USER MOD reduce.3.24.130724 H: found=0, std=0, add=856, rem=0, adj=25 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 169:sc= -0.301 USER MOD Set 1.2: A 740 GLN : amide:sc= -0.448 K(o=-0.75,f=0.15) USER MOD Set 2.1: A 728 HIS : no HD1:sc= -0.205 X(o=-0.21,f=0.13) USER MOD Set 2.2: A 730 SER OG : rot 180:sc= -0.0035 USER MOD Set 3.1: A 651 HIS : no HD1:sc= 0 X(o=0,f=0.074) USER MOD Set 3.2: A 652 SER OG : rot 180:sc= 0 USER MOD Single : A 629 SER OG : rot -25:sc= 0.147 USER MOD Single : A 638 ASN : amide:sc= -2.13 K(o=-2.1,f=-0.47) USER MOD Single : A 640 ASN : amide:sc= -0.291 K(o=-0.29,f=-1.8!) USER MOD Single : A 642 LYS NZ :NH3+ -165:sc= 1.32 (180deg=1.12) USER MOD Single : A 644 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 645 THR OG1 : rot 42:sc= 0.0541 USER MOD Single : A 646 LYS NZ :NH3+ -165:sc= 1.28 (180deg=1.17) USER MOD Single : A 649 TYR OH : rot 180:sc= -0.336 USER MOD Single : A 657 TYR OH : rot -146:sc= 1.23 USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 660 ASN : amide:sc= -3.45! C(o=-3.4!,f=-6!) USER MOD Single : A 665 MET CE :methyl -122:sc= -3.55! (180deg=-5.1!) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 669 ASN : amide:sc= -1.69 K(o=-1.7,f=-0.3) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 672 GLN : amide:sc= -0.534 X(o=-0.53,f=-0.44) USER MOD Single : A 679 THR OG1 : rot 180:sc= 0.98 USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD Single : A 690 THR OG1 : rot -40:sc= 0.241 USER MOD Single : A 699 HIS : no HD1:sc= -0.0501 X(o=-0.05,f=-0.031) USER MOD Single : A 703 GLN : amide:sc= -4.45! C(o=-4.5!,f=-2.9!) USER MOD Single : A 705 SER OG : rot 35:sc= 0.143 USER MOD Single : A 706 SER OG : rot 180:sc= 0 USER MOD Single : A 709 TYR OH : rot 62:sc= -1.09 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= -3.4! K(o=-3.4!,f=-0.021) USER MOD Single : A 720 SER OG : rot 86:sc= 0.403 USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 724 THR OG1 : rot 180:sc= 0 USER MOD Single : A 725 MET CE :methyl -151:sc= -4.31! (180deg=-5.85!) USER MOD Single : A 732 THR OG1 : rot 180:sc= 0 USER MOD Single : A 735 HIS : no HD1:sc= -0.887 K(o=-0.89,f=-0.12) USER MOD Single : A 743 GLN : amide:sc= -1.1 K(o=-1.1,f=-0.00042) USER MOD ----------------------------------------------------------------- ATOM 103 N SER A 629 28.841 -7.925 1.867 1.00 0.00 N ATOM 104 CA SER A 629 27.731 -8.670 2.474 1.00 0.00 C ATOM 105 C SER A 629 26.732 -7.689 3.092 1.00 0.00 C ATOM 106 O SER A 629 27.136 -6.734 3.747 1.00 0.00 O ATOM 107 CB SER A 629 28.217 -9.650 3.551 1.00 0.00 C ATOM 108 OG SER A 629 29.108 -9.018 4.480 1.00 0.00 O ATOM 0 HA SER A 629 27.253 -9.251 1.686 1.00 0.00 H new ATOM 0 HB2 SER A 629 27.359 -10.055 4.088 1.00 0.00 H new ATOM 0 HB3 SER A 629 28.723 -10.491 3.076 1.00 0.00 H new ATOM 0 HG SER A 629 29.543 -8.253 4.048 1.00 0.00 H new ATOM 114 N CYS A 630 25.463 -7.885 2.851 1.00 0.00 N ATOM 115 CA CYS A 630 24.455 -7.054 3.466 1.00 0.00 C ATOM 116 C CYS A 630 23.315 -7.916 3.918 1.00 0.00 C ATOM 117 O CYS A 630 22.977 -8.924 3.248 1.00 0.00 O ATOM 118 CB CYS A 630 23.949 -5.969 2.518 1.00 0.00 C ATOM 119 SG CYS A 630 23.100 -6.584 1.029 1.00 0.00 S ATOM 0 H CYS A 630 25.100 -8.612 2.234 1.00 0.00 H new ATOM 0 HA CYS A 630 24.906 -6.549 4.320 1.00 0.00 H new ATOM 0 HB2 CYS A 630 23.266 -5.319 3.065 1.00 0.00 H new ATOM 0 HB3 CYS A 630 24.795 -5.355 2.208 1.00 0.00 H new ATOM 124 N GLY A 631 22.763 -7.582 5.047 1.00 0.00 N ATOM 125 CA GLY A 631 21.663 -8.300 5.577 1.00 0.00 C ATOM 126 C GLY A 631 20.354 -7.667 5.193 1.00 0.00 C ATOM 127 O GLY A 631 20.157 -7.323 4.033 1.00 0.00 O ATOM 0 H GLY A 631 23.072 -6.798 5.622 1.00 0.00 H new ATOM 0 HA2 GLY A 631 21.691 -9.328 5.216 1.00 0.00 H new ATOM 0 HA3 GLY A 631 21.744 -8.341 6.663 1.00 0.00 H new ATOM 131 N PRO A 632 19.437 -7.515 6.151 1.00 0.00 N ATOM 132 CA PRO A 632 18.118 -6.901 5.932 1.00 0.00 C ATOM 133 C PRO A 632 18.199 -5.509 5.286 1.00 0.00 C ATOM 134 O PRO A 632 19.149 -4.749 5.535 1.00 0.00 O ATOM 135 CB PRO A 632 17.549 -6.782 7.347 1.00 0.00 C ATOM 136 CG PRO A 632 18.222 -7.861 8.102 1.00 0.00 C ATOM 137 CD PRO A 632 19.608 -7.945 7.547 1.00 0.00 C ATOM 0 HA PRO A 632 17.513 -7.495 5.247 1.00 0.00 H new ATOM 0 HB2 PRO A 632 17.758 -5.803 7.779 1.00 0.00 H new ATOM 0 HB3 PRO A 632 16.466 -6.908 7.353 1.00 0.00 H new ATOM 0 HG2 PRO A 632 18.241 -7.638 9.169 1.00 0.00 H new ATOM 0 HG3 PRO A 632 17.695 -8.808 7.983 1.00 0.00 H new ATOM 0 HD2 PRO A 632 20.298 -7.296 8.087 1.00 0.00 H new ATOM 0 HD3 PRO A 632 20.007 -8.957 7.611 1.00 0.00 H new ATOM 145 N PRO A 633 17.205 -5.166 4.448 1.00 0.00 N ATOM 146 CA PRO A 633 17.151 -3.869 3.785 1.00 0.00 C ATOM 147 C PRO A 633 16.954 -2.729 4.797 1.00 0.00 C ATOM 148 O PRO A 633 16.493 -2.965 5.931 1.00 0.00 O ATOM 149 CB PRO A 633 15.923 -3.984 2.855 1.00 0.00 C ATOM 150 CG PRO A 633 15.096 -5.071 3.430 1.00 0.00 C ATOM 151 CD PRO A 633 16.051 -6.014 4.099 1.00 0.00 C ATOM 0 HA PRO A 633 18.074 -3.637 3.253 1.00 0.00 H new ATOM 0 HB2 PRO A 633 15.369 -3.046 2.818 1.00 0.00 H new ATOM 0 HB3 PRO A 633 16.224 -4.217 1.834 1.00 0.00 H new ATOM 0 HG2 PRO A 633 14.375 -4.675 4.145 1.00 0.00 H new ATOM 0 HG3 PRO A 633 14.527 -5.580 2.652 1.00 0.00 H new ATOM 0 HD2 PRO A 633 15.608 -6.469 4.985 1.00 0.00 H new ATOM 0 HD3 PRO A 633 16.340 -6.828 3.434 1.00 0.00 H new ATOM 159 N PRO A 634 17.325 -1.500 4.425 1.00 0.00 N ATOM 160 CA PRO A 634 17.155 -0.326 5.278 1.00 0.00 C ATOM 161 C PRO A 634 15.680 0.091 5.399 1.00 0.00 C ATOM 162 O PRO A 634 14.762 -0.647 4.981 1.00 0.00 O ATOM 163 CB PRO A 634 17.957 0.766 4.565 1.00 0.00 C ATOM 164 CG PRO A 634 18.107 0.311 3.154 1.00 0.00 C ATOM 165 CD PRO A 634 17.957 -1.174 3.141 1.00 0.00 C ATOM 0 HA PRO A 634 17.490 -0.516 6.298 1.00 0.00 H new ATOM 0 HB2 PRO A 634 17.440 1.724 4.613 1.00 0.00 H new ATOM 0 HB3 PRO A 634 18.930 0.905 5.036 1.00 0.00 H new ATOM 0 HG2 PRO A 634 17.354 0.778 2.519 1.00 0.00 H new ATOM 0 HG3 PRO A 634 19.081 0.601 2.759 1.00 0.00 H new ATOM 0 HD2 PRO A 634 17.342 -1.502 2.303 1.00 0.00 H new ATOM 0 HD3 PRO A 634 18.923 -1.668 3.039 1.00 0.00 H new ATOM 173 N GLU A 635 15.439 1.246 5.956 1.00 0.00 N ATOM 174 CA GLU A 635 14.092 1.709 6.107 1.00 0.00 C ATOM 175 C GLU A 635 13.848 2.857 5.147 1.00 0.00 C ATOM 176 O GLU A 635 14.756 3.643 4.857 1.00 0.00 O ATOM 177 CB GLU A 635 13.826 2.178 7.542 1.00 0.00 C ATOM 178 CG GLU A 635 14.465 3.509 7.862 1.00 0.00 C ATOM 179 CD GLU A 635 14.340 3.904 9.291 1.00 0.00 C ATOM 180 OE1 GLU A 635 13.280 4.460 9.678 1.00 0.00 O ATOM 181 OE2 GLU A 635 15.292 3.695 10.056 1.00 0.00 O ATOM 0 H GLU A 635 16.156 1.879 6.311 1.00 0.00 H new ATOM 0 HA GLU A 635 13.416 0.883 5.886 1.00 0.00 H new ATOM 0 HB2 GLU A 635 12.750 2.252 7.699 1.00 0.00 H new ATOM 0 HB3 GLU A 635 14.199 1.427 8.238 1.00 0.00 H new ATOM 0 HG2 GLU A 635 15.521 3.468 7.597 1.00 0.00 H new ATOM 0 HG3 GLU A 635 14.010 4.280 7.240 1.00 0.00 H new ATOM 188 N LEU A 636 12.657 2.961 4.658 1.00 0.00 N ATOM 189 CA LEU A 636 12.298 4.069 3.810 1.00 0.00 C ATOM 190 C LEU A 636 11.973 5.218 4.756 1.00 0.00 C ATOM 191 O LEU A 636 11.441 4.971 5.847 1.00 0.00 O ATOM 192 CB LEU A 636 11.062 3.684 2.955 1.00 0.00 C ATOM 193 CG LEU A 636 10.694 4.504 1.680 1.00 0.00 C ATOM 194 CD1 LEU A 636 9.459 3.994 1.016 1.00 0.00 C ATOM 195 CD2 LEU A 636 10.660 5.996 1.857 1.00 0.00 C ATOM 0 H LEU A 636 11.906 2.292 4.827 1.00 0.00 H new ATOM 0 HA LEU A 636 13.095 4.345 3.120 1.00 0.00 H new ATOM 0 HB2 LEU A 636 11.197 2.648 2.643 1.00 0.00 H new ATOM 0 HB3 LEU A 636 10.195 3.708 3.615 1.00 0.00 H new ATOM 0 HG LEU A 636 11.536 4.332 1.009 1.00 0.00 H new ATOM 0 HD11 LEU A 636 9.245 4.597 0.134 1.00 0.00 H new ATOM 0 HD12 LEU A 636 9.608 2.956 0.718 1.00 0.00 H new ATOM 0 HD13 LEU A 636 8.621 4.055 1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 636 10.394 6.469 0.911 1.00 0.00 H new ATOM 0 HD22 LEU A 636 9.919 6.256 2.613 1.00 0.00 H new ATOM 0 HD23 LEU A 636 11.642 6.347 2.175 1.00 0.00 H new ATOM 207 N LEU A 637 12.378 6.427 4.360 1.00 0.00 N ATOM 208 CA LEU A 637 12.115 7.693 5.056 1.00 0.00 C ATOM 209 C LEU A 637 10.762 7.667 5.749 1.00 0.00 C ATOM 210 O LEU A 637 10.691 7.613 6.970 1.00 0.00 O ATOM 211 CB LEU A 637 12.164 8.842 4.006 1.00 0.00 C ATOM 212 CG LEU A 637 12.108 10.323 4.481 1.00 0.00 C ATOM 213 CD1 LEU A 637 10.760 10.750 5.059 1.00 0.00 C ATOM 214 CD2 LEU A 637 13.239 10.619 5.434 1.00 0.00 C ATOM 0 H LEU A 637 12.923 6.558 3.508 1.00 0.00 H new ATOM 0 HA LEU A 637 12.870 7.850 5.826 1.00 0.00 H new ATOM 0 HB2 LEU A 637 13.082 8.719 3.431 1.00 0.00 H new ATOM 0 HB3 LEU A 637 11.333 8.689 3.317 1.00 0.00 H new ATOM 0 HG LEU A 637 12.231 10.929 3.583 1.00 0.00 H new ATOM 0 HD11 LEU A 637 10.810 11.795 5.365 1.00 0.00 H new ATOM 0 HD12 LEU A 637 9.985 10.630 4.302 1.00 0.00 H new ATOM 0 HD13 LEU A 637 10.522 10.130 5.923 1.00 0.00 H new ATOM 0 HD21 LEU A 637 13.182 11.659 5.754 1.00 0.00 H new ATOM 0 HD22 LEU A 637 13.162 9.967 6.304 1.00 0.00 H new ATOM 0 HD23 LEU A 637 14.192 10.445 4.933 1.00 0.00 H new ATOM 226 N ASN A 638 9.697 7.682 4.973 1.00 0.00 N ATOM 227 CA ASN A 638 8.390 7.689 5.580 1.00 0.00 C ATOM 228 C ASN A 638 7.713 6.341 5.370 1.00 0.00 C ATOM 229 O ASN A 638 6.988 5.850 6.218 1.00 0.00 O ATOM 230 CB ASN A 638 7.493 8.798 5.007 1.00 0.00 C ATOM 231 CG ASN A 638 6.237 9.015 5.852 1.00 0.00 C ATOM 232 OD1 ASN A 638 6.199 9.887 6.704 1.00 0.00 O ATOM 233 ND2 ASN A 638 5.232 8.204 5.661 1.00 0.00 N ATOM 0 H ASN A 638 9.711 7.689 3.953 1.00 0.00 H new ATOM 0 HA ASN A 638 8.528 7.881 6.644 1.00 0.00 H new ATOM 0 HB2 ASN A 638 8.058 9.729 4.952 1.00 0.00 H new ATOM 0 HB3 ASN A 638 7.204 8.540 3.988 1.00 0.00 H new ATOM 0 HD21 ASN A 638 4.391 8.292 6.231 1.00 0.00 H new ATOM 0 HD22 ASN A 638 5.288 7.483 4.942 1.00 0.00 H new ATOM 240 N GLY A 639 7.923 5.788 4.197 1.00 0.00 N ATOM 241 CA GLY A 639 7.350 4.518 3.820 1.00 0.00 C ATOM 242 C GLY A 639 8.052 3.340 4.449 1.00 0.00 C ATOM 243 O GLY A 639 8.662 3.463 5.526 1.00 0.00 O ATOM 0 H GLY A 639 8.502 6.212 3.472 1.00 0.00 H new ATOM 0 HA2 GLY A 639 6.298 4.502 4.107 1.00 0.00 H new ATOM 0 HA3 GLY A 639 7.386 4.418 2.735 1.00 0.00 H new ATOM 247 N ASN A 640 8.023 2.208 3.768 1.00 0.00 N ATOM 248 CA ASN A 640 8.656 1.015 4.287 1.00 0.00 C ATOM 249 C ASN A 640 8.716 -0.061 3.228 1.00 0.00 C ATOM 250 O ASN A 640 8.250 0.139 2.124 1.00 0.00 O ATOM 251 CB ASN A 640 7.944 0.509 5.533 1.00 0.00 C ATOM 252 CG ASN A 640 8.939 -0.112 6.484 1.00 0.00 C ATOM 253 OD1 ASN A 640 9.090 -1.329 6.549 1.00 0.00 O ATOM 254 ND2 ASN A 640 9.730 0.718 7.093 1.00 0.00 N ATOM 0 H ASN A 640 7.571 2.093 2.861 1.00 0.00 H new ATOM 0 HA ASN A 640 9.676 1.274 4.571 1.00 0.00 H new ATOM 0 HB2 ASN A 640 7.425 1.332 6.024 1.00 0.00 H new ATOM 0 HB3 ASN A 640 7.187 -0.225 5.256 1.00 0.00 H new ATOM 0 HD21 ASN A 640 10.509 0.365 7.649 1.00 0.00 H new ATOM 0 HD22 ASN A 640 9.573 1.723 7.015 1.00 0.00 H new ATOM 261 N VAL A 641 9.273 -1.184 3.567 1.00 0.00 N ATOM 262 CA VAL A 641 9.487 -2.272 2.645 1.00 0.00 C ATOM 263 C VAL A 641 8.386 -3.316 2.805 1.00 0.00 C ATOM 264 O VAL A 641 7.919 -3.558 3.909 1.00 0.00 O ATOM 265 CB VAL A 641 10.891 -2.900 2.888 1.00 0.00 C ATOM 266 CG1 VAL A 641 11.060 -3.270 4.337 1.00 0.00 C ATOM 267 CG2 VAL A 641 11.113 -4.112 2.022 1.00 0.00 C ATOM 0 H VAL A 641 9.601 -1.380 4.513 1.00 0.00 H new ATOM 0 HA VAL A 641 9.451 -1.894 1.623 1.00 0.00 H new ATOM 0 HB VAL A 641 11.635 -2.150 2.619 1.00 0.00 H new ATOM 0 HG11 VAL A 641 12.047 -3.707 4.488 1.00 0.00 H new ATOM 0 HG12 VAL A 641 10.960 -2.377 4.954 1.00 0.00 H new ATOM 0 HG13 VAL A 641 10.295 -3.994 4.619 1.00 0.00 H new ATOM 0 HG21 VAL A 641 12.103 -4.523 2.219 1.00 0.00 H new ATOM 0 HG22 VAL A 641 10.356 -4.864 2.247 1.00 0.00 H new ATOM 0 HG23 VAL A 641 11.041 -3.827 0.972 1.00 0.00 H new ATOM 277 N LYS A 642 7.959 -3.899 1.709 1.00 0.00 N ATOM 278 CA LYS A 642 6.892 -4.889 1.757 1.00 0.00 C ATOM 279 C LYS A 642 7.463 -6.296 1.774 1.00 0.00 C ATOM 280 O LYS A 642 6.856 -7.220 2.309 1.00 0.00 O ATOM 281 CB LYS A 642 5.962 -4.696 0.569 1.00 0.00 C ATOM 282 CG LYS A 642 6.609 -4.952 -0.778 1.00 0.00 C ATOM 283 CD LYS A 642 5.877 -4.235 -1.867 1.00 0.00 C ATOM 284 CE LYS A 642 6.152 -2.756 -1.794 1.00 0.00 C ATOM 285 NZ LYS A 642 5.435 -2.015 -2.864 1.00 0.00 N ATOM 0 H LYS A 642 8.327 -3.711 0.776 1.00 0.00 H new ATOM 0 HA LYS A 642 6.323 -4.752 2.676 1.00 0.00 H new ATOM 0 HB2 LYS A 642 5.106 -5.362 0.680 1.00 0.00 H new ATOM 0 HB3 LYS A 642 5.577 -3.677 0.586 1.00 0.00 H new ATOM 0 HG2 LYS A 642 7.648 -4.623 -0.755 1.00 0.00 H new ATOM 0 HG3 LYS A 642 6.618 -6.022 -0.984 1.00 0.00 H new ATOM 0 HD2 LYS A 642 6.186 -4.622 -2.838 1.00 0.00 H new ATOM 0 HD3 LYS A 642 4.806 -4.418 -1.777 1.00 0.00 H new ATOM 0 HE2 LYS A 642 5.846 -2.376 -0.819 1.00 0.00 H new ATOM 0 HE3 LYS A 642 7.224 -2.579 -1.