.311 1.00 0.00 C ATOM 1712 C HIS A 735 -8.832 10.382 -6.559 1.00 0.00 C ATOM 1713 O HIS A 735 -9.691 11.079 -7.110 1.00 0.00 O ATOM 1714 CB HIS A 735 -7.870 9.781 -8.823 1.00 0.00 C ATOM 1715 CG HIS A 735 -6.637 9.816 -9.675 1.00 0.00 C ATOM 1716 ND1 HIS A 735 -6.181 10.957 -10.281 1.00 0.00 N ATOM 1717 CD2 HIS A 735 -5.762 8.848 -10.014 1.00 0.00 C ATOM 1718 CE1 HIS A 735 -5.087 10.695 -10.949 1.00 0.00 C ATOM 1719 NE2 HIS A 735 -4.810 9.422 -10.802 1.00 0.00 N ATOM 0 H HIS A 735 -6.111 8.865 -6.263 1.00 0.00 H new ATOM 0 HA HIS A 735 -6.843 10.697 -7.192 1.00 0.00 H new ATOM 0 HB2 HIS A 735 -8.396 8.843 -9.002 1.00 0.00 H new ATOM 0 HB3 HIS A 735 -8.537 10.585 -9.134 1.00 0.00 H new ATOM 0 HD2 HIS A 735 -5.807 7.811 -9.716 1.00 0.00 H new ATOM 0 HE1 HIS A 735 -4.511 11.406 -11.523 1.00 0.00 H new ATOM 0 HE2 HIS A 735 -4.010 8.939 -11.212 1.00 0.00 H new ATOM 1728 N GLY A 736 -8.895 10.046 -5.278 1.00 0.00 N ATOM 1729 CA GLY A 736 -10.021 10.450 -4.469 1.00 0.00 C ATOM 1730 C GLY A 736 -11.132 9.434 -4.531 1.00 0.00 C ATOM 1731 O GLY A 736 -12.195 9.628 -3.939 1.00 0.00 O ATOM 0 H GLY A 736 -8.186 9.501 -4.787 1.00 0.00 H new ATOM 0 HA2 GLY A 736 -9.701 10.579 -3.435 1.00 0.00 H new ATOM 0 HA3 GLY A 736 -10.390 11.417 -4.812 1.00 0.00 H new ATOM 1735 N VAL A 737 -10.881 8.340 -5.237 1.00 0.00 N ATOM 1736 CA VAL A 737 -11.864 7.289 -5.433 1.00 0.00 C ATOM 1737 C VAL A 737 -11.163 5.994 -5.104 1.00 0.00 C ATOM 1738 O VAL A 737 -9.977 5.921 -5.217 1.00 0.00 O ATOM 1739 CB VAL A 737 -12.361 7.257 -6.924 1.00 0.00 C ATOM 1740 CG1 VAL A 737 -13.463 6.225 -7.137 1.00 0.00 C ATOM 1741 CG2 VAL A 737 -12.839 8.632 -7.376 1.00 0.00 C ATOM 0 H VAL A 737 -9.986 8.158 -5.691 1.00 0.00 H new ATOM 0 HA VAL A 737 -12.738 7.453 -4.802 1.00 0.00 H new ATOM 0 HB VAL A 737 -11.505 6.965 -7.533 1.00 0.00 H new ATOM 0 HG11 VAL A 737 -13.776 6.237 -8.181 1.00 0.00 H new ATOM 0 HG12 VAL A 737 -13.087 5.234 -6.882 1.00 0.00 H new ATOM 0 HG13 VAL A 737 -14.314 6.465 -6.500 1.00 0.00 H new ATOM 0 HG21 VAL A 737 -13.176 8.578 -8.411 1.00 0.00 H new ATOM 0 HG22 VAL A 737 -13.664 8.957 -6.742 1.00 0.00 H new ATOM 0 HG23 VAL A 737 -12.019 9.346 -7.299 1.00 0.00 H new ATOM 1751 N TRP A 738 -11.857 5.002 -4.682 1.00 0.00 N ATOM 1752 CA TRP A 738 -11.203 3.760 -4.342 1.00 0.00 C ATOM 1753 C TRP A 738 -11.046 2.904 -5.590 1.00 0.00 C