USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 832 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 672 GLN : amide:sc= -0.531 K(o=0.46,f=1.8) USER MOD Set 1.2: A 679 THR OG1 : rot 120:sc= 0.992 USER MOD Set 2.1: A 602 THR OG1 : rot 110:sc= -0.316 USER MOD Set 2.2: A 651 HIS : no HD1:sc= -4.03 K(o=-4.3,f=-5.7!) USER MOD Set 2.3: A 652 SER OG : rot 180:sc= -0.0062 USER MOD Set 3.1: A 644 LYS NZ :NH3+ 152:sc= 1.22 (180deg=0.492) USER MOD Set 3.2: A 649 TYR OH : rot -50:sc= 1.04 USER MOD Single : A 573 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00544) USER MOD Single : A 577 HIS : no HD1:sc= -0.201 X(o=-0.2,f=-0.1) USER MOD Single : A 583 LYS NZ :NH3+ -110:sc= 0.113 (180deg=-1.44) USER MOD Single : A 584 LYS NZ :NH3+ 170:sc= 1.19 (180deg=1.13) USER MOD Single : A 586 GLN : amide:sc= -1.13 K(o=-1.1,f=-0.076) USER MOD Single : A 587 TYR OH : rot 130:sc= -0.107 USER MOD Single : A 588 LYS NZ :NH3+ -159:sc= 1.15 (180deg=0.962) USER MOD Single : A 594 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 SER OG : rot 180:sc= 0 USER MOD Single : A 598 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 607 ASN : amide:sc= -0.564 K(o=-0.56,f=0) USER MOD Single : A 608 SER OG : rot 38:sc= 0.0921 USER MOD Single : A 610 GLN : amide:sc= -5.39! K(o=-5.4!,f=-0.73) USER MOD Single : A 612 TYR OH : rot 180:sc= 0 USER MOD Single : A 613 HIS : no HD1:sc= -0.056 X(o=-0.056,f=-0.006) USER MOD Single : A 617 SER OG : rot 180:sc= -0.448 USER MOD Single : A 624 LYS NZ :NH3+ -112:sc= 0.807 (180deg=-0.468!) USER MOD Single : A 626 GLN : amide:sc= -1.08 K(o=-1.1,f=-0.5) USER MOD Single : A 628 GLN : amide:sc= -0.528 X(o=-0.53,f=-0.042) USER MOD Single : A 629 SER OG : rot 180:sc=-0.00309 USER MOD Single : A 638 ASN : amide:sc= -1.92! K(o=-1.9!,f=-0.061) USER MOD Single : A 640 ASN : amide:sc= -1.01 K(o=-1,f=-0.16) USER MOD Single : A 642 LYS NZ :NH3+ -158:sc= 1.29 (180deg=1.2) USER MOD Single : A 645 THR OG1 : rot 180:sc= 0.0137 USER MOD Single : A 646 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 657 TYR OH : rot -149:sc= 0.581 USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 660 ASN : amide:sc= 0.964 K(o=0.96,f=-0.032) USER MOD Single : A 665 MET CE :methyl -114:sc= -0.621 (180deg=-7.4!) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 669 ASN : amide:sc= -2.12 K(o=-2.1,f=-7!) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 680 THR OG1 : rot 180:sc= 0.0126 USER MOD ----------------------------------------------------------------- ATOM 84 N GLU A 568 25.009 -10.325 -2.767 1.00 0.00 N ATOM 85 CA GLU A 568 23.839 -10.123 -1.969 1.00 0.00 C ATOM 86 C GLU A 568 23.495 -8.653 -2.044 1.00 0.00 C ATOM 87 O GLU A 568 24.209 -7.892 -2.719 1.00 0.00 O ATOM 88 CB GLU A 568 24.064 -10.601 -0.518 1.00 0.00 C ATOM 89 CG GLU A 568 25.219 -9.930 0.209 1.00 0.00 C ATOM 90 CD GLU A 568 25.446 -10.503 1.587 1.00 0.00 C ATOM 91 OE1 GLU A 568 24.771 -10.099 2.534 1.00 