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 5.833 -1.058 -2.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 5.544 -2.518 -3.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 4.425 -1.950 -2.624 1.00 0.00 H new ATOM 299 N GLU A 643 8.636 -6.443 1.203 1.00 0.00 N ATOM 300 CA GLU A 643 9.280 -7.721 1.128 1.00 0.00 C ATOM 301 C GLU A 643 9.925 -8.037 2.441 1.00 0.00 C ATOM 302 O GLU A 643 10.464 -7.147 3.102 1.00 0.00 O ATOM 303 CB GLU A 643 10.290 -7.745 0.005 1.00 0.00 C ATOM 304 CG GLU A 643 9.659 -7.518 -1.346 1.00 0.00 C ATOM 305 CD GLU A 643 10.648 -7.616 -2.452 1.00 0.00 C ATOM 306 OE1 GLU A 643 10.984 -8.740 -2.863 1.00 0.00 O ATOM 307 OE2 GLU A 643 11.083 -6.582 -2.956 1.00 0.00 O ATOM 0 H GLU A 643 9.164 -5.679 0.781 1.00 0.00 H new ATOM 0 HA GLU A 643 8.533 -8.485 0.914 1.00 0.00 H new ATOM 0 HB2 GLU A 643 11.044 -6.979 0.183 1.00 0.00 H new ATOM 0 HB3 GLU A 643 10.805 -8.706 0.005 1.00 0.00 H new ATOM 0 HG2 GLU A 643 8.867 -8.251 -1.503 1.00 0.00 H new ATOM 0 HG3 GLU A 643 9.191 -6.534 -1.366 1.00 0.00 H new ATOM 314 N LYS A 644 9.873 -9.275 2.814 1.00 0.00 N ATOM 315 CA LYS A 644 10.351 -9.713 4.087 1.00 0.00 C ATOM 316 C LYS A 644 11.842 -9.950 4.053 1.00 0.00 C ATOM 317 O LYS A 644 12.444 -10.132 2.982 1.00 0.00 O ATOM 318 CB LYS A 644 9.587 -10.955 4.548 1.00 0.00 C ATOM 319 CG LYS A 644 8.076 -10.735 4.652 1.00 0.00 C ATOM 320 CD LYS A 644 7.726 -9.636 5.655 1.00 0.00 C ATOM 321 CE LYS A 644 8.075 -10.039 7.080 1.00 0.00 C ATOM 322 NZ LYS A 644 7.844 -8.942 8.033 1.00 0.00 N ATOM 0 H LYS A 644 9.491 -10.022 2.234 1.00 0.00 H new ATOM 0 HA LYS A 644 10.169 -8.924 4.816 1.00 0.00 H new ATOM 0 HB2 LYS A 644 9.781 -11.771 3.852 1.00 0.00 H new ATOM 0 HB3 LYS A 644 9.969 -11.268 5.520 1.00 0.00 H new ATOM 0 HG2 LYS A 644 7.680 -10.471 3.672 1.00 0.00 H new ATOM 0 HG3 LYS A 644 7.594 -11.666 4.951 1.00 0.00 H new ATOM 0 HD2 LYS A 644 8.261 -8.723 5.394 1.00 0.00 H new ATOM 0 HD3 LYS A 644 6.661 -9.411 5.591 1.00 0.00 H new ATOM 0 HE2 LYS A 644 7.477 -10.903 7.370 1.00 0.00 H new ATOM 0 HE3 LYS A 644 9.120 -10.345 7.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 8.094 -9.257 8.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 8.433 -8.126 7.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 6.841 -8.667 8.009 1.00 0.00 H new ATOM 336 N THR A 645 12.427 -9.940 5.207 1.00 0.00 N ATOM 337 CA THR A 645 13.829 -10.041 5.355 1.00 0.00 C ATOM 338 C THR A 645 14.348 -11.439 5.084 1.00 0.00 C ATOM 339 O THR A 645 13.891 -12.425 5.668 1.00 0.00 O ATOM 340 CB THR A 645 14.227 -9.577 6.750 1.00 0.00 C ATOM 341 OG1 THR A 645 13.384 -10.226 7.721 1.00 0.00 O ATOM 342 CG2 THR A 645 14.062 -8.077 6.866 1.00 0.00 C ATOM 0 H THR A 645 11.924 -9.859 6.090 1.00 0.00 H new ATOM 0 HA THR A 645 14.288 -9.395 4.607 1.00 0.00 H new ATOM 0 HB THR A 645 15.271 -9.835 6.930 1.00 0.00 H new ATOM 0 HG1 THR A 645 13.262 -11.166 7.472 1.00 0.00 H new ATOM 0 HG21 THR A 645 14.349 -7.756 7.867 1.00 0.00 H new ATOM 0 HG22 THR A 645 14.697 -7.583 6.130 1.00 0.00 H new ATOM 0 HG23 THR A 645 13.021 -7.810 6.684 1.00 0.00 H new ATOM 350 N LYS A 646 15.252 -11.523 4.147 1.00 0.00 N ATOM 351 CA LYS A 646 15.913 -12.786 3.858 1.00 0.00 C ATOM 352 C LYS A 646 17.226 -12.809 4.589 1.00 0.00 C ATOM 353 O LYS A 646 17.748 -13.856 4.924 1.00 0.00 O ATOM 354 CB LYS A 646 16.182 -12.966 2.358 1.00 0.00 C ATOM 355 CG LYS A 646 14.972 -12.755 1.475 1.00 0.00 C ATOM 356 CD LYS A 646 15.226 -13.213 0.038 1.00 0.00 C ATOM 357 CE LYS A 646 16.379 -12.470 -0.617 1.00 0.00 C ATOM 358 NZ LYS A 646 16.635 -12.949 -1.992 1.00 0.00 N ATOM 0 H LYS A 646 15.554 -10.740 3.567 1.00 0.00 H new ATOM 0 HA LYS A 646 15.259 -13.596 4.180 1.00 0.00 H new ATOM 0 HB2 LYS A 646 16.963 -12.269 2.055 1.00 0.00 H new ATOM 0 HB3 LYS A 646 16.569 -13.971 2.189 1.00 0.00 H new ATOM 0 HG2 LYS A 646 14.123 -13.302 1.886 1.00 0.00 H new ATOM 0 HG3 LYS A 646 14.701 -11.699 1.477 1.00 0.00 H new ATOM 0 HD2 LYS A 646 15.438 -14.282 0.033 1.00 0.00 H new ATOM 0 HD3 LYS A 646 14.321 -13.065 -0.552 1.00 0.00 H new ATOM 0 HE2 LYS A 646 16.157 -11.403 -0.640 1.00 0.00 H new ATOM 0 HE3 LYS A 646 17.279 -12.595 -0.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 17.566 -12.611 -2.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 16.621 -13.989 -2.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 15.899 -12.584 -2.629 1.00 0.00 H new ATOM 372 N GLU A 647 17.773 -11.604 4.779 1.00 0.00 N ATOM 373 CA GLU A 647 19.054 -11.330 5.463 1.00 0.00 C ATOM 374 C GLU A 647 20.275 -11.767 4.647 1.00 0.00 C ATOM 375 O GLU A 647 21.336 -11.192 4.749 1.00 0.00 O ATOM 376 CB GLU A 647 19.079 -11.908 6.870 1.00 0.00 C ATOM 377 CG GLU A 647 17.958 -11.381 7.737 1.00 0.00 C ATOM 378 CD GLU A 647 18.037 -11.885 9.136 1.00 0.00 C ATOM 379 OE1 GLU A 647 18.941 -11.465 9.873 1.00 0.00 O ATOM 380 OE2 GLU A 647 17.192 -12.700 9.535 1.00 0.00 O ATOM 0 H GLU A 647 17.320 -10.752 4.448 1.00 0.00 H new ATOM 0 HA GLU A 647 19.122 -10.246 5.553 1.00 0.00 H new ATOM 0 HB2 GLU A 647 19.009 -12.994 6.813 1.00 0.00 H new ATOM 0 HB3 GLU A 647 20.035 -11.674 7.338 1.00 0.00 H new ATOM 0 HG2 GLU A 647 17.989 -10.291 7.744 1.00 0.00 H new ATOM 0 HG3 GLU A 647 17.001 -11.670 7.303 1.00 0.00 H new ATOM 387 N GLU A 648 20.088 -12.726 3.804 1.00 0.00 N ATOM 388 CA GLU A 648 21.144 -13.267 2.979 1.00 0.00 C ATOM 389 C GLU A 648 21.156 -12.603 1.597 1.00 0.00 C ATOM 390 O GLU A 648 21.365 -13.267 0.577 1.00 0.00 O ATOM 391 CB GLU A 648 20.944 -14.772 2.852 1.00 0.00 C ATOM 392 CG GLU A 648 19.544 -15.169 2.415 1.00 0.00 C ATOM 393 CD GLU A 648 19.415 -16.638 2.201 1.00 0.00 C ATOM 394 OE1 GLU A 648 19.186 -17.377 3.178 1.00 0.00 O ATOM 395 OE2 GLU A 648 19.553 -17.081 1.055 1.00 0.00 O ATOM 0 H GLU A 648 19.183 -13.173 3.657 1.00 0.00 H new ATOM 0 HA GLU A 648 22.108 -13.063 3.446 1.00 0.00 H new ATOM 0 HB2 GLU A 648 21.664 -15.166 2.135 1.00 0.00 H new ATOM 0 HB3 GLU A 648 21.162 -15.240 3.812 1.00 0.00 H new ATOM 0 HG2 GLU A 648 18.826 -14.849 3.170 1.00 0.00 H new ATOM 0 HG3 GLU A 648 19.291 -14.646 1.493 1.00 0.00 H new ATOM 402 N TYR A 649 20.975 -11.291 1.566 1.00 0.00 N ATOM 403 CA TYR A 649 20.941 -10.578 0.294 1.00 0.00 C ATOM 404 C TYR A 649 22.338 -10.573 -0.318 1.00 0.00 C ATOM 405 O TYR A 649 22.612 -11.288 -1.284 1.00 0.00 O ATOM 406 CB TYR A 649 20.385 -9.153 0.460 1.00 0.00 C ATOM 407 CG TYR A 649 18.955 -9.112 0.966 1.00 0.00 C ATOM 408 CD1 TYR A 649 18.691 -9.243 2.307 1.00 0.00 C ATOM 409 CD2 TYR A 649 17.875 -8.946 0.101 1.00 0.00 C ATOM 410 CE1 TYR A 649 17.417 -9.211 2.791 1.00 0.00 C ATOM 411 CE2 TYR A 649 16.575 -8.914 0.591 1.00 0.00 C ATOM 412 CZ TYR A 649 16.365 -9.046 1.946 1.00 0.00 C ATOM 413 OH TYR A 649 15.097 -9.024 2.475 1.00 0.00 O ATOM 0 H TYR A 649 20.851 -10.705 2.391 1.00 0.00 H new ATOM 0 HA TYR A 649 20.263 -11.095 -0.385 1.00 0.00 H new ATOM 0 HB2 TYR A 649 21.022 -8.602 1.152 1.00 0.00 H new ATOM 0 HB3 TYR A 649 20.437 -8.638 -0.499 1.00 0.00 H new ATOM 0 HD1 TYR A 649 19.513 -9.375 2.995 1.00 0.00 H new ATOM 0 HD2 TYR A 649 18.050 -8.841 -0.960 1.00 0.00 H new ATOM 0 HE1 TYR A 649 17.243 -9.317 3.851 1.00 0.00 H new ATOM 0 HE2 TYR A 649 15.740 -8.787 -0.082 1.00 0.00 H new ATOM 0 HH TYR A 649 14.444 -8.898 1.755 1.00 0.00 H new ATOM 423 N GLY A 650 23.206 -9.791 0.237 1.00 0.00 N ATOM 424 CA GLY A 650 24.593 -9.851 -0.149 1.00 0.00 C ATOM 425 C GLY A 650 24.979 -8.890 -1.240 1.00 0.00 C ATOM 426 O GLY A 650 25.746 -7.950 -0.994 1.00 0.00 O ATOM 0 H GLY A 650 22.988 -9.103 0.958 1.00 0.00 H new ATOM 0 HA2 GLY A 650 25.210 -9.653 0.727 1.00 0.00 H new ATOM 0 HA3 GLY A 650 24.822 -10.865 -0.477 1.00 0.00 H new ATOM 430 N HIS A 651 24.477 -9.112 -2.451 1.00 0.00 N ATOM 431 CA HIS A 651 24.861 -8.281 -3.572 1.00 0.00 C ATOM 432 C HIS A 651 23.873 -8.388 -4.735 1.00 0.00 C ATOM 433 O HIS A 651 23.359 -9.464 -5.030 1.00 0.00 O ATOM 434 CB HIS A 651 26.280 -8.662 -4.013 1.00 0.00 C ATOM 435 CG HIS A 651 26.843 -7.868 -5.131 1.00 0.00 C ATOM 436 ND1 HIS A 651 27.153 -6.535 -5.032 1.00 0.00 N ATOM 437 CD2 HIS A 651 27.172 -8.240 -6.370 1.00 0.00 C ATOM 438 CE1 HIS A 651 27.655 -6.121 -6.172 1.00 0.00 C ATOM 439 NE2 HIS A 651 27.675 -7.144 -7.008 1.00 0.00 N ATOM 0 H HIS A 651 23.812 -9.853 -2.673 1.00 0.00 H new ATOM 0 HA HIS A 651 24.845 -7.239 -3.253 1.00 0.00 H new ATOM 0 HB2 HIS A 651 26.945 -8.567 -3.154 1.00 0.00 H new ATOM 0 HB3 HIS A 651 26.280 -9.713 -4.302 1.00 0.00 H new ATOM 0 HD2 HIS A 651 27.060 -9.228 -6.791 1.00 0.00 H new ATOM 0 HE1 HIS A 651 27.993 -5.118 -6.389 1.00 0.00 H new ATOM 0 HE2 HIS A 651 28.011 -7.119 -7.971 1.00 0.00 H new ATOM 448 N SER A 652 23.586 -7.230 -5.334 1.00 0.00 N ATOM 449 CA SER A 652 22.735 -7.061 -6.519 1.00 0.00 C ATOM 450 C SER A 652 21.273 -7.469 -6.280 1.00 0.00 C ATOM 451 O SER A 652 20.467 -7.559 -7.211 1.00 0.00 O ATOM 452 CB SER A 652 23.371 -7.737 -7.734 1.00 0.00 C ATOM 453 OG SER A 652 24.691 -7.220 -7.926 1.00 0.00 O ATOM 0 H SER A 652 23.956 -6.343 -4.992 1.00 0.00 H new ATOM 0 HA SER A 652 22.678 -5.994 -6.736 1.00 0.00 H new ATOM 0 HB2 SER A 652 23.409 -8.816 -7.586 1.00 0.00 H new ATOM 0 HB3 SER A 652 22.765 -7.558 -8.622 1.00 0.00 H new ATOM 0 HG SER A 652 25.102 -7.653 -8.703 1.00 0.00 H new ATOM 459 N GLU A 653 20.946 -7.625 -5.022 1.00 0.00 N ATOM 460 CA GLU A 653 19.618 -7.959 -4.569 1.00 0.00 C ATOM 461 C GLU A 653 18.756 -6.725 -4.592 1.00 0.00 C ATOM 462 O GLU A 653 19.208 -5.661 -4.176 1.00 0.00 O ATOM 463 CB GLU A 653 19.709 -8.519 -3.159 1.00 0.00 C ATOM 464 CG GLU A 653 20.350 -9.883 -3.101 1.00 0.00 C ATOM 465 CD GLU A 653 19.460 -10.952 -3.678 1.00 0.00 C ATOM 466 OE1 GLU A 653 19.404 -11.114 -4.919 1.00 0.00 O ATOM 467 OE2 GLU A 653 18.768 -11.628 -2.907 1.00 0.00 O ATOM 0 H GLU A 653 21.617 -7.520 -4.261 1.00 0.00 H new ATOM 0 HA GLU A 653 19.171 -8.707 -5.224 1.00 0.00 H new ATOM 0 HB2 GLU A 653 20.280 -7.830 -2.538 1.00 0.00 H new ATOM 0 HB3 GLU A 653 18.707 -8.577 -2.733 1.00 0.00 H new ATOM 0 HG2 GLU A 653 21.293 -9.863 -3.647 1.00 0.00 H new ATOM 0 HG3 GLU A 653 20.586 -10.128 -2.066 1.00 0.00 H new ATOM 474 N VAL A 654 17.545 -6.861 -5.076 1.00 0.00 N ATOM 475 CA VAL A 654 16.644 -5.732 -5.206 1.00 0.00 C ATOM 476 C VAL A 654 15.510 -5.880 -4.198 1.00 0.00 C ATOM 477 O VAL A 654 15.067 -7.002 -3.910 1.00 0.00 O ATOM 478 CB VAL A 654 16.049 -5.621 -6.648 1.00 0.00 C ATOM 479 CG1 VAL A 654 15.302 -4.304 -6.866 1.00 0.00 C ATOM 480 CG2 VAL A 654 17.107 -5.849 -7.727 1.00 0.00 C ATOM 0 H VAL A 654 17.154 -7.749 -5.390 1.00 0.00 H new ATOM 0 HA VAL A 654 17.213 -4.822 -5.012 1.00 0.00 H new ATOM 0 HB VAL A 654 15.317 -6.423 -6.740 1.00 0.00 H new ATOM 0 HG11 VAL A 654 14.907 -4.273 -7.881 1.00 0.00 H new ATOM 0 HG12 VAL A 654 14.480 -4.230 -6.154 1.00 0.00 H new ATOM 0 HG13 VAL A 654 15.986 -3.469 -6.718 1.00 0.00 H new ATOM 0 HG21 VAL A 654 16.647 -5.762 -8.711 1.00 0.00 H new ATOM 0 HG22 VAL A 654 17.895 -5.103 -7.627 1.00 0.00 H new ATOM 0 HG23 VAL A 654 17.534 -6.845 -7.613 1.00 0.00 H new ATOM 490 N VAL A 655 15.080 -4.775 -3.646 1.00 0.00 N ATOM 491 CA VAL A 655 14.015 -4.740 -2.653 1.00 0.00 C ATOM 492 C VAL A 655 13.002 -3.662 -3.018 1.00 0.00 C ATOM 493 O VAL A 655 13.396 -2.559 -3.411 1.00 0.00 O ATOM 494 CB VAL A 655 14.604 -4.447 -1.243 1.00 0.00 C ATOM 495 CG1 VAL A 655 13.517 -4.185 -0.243 1.00 0.00 C ATOM 496 CG2 VAL A 655 15.455 -5.606 -0.767 1.00 0.00 C ATOM 0 H VAL A 655 15.460 -3.855 -3.871 1.00 0.00 H new ATOM 0 HA VAL A 655 13.520 -5.711 -2.636 1.00 0.00 H new ATOM 0 HB VAL A 655 15.224 -3.555 -1.329 1.00 0.00 H new ATOM 0 HG11 VAL A 655 13.960 -3.984 0.732 1.00 0.00 H new ATOM 0 HG12 VAL A 655 12.931 -3.322 -0.560 1.00 0.00 H new ATOM 0 HG13 VAL A 655 12.869 -5.058 -0.173 1.00 0.00 H new ATOM 0 HG21 VAL A 655 15.857 -5.381 0.221 1.00 0.00 H new ATOM 0 HG22 VAL A 655 14.845 -6.508 -0.713 1.00 0.00 H new ATOM 0 HG23 VAL A 655 16.276 -5.765 -1.466 1.00 0.00 H new ATOM 506 N GLU A 656 11.715 -3.984 -2.914 1.00 0.00 N ATOM 507 CA GLU A 656 10.676 -3.054 -3.217 1.00 0.00 C ATOM 508 C GLU A 656 10.040 -2.472 -1.941 1.00 0.00 C ATOM 509 O GLU A 656 9.670 -3.198 -0.989 1.00 0.00 O ATOM 510 CB GLU A 656 9.607 -3.711 -4.070 1.00 0.00 C ATOM 511 CG GLU A 656 8.591 -2.724 -4.594 1.00 0.00 C ATOM 512 CD GLU A 656 7.506 -3.341 -5.437 1.00 0.00 C ATOM 513 OE1 GLU A 656 7.716 -3.555 -6.641 1.00 0.00 O ATOM 514 OE2 GLU A 656 6.398 -3.580 -4.912 1.00 0.00 O ATOM 0 H GLU A 656 11.382 -4.901 -2.616 1.00 0.00 H new ATOM 0 HA GLU A 656 11.128 -2.233 -3.773 1.00 0.00 H new ATOM 0 HB2 GLU A 656 10.080 -4.220 -4.910 1.00 0.00 H new ATOM 0 HB3 GLU A 656 9.097 -4.474 -3.482 1.00 0.00 H new ATOM 0 HG2 GLU A 656 8.131 -2.211 -3.750 1.00 0.00 H new ATOM 0 HG3 GLU A 656 9.108 -1.967 -5.184 1.00 0.00 H new ATOM 521 N TYR A 657 9.904 -1.182 -1.943 1.00 0.00 N ATOM 522 CA TYR A 657 9.311 -0.426 -0.874 1.00 0.00 C ATOM 