ATOM 1754 O TRP A 738 -11.835 3.042 -6.526 1.00 0.00 O ATOM 1755 CB TRP A 738 -11.990 3.038 -3.286 1.00 0.00 C ATOM 1756 CG TRP A 738 -12.170 3.852 -2.034 1.00 0.00 C ATOM 1757 CD1 TRP A 738 -13.233 4.619 -1.701 1.00 0.00 C ATOM 1758 CD2 TRP A 738 -11.245 3.982 -0.970 1.00 0.00 C ATOM 1759 NE1 TRP A 738 -13.031 5.212 -0.488 1.00 0.00 N ATOM 1760 CE2 TRP A 738 -11.806 4.844 -0.022 1.00 0.00 C ATOM 1761 CE3 TRP A 738 -10.002 3.450 -0.734 1.00 0.00 C ATOM 1762 CZ2 TRP A 738 -11.147 5.183 1.147 1.00 0.00 C ATOM 1763 CZ3 TRP A 738 -9.345 3.775 0.410 1.00 0.00 C ATOM 1764 CH2 TRP A 738 -9.911 4.641 1.346 1.00 0.00 C ATOM 0 H TRP A 738 -12.870 5.009 -4.559 1.00 0.00 H new ATOM 0 HA TRP A 738 -10.211 3.968 -3.942 1.00 0.00 H new ATOM 0 HB2 TRP A 738 -12.969 2.774 -3.686 1.00 0.00 H new ATOM 0 HB3 TRP A 738 -11.485 2.105 -3.037 1.00 0.00 H new ATOM 0 HD1 TRP A 738 -14.117 4.745 -2.309 1.00 0.00 H new ATOM 0 HE1 TRP A 738 -13.689 5.828 -0.010 1.00 0.00 H new ATOM 0 HE3 TRP A 738 -9.551 2.780 -1.451 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 -11.593 5.849 1.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 -8.368 3.356 0.598 1.00 0.00 H new ATOM 0 HH2 TRP A 738 -9.362 4.886 2.243 1.00 0.00 H new ATOM 1775 N THR A 739 -10.040 2.028 -5.562 1.00 0.00 N ATOM 1776 CA THR A 739 -9.620 1.178 -6.697 1.00 0.00 C ATOM 1777 C THR A 739 -10.716 0.711 -7.618 1.00 0.00 C ATOM 1778 O THR A 739 -10.783 1.151 -8.757 1.00 0.00 O ATOM 1779 CB THR A 739 -8.769 -0.033 -6.253 1.00 0.00 C ATOM 1780 OG1 THR A 739 -9.424 -0.771 -5.198 1.00 0.00 O ATOM 1781 CG2 THR A 739 -7.418 0.411 -5.781 1.00 0.00 C ATOM 0 H THR A 739 -9.473 1.880 -4.727 1.00 0.00 H new ATOM 0 HA THR A 739 -9.010 1.865 -7.283 1.00 0.00 H new ATOM 0 HB THR A 739 -8.652 -0.684 -7.120 1.00 0.00 H new ATOM 0 HG1 THR A 739 -8.866 -1.533 -4.936 1.00 0.00 H new ATOM 0 HG21 THR A 739 -6.836 -0.458 -5.473 1.00 0.00 H new ATOM 0 HG22 THR A 739 -6.901 0.926 -6.591 1.00 0.00 H new ATOM 0 HG23 THR A 739 -7.533 1.089 -4.935 1.00 0.00 H new ATOM 1789 N GLN A 740 -11.565 -0.162 -7.135 1.00 0.00 N ATOM 1790 CA GLN A 740 -12.569 -0.757 -7.996 1.00 0.00 C ATOM 1791 C GLN A 740 -13.707 -1.389 -7.271 1.00 0.00 C ATOM 1792 O GLN A 740 -14.828 -1.360 -7.767 1.00 0.00 O ATOM 1793 CB GLN A 740 -11.932 -1.715 -9.032 1.00 0.00 C ATOM 1794 CG GLN A 740 -10.730 -2.572 -8.535 1.00 