0.00 O ATOM 92 OE2 GLU A 568 26.341 -11.369 1.752 1.00 0.00 O ATOM 0 HA GLU A 568 23.005 -10.715 -2.346 1.00 0.00 H new ATOM 0 HB2 GLU A 568 23.149 -10.431 0.050 1.00 0.00 H new ATOM 0 HB3 GLU A 568 24.238 -11.677 -0.529 1.00 0.00 H new ATOM 0 HG2 GLU A 568 26.129 -10.040 -0.381 1.00 0.00 H new ATOM 0 HG3 GLU A 568 25.020 -8.861 0.292 1.00 0.00 H new ATOM 99 N CYS A 569 22.462 -8.244 -1.389 1.00 0.00 N ATOM 100 CA CYS A 569 22.011 -6.882 -1.483 1.00 0.00 C ATOM 101 C CYS A 569 22.739 -6.000 -0.493 1.00 0.00 C ATOM 102 O CYS A 569 23.129 -6.440 0.573 1.00 0.00 O ATOM 103 CB CYS A 569 20.527 -6.834 -1.226 1.00 0.00 C ATOM 104 SG CYS A 569 19.586 -7.949 -2.278 1.00 0.00 S ATOM 0 H CYS A 569 21.903 -8.835 -0.774 1.00 0.00 H new ATOM 0 HA CYS A 569 22.225 -6.508 -2.484 1.00 0.00 H new ATOM 0 HB2 CYS A 569 20.338 -7.084 -0.182 1.00 0.00 H new ATOM 0 HB3 CYS A 569 20.172 -5.815 -1.379 1.00 0.00 H new ATOM 109 N GLU A 570 22.936 -4.779 -0.861 1.00 0.00 N ATOM 110 CA GLU A 570 23.572 -3.807 -0.007 1.00 0.00 C ATOM 111 C GLU A 570 22.656 -2.587 0.127 1.00 0.00 C ATOM 112 O GLU A 570 22.897 -1.688 0.950 1.00 0.00 O ATOM 113 CB GLU A 570 24.916 -3.420 -0.616 1.00 0.00 C ATOM 114 CG GLU A 570 25.698 -2.408 0.179 1.00 0.00 C ATOM 115 CD GLU A 570 26.986 -2.060 -0.473 1.00 0.00 C ATOM 116 OE1 GLU A 570 26.968 -1.342 -1.493 1.00 0.00 O ATOM 117 OE2 GLU A 570 28.043 -2.529 0.003 1.00 0.00 O ATOM 0 H GLU A 570 22.660 -4.414 -1.773 1.00 0.00 H new ATOM 0 HA GLU A 570 23.746 -4.220 0.986 1.00 0.00 H new ATOM 0 HB2 GLU A 570 25.521 -4.320 -0.729 1.00 0.00 H new ATOM 0 HB3 GLU A 570 24.745 -3.023 -1.617 1.00 0.00 H new ATOM 0 HG2 GLU A 570 25.100 -1.505 0.304 1.00 0.00 H new ATOM 0 HG3 GLU A 570 25.892 -2.803 1.176 1.00 0.00 H new ATOM 124 N LEU A 571 21.593 -2.603 -0.685 1.00 0.00 N ATOM 125 CA LEU A 571 20.601 -1.539 -0.794 1.00 0.00 C ATOM 126 C LEU A 571 21.139 -0.413 -1.651 1.00 0.00 C ATOM 127 O LEU A 571 22.163 0.209 -1.317 1.00 0.00 O ATOM 128 CB LEU A 571 20.103 -1.030 0.584 1.00 0.00 C ATOM 129 CG LEU A 571 19.131 0.149 0.603 1.00 0.00 C ATOM 130 CD1 LEU A 571 17.813 -0.195 -0.068 1.00 0.00 C ATOM 131 CD2 LEU A 571 18.895 0.638 2.021 1.00 0.00 C ATOM 0 H LEU A 571 21.397 -3.389 -1.305 1.00 0.00 H new ATOM 0 HA LEU A 571 19.722 -1.960 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 571 19.625 -1.865 1.096 1.00 0.00 H new ATOM 0 HB3 LEU A 571 20.977 -0.752 1.173 1.00 0.00 H new ATOM 0 HG LEU A 571 19.592 0.954 0.032 1.00 0.00 H new ATOM 0 HD11 LEU A 571 17.150 0.670 -0.033 1.00 0.00 H new ATOM 0 HD12 LEU A 571 17.995 -0.471 -1.107 1.00 0.00 H new ATOM 0 HD13 LEU A 571 17.346 -1.031 0.453 1.00 0.00 H new ATOM 0 HD21 LEU A 571 18.200 1.477 2.005 1.00 0.00 H new ATOM 0 HD22 LEU A 571 18.475 -0.170 2.619 1.00 0.00 H new ATOM 0 HD23 LEU A 571 19.841 0.959 2.457 1.00 0.00 H new ATOM 143 N PRO A 572 20.503 -0.181 -2.809 1.00 0.00 N ATOM 144 CA PRO A 572 20.850 0.922 -3.686 1.00 0.00 