523 C TYR A 657 7.954 0.107 -1.287 1.00 0.00 C ATOM 524 O TYR A 657 7.600 0.064 -2.462 1.00 0.00 O ATOM 525 CB TYR A 657 10.201 0.749 -0.492 1.00 0.00 C ATOM 526 CG TYR A 657 11.452 0.385 0.262 1.00 0.00 C ATOM 527 CD1 TYR A 657 12.525 -0.202 -0.369 1.00 0.00 C ATOM 528 CD2 TYR A 657 11.548 0.629 1.622 1.00 0.00 C ATOM 529 CE1 TYR A 657 13.652 -0.534 0.324 1.00 0.00 C ATOM 530 CE2 TYR A 657 12.672 0.305 2.329 1.00 0.00 C ATOM 531 CZ TYR A 657 13.728 -0.281 1.667 1.00 0.00 C ATOM 532 OH TYR A 657 14.860 -0.613 2.337 1.00 0.00 O ATOM 0 H TYR A 657 10.215 -0.599 -2.720 1.00 0.00 H new ATOM 0 HA TYR A 657 9.198 -1.093 -0.019 1.00 0.00 H new ATOM 0 HB2 TYR A 657 10.485 1.280 -1.401 1.00 0.00 H new ATOM 0 HB3 TYR A 657 9.619 1.443 0.114 1.00 0.00 H new ATOM 0 HD1 TYR A 657 12.474 -0.403 -1.429 1.00 0.00 H new ATOM 0 HD2 TYR A 657 10.715 1.086 2.136 1.00 0.00 H new ATOM 0 HE1 TYR A 657 14.484 -0.996 -0.187 1.00 0.00 H new ATOM 0 HE2 TYR A 657 12.731 0.505 3.389 1.00 0.00 H new ATOM 0 HH TYR A 657 14.631 -0.894 3.248 1.00 0.00 H new ATOM 542 N TYR A 658 7.209 0.575 -0.317 1.00 0.00 N ATOM 543 CA TYR A 658 5.915 1.192 -0.504 1.00 0.00 C ATOM 544 C TYR A 658 5.867 2.414 0.395 1.00 0.00 C ATOM 545 O TYR A 658 6.652 2.502 1.349 1.00 0.00 O ATOM 546 CB TYR A 658 4.765 0.226 -0.105 1.00 0.00 C ATOM 547 CG TYR A 658 4.725 -0.198 1.376 1.00 0.00 C ATOM 548 CD1 TYR A 658 4.107 0.593 2.344 1.00 0.00 C ATOM 549 CD2 TYR A 658 5.280 -1.390 1.787 1.00 0.00 C ATOM 550 CE1 TYR A 658 4.044 0.202 3.662 1.00 0.00 C ATOM 551 CE2 TYR A 658 5.227 -1.785 3.112 1.00 0.00 C ATOM 552 CZ TYR A 658 4.604 -0.981 4.041 1.00 0.00 C ATOM 553 OH TYR A 658 4.501 -1.386 5.356 1.00 0.00 O ATOM 0 H TYR A 658 7.496 0.536 0.661 1.00 0.00 H new ATOM 0 HA TYR A 658 5.783 1.453 -1.554 1.00 0.00 H new ATOM 0 HB2 TYR A 658 3.816 0.701 -0.353 1.00 0.00 H new ATOM 0 HB3 TYR A 658 4.842 -0.672 -0.718 1.00 0.00 H new ATOM 0 HD1 TYR A 658 3.667 1.535 2.052 1.00 0.00 H new ATOM 0 HD2 TYR A 658 5.765 -2.027 1.062 1.00 0.00 H new ATOM 0 HE1 TYR A 658 3.554 0.829 4.392 1.00 0.00 H new ATOM 0 HE2 TYR A 658 5.673 -2.720 3.417 1.00 0.00 H new ATOM 0 HH TYR A 658 4.950 -2.250 5.468 1.00 0.00 H new ATOM 563 N CYS A 659 5.001 3.333 0.129 1.00 0.00 N ATOM 564 CA CYS A 659 4.843 4.455 1.015 1.00 0.00 C ATOM 565 C CYS A 659 3.665 4.263 1.960 1.00 0.00 C ATOM 566 O CYS A 659 2.881 3.327 1.809 1.00 0.00 O ATOM 567 CB CYS A 659 4.751 5.769 0.257 1.00 0.00 C ATOM 568 SG CYS A 659 6.321 6.303 -0.482 1.00 0.00 S ATOM 0 H CYS A 659 4.391 3.337 -0.688 1.00 0.00 H new ATOM 0 HA CYS A 659 5.743 4.507 1.628 1.00 0.00 H new ATOM 0 HB2 CYS A 659 4.004 5.671 -0.531 1.00 0.00 H new ATOM 0 HB3 CYS A 659 4.398 6.545 0.936 1.00 0.00 H new ATOM 573 N ASN A 660 3.581 5.142 2.951 1.00 0.00 N ATOM 574 CA ASN A 660 2.519 5.137 3.985 1.00 0.00 C ATOM 575 C ASN A 660 1.140 5.262 3.303 1.00 0.00 C ATOM 576 O ASN A 660 1.062 5.685 2.183 1.00 0.00 O ATOM 577 CB ASN A 660 2.686 6.381 4.844 1.00 0.00 C ATOM 578 CG ASN A 660 2.584 6.181 6.347 1.00 0.00 C ATOM 579 OD1 ASN A 660 2.146 7.087 7.048 1.00 0.00 O ATOM 580 ND2 ASN A 660 2.999 5.052 6.847 1.00 0.00 N ATOM 0 H ASN A 660 4.255 5.898 3.073 1.00 0.00 H new ATOM 0 HA ASN A 660 2.587 4.219 4.569 1.00 0.00 H new ATOM 0 HB2 ASN A 660 3.658 6.821 4.623 1.00 0.00 H new ATOM 0 HB3 ASN A 660 1.931 7.108 4.544 1.00 0.00 H new ATOM 0 HD21 ASN A 660 2.966 4.898 7.855 1.00 0.00 H new ATOM 0 HD22 ASN A 660 3.357 4.322 6.231 1.00 0.00 H new ATOM 587 N PRO A 661 0.040 4.984 4.003 1.00 0.00 N ATOM 588 CA PRO A 661 -1.326 5.096 3.431 1.00 0.00 C ATOM 589 C PRO A 661 -1.801 6.564 3.310 1.00 0.00 C ATOM 590 O PRO A 661 -2.972 6.838 3.134 1.00 0.00 O ATOM 591 CB PRO A 661 -2.169 4.362 4.466 1.00 0.00 C ATOM 592 CG PRO A 661 -1.439 4.557 5.739 1.00 0.00 C ATOM 593 CD PRO A 661 0.001 4.503 5.389 1.00 0.00 C ATOM 0 HA PRO A 661 -1.387 4.695 2.419 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -3.178 4.771 4.520 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -2.267 3.304 4.222 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -1.695 5.513 6.195 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -1.696 3.781 6.460 1.00 0.00 H new ATOM 0 HD2 PRO A 661 0.597 5.133 6.049 1.00 0.00 H new ATOM 0 HD3 PRO A 661 0.396 3.490 5.473 1.00 0.00 H new ATOM 601 N ARG A 662 -0.875 7.471 3.466 1.00 0.00 N ATOM 602 CA ARG A 662 -1.138 8.897 3.375 1.00 0.00 C ATOM 603 C ARG A 662 0.050 9.608 2.733 1.00 0.00 C ATOM 604 O ARG A 662 0.190 10.817 2.800 1.00 0.00 O ATOM 605 CB ARG A 662 -1.348 9.434 4.756 1.00 0.00 C ATOM 606 CG ARG A 662 -0.180 9.188 5.655 1.00 0.00 C ATOM 607 CD ARG A 662 -0.441 9.773 6.962 1.00 0.00 C ATOM 608 NE ARG A 662 0.638 9.523 7.929 1.00 0.00 N ATOM 609 CZ ARG A 662 0.924 10.329 8.967 1.00 0.00 C ATOM 610 NH1 ARG A 662 0.267 11.484 9.121 1.00 0.00 N ATOM 611 NH2 ARG A 662 1.879 9.986 9.826 1.00 0.00 N ATOM 0 H ARG A 662 0.100 7.245 3.663 1.00 0.00 H new ATOM 0 HA ARG A 662 -2.024 9.067 2.764 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -1.538 10.506 4.699 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -2.237 8.975 5.188 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -0.002 8.117 5.753 1.00 0.00 H new ATOM 0 HG3 ARG A 662 0.722 9.622 5.224 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -0.580 10.848 6.851 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -1.374 9.369 7.355 1.00 0.00 H new ATOM 0 HE ARG A 662 1.206 8.685 7.805 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -0.452 11.755 8.451 1.00 0.00 H new ATOM 0 HH12 ARG A 662 0.485 12.094 9.909 1.00 0.00 H new ATOM 0 HH21 ARG A 662 2.392 9.114 9.697 1.00 0.00 H new ATOM 0 HH22 ARG A 662 2.099 10.595 10.614 1.00 0.00 H new ATOM 625 N PHE A 663 0.937 8.822 2.208 1.00 0.00 N ATOM 626 CA PHE A 663 2.105 9.298 1.499 1.00 0.00 C ATOM 627 C PHE A 663 2.269 8.517 0.250 1.00 0.00 C ATOM 628 O PHE A 663 2.130 7.306 0.250 1.00 0.00 O ATOM 629 CB PHE A 663 3.394 9.171 2.312 1.00 0.00 C ATOM 630 CG PHE A 663 3.610 10.235 3.357 1.00 0.00 C ATOM 631 CD1 PHE A 663 3.002 10.153 4.589 1.00 0.00 C ATOM 632 CD2 PHE A 663 4.428 11.314 3.096 1.00 0.00 C ATOM 633 CE1 PHE A 663 3.197 11.130 5.546 1.00 0.00 C ATOM 634 CE2 PHE A 663 4.632 12.296 4.042 1.00 0.00 C ATOM 635 CZ PHE A 663 4.015 12.206 5.270 1.00 0.00 C ATOM 0 H PHE A 663 0.876 7.805 2.256 1.00 0.00 H new ATOM 0 HA PHE A 663 1.940 10.356 1.297 1.00 0.00 H new ATOM 0 HB2 PHE A 663 3.399 8.198 2.803 1.00 0.00 H new ATOM 0 HB3 PHE A 663 4.240 9.185 1.624 1.00 0.00 H new ATOM 0 HD1 PHE A 663 2.362 9.312 4.811 1.00 0.00 H new ATOM 0 HD2 PHE A 663 4.916 11.391 2.136 1.00 0.00 H new ATOM 0 HE1 PHE A 663 2.711 11.052 6.507 1.00 0.00 H new ATOM 0 HE2 PHE A 663 5.275 13.135 3.820 1.00 0.00 H new ATOM 0 HZ PHE A 663 4.171 12.974 6.013 1.00 0.00 H new ATOM 645 N LEU A 664 2.596 9.177 -0.793 1.00 0.00 N ATOM 646 CA LEU A 664 2.747 8.535 -2.043 1.00 0.00 C ATOM 647 C LEU A 664 4.194 8.385 -2.369 1.00 0.00 C ATOM 648 O LEU A 664 5.054 9.138 -1.867 1.00 0.00 O ATOM 649 CB LEU A 664 2.048 9.301 -3.156 1.00 0.00 C ATOM 650 CG LEU A 664 0.612 9.665 -2.927 1.00 0.00 C ATOM 651 CD1 LEU A 664 -0.064 10.028 -4.223 1.00 0.00 C ATOM 652 CD2 LEU A 664 -0.121 8.599 -2.219 1.00 0.00 C ATOM 0 H LEU A 664 2.768 10.182 -0.806 1.00 0.00 H new ATOM 0 HA LEU A 664 2.283 7.552 -1.967 1.00 0.00 H new ATOM 0 HB2 LEU A 664 2.606 10.219 -3.339 1.00 0.00 H new ATOM 0 HB3 LEU A 664 2.106 8.705 -4.067 1.00 0.00 H new ATOM 0 HG LEU A 664 0.597 10.543 -2.281 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -1.105 10.288 -4.030 1.00 0.00 H new ATOM 0 HD12 LEU A 664 0.446 10.880 -4.673 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -0.023 9.179 -4.905 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -1.157 8.904 -2.074 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -0.092 7.683 -2.810 1.00 0.00 H new ATOM 0 HD23 LEU A 664 0.344 8.420 -1.249 1.00 0.00 H new ATOM 664 N MET A 665 4.464 7.415 -3.169 1.00 0.00 N ATOM 665 CA MET A 665 5.800 7.116 -3.617 1.00 0.00 C ATOM 666 C MET A 665 6.276 8.140 -4.633 1.00 0.00 C ATOM 667 O MET A 665 5.608 8.397 -5.639 1.00 0.00 O ATOM 668 CB MET A 665 5.869 5.707 -4.205 1.00 0.00 C ATOM 669 CG MET A 665 7.248 5.314 -4.695 1.00 0.00 C ATOM 670 SD MET A 665 8.486 5.335 -3.384 1.00 0.00 S ATOM 671 CE MET A 665 7.858 4.026 -2.321 1.00 0.00 C ATOM 0 H MET A 665 3.754 6.786 -3.545 1.00 0.00 H new ATOM 0 HA MET A 665 6.462 7.163 -2.753 1.00 0.00 H new ATOM 0 HB2 MET A 665 5.545 4.992 -3.449 1.00 0.00 H new ATOM 0 HB3 MET A 665 5.165 5.635 -5.034 1.00 0.00 H new ATOM 0 HG2 MET A 665 7.203 4.316 -5.131 1.00 0.00 H new ATOM 0 HG3 MET A 665 7.554 5.995 -5.489 1.00 0.00 H new ATOM 0 HE1 MET A 665 7.671 4.425 -1.324 1.00 0.00 H new ATOM 0 HE2 MET A 665 6.929 3.635 -2.735 1.00 0.00 H new ATOM 0 HE3 MET A 665 8.593 3.224 -2.259 1.00 0.00 H new ATOM 681 N LYS A 666 7.397 8.741 -4.346 1.00 0.00 N ATOM 682 CA LYS A 666 8.003 9.707 -5.232 1.00 0.00 C ATOM 683 C LYS A 666 9.292 9.133 -5.829 1.00 0.00 C ATOM 684 O LYS A 666 9.697 9.487 -6.939 1.00 0.00 O ATOM 685 CB LYS A 666 8.292 11.001 -4.449 1.00 0.00 C ATOM 686 CG LYS A 666 8.902 12.119 -5.257 1.00 0.00 C ATOM 687 CD LYS A 666 8.022 12.441 -6.417 1.00 0.00 C ATOM 688 CE LYS A 666 8.533 13.635 -7.200 1.00 0.00 C ATOM 689 NZ LYS A 666 7.660 13.967 -8.343 1.00 0.00 N ATOM 0 H LYS A 666 7.922 8.577 -3.487 1.00 0.00 H new ATOM 0 HA LYS A 666 7.321 9.934 -6.051 1.00 0.00 H new ATOM 0 HB2 LYS A 666 7.360 11.358 -4.011 1.00 0.00 H new ATOM 0 HB3 LYS A 666 8.962 10.764 -3.622 1.00 0.00 H new ATOM 0 HG2 LYS A 666 9.033 13.002 -4.632 1.00 0.00 H new ATOM 0 HG3 LYS A 666 9.892 11.828 -5.609 1.00 0.00 H new ATOM 0 HD2 LYS A 666 7.958 11.575 -7.076 1.00 0.00 H new ATOM 0 HD3 LYS A 666 7.012 12.645 -6.061 1.00 0.00 H new ATOM 0 HE2 LYS A 666 8.605 14.498 -6.538 1.00 0.00 H new ATOM 0 HE3 LYS A 666 9.540 13.426 -7.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 8.048 14.789 -8.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 7.611 13.154 -8.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 6.706 14.193 -7.997 1.00 0.00 H new ATOM 703 N GLY A 667 9.885 8.211 -5.110 1.00 0.00 N ATOM 704 CA GLY A 667 11.161 7.654 -5.520 1.00 0.00 C ATOM 705 C GLY A 667 11.028 6.442 -6.434 1.00 0.00 C ATOM 706 O GLY A 667 9.922 6.082 -6.833 1.00 0.00 O ATOM 0 H GLY A 667 9.511 7.829 -4.242 1.00 0.00 H new ATOM 0 HA2 GLY A 667 11.737 8.424 -6.032 1.00 0.00 H new ATOM 0 HA3 GLY A 667 11.727 7.370 -4.633 1.00 0.00 H new ATOM 710 N PRO A 668 12.161 5.762 -6.752 1.00 0.00 N ATOM 711 CA PRO A 668 12.178 4.574 -7.643 1.00 0.00 C ATOM 712 C PRO A 668 11.577 3.332 -6.971 1.00 0.00 C ATOM 713 O PRO A 668 11.397 2.298 -7.601 1.00 0.00 O ATOM 714 CB PRO A 668 13.675 4.356 -7.901 1.00 0.00 C ATOM 715 CG PRO A 668 14.356 4.935 -6.707 1.00 0.00 C ATOM 716 CD PRO A 668 13.532 6.126 -6.305 1.00 0.00 C ATOM 0 HA PRO A 668 11.585 4.731 -8.544 1.00 0.00 H new ATOM 0 HB2 PRO A 668 13.907 3.297 -8.014 1.00 0.00 H new ATOM 0 HB3 PRO A 668 13.995 4.852 -8.818 1.00 0.00 H new ATOM 0 HG2 PRO A 668 14.413 4.207 -5.898 1.00 0.00 H new ATOM 0 HG3 PRO A 668 15.379 5.229 -6.944 1.00 0.00 H new ATOM 0 HD2 PRO A 668 13.572 6.298 -5.229 1.00 0.00 H new ATOM 0 HD3 PRO A 668 13.883 7.039 -6.787 1.00 0.00 H new ATOM 724 N ASN A 669 11.337 3.465 -5.665 1.00 0.00 N ATOM 725 CA ASN A 669 10.728 2.457 -4.741 1.00 0.00 C ATOM 726 C ASN A 669 11.429 1.091 -4.680 1.00 0.00 C ATOM 727 O ASN A 669 11.003 0.221 -3.941 1.00 0.00 O ATOM 728 CB ASN A 669 9.201 2.277 -4.931 1.00 0.00 C ATOM 729 CG ASN A 669 8.780 1.519 -6.165 1.00 0.00 C ATOM 730 OD1 ASN A 669 8.535 2.099 -7.228 1.00 0.00 O ATOM 731 ND2 ASN A 669 8.674 0.235 -6.032 1.00 0.00 N ATOM 0 H ASN A 669 11.571 4.329 -5.175 1.00 0.00 H new ATOM 0 HA ASN A 669 10.898 2.918 -3.768 1.00 0.00 H new ATOM 0 HB2 ASN A 669 8.803 1.761 -4.057 1.00 0.00 H new ATOM 0 HB3 ASN A 669 8.738 3.263 -4.957 1.00 0.00 H new ATOM 0 HD21 ASN A 669 8.378 -0.337 -6.823 1.00 0.00 H new ATOM 0 HD22 ASN A 669 8.886 -0.204 -5.136 1.00 0.00 H new ATOM 738 N LYS A 670 12.473 0.917 -5.424 1.00 0.00 N ATOM 739 CA LYS A 670 13.232 -0.311 -5.441 1.00 0.00 C ATOM 740 C LYS A 670 14.680 0.021 -5.273 1.00 0.00 C ATOM 741 O LYS A 670 15.133 1.072 -5.745 1.00 0.00 O ATOM 742 CB LYS A 670 12.989 -1.065 -6.746 1.00 0.00 C ATOM 743 CG LYS A 670 11.645 -1.777 -6.807 1.00 0.00 C ATOM 744 CD LYS A 670 11.207 -2.005 -8.238 1.00 0.00 C ATOM 745 CE LYS A 670 10.876 -0.671 -8.879 1.00 0.00 C ATOM 746 NZ LYS A 670 10.441 -0.779 -10.279 1.00 0.00 N ATOM 0 H LYS A 670 12.837 1.633 -6.053 1.00 0.00 H new ATOM 0 HA LYS A 670 12.915 -0.958 -4.624 1.00 0.00 H new ATOM 0 HB2 LYS A 670 13.055 -0.363 -7.577 1.00 0.00 H new ATOM 0 HB3 LYS A 670 13.784 -1.798 -6.884 1.00 0.00 H new ATOM 0 HG2 LYS A 670 11.714 -2.734 -6.289 1.00 0.00 H new ATOM 0 HG3 LYS A 670 10.894 -1.185 -6.284 1.00 0.00 H new ATOM 0 HD2 LYS A 670 11.998 -2.504 -8.798 1.00 0.00 H new ATOM 0 HD3 LYS A 670 10.336 -2.660 -8.264 1.00 0.00 H new ATOM 0 HE2 LYS A 670 10.090 -0.185 -8.300 1.00 0.00 H new ATOM 0 HE3 LYS A 670 11.754 -0.026 -8.