0.00 C ATOM 1795 CD GLN A 740 -11.042 -3.549 -7.411 1.00 0.00 C ATOM 1796 OE1 GLN A 740 -11.439 -4.687 -7.647 1.00 0.00 O ATOM 1797 NE2 GLN A 740 -10.775 -3.147 -6.183 1.00 0.00 N ATOM 0 H GLN A 740 -11.586 -0.476 -6.165 1.00 0.00 H new ATOM 0 HA GLN A 740 -13.017 0.076 -8.537 1.00 0.00 H new ATOM 0 HB2 GLN A 740 -12.707 -2.391 -9.394 1.00 0.00 H new ATOM 0 HB3 GLN A 740 -11.600 -1.124 -9.885 1.00 0.00 H new ATOM 0 HG2 GLN A 740 -10.332 -3.133 -9.381 1.00 0.00 H new ATOM 0 HG3 GLN A 740 -9.941 -1.899 -8.199 1.00 0.00 H new ATOM 0 HE21 GLN A 740 -10.447 -2.196 -6.018 1.00 0.00 H new ATOM 0 HE22 GLN A 740 -10.897 -3.788 -5.399 1.00 0.00 H new ATOM 1806 N LEU A 741 -13.421 -1.925 -6.097 1.00 0.00 N ATOM 1807 CA LEU A 741 -14.386 -2.648 -5.264 1.00 0.00 C ATOM 1808 C LEU A 741 -14.776 -3.996 -5.895 1.00 0.00 C ATOM 1809 O LEU A 741 -14.635 -4.203 -7.102 1.00 0.00 O ATOM 1810 CB LEU A 741 -15.617 -1.790 -5.025 1.00 0.00 C ATOM 1811 CG LEU A 741 -15.320 -0.435 -4.432 1.00 0.00 C ATOM 1812 CD1 LEU A 741 -16.526 0.422 -4.556 1.00 0.00 C ATOM 1813 CD2 LEU A 741 -14.975 -0.572 -2.977 1.00 0.00 C ATOM 0 H LEU A 741 -12.491 -1.872 -5.680 1.00 0.00 H new ATOM 0 HA LEU A 741 -13.913 -2.860 -4.305 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -16.140 -1.653 -5.971 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -16.295 -2.325 -4.360 1.00 0.00 H new ATOM 0 HG LEU A 741 -14.479 0.010 -4.963 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -16.320 1.404 -4.130 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -16.788 0.531 -5.608 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -17.356 -0.039 -4.021 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -14.762 0.412 -2.559 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -15.815 -1.019 -2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -14.097 -1.209 -2.870 1.00 0.00 H new ATOM 1825 N PRO A 742 -15.200 -4.944 -5.082 1.00 0.00 N ATOM 1826 CA PRO A 742 -15.660 -6.241 -5.566 1.00 0.00 C ATOM 1827 C PRO A 742 -17.146 -6.196 -5.984 1.00 0.00 C ATOM 1828 O PRO A 742 -17.719 -5.126 -6.178 1.00 0.00 O ATOM 1829 CB PRO A 742 -15.497 -7.115 -4.325 1.00 0.00 C ATOM 1830 CG PRO A 742 -15.790 -6.190 -3.201 1.00 0.00 C ATOM 1831 CD PRO A 742 -15.245 -4.859 -3.609 1.00 0.00 C ATOM 0 HA PRO A 742 -15.117 -6.589 -6.445 1.00 0.00 H new ATOM 0 HB2 PRO A 742 -16.185 -7.960 -4.338 1.00 0.00 H new ATOM 0 HB3 PRO A 742 -14.490 -7.525 -4.254 1.00 0.00 H new ATOM 0 HG2 PRO A 742 -16.862 -6.132 -3.013 1.00 0.00 H new ATOM 0 HG3 PRO A 742 -15.323 -6.537 -2.279 1.00 0.00 H new ATOM 0 HD2 PRO A 742 -15.885 -4.043 -3.273 1.00 0.00 H new ATOM 0 HD3 PRO A 742 -14.256 -4.683 -3.186 1.00 0.00 H new ATOM 1839 N GLN A 743 -17.748 -7.346 -6.117 1.00 0.00 N ATOM 1840 CA GLN A 743 -19.153 -7.463 -6.408 1.00 0.00 C ATOM 1841 C GLN A 743 -19.681 -8.601 -5.582 1.00 0.00 C ATOM 1842 O GLN A 743 -18.906 -9.467 -5.178 1.00 0.00 O ATOM 1843 CB GLN A 743 -19.405 -7.749 -7.891 1.00 0.00 C ATOM 1844 CG GLN A 743 -18.761 -9.031 -8.396 1.00 0.00 C ATOM 1845 CD GLN A 743 -19.216 -9.431 -9.783 1.00 0.00 C ATOM 1846 OE1 GLN A 743 -18.459 -10.027 -10.540 1.00 0.00 O ATOM 1847 NE2 GLN A 743 -20.459 -9.164 -10.115 1.00 0.00 N ATOM 0 H GLN A 743 -17.270 -8.242 -6.025 1.00 0.00 H new ATOM 0 HA GLN A 743 -19.653 -6.524 -6.172 1.00 0.00 H new ATOM 0 HB2 GLN A 743 -20.480 -7.804 -8.061 1.00 0.00 H new ATOM 0 HB3 GLN A 743 -19.031 -6.911 -8.480 1.00 0.00 H new ATOM 0 HG2 GLN A 743 -17.678 -8.907 -8.399 1.00 0.00 H new ATOM 0 HG3 GLN A 743 -18.987 -9.840 -7.701 1.00 0.00 H new ATOM 0 HE21 GLN A 743 -21.065 -8.666 -9.463 1.00 0.00 H new ATOM 0 HE22 GLN A 743 -20.818 -9.455 -11.025 1.00 0.00 H new ATOM 1856 N CYS A 744 -20.936 -8.595 -5.294 1.00 0.00 N ATOM 1857 CA CYS A 744 -21.533 -9.672 -4.542 1.00 0.00 C ATOM 1858 C CYS A 744 -22.479 -10.485 -5.401 1.00 0.00 C ATOM 1859 O CYS A 744 -23.184 -9.946 -6.244 1.00 0.00 O ATOM 1860 CB CYS A 744 -22.274 -9.131 -3.334 1.00 0.00 C ATOM 1861 SG CYS A 744 -21.207 -8.436 -2.037 1.00 0.00 S ATOM 0 H CYS A 744 -21.583 -7.855 -5.565 1.00 0.00 H new ATOM 0 HA CYS A 744 -20.727 -10.324 -4.206 1.00 0.00 H new ATOM 0 HB2 CYS A 744 -22.968 -8.359 -3.666 1.00 0.00 H new ATOM 0 HB3 CYS A 744 -22.872 -9.934 -2.902 1.00 0.00 H new ATOM 1866 N VAL A 745 -22.479 -11.772 -5.208 1.00 0.00 N ATOM 1867 CA VAL A 745 -23.386 -12.643 -5.893 1.00 0.00 C ATOM 1868 C VAL A 745 -24.010 -13.557 -4.879 1.00 0.00 C ATOM 1869 O VAL A 745 -23.346 -13.958 -3.910 1.00 0.00 O ATOM 1870 CB VAL A 745 -22.722 -13.462 -7.048 1.00 0.00 C ATOM 1871 CG1 VAL A 745 -22.339 -12.559 -8.211 1.00 0.00 C ATOM 1872 CG2 VAL A 745 -21.502 -14.204 -6.557 1.00 0.00 C ATOM 0 H VAL A 745 -21.845 -12.249 -4.567 