C ATOM 145 C PRO A 572 20.411 2.245 -3.065 1.00 0.00 C ATOM 146 O PRO A 572 20.005 2.309 -1.889 1.00 0.00 O ATOM 147 CB PRO A 572 20.024 0.636 -4.949 1.00 0.00 C ATOM 148 CG PRO A 572 18.859 -0.106 -4.445 1.00 0.00 C ATOM 149 CD PRO A 572 19.399 -0.984 -3.366 1.00 0.00 C ATOM 0 HA PRO A 572 21.920 1.002 -3.876 1.00 0.00 H new ATOM 0 HB2 PRO A 572 19.726 1.557 -5.449 1.00 0.00 H new ATOM 0 HB3 PRO A 572 20.590 0.049 -5.673 1.00 0.00 H new ATOM 0 HG2 PRO A 572 18.097 0.571 -4.059 1.00 0.00 H new ATOM 0 HG3 PRO A 572 18.393 -0.694 -5.236 1.00 0.00 H new ATOM 0 HD2 PRO A 572 18.644 -1.210 -2.613 1.00 0.00 H new ATOM 0 HD3 PRO A 572 19.752 -1.937 -3.760 1.00 0.00 H new ATOM 157 N LYS A 573 20.443 3.277 -3.824 1.00 0.00 N ATOM 158 CA LYS A 573 20.090 4.542 -3.311 1.00 0.00 C ATOM 159 C LYS A 573 18.607 4.743 -3.434 1.00 0.00 C ATOM 160 O LYS A 573 18.071 4.942 -4.538 1.00 0.00 O ATOM 161 CB LYS A 573 20.892 5.651 -3.993 1.00 0.00 C ATOM 162 CG LYS A 573 22.390 5.457 -3.845 1.00 0.00 C ATOM 163 CD LYS A 573 22.790 5.372 -2.379 1.00 0.00 C ATOM 164 CE LYS A 573 24.239 4.960 -2.210 1.00 0.00 C ATOM 165 NZ LYS A 573 25.187 5.935 -2.789 1.00 0.00 N ATOM 0 H LYS A 573 20.712 3.267 -4.808 1.00 0.00 H new ATOM 0 HA LYS A 573 20.343 4.587 -2.252 1.00 0.00 H new ATOM 0 HB2 LYS A 573 20.635 5.682 -5.052 1.00 0.00 H new ATOM 0 HB3 LYS A 573 20.609 6.614 -3.568 1.00 0.00 H new ATOM 0 HG2 LYS A 573 22.695 4.547 -4.361 1.00 0.00 H new ATOM 0 HG3 LYS A 573 22.916 6.285 -4.321 1.00 0.00 H new ATOM 0 HD2 LYS A 573 22.630 6.339 -1.903 1.00 0.00 H new ATOM 0 HD3 LYS A 573 22.147 4.655 -1.869 1.00 0.00 H new ATOM 0 HE2 LYS A 573 24.455 4.838 -1.149 1.00 0.00 H new ATOM 0 HE3 LYS A 573 24.392 3.989 -2.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 573 26.162 5.618 -2.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 573 25.026 6.009 -3.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 573 25.041 6.865 -2.347 1.00 0.00 H new ATOM 179 N ILE A 574 17.936 4.589 -2.314 1.00 0.00 N ATOM 180 CA ILE A 574 16.507 4.815 -2.220 1.00 0.00 C ATOM 181 C ILE A 574 16.203 6.317 -2.350 1.00 0.00 C ATOM 182 O ILE A 574 17.083 7.128 -2.687 1.00 0.00 O ATOM 183 CB ILE A 574 15.944 4.343 -0.842 1.00 0.00 C ATOM 184 CG1 ILE A 574 16.702 5.020 0.303 1.00 0.00 C ATOM 185 CG2 ILE A 574 16.021 2.837 -0.709 1.00 0.00 C ATOM 186 CD1 ILE A 574 16.096 4.789 1.656 1.00 0.00 C ATOM 0 H ILE A 574 18.368 4.302 -1.436 1.00 0.00 H new ATOM 0 HA ILE A 574 16.038 4.247 -3.023 1.00 0.00 H new ATOM 0 HB ILE A 574 14.895 4.633 -0.788 1.00 0.00 H new ATOM 0 HG12 ILE A 574 17.730 4.657 0.310 1.00 0.00 H new ATOM 0 HG13 ILE A 574 16.744 6.093 0.113 1.00 0.00 H new ATOM 0 HG21 ILE A 574 15.622 2.536 0.260 1.00 0.00 H new ATOM 0 HG22 ILE A 574 15.436 2.371 -1.502 1.00 0.00 H new ATOM 0 HG23 ILE A 574 17.060 2.517 -0.789 1.00 0.00 H new ATOM 0 HD11 ILE A 574 16.690 5.301 2.413 1.00 0.00 H new ATOM 0 HD12 ILE A 574 15.078 5.178 