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 10.232 0.169 -10.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 11.197 -1.215 -10.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 9.586 -1.368 -10.332 1.00 0.00 H new ATOM 760 N ILE A 671 15.396 -0.824 -4.579 1.00 0.00 N ATOM 761 CA ILE A 671 16.797 -0.584 -4.297 1.00 0.00 C ATOM 762 C ILE A 671 17.586 -1.848 -4.509 1.00 0.00 C ATOM 763 O ILE A 671 17.018 -2.916 -4.596 1.00 0.00 O ATOM 764 CB ILE A 671 17.048 -0.075 -2.846 1.00 0.00 C ATOM 765 CG1 ILE A 671 16.600 -1.111 -1.820 1.00 0.00 C ATOM 766 CG2 ILE A 671 16.339 1.245 -2.605 1.00 0.00 C ATOM 767 CD1 ILE A 671 16.928 -0.728 -0.400 1.00 0.00 C ATOM 0 H ILE A 671 15.032 -1.695 -4.193 1.00 0.00 H new ATOM 0 HA ILE A 671 17.121 0.198 -4.984 1.00 0.00 H new ATOM 0 HB ILE A 671 18.120 0.083 -2.730 1.00 0.00 H new ATOM 0 HG12 ILE A 671 15.524 -1.258 -1.909 1.00 0.00 H new ATOM 0 HG13 ILE A 671 17.072 -2.066 -2.049 1.00 0.00 H new ATOM 0 HG21 ILE A 671 16.530 1.579 -1.585 1.00 0.00 H new ATOM 0 HG22 ILE A 671 16.711 1.991 -3.307 1.00 0.00 H new ATOM 0 HG23 ILE A 671 15.267 1.114 -2.749 1.00 0.00 H new ATOM 0 HD11 ILE A 671 16.582 -1.509 0.277 1.00 0.00 H new ATOM 0 HD12 ILE A 671 18.006 -0.609 -0.295 1.00 0.00 H new ATOM 0 HD13 ILE A 671 16.434 0.212 -0.153 1.00 0.00 H new ATOM 779 N GLN A 672 18.873 -1.717 -4.534 1.00 0.00 N ATOM 780 CA GLN A 672 19.778 -2.799 -4.778 1.00 0.00 C ATOM 781 C GLN A 672 20.931 -2.748 -3.813 1.00 0.00 C ATOM 782 O GLN A 672 21.404 -1.675 -3.457 1.00 0.00 O ATOM 783 CB GLN A 672 20.286 -2.771 -6.222 1.00 0.00 C ATOM 784 CG GLN A 672 21.486 -3.666 -6.459 1.00 0.00 C ATOM 785 CD GLN A 672 21.893 -3.753 -7.885 1.00 0.00 C ATOM 786 OE1 GLN A 672 22.693 -2.956 -8.377 1.00 0.00 O ATOM 787 NE2 GLN A 672 21.370 -4.733 -8.547 1.00 0.00 N ATOM 0 H GLN A 672 19.341 -0.824 -4.380 1.00 0.00 H new ATOM 0 HA GLN A 672 19.239 -3.734 -4.626 1.00 0.00 H new ATOM 0 HB2 GLN A 672 19.479 -3.075 -6.889 1.00 0.00 H new ATOM 0 HB3 GLN A 672 20.549 -1.747 -6.486 1.00 0.00 H new ATOM 0 HG2 GLN A 672 22.326 -3.295 -5.872 1.00 0.00 H new ATOM 0 HG3 GLN A 672 21.259 -4.667 -6.093 1.00 0.00 H new ATOM 0 HE21 GLN A 672 20.712 -5.364 -8.089 1.00 0.00 H new ATOM 0 HE22 GLN A 672 21.616 -4.875 -9.527 1.00 0.00 H new ATOM 796 N CYS A 673 21.337 -3.898 -3.353 1.00 0.00 N ATOM 797 CA CYS A 673 22.462 -3.996 -2.474 1.00 0.00 C ATOM 798 C CYS A 673 23.751 -4.056 -3.259 1.00 0.00 C ATOM 799 O CYS A 673 24.130 -5.107 -3.791 1.00 0.00 O ATOM 800 CB CYS A 673 22.362 -5.207 -1.566 1.00 0.00 C ATOM 801 SG CYS A 673 23.777 -5.363 -0.438 1.00 0.00 S ATOM 0 H CYS A 673 20.897 -4.790 -3.578 1.00 0.00 H new ATOM 0 HA CYS A 673 22.460 -3.101 -1.852 1.00 0.00 H new ATOM 0 HB2 CYS A 673 21.444 -5.142 -0.982 1.00 0.00 H new ATOM 0 HB3 CYS A 673 22.289 -6.107 -2.176 1.00 0.00 H new ATOM 806 N VAL A 674 24.393 -2.946 -3.355 1.00 0.00 N ATOM 807 CA VAL A 674 25.665 -2.836 -4.006 1.00 0.00 C ATOM 808 C VAL A 674 26.725 -3.310 -3.009 1.00 0.00 C ATOM 809 O VAL A 674 26.422 -3.480 -1.816 1.00 0.00 O ATOM 810 CB VAL A 674 25.881 -1.351 -4.445 1.00 0.00 C ATOM 811 CG1 VAL A 674 27.278 -1.084 -4.968 1.00 0.00 C ATOM 812 CG2 VAL A 674 24.857 -0.997 -5.505 1.00 0.00 C ATOM 0 H VAL A 674 24.047 -2.064 -2.977 1.00 0.00 H new ATOM 0 HA VAL A 674 25.727 -3.450 -4.905 1.00 0.00 H new ATOM 0 HB VAL A 674 25.756 -0.726 -3.561 1.00 0.00 H new ATOM 0 HG11 VAL A 674 27.365 -0.036 -5.256 1.00 0.00 H new ATOM 0 HG12 VAL A 674 28.007 -1.308 -4.189 1.00 0.00 H new ATOM 0 HG13 VAL A 674 27.469 -1.716 -5.835 1.00 0.00 H new ATOM 0 HG21 VAL A 674 25.000 0.037 -5.818 1.00 0.00 H new ATOM 0 HG22 VAL A 674 24.980 -1.656 -6.364 1.00 0.00 H new ATOM 0 HG23 VAL A 674 23.854 -1.117 -5.096 1.00 0.00 H new ATOM 822 N ASP A 675 27.939 -3.584 -3.451 1.00 0.00 N ATOM 823 CA ASP A 675 28.927 -4.011 -2.508 1.00 0.00 C ATOM 824 C ASP A 675 29.477 -2.889 -1.649 1.00 0.00 C ATOM 825 O ASP A 675 30.517 -2.303 -1.921 1.00 0.00 O ATOM 826 CB ASP A 675 30.013 -4.928 -3.045 1.00 0.00 C ATOM 827 CG ASP A 675 30.740 -4.446 -4.246 1.00 0.00 C ATOM 828 OD1 ASP A 675 31.653 -3.624 -4.137 1.00 0.00 O ATOM 829 OD2 ASP A 675 30.455 -4.961 -5.312 1.00 0.00 O ATOM 0 H ASP A 675 28.247 -3.519 -4.421 1.00 0.00 H new ATOM 0 HA ASP A 675 28.352 -4.657 -1.845 1.00 0.00 H new ATOM 0 HB2 ASP A 675 30.739 -5.101 -2.251 1.00 0.00 H new ATOM 0 HB3 ASP A 675 29.562 -5.892 -3.281 1.00 0.00 H new ATOM 834 N GLY A 676 28.717 -2.562 -0.650 1.00 0.00 N ATOM 835 CA GLY A 676 29.106 -1.612 0.330 1.00 0.00 C ATOM 836 C GLY A 676 27.899 -1.064 1.029 1.00 0.00 C ATOM 837 O GLY A 676 27.887 -0.908 2.252 1.00 0.00 O ATOM 0 H GLY A 676 27.791 -2.960 -0.495 1.00 0.00 H new ATOM 0 HA2 GLY A 676 29.774 -2.079 1.054 1.00 0.00 H new ATOM 0 HA3 GLY A 676 29.662 -0.801 -0.140 1.00 0.00 H new ATOM 841 N GLU A 677 26.860 -0.821 0.263 1.00 0.00 N ATOM 842 CA GLU A 677 25.629 -0.274 0.770 1.00 0.00 C ATOM 843 C GLU A 677 24.541 -0.458 -0.262 1.00 0.00 C ATOM 844 O GLU A 677 24.802 -0.921 -1.377 1.00 0.00 O ATOM 845 CB GLU A 677 25.796 1.216 1.066 1.00 0.00 C ATOM 846 CG GLU A 677 26.177 2.044 -0.150 1.00 0.00 C ATOM 847 CD GLU A 677 26.352 3.491 0.183 1.00 0.00 C ATOM 848 OE1 GLU A 677 25.341 4.179 0.432 1.00 0.00 O ATOM 849 OE2 GLU A 677 27.495 3.981 0.191 1.00 0.00 O ATOM 0 H GLU A 677 26.849 -1.001 -0.741 1.00 0.00 H new ATOM 0 HA GLU A 677 25.362 -0.792 1.691 1.00 0.00 H new ATOM 0 HB2 GLU A 677 24.864 1.602 1.479 1.00 0.00 H new ATOM 0 HB3 GLU A 677 26.560 1.341 1.833 1.00 0.00 H new ATOM 0 HG2 GLU A 677 27.103 1.657 -0.575 1.00 0.00 H new ATOM 0 HG3 GLU A 677 25.407 1.940 -0.914 1.00 0.00 H new ATOM 856 N TRP A 678 23.351 -0.086 0.096 1.00 0.00 N ATOM 857 CA TRP A 678 22.230 -0.139 -0.810 1.00 0.00 C ATOM 858 C TRP A 678 22.241 1.093 -1.716 1.00 0.00 C ATOM 859 O TRP A 678 23.032 2.016 -1.509 1.00 0.00 O ATOM 860 CB TRP A 678 20.912 -0.245 -0.036 1.00 0.00 C ATOM 861 CG TRP A 678 20.749 -1.547 0.703 1.00 0.00 C ATOM 862 CD1 TRP A 678 21.215 -1.857 1.939 1.00 0.00 C ATOM 863 CD2 TRP A 678 20.064 -2.704 0.238 1.00 0.00 C ATOM 864 NE1 TRP A 678 20.861 -3.140 2.270 1.00 0.00 N ATOM 865 CE2 TRP A 678 20.154 -3.684 1.237 1.00 0.00 C ATOM 866 CE3 TRP A 678 19.388 -2.996 -0.926 1.00 0.00 C ATOM 867 CZ2 TRP A 678 19.583 -4.947 1.093 1.00 0.00 C ATOM 868 CZ3 TRP A 678 18.822 -4.226 -1.084 1.00 0.00 C ATOM 869 CH2 TRP A 678 18.919 -5.202 -0.080 1.00 0.00 C ATOM 0 H TRP A 678 23.122 0.265 1.026 1.00 0.00 H new ATOM 0 HA TRP A 678 22.317 -1.029 -1.433 1.00 0.00 H new ATOM 0 HB2 TRP A 678 20.852 0.577 0.677 1.00 0.00 H new ATOM 0 HB3 TRP A 678 20.081 -0.125 -0.732 1.00 0.00 H new ATOM 0 HD1 TRP A 678 21.783 -1.190 2.571 1.00 0.00 H new ATOM 0 HE1 TRP A 678 21.089 -3.611 3.146 1.00 0.00 H new ATOM 0 HE3 TRP A 678 19.307 -2.256 -1.708 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 19.660 -5.692 1.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 18.290 -4.453 -1.996 1.00 0.00 H new ATOM 0 HH2 TRP A 678 18.464 -6.169 -0.233 1.00 0.00 H new ATOM 880 N THR A 679 21.398 1.105 -2.702 1.00 0.00 N ATOM 881 CA THR A 679 21.322 2.201 -3.638 1.00 0.00 C ATOM 882 C THR A 679 20.465 3.350 -3.090 1.00 0.00 C ATOM 883 O THR A 679 20.190 3.413 -1.876 1.00 0.00 O ATOM 884 CB THR A 679 20.754 1.698 -4.970 1.00 0.00 C ATOM 885 OG1 THR A 679 19.561 0.946 -4.724 1.00 0.00 O ATOM 886 CG2 THR A 679 21.761 0.834 -5.706 1.00 0.00 C ATOM 0 H THR A 679 20.735 0.352 -2.887 1.00 0.00 H new ATOM 0 HA THR A 679 22.328 2.590 -3.795 1.00 0.00 H new ATOM 0 HB THR A 679 20.528 2.561 -5.596 1.00 0.00 H new ATOM 0 HG1 THR A 679 19.195 0.625 -5.575 1.00 0.00 H new ATOM 0 HG21 THR A 679 21.329 0.493 -6.647 1.00 0.00 H new ATOM 0 HG22 THR A 679 22.660 1.416 -5.910 1.00 0.00 H new ATOM 0 HG23 THR A 679 22.019 -0.028 -5.091 1.00 0.00 H new ATOM 894 N THR A 680 20.084 4.267 -3.957 1.00 0.00 N ATOM 895 CA THR A 680 19.256 5.375 -3.587 1.00 0.00 C ATOM 896 C THR A 680 17.857 4.900 -3.191 1.00 0.00 C ATOM 897 O THR A 680 17.107 4.355 -4.024 1.00 0.00 O ATOM 898 CB THR A 680 19.171 6.399 -4.750 1.00 0.00 C ATOM 899 OG1 THR A 680 20.499 6.883 -5.055 1.00 0.00 O ATOM 900 CG2 THR A 680 18.273 7.579 -4.387 1.00 0.00 C ATOM 0 H THR A 680 20.347 4.255 -4.942 1.00 0.00 H new ATOM 0 HA THR A 680 19.707 5.864 -2.724 1.00 0.00 H new ATOM 0 HB THR A 680 18.741 5.899 -5.618 1.00 0.00 H new ATOM 0 HG1 THR A 680 20.451 7.529 -5.790 1.00 0.00 H new ATOM 0 HG21 THR A 680 18.235 8.278 -5.223 1.00 0.00 H new ATOM 0 HG22 THR A 680 17.268 7.218 -4.170 1.00 0.00 H new ATOM 0 HG23 THR A 680 18.674 8.085 -3.509 1.00 0.00 H new ATOM 908 N LEU A 681 17.543 5.041 -1.915 1.00 0.00 N ATOM 909 CA LEU A 681 16.222 4.730 -1.423 1.00 0.00 C ATOM 910 C LEU A 681 15.198 5.725 -1.919 1.00 0.00 C ATOM 911 O LEU A 681 15.535 6.860 -2.258 1.00 0.00 O ATOM 912 CB LEU A 681 16.150 4.625 0.103 1.00 0.00 C ATOM 913 CG LEU A 681 16.634 3.328 0.727 1.00 0.00 C ATOM 914 CD1 LEU A 681 18.135 3.330 0.965 1.00 0.00 C ATOM 915 CD2 LEU A 681 15.846 3.044 1.987 1.00 0.00 C ATOM 0 H LEU A 681 18.192 5.371 -1.201 1.00 0.00 H new ATOM 0 HA LEU A 681 15.989 3.744 -1.824 1.00 0.00 H new ATOM 0 HB2 LEU A 681 16.732 5.443 0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 681 15.114 4.781 0.405 1.00 0.00 H new ATOM 0 HG LEU A 681 16.454 2.515 0.023 1.00 0.00 H new ATOM 0 HD11 LEU A 681 18.434 2.382 1.412 1.00 0.00 H new ATOM 0 HD12 LEU A 681 18.654 3.463 0.016 1.00 0.00 H new ATOM 0 HD13 LEU A 681 18.396 4.147 1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 681 16.196 2.113 2.433 1.00 0.00 H new ATOM 0 HD22 LEU A 681 15.986 3.860 2.696 1.00 0.00 H new ATOM 0 HD23 LEU A 681 14.788 2.954 1.742 1.00 0.00 H new ATOM 927 N PRO A 682 13.937 5.304 -1.999 1.00 0.00 N ATOM 928 CA PRO A 682 12.854 6.163 -2.447 1.00 0.00 C ATOM 929 C PRO A 682 12.488 7.292 -1.465 1.00 0.00 C ATOM 930 O PRO A 682 13.066 7.435 -0.375 1.00 0.00 O ATOM 931 CB PRO A 682 11.688 5.203 -2.583 1.00 0.00 C ATOM 932 CG PRO A 682 11.989 4.101 -1.647 1.00 0.00 C ATOM 933 CD PRO A 682 13.463 3.931 -1.696 1.00 0.00 C ATOM 0 HA PRO A 682 13.133 6.687 -3.361 1.00 0.00 H new ATOM 0 HB2 PRO A 682 10.745 5.689 -2.331 1.00 0.00 H new ATOM 0 HB3 PRO A 682 11.595 4.838 -3.606 1.00 0.00 H new ATOM 0 HG2 PRO A 682 11.655 4.341 -0.638 1.00 0.00 H new ATOM 0 HG3 PRO A 682 11.478 3.185 -1.942 1.00 0.00 H new ATOM 0 HD2 PRO A 682 13.861 3.565 -0.750 1.00 0.00 H new ATOM 0 HD3 PRO A 682 13.764 3.219 -2.465 1.00 0.00 H new ATOM 941 N VAL A 683 11.496 8.049 -1.858 1.00 0.00 N ATOM 942 CA VAL A 683 11.006 9.188 -1.125 1.00 0.00 C ATOM 943 C VAL A 683 9.496 9.058 -1.055 1.00 0.00 C ATOM 944 O VAL A 683 8.876 8.536 -1.992 1.00 0.00 O ATOM 945 CB VAL A 683 11.366 10.541 -1.845 1.00 0.00 C ATOM 946 CG1 VAL A 683 10.863 11.748 -1.062 1.00 0.00 C ATOM 947 CG2 VAL A 683 12.863 10.668 -2.071 1.00 0.00 C ATOM 0 H VAL A 683 10.989 7.883 -2.728 1.00 0.00 H new ATOM 0 HA VAL A 683 11.464 9.206 -0.136 1.00 0.00 H new ATOM 0 HB VAL A 683 10.864 10.522 -2.812 1.00 0.00 H new ATOM 0 HG11 VAL A 683 11.131 12.662 -1.591 1.00 0.00 H new ATOM 0 HG12 VAL A 683 9.779 11.691 -0.962 1.00 0.00 H new ATOM 0 HG13 VAL A 683 11.319 11.755 -0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 683 13.077 11.613 -2.570 1.00 0.00 H new ATOM 0 HG22 VAL A 683 13.380 10.639 -1.112 1.00 0.00 H new ATOM 0 HG23 VAL A 683 13.208 9.843 -2.694 1.00 0.00 H new ATOM 957 N CYS A 684 8.920 9.496 0.032 1.00 0.00 N ATOM 958 CA CYS A 684 7.496 9.456 0.225 1.00 0.00 C ATOM 959 C CYS A 684 6.993 10.855 0.507 1.00 0.00 C ATOM 960 O CYS A 684 7.511 11.533 1.396 1.00 0.00 O ATOM 961 CB CYS A 684 7.141 8.534 1.383 1.00 0.00 C ATOM 962 SG CYS A 684 7.477 6.782 1.112 1.00 0.00 S ATOM 0 H CYS A 684 9.433 9.895 0.818 1.00 0.00 H new ATOM 0 HA CYS A 684 7.024 9.071 -0.679 1.00 0.00 H new ATOM 0 HB2 CYS A 684 7.692 8.859 2.266 1.00 0.00 H new ATOM 0 HB3 CYS A 684 6.081 8.652 1.607 1.00 0.00 H new ATOM 967 N ILE A 685 6.006 11.276 -0.232 1.00 0.00 N ATOM 968 CA ILE A 685 5.443 12.611 -0.109 1.00 0.00 C ATOM 969 C ILE A 685 3.946 12.514 0.067 1.00 0.00 C ATOM 970 O ILE A 685 3.313 11.676 -0.541 1.00 0.00 O ATOM 971 CB ILE A 685 5.732 13.485 -1.355 1.00 0.00 C ATOM 972 CG1 ILE A 685 5.246 12.776 -2.632 1.00 0.00 C ATOM 973 CG2 ILE A 685 7.218 13.836 -1.443 1.00 0.00 C ATOM 974 CD1 ILE A 685 5.299 13.631 -3.860 1.00 0.00 C ATOM 0 H ILE A 685 5.558 10.704 -0.947 1.00 0.00 H new ATOM 0 HA ILE A 685 5.911 13.080 0.757 1.00 0.00 H new ATOM 0 HB ILE A 685 5.180 14.420 -1.258 1.00 0.00 H new ATOM 0 HG12 ILE A 685 5.854 11.886 -2.795 1.00 0.00 H new ATOM 0 HG13 ILE A 685 4.221 12.439 -2.480 1.00 0.00 H new ATOM 0 HG21 