1.00 0.00 H new ATOM 0 HA VAL A 745 -24.141 -12.027 -6.381 1.00 0.00 H new ATOM 0 HB VAL A 745 -23.458 -14.187 -7.395 1.00 0.00 H new ATOM 0 HG11 VAL A 745 -21.880 -13.156 -8.999 1.00 0.00 H new ATOM 0 HG12 VAL A 745 -23.231 -12.069 -8.600 1.00 0.00 H new ATOM 0 HG13 VAL A 745 -21.631 -11.804 -7.868 1.00 0.00 H new ATOM 0 HG21 VAL A 745 -21.061 -14.765 -7.381 1.00 0.00 H new ATOM 0 HG22 VAL A 745 -20.773 -13.491 -6.172 1.00 0.00 H new ATOM 0 HG23 VAL A 745 -21.790 -14.893 -5.763 1.00 0.00 H new ATOM 1882 N ALA A 746 -25.272 -13.820 -5.044 1.00 0.00 N ATOM 1883 CA ALA A 746 -26.009 -14.650 -4.118 1.00 0.00 C ATOM 1884 C ALA A 746 -25.515 -16.083 -4.144 1.00 0.00 C ATOM 1885 O ALA A 746 -25.521 -16.729 -5.198 1.00 0.00 O ATOM 1886 CB ALA A 746 -27.497 -14.590 -4.419 1.00 0.00 C ATOM 0 H ALA A 746 -25.827 -13.468 -5.824 1.00 0.00 H new ATOM 0 HA ALA A 746 -25.840 -14.261 -3.114 1.00 0.00 H new ATOM 0 HB1 ALA A 746 -28.037 -15.221 -3.713 1.00 0.00 H new ATOM 0 HB2 ALA A 746 -27.846 -13.561 -4.327 1.00 0.00 H new ATOM 0 HB3 ALA A 746 -27.678 -14.945 -5.434 1.00 0.00 H new ATOM 1892 N ILE A 747 -25.034 -16.540 -3.013 1.00 0.00 N ATOM 1893 CA ILE A 747 -24.603 -17.913 -2.840 1.00 0.00 C ATOM 1894 C ILE A 747 -25.837 -18.802 -2.848 1.00 0.00 C ATOM 1895 O ILE A 747 -26.615 -18.754 -1.879 1.00 0.00 O ATOM 1896 CB ILE A 747 -23.833 -18.121 -1.503 1.00 0.00 C ATOM 1897 CG1 ILE A 747 -22.628 -17.180 -1.426 1.00 0.00 C ATOM 1898 CG2 ILE A 747 -23.379 -19.577 -1.365 1.00 0.00 C ATOM 1899 CD1 ILE A 747 -21.859 -17.260 -0.119 1.00 0.00 C ATOM 1900 OXT ILE A 747 -26.053 -19.528 -3.835 1.00 0.00 O ATOM 0 H ILE A 747 -24.928 -15.966 -2.176 1.00 0.00 H new ATOM 0 HA ILE A 747 -23.923 -18.167 -3.653 1.00 0.00 H new ATOM 0 HB ILE A 747 -24.508 -17.889 -0.679 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -21.950 -17.408 -2.248 1.00 0.00 H new ATOM 0 HG13 ILE A 747 -22.971 -16.156 -1.571 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -22.843 -19.703 -0.425 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -24.250 -20.232 -1.377 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -22.721 -19.833 -2.195 1.00 0.00 H new ATOM 0 HD11 ILE A 747 -21.022 -16.563 -0.146 1.00 0.00 H new ATOM 0 HD12 ILE A 747 -22.520 -17.002 0.708 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -21.483 -18.273 0.020 1.00 0.00 H new