ILE A 685 7.395 14.450 -2.326 1.00 0.00 H new ATOM 0 HG22 ILE A 685 7.515 14.388 -0.551 1.00 0.00 H new ATOM 0 HG23 ILE A 685 7.805 12.920 -1.514 1.00 0.00 H new ATOM 0 HD11 ILE A 685 4.941 13.060 -4.717 1.00 0.00 H new ATOM 0 HD12 ILE A 685 4.668 14.509 -3.720 1.00 0.00 H new ATOM 0 HD13 ILE A 685 6.327 13.947 -4.039 1.00 0.00 H new ATOM 986 N VAL A 686 3.395 13.335 0.904 1.00 0.00 N ATOM 987 CA VAL A 686 1.961 13.317 1.137 1.00 0.00 C ATOM 988 C VAL A 686 1.254 13.946 -0.054 1.00 0.00 C ATOM 989 O VAL A 686 1.625 15.038 -0.501 1.00 0.00 O ATOM 990 CB VAL A 686 1.575 14.028 2.493 1.00 0.00 C ATOM 991 CG1 VAL A 686 2.029 15.475 2.537 1.00 0.00 C ATOM 992 CG2 VAL A 686 0.085 13.940 2.770 1.00 0.00 C ATOM 0 H VAL A 686 3.906 14.033 1.445 1.00 0.00 H new ATOM 0 HA VAL A 686 1.633 12.282 1.237 1.00 0.00 H new ATOM 0 HB VAL A 686 2.106 13.488 3.277 1.00 0.00 H new ATOM 0 HG11 VAL A 686 1.739 15.918 3.490 1.00 0.00 H new ATOM 0 HG12 VAL A 686 3.113 15.520 2.431 1.00 0.00 H new ATOM 0 HG13 VAL A 686 1.561 16.028 1.722 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -0.140 14.441 3.712 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -0.464 14.423 1.962 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -0.212 12.893 2.836 1.00 0.00 H new ATOM 1043 N THR A 690 -7.904 13.186 -0.504 1.00 0.00 N ATOM 1044 CA THR A 690 -8.807 12.259 0.119 1.00 0.00 C ATOM 1045 C THR A 690 -9.733 11.585 -0.905 1.00 0.00 C ATOM 1046 O THR A 690 -9.951 12.105 -2.004 1.00 0.00 O ATOM 1047 CB THR A 690 -9.647 12.969 1.208 1.00 0.00 C ATOM 1048 OG1 THR A 690 -10.182 14.196 0.683 1.00 0.00 O ATOM 1049 CG2 THR A 690 -8.809 13.268 2.438 1.00 0.00 C ATOM 0 HA THR A 690 -8.202 11.480 0.583 1.00 0.00 H new ATOM 0 HB THR A 690 -10.460 12.304 1.499 1.00 0.00 H new ATOM 0 HG1 THR A 690 -9.505 14.637 0.128 1.00 0.00 H new ATOM 0 HG21 THR A 690 -9.426 13.767 3.186 1.00 0.00 H new ATOM 0 HG22 THR A 690 -8.422 12.336 2.850 1.00 0.00 H new ATOM 0 HG23 THR A 690 -7.977 13.916 2.163 1.00 0.00 H new ATOM 1057 N CYS A 691 -10.214 10.406 -0.566 1.00 0.00 N ATOM 1058 CA CYS A 691 -11.187 9.689 -1.391 1.00 0.00 C ATOM 1059 C CYS A 691 -12.615 9.970 -0.975 1.00 0.00 C ATOM 1060 O CYS A 691 -13.559 9.478 -1.589 1.00 0.00 O ATOM 1061 CB CYS A 691 -10.915 8.187 -1.400 1.00 0.00 C ATOM 1062 SG CYS A 691 -9.670 7.675 -2.620 1.00 0.00 S ATOM 0 H CYS A 691 -9.947 9.912 0.286 1.00 0.00 H new ATOM 0 HA CYS A 691 -11.065 10.065 -2.407 1.00 0.00 H new ATOM 0 HB2 CYS A 691 -10.585 7.881 -0.407 1.00 0.00 H new ATOM 0 HB3 CYS A 691 -11.847 7.660 -1.603 1.00 0.00 H new ATOM 1067 N GLY A 692 -12.775 10.743 0.065 1.00 0.00 N ATOM 1068 CA GLY A 692 -14.090 11.091 0.515 1.00 0.00 C ATOM 1069 C GLY A 692 -14.482 10.228 1.663 1.00 0.00 C ATOM 1070 O GLY A 692 -14.252 10.598 2.821 1.00 0.00 O ATOM 0 H GLY A 692 -12.012 11.141 0.613 1.00 0.00 H new ATOM 0 HA2 GLY A 692 -14.116 12.139 0.812 1.00 0.00 H new ATOM 0 HA3 GLY A 692 -14.805 10.973 -0.299 1.00 0.00 H new ATOM 1074 N ASP A 693 -15.044 9.092 1.363 1.00 0.00 N ATOM 1075 CA ASP A 693 -15.409 8.114 2.362 1.00 0.00 C ATOM 1076 C ASP A 693 -15.514 6.777 1.659 1.00 0.00 C ATOM 1077 O ASP A 693 -15.024 6.626 0.527 1.00 0.00 O ATOM 1078 CB ASP A 693 -16.751 8.491 3.059 1.00 0.00 C ATOM 1079 CG ASP A 693 -16.877 7.923 4.482 1.00 0.00 C ATOM 1080 OD1 ASP A 693 -16.917 6.690 4.658 1.00 0.00 O ATOM 1081 OD2 ASP A 693 -16.896 8.708 5.449 1.00 0.00 O ATOM 0 H ASP A 693 -15.267 8.810 0.408 1.00 0.00 H new ATOM 0 HA ASP A 693 -14.656 8.074 3.149 1.00 0.00 H new ATOM 0 HB2 ASP A 693 -16.839 9.577 3.099 1.00 0.00 H new ATOM 0 HB3 ASP A 693 -17.581 8.126 2.455 1.00 0.00 H new ATOM 1086 N ILE A 694 -16.067 5.824 2.322 1.00 0.00 N ATOM 1087 CA ILE A 694 -16.329 4.548 1.791 1.00 0.00 C ATOM 1088 C ILE A 694 -17.500 4.617 0.828 1.00 0.00 C ATOM 1089 O ILE A 694 -18.523 5.258 1.109 1.00 0.00 O ATOM 1090 CB ILE A 694 -16.539 3.535 2.951 1.00 0.00 C ATOM 1091 CG1 ILE A 694 -15.196 2.966 3.355 1.00 0.00 C ATOM 1092 CG2 ILE A 694 -17.551 2.436 2.650 1.00 0.00 C ATOM 1093 CD1 ILE A 694 -14.893 3.066 4.821 1.00 0.00 C ATOM 0 H ILE A 694 -16.360 5.925 3.294 1.00 0.00 H new ATOM 0 HA ILE A 694 -15.477 4.192 1.212 1.00 0.00 H new ATOM 0 HB ILE A 694 -16.980 4.083 3.784 1.00 0.00 H new ATOM 0 HG12 ILE A 694 -15.156 1.918 3.059 1.00 0.00 H new ATOM 0 HG13 ILE A 694 -14.414 3.484 2.799 1.00 0.00 H new ATOM 0 HG21 ILE A 694 -17.636 1.774 3.512 1.00 0.00 H new ATOM 0 HG22 ILE A 694 -18.522 2.884 2.439 1.00 0.00 H new ATOM 0 HG23 ILE A 694 -17.219 1.863 1.784 1.00 0.00 H new ATOM 0 HD11 ILE A 694 -13.912 2.634 5.020 1.00 0.00 H new ATOM 0 HD12 ILE A 694 -14.897 4.113 5.123 1.00 0.00 H new ATOM 0 HD13 ILE A 694 -15.650 2.523 5.387 1.00 0.00 H new ATOM 1105 N PRO A 695 -17.334 4.004 -0.334 1.00 0.00 N ATOM 1106 CA PRO A 695 -18.341 3.987 -1.373 1.00 0.00 C ATOM 1107 C PRO A 695 -19.491 3.058 -1.013 1.00 0.00 C ATOM 1108 O PRO A 695 -19.663 2.639 0.145 1.00 0.00 O ATOM 1109 CB PRO A 695 -17.581 3.422 -2.584 1.00 0.00 C ATOM 1110 CG PRO A 695 -16.526 2.573 -1.983 1.00 0.00 C ATOM 1111 CD PRO A 695 -16.130 3.263 -0.718 1.00 0.00 C ATOM 0 HA PRO A 695 -18.783 4.969 -1.543 1.00 0.00 H new ATOM 0 HB2 PRO A 695 -18.238 2.842 -3.232 1.00 0.00 H new ATOM 0 HB3 PRO A 695 -17.153 4.218 -3.193 1.00 0.00 H new ATOM 0 HG2 PRO A 695 -16.898 1.568 -1.782 1.00 0.00 H new ATOM 0 HG3 PRO A 695 -15.675 2.469 -2.656 1.00 0.00 H new ATOM 0 HD2 PRO A 695 -15.836 2.550 0.052 1.00 0.00 H new ATOM 0 HD3 PRO A 695 -15.282 3.930 -0.874 1.00 0.00 H new ATOM 1119 N GLU A 696 -20.269 2.742 -1.970 1.00 0.00 N ATOM 1120 CA GLU A 696 -21.331 1.844 -1.768 1.00 0.00 C ATOM 1121 C GLU A 696 -21.120 0.641 -2.622 1.00 0.00 C ATOM 1122 O GLU A 696 -20.606 0.739 -3.746 1.00 0.00 O ATOM 1123 CB GLU A 696 -22.678 2.491 -2.047 1.00 0.00 C ATOM 1124 CG GLU A 696 -22.841 3.029 -3.449 1.00 0.00 C ATOM 1125 CD GLU A 696 -24.185 3.638 -3.642 1.00 0.00 C ATOM 1126 OE1 GLU A 696 -25.130 2.911 -3.990 1.00 0.00 O ATOM 1127 OE2 GLU A 696 -24.322 4.855 -3.428 1.00 0.00 O ATOM 0 H GLU A 696 -20.187 3.101 -2.921 1.00 0.00 H new ATOM 0 HA GLU A 696 -21.344 1.544 -0.720 1.00 0.00 H new ATOM 0 HB2 GLU A 696 -23.463 1.759 -1.860 1.00 0.00 H new ATOM 0 HB3 GLU A 696 -22.828 3.307 -1.340 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -22.070 3.774 -3.647 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -22.698 2.223 -4.169 1.00 0.00 H new ATOM 1134 N LEU A 697 -21.451 -0.469 -2.096 1.00 0.00 N ATOM 1135 CA LEU A 697 -21.362 -1.682 -2.816 1.00 0.00 C ATOM 1136 C LEU A 697 -22.795 -2.167 -2.897 1.00 0.00 C ATOM 1137 O LEU A 697 -23.513 -2.071 -1.902 1.00 0.00 O ATOM 1138 CB LEU A 697 -20.447 -2.679 -2.055 1.00 0.00 C ATOM 1139 CG LEU A 697 -19.800 -3.846 -2.849 1.00 0.00 C ATOM 1140 CD1 LEU A 697 -18.876 -4.665 -1.952 1.00 0.00 C ATOM 1141 CD2 LEU A 697 -20.826 -4.754 -3.493 1.00 0.00 C ATOM 0 H LEU A 697 -21.796 -0.568 -1.141 1.00 0.00 H new ATOM 0 HA LEU A 697 -20.922 -1.573 -3.807 1.00 0.00 H new ATOM 0 HB2 LEU A 697 -19.643 -2.105 -1.595 1.00 0.00 H new ATOM 0 HB3 LEU A 697 -21.032 -3.114 -1.245 1.00 0.00 H new ATOM 0 HG LEU A 697 -19.219 -3.389 -3.650 1.00 0.00 H new ATOM 0 HD11 LEU A 697 -18.434 -5.477 -2.530 1.00 0.00 H new ATOM 0 HD12 LEU A 697 -18.085 -4.024 -1.563 1.00 0.00 H new ATOM 0 HD13 LEU A 697 -19.448 -5.080 -1.122 1.00 0.00 H new ATOM 0 HD21 LEU A 697 -20.317 -5.552 -4.034 1.00 0.00 H new ATOM 0 HD22 LEU A 697 -21.463 -5.188 -2.722 1.00 0.00 H new ATOM 0 HD23 LEU A 697 -21.438 -4.177 -4.187 1.00 0.00 H new ATOM 1153 N GLU A 698 -23.193 -2.660 -4.063 1.00 0.00 N ATOM 1154 CA GLU A 698 -24.568 -3.109 -4.370 1.00 0.00 C ATOM 1155 C GLU A 698 -25.214 -3.906 -3.222 1.00 0.00 C ATOM 1156 O GLU A 698 -26.402 -3.760 -2.943 1.00 0.00 O ATOM 1157 CB GLU A 698 -24.568 -3.967 -5.647 1.00 0.00 C ATOM 1158 CG GLU A 698 -23.792 -5.272 -5.510 1.00 0.00 C ATOM 1159 CD GLU A 698 -23.847 -6.125 -6.734 1.00 0.00 C ATOM 1160 OE1 GLU A 698 -24.914 -6.680 -7.019 1.00 0.00 O ATOM 1161 OE2 GLU A 698 -22.815 -6.301 -7.394 1.00 0.00 O ATOM 0 H GLU A 698 -22.557 -2.767 -4.853 1.00 0.00 H new ATOM 0 HA GLU A 698 -25.164 -2.208 -4.514 1.00 0.00 H new ATOM 0 HB2 GLU A 698 -25.598 -4.195 -5.921 1.00 0.00 H new ATOM 0 HB3 GLU A 698 -24.142 -3.386 -6.465 1.00 0.00 H new ATOM 0 HG2 GLU A 698 -22.751 -5.045 -5.281 1.00 0.00 H new ATOM 0 HG3 GLU A 698 -24.189 -5.835 -4.665 1.00 0.00 H new ATOM 1168 N HIS A 699 -24.426 -4.758 -2.584 1.00 0.00 N ATOM 1169 CA HIS A 699 -24.886 -5.590 -1.492 1.00 0.00 C ATOM 1170 C HIS A 699 -23.753 -5.752 -0.485 1.00 0.00 C ATOM 1171 O HIS A 699 -23.659 -6.766 0.226 1.00 0.00 O ATOM 1172 CB HIS A 699 -25.368 -6.973 -2.003 1.00 0.00 C ATOM 1173 CG HIS A 699 -26.604 -6.939 -2.879 1.00 0.00 C ATOM 1174 ND1 HIS A 699 -27.876 -6.808 -2.379 1.00 0.00 N ATOM 1175 CD2 HIS A 699 -26.745 -7.011 -4.222 1.00 0.00 C ATOM 1176 CE1 HIS A 699 -28.741 -6.803 -3.366 1.00 0.00 C ATOM 1177 NE2 HIS A 699 -28.079 -6.924 -4.493 1.00 0.00 N ATOM 0 H HIS A 699 -23.441 -4.890 -2.815 1.00 0.00 H new ATOM 0 HA HIS A 699 -25.738 -5.109 -1.011 1.00 0.00 H new ATOM 0 HB2 HIS A 699 -24.557 -7.439 -2.563 1.00 0.00 H new ATOM 0 HB3 HIS A 699 -25.569 -7.611 -1.143 1.00 0.00 H new ATOM 0 HD2 HIS A 699 -25.950 -7.118 -4.945 1.00 0.00 H new ATOM 0 HE1 HIS A 699 -29.813 -6.715 -3.268 1.00 0.00 H new ATOM 0 HE2 HIS A 699 -28.496 -6.949 -5.424 1.00 0.00 H new ATOM 1186 N GLY A 700 -22.911 -4.741 -0.426 1.00 0.00 N ATOM 1187 CA GLY A 700 -21.776 -4.748 0.457 1.00 0.00 C ATOM 1188 C GLY A 700 -21.653 -3.443 1.216 1.00 0.00 C ATOM 1189 O GLY A 700 -22.340 -2.476 0.905 1.00 0.00 O ATOM 0 H GLY A 700 -22.999 -3.896 -0.990 1.00 0.00 H new ATOM 0 HA2 GLY A 700 -21.869 -5.573 1.163 1.00 0.00 H new ATOM 0 HA3 GLY A 700 -20.867 -4.922 -0.119 1.00 0.00 H new ATOM 1193 N TRP A 701 -20.775 -3.422 2.180 1.00 0.00 N ATOM 1194 CA TRP A 701 -20.542 -2.339 3.070 1.00 0.00 C ATOM 1195 C TRP A 701 -19.161 -2.531 3.619 1.00 0.00 C ATOM 1196 O TRP A 701 -18.380 -3.232 3.006 1.00 0.00 O ATOM 1197 CB TRP A 701 -21.623 -2.281 4.162 1.00 0.00 C ATOM 1198 CG TRP A 701 -22.085 -3.610 4.652 1.00 0.00 C ATOM 1199 CD1 TRP A 701 -23.079 -4.335 4.126 1.00 0.00 C ATOM 1200 CD2 TRP A 701 -21.582 -4.349 5.746 1.00 0.00 C ATOM 1201 NE1 TRP A 701 -23.232 -5.508 4.800 1.00 0.00 N ATOM 1202 CE2 TRP A 701 -22.323 -5.540 5.823 1.00 0.00 C ATOM 1203 CE3 TRP A 701 -20.581 -4.119 6.659 1.00 0.00 C ATOM 1204 CZ2 TRP A 701 -22.080 -6.501 6.796 1.00 0.00 C ATOM 1205 CZ3 TRP A 701 -20.333 -5.053 7.620 1.00 0.00 C ATOM 1206 CH2 TRP A 701 -21.078 -6.237 7.691 1.00 0.00 C ATOM 0 H TRP A 701 -20.167 -4.219 2.370 1.00 0.00 H new ATOM 0 HA TRP A 701 -20.604 -1.377 2.562 1.00 0.00 H new ATOM 0 HB2 TRP A 701 -21.236 -1.712 5.007 1.00 0.00 H new ATOM 0 HB3 TRP A 701 -22.482 -1.733 3.775 1.00 0.00 H new ATOM 0 HD1 TRP A 701 -23.679 -4.031 3.281 1.00 0.00 H new ATOM 0 HE1 TRP A 701 -23.909 -6.239 4.580 1.00 0.00 H new ATOM 0 HE3 TRP A 701 -19.999 -3.210 6.616 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 -22.655 -7.414 6.844 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 -19.548 -4.877 8.340 1.00 0.00 H new ATOM 0 HH2 TRP A 701 -20.858 -6.956 8.467 1.00 0.00 H new ATOM 1217 N ALA A 702 -18.860 -2.014 4.757 1.00 0.00 N ATOM 1218 CA ALA A 702 -17.483 -1.954 5.160 1.00 0.00 C ATOM 1219 C ALA A 702 -17.249 -2.340 6.613 1.00 0.00 C ATOM 1220 O ALA A 702 -18.125 -2.167 7.461 1.00 0.00 O ATOM 1221 CB ALA A 702 -17.001 -0.562 4.886 1.00 0.00 C ATOM 0 H ALA A 702 -19.530 -1.629 5.423 1.00 0.00 H new ATOM 0 HA ALA A 702 -16.920 -2.692 4.588 1.00 0.00 H new ATOM 0 HB1 ALA A 702 -15.955 -0.475 5.180 1.00 0.00 H new ATOM 0 HB2 ALA A 702 -17.099 -0.346 3.822 1.00 0.00 H new ATOM 0 HB3 ALA A 702 -17.598 0.149 5.457 1.00 0.00 H new ATOM 1227 N GLN A 703 -16.049 -2.854 6.885 1.00 0.00 N ATOM 1228 CA GLN A 703 -15.657 -3.245 8.245 1.00 0.00 C ATOM 1229 C GLN A 703 -14.953 -2.104 8.953 1.00 0.00 C ATOM 1230 O GLN A 703 -15.290 -1.758 10.088 1.00 0.00 O ATOM 1231 CB GLN A 703 -14.725 -4.477 8.281 1.00 0.00 C ATOM 1232 CG GLN A 703 -15.380 -5.833 8.054 1.00 0.00 C ATOM 1233 CD GLN A 703 -15.051 -6.466 6.719 1.00 0.00 C ATOM 1234 OE1 GLN A 703 -14.982 -7.681 6.602 1.00 0.00 O ATOM 1235 NE2 GLN A 703 -14.858 -5.670 5.715 1.00 0.00 N ATOM 0 H GLN A 703 -15.328 -3.011 6.181 1.00 0.00 H new ATOM 0 HA GLN A 703 -16.587 -3.502 8.752 1.00 0.00 H new ATOM 0 HB2 GLN A 703 -13.951 -4.341 7.525 1.00 0.00 H new ATOM 0 HB3 GLN A 703 -14.225 -4.498 9.249 1.00 0.00 H new ATOM 0 HG2 GLN A 703 -15.072 -6.511 8.850 1.00 0.00 H new ATOM 0 HG3 GLN A 703 -16.461 -5.719 8.133 1.00 0.00 H new ATOM 0 HE21 GLN A 703 -14.923 -4.660 5.845 1.00 0.00 H new ATOM 0 HE22 GLN A 703 -14.642 -6.053 4.795 1.00 0.00 H new ATOM 1244 N LEU A 704 -13.986 -1.516 8.284 1.00 0.00 N ATOM 1245 CA LEU A 704 -13.193 -0.467 8.868 1.00 0.00 C ATOM 1246 C LEU A 704 -13.225 0.774 8.010 1.00 0.00 C ATOM 1247 O LEU A 704 -13.426 0.687 6.790 1.00 0.00 O ATOM 1248 CB LEU A 704 -11.743 -0.954 9.183 1.00 0.00 C ATOM 1249 CG LEU A 704 -10.889 -1.563 8.034 1.00 0.00 C ATOM 1250 CD1 LEU A 704 -10.404 -0.508 7.044 1.00 0.00 C ATOM 1251 CD2 LEU A 704 -9.712 -2.333 8.602 1.00 0.00 C ATOM 0 H LEU A 704 -13.731 -1.753 7.325 1.00 0.00 H new ATOM 0 HA LEU A 704 -13.635 -0.196 9.827 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -11.192 -0.106 9.590 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -11.810 -1.700 9.975 1.00 0.00 H new ATOM 0 HG LEU A 704 -11.536 -2.246 7.483 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -9.813 -0.986 6.263 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -11.262 -0.008 6.595 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -9.789 0.225 7.566 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -9.124 -2.753 7.786 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -9.088 -1.661 9.191 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -10.077 -3.139 9.238 1.00 0.00 H new ATOM 1263 N SER A 705 -13.040 1.891 8.643 1.00 0.00 N ATOM 1264 CA SER A 705 -13.055 3.173 8.028 1.00 0.00 C ATOM 1265 C SER A 705 -12.091 4.088 8.763 1.00 0.00 C ATOM 1266 O SER A 705 -12.186 4.241 9.986 1.00 0.00 O ATOM 1267 CB SER A 705 -14.466 3.729 8.111 1.00 0.00 C ATOM 1268 OG SER A 705 -15.003 3.595 9.422 1.00 0.00 O ATOM 0 H SER A 705 -12.867 1.931 9.647 1.00 0.00 H new ATOM 0 HA SER A 705 -12.750 3.101 6.984 1.00 0.00 H new ATOM 0 HB2 SER A 705 -14.461 4.781 7.824 1.00 0.00 H new ATOM 0 HB3 SER A 705 -15.106 3.208 7.399 1.00 0.00 H new ATOM 0 HG SER A 705 -14.289 3.720 10.082 1.00 0.00 H new ATOM 1274 N SER A 706 -11.163 4.657 8.073 1.00 0.00 N ATOM 1275 CA SER A 706 -10.250 5.552 8.712 1.00 0.00 C ATOM 1276 C SER A 706 -10.119 6.849 7.912 1.00 0.00 C ATOM 1277 O SER A 706 -9.366 6.932 6.949 1.00 0.00 O ATOM 1278 CB SER A 706 -8.889 4.871 8.934 1.00 0.00 C ATOM 1279 OG SER A 706 -8.053 5.620 9.820 1.00 0.00 O ATOM 0 H SER A 706 -11.014 4.523 7.073 1.00 0.00 H new ATOM 0 HA SER A 706 -10.644 5.815 9.694 1.00 0.00 H new ATOM 0 HB2 SER A 706 -9.046 3.872 9.341 1.00 0.00 H new ATOM 0 HB3 SER A 706 -8.384 4.749 7.976 1.00 0.00 H new ATOM 0 HG SER A 706 -7.199 5.154 9.936 1.00 0.00 H new ATOM 1285 N PRO A 707 -10.938 7.847 8.245 1.00 0.00 N ATOM 1286 CA PRO A 707 -10.862 9.147 7.638 1.00 0.00 C ATOM 1287 C PRO A 707 -9.859 10.051 8.370 1.00 0.00 C ATOM 1288 O PRO A 707 -9.663 9.929 9.589 1.00 0.00 O ATOM 1289 CB PRO A 707 -12.287 9.691 7.754 1.00 0.00 C ATOM 1290 CG PRO A 707 -13.048 8.679 8.572 1.00 0.00 C ATOM 1291 CD PRO A 707 -12.029 7.780 9.198 1.00 0.00 C ATOM 0 HA PRO A 707 -10.511 9.105 6.607 1.00 0.00 H new ATOM 0 HB2 PRO A 707 -12.294 10.669 8.236 1.00 0.00 H new ATOM 0 HB3 PRO A 707 -12.738 9.818 6.770 1.00 0.00 H new ATOM 0 HG2 PRO A 707 -13.650 9.172 9.335 1.00 0.00 H new ATOM 0 HG3 PRO A 707 -13.733 8.110 7.944 1.00 0.00 H new ATOM 0 HD2 PRO A 707 -11.729 8.130 10.186 1.00 0.00 H new ATOM 0 HD3 PRO A 707 -12.402 6.763 9.319 1.00 0.00 H new ATOM 1299 N PRO A 708 -9.219 10.975 7.655 1.00 0.00 N ATOM 1300 CA PRO A 708 -9.433 11.166 6.222 1.00 0.00 C ATOM 1301 C PRO A 708 -8.769 10.066 5.376 1.00 0.00 C ATOM 1302 O PRO A 708 -7.613 9.698 5.600 1.00 0.00 O ATOM 1303 CB PRO A 708 -8.802 12.528 5.957 1.00 0.00 C ATOM 1304 CG PRO A 708 -7.743 12.659 6.990 1.00 0.00 C ATOM 1305 CD PRO A 708 -8.228 11.915 8.195 1.00 0.00 C ATOM 0 HA PRO A 708 -10.487 11.115 5.949 1.00 0.00 H new ATOM 0 HB2 PRO A 708 -8.384 12.582 4.952 1.00 0.00 H new ATOM 0 HB3 PRO A 708 -9.537 13.328 6.040 1.00 0.00 H new ATOM 0 HG2 PRO A 708 -6.800 12.246 6.633 1.00 0.00 H new ATOM 0 HG3 PRO A 708 -7.562 13.707 7.229 1.00 0.00 H new ATOM 0 HD2 PRO A 708 -7.413 11.392 8.696 1.00 0.00 H new ATOM 0 HD3 PRO A 708 -8.674 12.588 8.928 1.00 0.00 H new ATOM 1313 N TYR A 709 -9.526 9.543 4.437 1.00 0.00 N ATOM 1314 CA TYR A 709 -9.063 8.468 3.568 1.00 0.00 C ATOM 1315 C TYR A 709 -8.126 9.049 2.514 1.00 0.00 C ATOM 1316 O TYR A 709 -8.597 9.554 1.487 1.00 0.00 O ATOM 1317 CB TYR A 709 -10.262 7.801 2.857 1.00 0.00 C ATOM 1318 CG TYR A 709 -11.378 7.352 3.772 1.00 0.00 C ATOM 1319 CD1 TYR A 709 -12.398 8.214 4.086 1.00 0.00 C ATOM 1320 CD2 TYR A 709 -11.421 6.070 4.291 1.00 0.00 C ATOM 1321 CE1 TYR A 709 -13.431 7.837 4.891 1.00 0.00 C ATOM 1322 CE2 TYR A 709 -12.468 5.673 5.101 1.00 0.00 C ATOM 1323 CZ TYR A 709 -13.472 6.568 5.398 1.00 0.00 C ATOM 1324 OH TYR A 709 -14.529 6.185 6.188 1.00 0.00 O ATOM 0 H TYR A 709 -10.481 9.847 4.249 1.00 0.00 H new ATOM 0 HA TYR A 709 -8.543 7.723 4.170 1.00 0.00 H new ATOM 0 HB2 TYR A 709 -10.669 8.502 2.129 1.00 0.00 H new ATOM 0 HB3 TYR A 709 -9.900 6.937 2.299 1.00 0.00 H new ATOM 0 HD1 TYR A 709 -12.382 9.217 3.685 1.00 0.00 H new ATOM 0 HD2 TYR A 709 -10.629 5.373 4.061 1.00 0.00 H new ATOM 0 HE1 TYR A 709 -14.216 8.540 5.128 1.00 0.00 H new ATOM 0 HE2 TYR A 709 -12.499 4.669 5.498 1.00 0.00 H new ATOM 0 HH TYR A 709 -15.359 6.234 5.670 1.00 0.00 H new ATOM 1334 N TYR A 710 -6.843 9.047 2.800 1.00 0.00 N ATOM 1335 CA TYR A 710 -5.822 9.570 1.885 1.00 0.00 C ATOM 1336 C TYR A 710 -5.488 8.579 0.799 1.00 0.00 C ATOM 1337 O TYR A 710 -5.858 7.391 0.890 1.00 0.00 O ATOM 1338 CB TYR A 710 -4.542 9.951 2.635 1.00 0.00 C ATOM 1339 CG TYR A 710 -4.535 11.330 3.257 1.00 0.00 C ATOM 1340 CD1 TYR A 710 -5.671 11.893 3.799 1.00 0.00 C ATOM 1341 CD2 TYR A 710 -3.364 12.066 3.301 1.00 0.00 C ATOM 1342 CE1 TYR A 710 -5.640 13.147 4.359 1.00 0.00 C ATOM 1343 CE2 TYR A 710 -3.325 13.317 3.860 1.00 0.00 C ATOM 1344 CZ TYR A 710 -4.467 13.853 4.392 1.00 0.00 C ATOM 1345 OH TYR A 710 -4.448 15.123 4.945 1.00 0.00 O ATOM 0 H TYR A 710 -6.465 8.683 3.675 1.00 0.00 H new ATOM 0 HA TYR A 710 -6.244 10.464 1.426 1.00 0.00 H new ATOM 0 HB2 TYR A 710 -4.371 9.216 3.422 1.00 0.00 H new ATOM 0 HB3 TYR A 710 -3.702 9.879 1.944 1.00 0.00 H new ATOM 0 HD1 TYR A 710 -6.599 11.340 3.783 1.00 0.00 H new ATOM 0 HD2 TYR A 710 -2.460 11.645 2.885 1.00 0.00 H new ATOM 0 HE1 TYR A 710 -6.540 13.576 4.773 1.00 0.00 H new ATOM 0 HE2 TYR A 710 -2.401 13.875 3.881 1.00 0.00 H new ATOM 0 HH TYR A 710 -3.540 15.489 4.893 1.00 0.00 H new ATOM 1355 N TYR A 711 -4.787 9.046 -0.231 1.00 0.00 N ATOM 1356 CA TYR A 711 -4.386 8.180 -1.319 1.00 0.00 C ATOM 1357 C TYR A 711 -3.399 7.205 -0.766 1.00 0.00 C ATOM 1358 O TYR A 711 -2.509 7.566 -0.001 1.00 0.00 O ATOM 1359 CB TYR A 711 -3.743 8.971 -2.483 1.00 0.00 C ATOM 1360 CG TYR A 711 -3.357 8.159 -3.753 1.00 0.00 C ATOM 1361 CD1 TYR A 711 -2.380 7.161 -3.730 1.00 0.00 C ATOM 1362 CD2 TYR A 711 -3.959 8.412 -4.953 1.00 0.00 C ATOM 1363 CE1 TYR A 711 -2.028 6.461 -4.843 1.00 0.00 C ATOM 1364 CE2 TYR A 711 -3.609 7.706 -6.090 1.00 0.00 C ATOM 1365 CZ TYR A 711 -2.639 6.727 -6.022 1.00 0.00 C ATOM 1366 OH TYR A 711 -2.280 6.021 -7.150 1.00 0.00 O ATOM 0 H TYR A 711 -4.489 10.017 -0.329 1.00 0.00 H new ATOM 0 HA TYR A 711 -5.264 7.678 -1.725 1.00 0.00 H new ATOM 0 HB2 TYR A 711 -4.434 9.759 -2.781 1.00 0.00 H new ATOM 0 HB3 TYR A 711 -2.845 9.460 -2.106 1.00 0.00 H new ATOM 0 HD1 TYR A 711 -1.886 6.937 -2.796 1.00 0.00 H new ATOM 0 HD2 TYR A 711 -4.720 9.175 -5.015 1.00 0.00 H new ATOM 0 HE1 TYR A 711 -1.266 5.698 -4.786 1.00 0.00 H new ATOM 0 HE2 TYR A 711 -4.095 7.921 -7.030 1.00 0.00 H new ATOM 0 HH TYR A 711 -2.812 6.331 -7.913 1.00 0.00 H new ATOM 1376 N GLY A 712 -3.564 5.983 -1.115 1.00 0.00 N ATOM 1377 CA GLY A 712 -2.652 5.024 -0.653 1.00 0.00 C ATOM 1378 C GLY A 712 -3.199 4.245 0.546 1.00 0.00 C ATOM 1379 O GLY A 712 -2.665 3.196 0.897 1.00 0.00 O ATOM 0 H GLY A 712 -4.314 5.633 -1.711 1.00 0.00 H new ATOM 0 HA2 GLY A 712 -2.416 4.330 -1.459 1.00 0.00 H new ATOM 0 HA3 GLY A 712 -1.720 5.515 -0.372 1.00 0.00 H new ATOM 1383 N ASP A 713 -4.277 4.742 1.167 1.00 0.00 N ATOM 1384 CA ASP A 713 -4.903 4.034 2.311 1.00 0.00 C ATOM 1385 C ASP A 713 -5.850 2.936 1.821 1.00 0.00 C ATOM 1386 O ASP A 713 -6.224 2.910 0.632 1.00 0.00 O ATOM 1387 CB ASP A 713 -5.620 5.004 3.280 1.00 0.00 C ATOM 1388 CG ASP A 713 -6.133 4.323 4.537 1.00 0.00 C ATOM 1389 OD1 ASP A 713 -5.313 3.746 5.313 1.00 0.00 O ATOM 1390 OD2 ASP A 713 -7.335 4.316 4.767 1.00 0.00 O ATOM 0 H ASP A 713 -4.734 5.617 0.908 1.00 0.00 H new ATOM 0 HA ASP A 713 -4.099 3.563 2.877 1.00 0.00 H new ATOM 0 HB2 ASP A 713 -4.932 5.801 3.561 1.00 0.00 H new ATOM 0 HB3 ASP A 713 -6.456 5.473 2.762 1.00 0.00 H new ATOM 1395 N SER A 714 -6.249 2.060 2.714 1.00 0.00 N ATOM 1396 CA SER A 714 -7.015 0.895 2.355 1.00 0.00 C ATOM 1397 C SER A 714 -8.272 0.790 3.189 1.00 0.00 C ATOM 1398 O SER A 714 -8.359 1.334 4.289 1.00 0.00 O ATOM 1399 CB SER A 714 -6.198 -0.344 2.617 1.00 0.00 C ATOM 1400 OG SER A 714 -4.805 -0.085 2.415 1.00 0.00 O ATOM 0 H SER A 714 -6.050 2.138 3.711 1.00 0.00 H new ATOM 0 HA SER A 714 -7.278 0.984 1.301 1.00 0.00 H new ATOM 0 HB2 SER A 714 -6.365 -0.686 3.638 1.00 0.00 H new ATOM 0 HB3 SER A 714 -6.523 -1.147 1.955 1.00 0.00 H new ATOM 0 HG SER A 714 -4.292 -0.901 2.592 1.00 0.00 H new ATOM 1406 N VAL A 715 -9.219 0.067 2.670 1.00 0.00 N ATOM 1407 CA VAL A 715 -10.458 -0.197 3.338 1.00 0.00 C ATOM 1408 C VAL A 715 -10.893 -1.624 3.059 1.00 0.00 C ATOM 1409 O VAL A 715 -10.672 -2.126 1.971 1.00 0.00 O ATOM 1410 CB VAL A 715 -11.578 0.800 2.907 1.00 0.00 C ATOM 1411 CG1 VAL A 715 -12.912 0.284 3.317 1.00 0.00 C ATOM 1412 CG2 VAL A 715 -11.381 2.138 3.559 1.00 0.00 C ATOM 0 H VAL A 715 -9.150 -0.366 1.749 1.00 0.00 H new ATOM 0 HA VAL A 715 -10.297 -0.062 4.408 1.00 0.00 H new ATOM 0 HB VAL A 715 -11.526 0.904 1.823 1.00 0.00 H new ATOM 0 HG11 VAL A 715 -13.685 0.989 3.010 1.00 0.00 H new ATOM 0 HG12 VAL A 715 -13.091 -0.680 2.841 1.00 0.00 H new ATOM 0 HG13 VAL A 715 -12.939 0.165 4.400 1.00 0.00 H new ATOM 0 HG21 VAL A 715 -12.174 2.817 3.244 1.00 0.00 H new ATOM 0 HG22 VAL A 715 -11.412 2.023 4.642 1.00 0.00 H new ATOM 0 HG23 VAL A 715 -10.415 2.547 3.265 1.00 0.00 H new ATOM 1422 N GLU A 716 -11.465 -2.277 4.052 1.00 0.00 N ATOM 1423 CA GLU A 716 -12.014 -3.608 3.864 1.00 0.00 C ATOM 1424 C GLU A 716 -13.524 -3.537 3.746 1.00 0.00 C ATOM 1425 O GLU A 716 -14.215 -2.995 4.645 1.00 0.00 O ATOM 1426 CB GLU A 716 -11.689 -4.549 5.009 1.00 0.00 C ATOM 1427 CG GLU A 716 -10.232 -4.848 5.233 1.00 0.00 C ATOM 1428 CD GLU A 716 -10.061 -5.920 6.281 1.00 0.00 C ATOM 1429 OE1 GLU A 716 -10.494 -5.726 7.412 1.00 0.00 O ATOM 1430 OE2 GLU A 716 -9.515 -7.000 5.973 1.00 0.00 O ATOM 0 H GLU A 716 -11.562 -1.908 4.998 1.00 0.00 H new ATOM 0 HA GLU A 716 -11.558 -3.996 2.953 1.00 0.00 H new ATOM 0 HB2 GLU A 716 -12.096 -4.125 5.927 1.00 0.00 H new ATOM 0 HB3 GLU A 716 -12.209 -5.491 4.836 1.00 0.00 H new ATOM 0 HG2 GLU A 716 -9.774 -5.171 4.298 1.00 0.00 H new ATOM 0 HG3 GLU A 716 -9.714 -3.941 5.545 1.00 0.00 H new ATOM 1437 N PHE A 717 -14.031 -4.094 2.693 1.00 0.00 N ATOM 1438 CA PHE A 717 -15.446 -4.196 2.463 1.00 0.00 C ATOM 1439 C PHE A 717 -15.940 -5.566 2.882 1.00 0.00 C ATOM 1440 O PHE A 717 -15.158 -6.510 2.970 1.00 0.00 O ATOM 1441 CB PHE A 717 -15.793 -3.894 1.003 1.00 0.00 C ATOM 1442 CG PHE A 717 -16.256 -2.480 0.772 1.00 0.00 C ATOM 1443 CD1 PHE A 717 -15.479 -1.390 1.132 1.00 0.00 C ATOM 1444 CD2 PHE A 717 -17.492 -2.250 0.200 1.00 0.00 C ATOM 1445 CE1 PHE A 717 -15.940 -0.106 0.917 1.00 0.00 C ATOM 1446 CE2 PHE A 717 -17.948 -0.978 -0.016 1.00 0.00 C ATOM 1447 CZ PHE A 717 -17.178 0.088 0.340 1.00 0.00 C ATOM 0 H PHE A 717 -13.464 -4.501 1.949 1.00 0.00 H new ATOM 0 HA PHE A 717 -15.954 -3.448 3.072 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -14.917 -4.086 0.383 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -16.573 -4.581 0.674 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -14.510 -1.545 1.582 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -18.110 -3.090 -0.082 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -15.334 0.742 1.199 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -18.916 -0.820 -0.468 1.00 0.00 H new ATOM 0 HZ PHE A 717 -17.539 1.091 0.169 1.00 0.00 H new ATOM 1457 N ASN A 718 -17.194 -5.642 3.208 1.00 0.00 N ATOM 1458 CA ASN A 718 -17.841 -6.855 3.686 1.00 0.00 C ATOM 1459 C ASN A 718 -19.181 -6.945 2.995 1.00 0.00 C ATOM 1460 O ASN A 718 -19.871 -5.941 2.868 1.00 0.00 O ATOM 1461 CB ASN A 718 -18.050 -6.730 5.219 1.00 0.00 C ATOM 1462 CG ASN A 718 -18.508 -8.000 5.980 1.00 0.00 C ATOM 1463 OD1 ASN A 718 -18.150 -8.181 7.141 1.00 0.00 O ATOM 1464 ND2 ASN A 718 -19.316 -8.834 5.400 1.00 0.00 N ATOM 0 H ASN A 718 -17.827 -4.844 3.152 1.00 0.00 H new ATOM 0 HA ASN A 718 -17.242 -7.741 3.477 1.00 0.00 H new ATOM 0 HB2 ASN A 718 -17.113 -6.392 5.661 1.00 0.00 H new ATOM 0 HB3 ASN A 718 -18.787 -5.947 5.396 1.00 0.00 H new ATOM 0 HD21 ASN A 718 -19.660 -9.649 5.909 1.00 0.00 H new ATOM 0 HD22 ASN A 718 -19.607 -8.675 4.436 1.00 0.00 H new ATOM 1471 N CYS A 719 -19.527 -8.102 2.524 1.00 0.00 N ATOM 1472 CA CYS A 719 -20.806 -8.305 1.888 1.00 0.00 C ATOM 1473 C CYS A 719 -21.818 -8.798 2.883 1.00 0.00 C ATOM 1474 O CYS A 719 -21.472 -9.562 3.788 1.00 0.00 O ATOM 1475 CB CYS A 719 -20.674 -9.268 0.735 1.00 0.00 C ATOM 1476 SG CYS A 719 -19.668 -8.602 -0.607 1.00 0.00 S ATOM 0 H CYS A 719 -18.939 -8.934 2.565 1.00 0.00 H new ATOM 0 HA CYS A 719 -21.154 -7.349 1.496 1.00 0.00 H new ATOM 0 HB2 CYS A 719 -20.230 -10.198 1.091 1.00 0.00 H new ATOM 0 HB3 CYS A 719 -21.666 -9.513 0.355 1.00 0.00 H new ATOM 1481 N SER A 720 -23.046 -8.361 2.719 1.00 0.00 N ATOM 1482 CA SER A 720 -24.146 -8.704 3.598 1.00 0.00 C ATOM 1483 C SER A 720 -24.379 -10.197 3.731 1.00 0.00 C ATOM 1484 O SER A 720 -23.917 -11.000 2.902 1.00 0.00 O ATOM 1485 CB SER A 720 -25.385 -8.061 3.058 1.00 0.00 C ATOM 1486 OG SER A 720 -25.205 -6.655 3.050 1.00 0.00 O ATOM 0 H SER A 720 -23.316 -7.743 1.954 1.00 0.00 H new ATOM 0 HA SER A 720 -23.894 -8.344 4.595 1.00 0.00 H new ATOM 0 HB2 SER A 720 -25.588 -8.421 2.049 1.00 0.00 H new ATOM 0 HB3 SER A 720 -26.246 -8.328 3.671 1.00 0.00 H new ATOM 0 HG SER A 720 -24.751 -6.388 2.224 1.00 0.00 H new ATOM 1492 N GLU A 721 -25.092 -10.564 4.775 1.00 0.00 N ATOM 1493 CA GLU A 721 -25.469 -11.920 4.996 1.00 0.00 C ATOM 1494 C GLU A 721 -26.281 -12.401 3.807 1.00 0.00 C ATOM 1495 O GLU A 721 -27.071 -11.633 3.224 1.00 0.00 O ATOM 1496 CB GLU A 721 -26.277 -12.066 6.277 1.00 0.00 C ATOM 1497 CG GLU A 721 -26.475 -13.508 6.700 1.00 0.00 C ATOM 1498 CD GLU A 721 -25.166 -14.191 6.975 1.00 0.00 C ATOM 1499 OE1 GLU A 721 -24.521 -14.691 6.024 1.00 0.00 O ATOM 1500 OE2 GLU A 721 -24.745 -14.223 8.143 1.00 0.00 O ATOM 0 H GLU A 721 -25.422 -9.917 5.491 1.00 0.00 H new ATOM 0 HA GLU A 721 -24.569 -12.525 5.104 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -25.774 -11.525 7.079 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -27.252 -11.598 6.139 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -27.098 -13.543 7.593 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -27.009 -14.047 5.917 1.00 0.00 H new ATOM 1507 N SER A 722 -26.022 -13.627 3.438 1.00 0.00 N ATOM 1508 CA SER A 722 -26.600 -14.312 2.305 1.00 0.00 C ATOM 1509 C SER A 722 -25.931 -13.898 0.991 1.00 0.00 C ATOM 1510 O SER A 722 -26.275 -14.405 -0.080 1.00 0.00 O ATOM 1511 CB SER A 722 -28.134 -14.197 2.266 1.00 0.00 C ATOM 1512 OG SER A 722 -28.708 -14.732 3.472 1.00 0.00 O ATOM 0 H SER A 722 -25.362 -14.213 3.950 1.00 0.00 H new ATOM 0 HA SER A 722 -26.393 -15.374 2.433 1.00 0.00 H new ATOM 0 HB2 SER A 722 -28.424 -13.153 2.150 1.00 0.00 H new ATOM 0 HB3 SER A 722 -28.523 -14.734 1.401 1.00 0.00 H new ATOM 0 HG SER A 722 -29.684 -14.651 3.434 1.00 0.00 H new ATOM 1518 N PHE A 723 -24.983 -12.972 1.057 1.00 0.00 N ATOM 1519 CA PHE A 723 -24.221 -12.622 -0.100 1.00 0.00 C ATOM 1520 C PHE A 723 -22.776 -12.960 0.104 1.00 0.00 C ATOM 1521 O PHE A 723 -22.231 -12.780 1.190 1.00 0.00 O ATOM 1522 CB PHE A 723 -24.372 -11.158 -0.456 1.00 0.00 C ATOM 1523 CG PHE A 723 -25.761 -10.787 -0.834 1.00 0.00 C ATOM 1524 CD1 PHE A 723 -26.742 -10.607 0.126 1.00 0.00 C ATOM 1525 CD2 PHE A 723 -26.088 -10.642 -2.156 1.00 0.00 C ATOM 1526 CE1 PHE A 723 -28.027 -10.282 -0.246 1.00 0.00 C ATOM 1527 CE2 PHE A 723 -27.357 -10.323 -2.536 1.00 0.00 C ATOM 1528 CZ PHE A 723 -28.338 -10.139 -1.581 1.00 0.00 C ATOM 0 H PHE A 723 -24.736 -12.460 1.904 1.00 0.00 H new ATOM 0 HA PHE A 723 -24.610 -13.205 -0.935 1.00 0.00 H new ATOM 0 HB2 PHE A 723 -24.059 -10.550 0.393 1.00 0.00 H new ATOM 0 HB3 PHE A 723 -23.702 -10.921 -1.282 1.00 0.00 H new ATOM 0 HD1 PHE A 723 -26.498 -10.722 1.172 1.00 0.00 H new ATOM 0 HD2 PHE A 723 -25.327 -10.783 -2.910 1.00 0.00 H new ATOM 0 HE1 PHE A 723 -28.789 -10.140 0.506 1.00 0.00 H new ATOM 0 HE2 PHE A 723 -27.596 -10.214 -3.584 1.00 0.00 H new ATOM 0 HZ PHE A 723 -29.344 -9.884 -1.879 1.00 0.00 H new ATOM 1538 N THR A 724 -22.178 -13.452 -0.916 1.00 0.00 N ATOM 1539 CA THR A 724 -20.808 -13.816 -0.892 1.00 0.00 C ATOM 1540 C THR A 724 -20.035 -12.810 -1.721 1.00 0.00 C ATOM 1541 O THR A 724 -20.552 -12.305 -2.736 1.00 0.00 O ATOM 1542 CB THR A 724 -20.628 -15.266 -1.418 1.00 0.00 C ATOM 1543 OG1 THR A 724 -19.251 -15.674 -1.405 1.00 0.00 O ATOM 1544 CG2 THR A 724 -21.210 -15.438 -2.810 1.00 0.00 C ATOM 0 H THR A 724 -22.636 -13.617 -1.812 1.00 0.00 H new ATOM 0 HA THR A 724 -20.423 -13.801 0.128 1.00 0.00 H new ATOM 0 HB THR A 724 -21.180 -15.911 -0.734 1.00 0.00 H new ATOM 0 HG1 THR A 724 -19.179 -16.592 -1.741 1.00 0.00 H new ATOM 0 HG21 THR A 724 -21.063 -16.466 -3.141 1.00 0.00 H new ATOM 0 HG22 THR A 724 -22.276 -15.212 -2.789 1.00 0.00 H new ATOM 0 HG23 THR A 724 -20.709 -14.760 -3.500 1.00 0.00 H new ATOM 1552 N MET A 725 -18.860 -12.462 -1.270 1.00 0.00 N ATOM 1553 CA MET A 725 -18.073 -11.481 -1.945 1.00 0.00 C ATOM 1554 C MET A 725 -17.159 -12.134 -2.960 1.00 0.00 C ATOM 1555 O MET A 725 -16.605 -13.223 -2.723 1.00 0.00 O ATOM 1556 CB MET A 725 -17.283 -10.642 -0.934 1.00 0.00 C ATOM 1557 CG MET A 725 -15.861 -11.072 -0.638 1.00 0.00 C ATOM 1558 SD MET A 725 -15.205 -10.275 0.851 1.00 0.00 S ATOM 1559 CE MET A 725 -15.595 -8.551 0.519 1.00 0.00 C ATOM 0 H MET A 725 -18.429 -12.850 -0.431 1.00 0.00 H new ATOM 0 HA MET A 725 -18.739 -10.810 -2.487 1.00 0.00 H new ATOM 0 HB2 MET A 725 -17.257 -9.614 -1.296 1.00 0.00 H new ATOM 0 HB3 MET A 725 -17.836 -10.636 0.005 1.00 0.00 H new ATOM 0 HG2 MET A 725 -15.828 -12.154 -0.514 1.00 0.00 H new ATOM 0 HG3 MET A 725 -15.225 -10.829 -1.489 1.00 0.00 H new ATOM 0 HE1 MET A 725 -14.863 -7.911 1.012 1.00 0.00 H new ATOM 0 HE2 MET A 725 -15.568 -8.372 -0.556 1.00 0.00 H new ATOM 0 HE3 MET A 725 -16.591 -8.323 0.899 1.00 0.00 H new ATOM 1569 N ILE A 726 -17.069 -11.520 -4.096 1.00 0.00 N ATOM 1570 CA ILE A 726 -16.202 -11.956 -5.152 1.00 0.00 C ATOM 1571 C ILE A 726 -15.286 -10.809 -5.506 1.00 0.00 C ATOM 1572 O ILE A 726 -15.748 -9.758 -5.960 1.00 0.00 O ATOM 1573 CB ILE A 726 -17.003 -12.354 -6.409 1.00 0.00 C ATOM 1574 CG1 ILE A 726 -18.131 -13.322 -6.035 1.00 0.00 C ATOM 1575 CG2 ILE A 726 -16.070 -12.979 -7.451 1.00 0.00 C ATOM 1576 CD1 ILE A 726 -18.967 -13.763 -7.205 1.00 0.00 C ATOM 0 H ILE A 726 -17.606 -10.683 -4.324 1.00 0.00 H new ATOM 0 HA ILE A 726 -15.642 -12.828 -4.813 1.00 0.00 H new ATOM 0 HB ILE A 726 -17.452 -11.460 -6.842 1.00 0.00 H new ATOM 0 HG12 ILE A 726 -17.699 -14.201 -5.558 1.00 0.00 H new ATOM 0 HG13 ILE A 726 -18.777 -12.845 -5.298 1.00 0.00 H new ATOM 0 HG21 ILE A 726 -16.645 -13.256 -8.334 1.00 0.00 H new ATOM 0 HG22 ILE A 726 -15.301 -12.258 -7.730 1.00 0.00 H new ATOM 0 HG23 ILE A 726 -15.599 -13.868 -7.031 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -19.743 -14.446 -6.860 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -19.430 -12.893 -7.670 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -18.335 -14.270 -7.933 1.00 0.00 H new ATOM 1588 N GLY A 727 -14.031 -10.985 -5.273 1.00 0.00 N ATOM 1589 CA GLY A 727 -13.068 -9.962 -5.539 1.00 0.00 C ATOM 1590 C GLY A 727 -12.210 -9.723 -4.367 1.00 0.00 C ATOM 1591 O GLY A 727 -12.051 -10.604 -3.513 1.00 0.00 O ATOM 0 H GLY A 727 -13.638 -11.845 -4.891 1.00 0.00 H new ATOM 0 HA2 GLY A 727 -12.453 -10.251 -6.391 1.00 0.00 H new ATOM 0 HA3 GLY A 727 -13.580 -9.039 -5.813 1.00 0.00 H new ATOM 1595 N HIS A 728 -11.680 -8.544 -4.279 1.00 0.00 N ATOM 1596 CA HIS A 728 -10.776 -8.244 -3.226 1.00 0.00 C ATOM 1597 C HIS A 728 -11.519 -7.615 -2.106 1.00 0.00 C ATOM 1598 O HIS A 728 -12.289 -6.679 -2.316 1.00 0.00 O ATOM 1599 CB HIS A 728 -9.663 -7.330 -3.707 1.00 0.00 C ATOM 1600 CG HIS A 728 -8.476 -7.326 -2.819 1.00 0.00 C ATOM 1601 ND1 HIS A 728 -7.542 -6.315 -2.776 1.00 0.00 N ATOM 1602 CD2 HIS A 728 -8.042 -8.280 -1.993 1.00 0.00 C ATOM 1603 CE1 HIS A 728 -6.568 -6.667 -1.955 1.00 0.00 C ATOM 1604 NE2 HIS A 728 -6.859 -7.862 -1.466 1.00 0.00 N ATOM 0 H HIS A 728 -11.861 -7.776 -4.926 1.00 0.00 H new ATOM 0 HA HIS A 728 -10.316 -9.170 -2.881 1.00 0.00 H new ATOM 0 HB2 HIS A 728 -9.358 -7.638 -4.707 1.00 0.00 H new ATOM 0 HB3 HIS A 728 -10.048 -6.314 -3.790 1.00 0.00 H new ATOM 0 HD2 HIS A 728 -8.540 -9.215 -1.781 1.00 0.00 H new ATOM 0 HE1 HIS A 728 -5.690 -6.083 -1.724 1.00 0.00 H new ATOM 0 HE2 HIS A 728 -6.289 -8.385 -0.802 1.00 0.00 H new ATOM 1613 N ARG A 729 -11.300 -8.134 -0.926 1.00 0.00 N ATOM 1614 CA ARG A 729 -11.940 -7.610 0.273 1.00 0.00 C ATOM 1615 C ARG A 729 -11.520 -6.180 0.551 1.00 0.00 C ATOM 1616 O ARG A 729 -12.282 -5.398 1.100 1.00 0.00 O ATOM 1617 CB ARG A 729 -11.628 -8.454 1.515 1.00 0.00 C ATOM 1618 CG ARG A 729 -10.144 -8.590 1.851 1.00 0.00 C ATOM 1619 CD ARG A 729 -9.938 -8.887 3.330 1.00 0.00 C ATOM 1620 NE ARG A 729 -10.702 -10.046 3.789 1.00 0.00 N ATOM 1621 CZ ARG A 729 -11.026 -10.303 5.071 1.00 0.00 C ATOM 1622 NH1 ARG A 729 -10.653 -9.464 6.050 1.00 0.00 N ATOM 1623 NH2 ARG A 729 -11.742 -11.387 5.360 1.00 0.00 N ATOM 0 H ARG A 729 -10.679 -8.926 -0.759 1.00 0.00 H new ATOM 0 HA ARG A 729 -13.011 -7.649 0.075 1.00 0.00 H new ATOM 0 HB2 ARG A 729 -12.140 -8.015 2.371 1.00 0.00 H new ATOM 0 HB3 ARG A 729 -12.045 -9.451 1.372 1.00 0.00 H new ATOM 0 HG2 ARG A 729 -9.705 -9.388 1.253 1.00 0.00 H new ATOM 0 HG3 ARG A 729 -9.623 -7.670 1.586 1.00 0.00 H new ATOM 0 HD2 ARG A 729 -8.878 -9.060 3.517 1.00 0.00 H new ATOM 0 HD3 ARG A 729 -10.226 -8.013 3.915 1.00 0.00 H new ATOM 0 HE ARG A 729 -11.014 -10.712 3.083 1.00 0.00 H new ATOM 0 HH11 ARG A 729 -10.120 -8.624 5.826 1.00 0.00 H new ATOM 0 HH12 ARG A 729 -10.903 -9.667 7.018 1.00 0.00 H new ATOM 0 HH21 ARG A 729 -12.041 -12.015 4.614 1.00 0.00 H new ATOM 0 HH22 ARG A 729 -11.992 -11.590 6.328 1.00 0.00 H new ATOM 1637 N SER A 730 -10.330 -5.842 0.159 1.00 0.00 N ATOM 1638 CA SER A 730 -9.813 -4.568 0.463 1.00 0.00 C ATOM 1639 C SER A 730 -9.613 -3.731 -0.769 1.00 0.00 C ATOM 1640 O SER A 730 -9.455 -4.247 -1.888 1.00 0.00 O ATOM 1641 CB SER A 730 -8.545 -4.702 1.285 1.00 0.00 C ATOM 1642 OG SER A 730 -7.710 -5.715 0.750 1.00 0.00 O ATOM 0 H SER A 730 -9.704 -6.444 -0.376 1.00 0.00 H new ATOM 0 HA SER A 730 -10.548 -4.035 1.066 1.00 0.00 H new ATOM 0 HB2 SER A 730 -8.011 -3.752 1.298 1.00 0.00 H new ATOM 0 HB3 SER A 730 -8.798 -4.939 2.318 1.00 0.00 H new ATOM 0 HG SER A 730 -6.896 -5.787 1.291 1.00 0.00 H new ATOM 1648 N ILE A 731 -9.681 -2.455 -0.572 1.00 0.00 N ATOM 1649 CA ILE A 731 -9.517 -1.493 -1.609 1.00 0.00 C ATOM 1650 C ILE A 731 -8.487 -0.497 -1.204 1.00 0.00 C ATOM 1651 O ILE A 731 -8.100 -0.444 -0.046 1.00 0.00 O ATOM 1652 CB ILE A 731 -10.838 -0.765 -1.905 1.00 0.00 C ATOM 1653 CG1 ILE A 731 -11.432 -0.196 -0.595 1.00 0.00 C ATOM 1654 CG2 ILE A 731 -11.791 -1.691 -2.630 1.00 0.00 C ATOM 1655 CD1 ILE A 731 -12.799 0.391 -0.716 1.00 0.00 C ATOM 0 H ILE A 731 -9.858 -2.042 0.344 1.00 0.00 H new ATOM 0 HA ILE A 731 -9.201 -2.015 -2.512 1.00 0.00 H new ATOM 0 HB ILE A 731 -10.656 0.082 -2.567 1.00 0.00 H new ATOM 0 HG12 ILE A 731 -11.461 -0.993 0.147 1.00 0.00 H new ATOM 0 HG13 ILE A 731 -10.758 0.571 -0.213 1.00 0.00 H new ATOM 0 HG21 ILE A 731 -12.724 -1.165 -2.835 1.00 0.00 H new ATOM 0 HG22 ILE A 731 -11.342 -2.013 -3.570 1.00 0.00 H new ATOM 0 HG23 ILE A 731 -11.995 -2.563 -2.008 1.00 0.00 H new ATOM 0 HD11 ILE A 731 -13.123 0.761 0.257 1.00 0.00 H new ATOM 0 HD12 ILE A 731 -12.779 1.215 -1.430 1.00 0.00 H new ATOM 0 HD13 ILE A 731 -13.494 -0.374 -1.064 1.00 0.00 H new ATOM 1667 N THR A 732 -8.054 0.276 -2.134 1.00 0.00 N ATOM 1668 CA THR A 732 -7.073 1.286 -1.900 1.00 0.00 C ATOM 1669 C THR A 732 -7.529 2.584 -2.558 1.00 0.00 C ATOM 1670 O THR A 732 -8.093 2.559 -3.648 1.00 0.00 O ATOM 1671 CB THR A 732 -5.702 0.848 -2.457 1.00 0.00 C ATOM 1672 OG1 THR A 732 -5.325 -0.403 -1.849 1.00 0.00 O ATOM 1673 CG2 THR A 732 -4.642 1.890 -2.166 1.00 0.00 C ATOM 0 H THR A 732 -8.375 0.227 -3.101 1.00 0.00 H new ATOM 0 HA THR A 732 -6.963 1.443 -0.827 1.00 0.00 H new ATOM 0 HB THR A 732 -5.783 0.733 -3.538 1.00 0.00 H new ATOM 0 HG1 THR A 732 -4.455 -0.688 -2.200 1.00 0.00 H new ATOM 0 HG21 THR A 732 -3.685 1.558 -2.569 1.00 0.00 H new ATOM 0 HG22 THR A 732 -4.923 2.835 -2.631 1.00 0.00 H new ATOM 0 HG23 THR A 732 -4.554 2.028 -1.088 1.00 0.00 H new ATOM 1681 N CYS A 733 -7.381 3.669 -1.837 1.00 0.00 N ATOM 1682 CA CYS A 733 -7.735 5.000 -2.299 1.00 0.00 C ATOM 1683 C CYS A 733 -6.818 5.431 -3.429 1.00 0.00 C ATOM 1684 O CYS A 733 -5.623 5.673 -3.213 1.00 0.00 O ATOM 1685 CB CYS A 733 -7.653 5.986 -1.133 1.00 0.00 C ATOM 1686 SG CYS A 733 -7.932 7.723 -1.584 1.00 0.00 S ATOM 0 H CYS A 733 -7.003 3.656 -0.890 1.00 0.00 H new ATOM 0 HA CYS A 733 -8.756 4.986 -2.680 1.00 0.00 H new ATOM 0 HB2 CYS A 733 -8.387 5.698 -0.380 1.00 0.00 H new ATOM 0 HB3 CYS A 733 -6.670 5.899 -0.670 1.00 0.00 H new ATOM 1691 N ILE A 734 -7.368 5.485 -4.630 1.00 0.00 N ATOM 1692 CA ILE A 734 -6.615 5.806 -5.820 1.00 0.00 C ATOM 1693 C ILE A 734 -7.266 6.968 -6.605 1.00 0.00 C ATOM 1694 O ILE A 734 -8.264 6.784 -7.307 1.00 0.00 O ATOM 1695 CB ILE A 734 -6.488 4.557 -6.756 1.00 0.00 C ATOM 1696 CG1 ILE A 734 -5.851 3.373 -6.012 1.00 0.00 C ATOM 1697 CG2 ILE A 734 -5.675 4.892 -7.997 1.00 0.00 C ATOM 1698 CD1 ILE A 734 -4.483 3.666 -5.477 1.00 0.00 C ATOM 0 H ILE A 734 -8.357 5.305 -4.803 1.00 0.00 H new ATOM 0 HA ILE A 734 -5.622 6.115 -5.495 1.00 0.00 H new ATOM 0 HB ILE A 734 -7.494 4.270 -7.064 1.00 0.00 H new ATOM 0 HG12 ILE A 734 -6.500 3.082 -5.186 1.00 0.00 H new ATOM 0 HG13 ILE A 734 -5.793 2.519 -6.687 1.00 0.00 H new ATOM 0 HG21 ILE A 734 -5.600 4.009 -8.632 1.00 0.00 H new ATOM 0 HG22 ILE A 734 -6.166 5.695 -8.548 1.00 0.00 H new ATOM 0 HG23 ILE A 734 -4.676 5.212 -7.702 1.00 0.00 H new ATOM 0 HD11 ILE A 734 -4.096 2.785 -4.965 1.00 0.00 H new ATOM 0 HD12 ILE A 734 -3.819 3.928 -6.301 1.00 0.00 H new ATOM 0 HD13 ILE A 734 -4.537 4.499 -4.776 1.00 0.00 H new ATOM 1710 N HIS A 735 -6.734 8.166 -6.413 1.00 0.00 N ATOM 1711 CA HIS A 735 -7.114 9.383 -7.165 1.00 0.00 C ATOM 1712 C HIS A 735 -8.536 9.817 -6.870 1.00 0.00 C ATOM 1713 O HIS A 735 -9.199 10.458 -7.695 1.00 0.00 O ATOM 1714 CB HIS A 735 -6.878 9.233 -8.687 1.00 0.00 C ATOM 1715 CG HIS A 735 -5.429 9.132 -9.074 1.00 0.00 C ATOM 1716 ND1 HIS A 735 -4.591 10.216 -9.138 1.00 0.00 N ATOM 1717 CD2 HIS A 735 -4.667 8.061 -9.389 1.00 0.00 C ATOM 1718 CE1 HIS A 735 -3.382 9.821 -9.467 1.00 0.00 C ATOM 1719 NE2 HIS A 735 -3.403 8.518 -9.625 1.00 0.00 N ATOM 0 H HIS A 735 -6.008 8.337 -5.717 1.00 0.00 H new ATOM 0 HA HIS A 735 -6.452 10.175 -6.814 1.00 0.00 H new ATOM 0 HB2 HIS A 735 -7.400 8.344 -9.039 1.00 0.00 H new ATOM 0 HB3 HIS A 735 -7.322 10.087 -9.199 1.00 0.00 H new ATOM 0 HD2 HIS A 735 -4.997 7.034 -9.444 1.00 0.00 H new ATOM 0 HE1 HIS A 735 -2.519 10.459 -9.587 1.00 0.00 H new ATOM 0 HE2 HIS A 735 -2.603 7.940 -9.883 1.00 0.00 H new ATOM 1728 N GLY A 736 -8.972 9.526 -5.676 1.00 0.00 N ATOM 1729 CA GLY A 736 -10.297 9.908 -5.253 1.00 0.00 C ATOM 1730 C GLY A 736 -11.296 8.792 -5.405 1.00 0.00 C ATOM 1731 O GLY A 736 -12.482 8.960 -5.085 1.00 0.00 O ATOM 0 H GLY A 736 -8.429 9.024 -4.974 1.00 0.00 H new ATOM 0 HA2 GLY A 736 -10.265 10.223 -4.210 1.00 0.00 H new ATOM 0 HA3 GLY A 736 -10.627 10.768 -5.836 1.00 0.00 H new ATOM 1735 N VAL A 737 -10.841 7.650 -5.881 1.00 0.00 N ATOM 1736 CA VAL A 737 -11.717 6.517 -6.090 1.00 0.00 C ATOM 1737 C VAL A 737 -11.025 5.318 -5.512 1.00 0.00 C ATOM 1738 O VAL A 737 -9.823 5.229 -5.578 1.00 0.00 O ATOM 1739 CB VAL A 737 -11.982 6.257 -7.614 1.00 0.00 C ATOM 1740 CG1 VAL A 737 -13.007 5.150 -7.825 1.00 0.00 C ATOM 1741 CG2 VAL A 737 -12.430 7.517 -8.324 1.00 0.00 C ATOM 0 H VAL A 737 -9.866 7.483 -6.131 1.00 0.00 H new ATOM 0 HA VAL A 737 -12.679 6.712 -5.616 1.00 0.00 H new ATOM 0 HB VAL A 737 -11.034 5.936 -8.046 1.00 0.00 H new ATOM 0 HG11 VAL A 737 -13.164 4.999 -8.893 1.00 0.00 H new ATOM 0 HG12 VAL A 737 -12.642 4.226 -7.377 1.00 0.00 H new ATOM 0 HG13 VAL A 737 -13.949 5.433 -7.356 1.00 0.00 H new ATOM 0 HG21 VAL A 737 -12.604 7.299 -9.378 1.00 0.00 H new ATOM 0 HG22 VAL A 737 -13.352 7.881 -7.872 1.00 0.00 H new ATOM 0 HG23 VAL A 737 -11.656 8.280 -8.235 1.00 0.00 H new ATOM 1751 N TRP A 738 -11.743 4.425 -4.929 1.00 0.00 N ATOM 1752 CA TRP A 738 -11.131 3.228 -4.420 1.00 0.00 C ATOM 1753 C TRP A 738 -10.878 2.278 -5.585 1.00 0.00 C ATOM 1754 O TRP A 738 -11.408 2.499 -6.677 1.00 0.00 O ATOM 1755 CB TRP A 738 -12.009 2.597 -3.362 1.00 0.00 C ATOM 1756 CG TRP A 738 -12.232 3.494 -2.172 1.00 0.00 C ATOM 1757 CD1 TRP A 738 -13.268 4.335 -1.957 1.00 0.00 C ATOM 1758 CD2 TRP A 738 -11.379 3.629 -1.049 1.00 0.00 C ATOM 1759 NE1 TRP A 738 -13.112 4.986 -0.759 1.00 0.00 N ATOM 1760 CE2 TRP A 738 -11.952 4.571 -0.188 1.00 0.00 C ATOM 1761 CE3 TRP A 738 -10.191 3.043 -0.694 1.00 0.00 C ATOM 1762 CZ2 TRP A 738 -11.360 4.936 1.006 1.00 0.00 C ATOM 1763 CZ3 TRP A 738 -9.595 3.394 0.481 1.00 0.00 C ATOM 1764 CH2 TRP A 738 -10.174 4.337 1.325 1.00 0.00 C ATOM 0 H TRP A 738 -12.751 4.490 -4.788 1.00 0.00 H new ATOM 0 HA TRP A 738 -10.179 3.463 -3.945 1.00 0.00 H new ATOM 0 HB2 TRP A 738 -12.972 2.340 -3.803 1.00 0.00 H new ATOM 0 HB3 TRP A 738 -11.553 1.665 -3.028 1.00 0.00 H new ATOM 0 HD1 TRP A 738 -14.100 4.475 -2.632 1.00 0.00 H new ATOM 0 HE1 TRP A 738 -13.759 5.668 -0.363 1.00 0.00 H new ATOM 0 HE3 TRP A 738 -9.731 2.310 -1.340 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 -11.816 5.665 1.660 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 -8.659 2.933 0.761 1.00 0.00 H new ATOM 0 HH2 TRP A 738 -9.678 4.600 2.247 1.00 0.00 H new ATOM 1775 N THR A 739 -10.076 1.259 -5.363 1.00 0.00 N ATOM 1776 CA THR A 739 -9.658 0.331 -6.425 1.00 0.00 C ATOM 1777 C THR A 739 -10.771 -0.217 -7.302 1.00 0.00 C ATOM 1778 O THR A 739 -10.880 0.150 -8.483 1.00 0.00 O ATOM 1779 CB THR A 739 -8.779 -0.817 -5.897 1.00 0.00 C ATOM 1780 OG1 THR A 739 -9.425 -1.487 -4.803 1.00 0.00 O ATOM 1781 CG2 THR A 739 -7.453 -0.291 -5.439 1.00 0.00 C ATOM 0 H THR A 739 -9.688 1.039 -4.446 1.00 0.00 H new ATOM 0 HA THR A 739 -9.061 0.968 -7.078 1.00 0.00 H new ATOM 0 HB THR A 739 -8.626 -1.526 -6.711 1.00 0.00 H new ATOM 0 HG1 THR A 739 -8.943 -2.315 -4.596 1.00 0.00 H new ATOM 0 HG21 THR A 739 -6.843 -1.115 -5.068 1.00 0.00 H new ATOM 0 HG22 THR A 739 -6.944 0.190 -6.274 1.00 0.00 H new ATOM 0 HG23 THR A 739 -7.606 0.435 -4.640 1.00 0.00 H new ATOM 1789 N GLN A 740 -11.604 -1.052 -6.754 1.00 0.00 N ATOM 1790 CA GLN A 740 -12.584 -1.741 -7.584 1.00 0.00 C ATOM 1791 C GLN A 740 -13.753 -2.293 -6.847 1.00 0.00 C ATOM 1792 O GLN A 740 -14.847 -2.348 -7.402 1.00 0.00 O ATOM 1793 CB GLN A 740 -11.908 -2.806 -8.478 1.00 0.00 C ATOM 1794 CG GLN A 740 -10.749 -3.620 -7.829 1.00 0.00 C ATOM 1795 CD GLN A 740 -11.136 -4.470 -6.621 1.00 0.00 C ATOM 1796 OE1 GLN A 740 -11.556 -5.616 -6.757 1.00 0.00 O ATOM 1797 NE2 GLN A 740 -10.896 -3.955 -5.431 1.00 0.00 N ATOM 0 H GLN A 740 -11.637 -1.278 -5.760 1.00 0.00 H new ATOM 0 HA GLN A 740 -13.010 -0.969 -8.224 1.00 0.00 H new ATOM 0 HB2 GLN A 740 -12.673 -3.507 -8.812 1.00 0.00 H new ATOM 0 HB3 GLN A 740 -11.520 -2.309 -9.368 1.00 0.00 H new ATOM 0 HG2 GLN A 740 -10.319 -4.274 -8.588 1.00 0.00 H new ATOM 0 HG3 GLN A 740 -9.966 -2.925 -7.526 1.00 0.00 H new ATOM 0 HE21 GLN A 740 -10.547 -3.000 -5.350 1.00 0.00 H new ATOM 0 HE22 GLN A 740 -11.059 -4.512 -4.592 1.00 0.00 H new ATOM 1806 N LEU A 741 -13.517 -2.674 -5.606 1.00 0.00 N ATOM 1807 CA LEU A 741 -14.509 -3.298 -4.731 1.00 0.00 C ATOM 1808 C LEU A 741 -14.894 -4.699 -5.224 1.00 0.00 C ATOM 1809 O LEU A 741 -14.858 -4.998 -6.423 1.00 0.00 O ATOM 1810 CB LEU A 741 -15.746 -2.428 -4.632 1.00 0.00 C ATOM 1811 CG LEU A 741 -15.473 -0.998 -4.226 1.00 0.00 C ATOM 1812 CD1 LEU A 741 -16.667 -0.159 -4.537 1.00 0.00 C ATOM 1813 CD2 LEU A 741 -15.212 -0.930 -2.753 1.00 0.00 C ATOM 0 H LEU A 741 -12.607 -2.558 -5.160 1.00 0.00 H new ATOM 0 HA LEU A 741 -14.059 -3.399 -3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -16.254 -2.428 -5.597 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -16.432 -2.873 -3.911 1.00 0.00 H new ATOM 0 HG LEU A 741 -14.603 -0.633 -4.772 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -16.473 0.873 -4.245 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -16.873 -0.201 -5.607 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -17.529 -0.535 -3.987 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -15.016 0.103 -2.466 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -16.084 -1.298 -2.212 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -14.346 -1.545 -2.508 1.00 0.00 H new ATOM 1825 N PRO A 742 -15.230 -5.578 -4.313 1.00 0.00 N ATOM 1826 CA PRO A 742 -15.713 -6.889 -4.659 1.00 0.00 C ATOM 1827 C PRO A 742 -17.188 -6.813 -5.019 1.00 0.00 C ATOM 1828 O PRO A 742 -17.814 -5.761 -4.886 1.00 0.00 O ATOM 1829 CB PRO A 742 -15.538 -7.675 -3.368 1.00 0.00 C ATOM 1830 CG PRO A 742 -15.689 -6.657 -2.297 1.00 0.00 C ATOM 1831 CD PRO A 742 -15.179 -5.366 -2.863 1.00 0.00 C ATOM 0 HA PRO A 742 -15.194 -7.332 -5.509 1.00 0.00 H new ATOM 0 HB2 PRO A 742 -16.286 -8.463 -3.277 1.00 0.00 H new ATOM 0 HB3 PRO A 742 -14.561 -8.157 -3.325 1.00 0.00 H new ATOM 0 HG2 PRO A 742 -16.732 -6.563 -1.995 1.00 0.00 H new ATOM 0 HG3 PRO A 742 -15.124 -6.941 -1.409 1.00 0.00 H new ATOM 0 HD2 PRO A 742 -15.800 -4.523 -2.560 1.00 0.00 H new ATOM 0 HD3 PRO A 742 -14.165 -5.153 -2.525 1.00 0.00 H new ATOM 1839 N GLN A 743 -17.741 -7.890 -5.441 1.00 0.00 N ATOM 1840 CA GLN A 743 -19.131 -7.912 -5.767 1.00 0.00 C ATOM 1841 C GLN A 743 -19.804 -8.950 -4.931 1.00 0.00 C ATOM 1842 O GLN A 743 -19.265 -10.034 -4.730 1.00 0.00 O ATOM 1843 CB GLN A 743 -19.385 -8.115 -7.268 1.00 0.00 C ATOM 1844 CG GLN A 743 -18.828 -9.397 -7.865 1.00 0.00 C ATOM 1845 CD GLN A 743 -19.154 -9.531 -9.341 1.00 0.00 C ATOM 1846 OE1 GLN A 743 -19.312 -10.635 -9.854 1.00 0.00 O ATOM 1847 NE2 GLN A 743 -19.187 -8.423 -10.046 1.00 0.00 N ATOM 0 H GLN A 743 -17.254 -8.777 -5.572 1.00 0.00 H new ATOM 0 HA GLN A 743 -19.560 -6.936 -5.540 1.00 0.00 H new ATOM 0 HB2 GLN A 743 -20.461 -8.093 -7.442 1.00 0.00 H new ATOM 0 HB3 GLN A 743 -18.958 -7.270 -7.807 1.00 0.00 H new ATOM 0 HG2 GLN A 743 -17.747 -9.419 -7.730 1.00 0.00 H new ATOM 0 HG3 GLN A 743 -19.234 -10.253 -7.326 1.00 0.00 H new ATOM 0 HE21 GLN A 743 -19.052 -7.522 -9.587 1.00 0.00 H new ATOM 0 HE22 GLN A 743 -19.348 -8.463 -11.052 1.00 0.00 H new ATOM 1856 N CYS A 744 -20.915 -8.602 -4.390 1.00 0.00 N ATOM 1857 CA CYS A 744 -21.625 -9.495 -3.513 1.00 0.00 C ATOM 1858 C CYS A 744 -22.781 -10.108 -4.263 1.00 0.00 C ATOM 1859 O CYS A 744 -23.664 -9.387 -4.750 1.00 0.00 O ATOM 1860 CB CYS A 744 -22.153 -8.719 -2.329 1.00 0.00 C ATOM 1861 SG CYS A 744 -20.978 -7.498 -1.682 1.00 0.00 S ATOM 0 H CYS A 744 -21.366 -7.698 -4.534 1.00 0.00 H new ATOM 0 HA CYS A 744 -20.954 -10.280 -3.165 1.00 0.00 H new ATOM 0 HB2 CYS A 744 -23.072 -8.209 -2.619 1.00 0.00 H new ATOM 0 HB3 CYS A 744 -22.414 -9.418 -1.534 1.00 0.00 H new ATOM 1866 N VAL A 745 -22.810 -11.404 -4.322 1.00 0.00 N ATOM 1867 CA VAL A 745 -23.812 -12.108 -5.070 1.00 0.00 C ATOM 1868 C VAL A 745 -24.629 -12.956 -4.147 1.00 0.00 C ATOM 1869 O VAL A 745 -24.141 -13.385 -3.085 1.00 0.00 O ATOM 1870 CB VAL A 745 -23.226 -12.977 -6.223 1.00 0.00 C ATOM 1871 CG1 VAL A 745 -22.606 -12.111 -7.302 1.00 0.00 C ATOM 1872 CG2 VAL A 745 -22.202 -13.959 -5.706 1.00 0.00 C ATOM 0 H VAL A 745 -22.137 -12.008 -3.851 1.00 0.00 H new ATOM 0 HA VAL A 745 -24.440 -11.354 -5.544 1.00 0.00 H new ATOM 0 HB VAL A 745 -24.056 -13.536 -6.656 1.00 0.00 H new ATOM 0 HG11 VAL A 745 -22.206 -12.746 -8.093 1.00 0.00 H new ATOM 0 HG12 VAL A 745 -23.365 -11.449 -7.718 1.00 0.00 H new ATOM 0 HG13 VAL A 745 -21.801 -11.515 -6.872 1.00 0.00 H new ATOM 0 HG21 VAL A 745 -21.813 -14.550 -6.535 1.00 0.00 H new ATOM 0 HG22 VAL A 745 -21.384 -13.416 -5.232 1.00 0.00 H new ATOM 0 HG23 VAL A 745 -22.669 -14.621 -4.977 1.00 0.00 H new ATOM 1882 N ALA A 746 -25.861 -13.143 -4.511 1.00 0.00 N ATOM 1883 CA ALA A 746 -26.798 -13.908 -3.735 1.00 0.00 C ATOM 1884 C ALA A 746 -26.406 -15.376 -3.689 1.00 0.00 C ATOM 1885 O ALA A 746 -26.381 -16.053 -4.723 1.00 0.00 O ATOM 1886 CB ALA A 746 -28.197 -13.747 -4.310 1.00 0.00 C ATOM 0 H ALA A 746 -26.254 -12.762 -5.372 1.00 0.00 H new ATOM 0 HA ALA A 746 -26.787 -13.531 -2.712 1.00 0.00 H new ATOM 0 HB1 ALA A 746 -28.903 -14.329 -3.718 1.00 0.00 H new ATOM 0 HB2 ALA A 746 -28.482 -12.695 -4.284 1.00 0.00 H new ATOM 0 HB3 ALA A 746 -28.210 -14.101 -5.341 1.00 0.00 H new ATOM 1892 N ILE A 747 -26.030 -15.831 -2.513 1.00 0.00 N ATOM 1893 CA ILE A 747 -25.741 -17.233 -2.279 1.00 0.00 C ATOM 1894 C ILE A 747 -27.061 -17.998 -2.340 1.00 0.00 C ATOM 1895 O ILE A 747 -27.814 -17.981 -1.344 1.00 0.00 O ATOM 1896 CB ILE A 747 -25.098 -17.474 -0.881 1.00 0.00 C ATOM 1897 CG1 ILE A 747 -23.869 -16.590 -0.684 1.00 0.00 C ATOM 1898 CG2 ILE A 747 -24.713 -18.941 -0.722 1.00 0.00 C ATOM 1899 CD1 ILE A 747 -23.254 -16.689 0.702 1.00 0.00 C ATOM 1900 OXT ILE A 747 -27.378 -18.583 -3.380 1.00 0.00 O ATOM 0 H ILE A 747 -25.915 -15.240 -1.690 1.00 0.00 H new ATOM 0 HA ILE A 747 -25.033 -17.571 -3.036 1.00 0.00 H new ATOM 0 HB ILE A 747 -25.835 -17.213 -0.122 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -23.117 -16.861 -1.425 1.00 0.00 H new ATOM 0 HG13 ILE A 747 -24.145 -15.553 -0.875 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -24.265 -19.095 0.260 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -25.603 -19.563 -0.816 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -23.996 -19.215 -1.496 1.00 0.00 H new ATOM 0 HD11 ILE A 747 -22.386 -16.032 0.763 1.00 0.00 H new ATOM 0 HD12 ILE A 747 -23.989 -16.389 1.449 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -22.945 -17.717 0.890 1.00 0.00 H new