1.670 1.00 0.00 H new ATOM 0 HD13 ILE A 574 16.079 3.720 1.869 1.00 0.00 H new ATOM 193 N ASP A 575 14.978 6.675 -2.095 1.00 0.00 N ATOM 194 CA ASP A 575 14.583 8.077 -2.046 1.00 0.00 C ATOM 195 C ASP A 575 15.203 8.679 -0.784 1.00 0.00 C ATOM 196 O ASP A 575 15.474 7.959 0.187 1.00 0.00 O ATOM 197 CB ASP A 575 13.080 8.192 -1.874 1.00 0.00 C ATOM 198 CG ASP A 575 12.516 9.549 -2.270 1.00 0.00 C ATOM 199 OD1 ASP A 575 12.694 10.509 -1.503 1.00 0.00 O ATOM 200 OD2 ASP A 575 11.873 9.678 -3.324 1.00 0.00 O ATOM 0 H ASP A 575 14.219 6.018 -1.914 1.00 0.00 H new ATOM 0 HA ASP A 575 14.901 8.575 -2.962 1.00 0.00 H new ATOM 0 HB2 ASP A 575 12.596 7.420 -2.472 1.00 0.00 H new ATOM 0 HB3 ASP A 575 12.827 7.994 -0.832 1.00 0.00 H new ATOM 205 N VAL A 576 15.403 9.952 -0.772 1.00 0.00 N ATOM 206 CA VAL A 576 15.904 10.635 0.405 1.00 0.00 C ATOM 207 C VAL A 576 14.820 10.628 1.502 1.00 0.00 C ATOM 208 O VAL A 576 15.108 10.591 2.702 1.00 0.00 O ATOM 209 CB VAL A 576 16.357 12.094 0.069 1.00 0.00 C ATOM 210 CG1 VAL A 576 15.209 12.916 -0.490 1.00 0.00 C ATOM 211 CG2 VAL A 576 16.963 12.783 1.278 1.00 0.00 C ATOM 0 H VAL A 576 15.229 10.563 -1.570 1.00 0.00 H new ATOM 0 HA VAL A 576 16.784 10.105 0.770 1.00 0.00 H new ATOM 0 HB VAL A 576 17.128 12.019 -0.698 1.00 0.00 H new ATOM 0 HG11 VAL A 576 15.558 13.924 -0.713 1.00 0.00 H new ATOM 0 HG12 VAL A 576 14.839 12.450 -1.403 1.00 0.00 H new ATOM 0 HG13 VAL A 576 14.405 12.964 0.244 1.00 0.00 H new ATOM 0 HG21 VAL A 576 17.266 13.794 1.007 1.00 0.00 H new ATOM 0 HG22 VAL A 576 16.225 12.828 2.079 1.00 0.00 H new ATOM 0 HG23 VAL A 576 17.834 12.222 1.618 1.00 0.00 H new ATOM 215 N HIS A 577 13.580 10.586 1.066 1.00 0.00 N ATOM 216 CA HIS A 577 12.445 10.587 1.950 1.00 0.00 C ATOM 217 C HIS A 577 11.945 9.185 2.201 1.00 0.00 C ATOM 218 O HIS A 577 10.929 9.010 2.845 1.00 0.00 O ATOM 219 CB HIS A 577 11.318 11.451 1.373 1.00 0.00 C ATOM 220 CG HIS A 577 11.632 12.912 1.352 1.00 0.00 C ATOM 221 ND1 HIS A 577 11.717 13.649 0.204 1.00 0.00 N ATOM 222 CD2 HIS A 577 11.851 13.779 2.361 1.00 0.00 C ATOM 223 CE1 HIS A 577 11.973 14.898 0.497 1.00 0.00 C ATOM 224 NE2 HIS A 577 12.056 15.006 1.803 1.00 0.00 N ATOM 0 H HIS A 577 13.333 10.550 0.077 1.00 0.00 H new ATOM 0 HA HIS A 577 12.766 11.009 2.902 1.00 0.00 H new ATOM 0 HB2 HIS A 577 11.102 11.120 0.357 1.00 0.00 H new ATOM 0 HB3 HIS A 577 10.413 11.291 1.959 1.00 0.00 H new ATOM 0 HD2 HIS A 577 11.862 13.545 3.415 1.00 0.00 H new ATOM 0 HE1 HIS A 577 12.095 15.702 -0.213 1.00 0.00 H new ATOM 0 HE2 HIS A 577 12.243 15.867 2.316 1.00 0.00 H new ATOM 233 N LEU A 578 12.666 8.204 1.711 1.00 0.00 N ATOM 234 CA LEU A 578 12.288 6.803 1.852 1.00 0.00 C ATOM 235 C LEU A 578 13.071 6.261 3.044 1.00 0.00 C ATOM 236 O LEU A 578 14.206 6.693 3.297 1.00 0.00 O ATOM 237 CB LEU A 578 12.671 6.068 0.538 1.00 0.00 C ATOM 238 CG LEU A 578 12.079 4.693 0.173 1.00 0.00 C ATOM 239 CD1 LEU A 578 12.513 3.656 1.061 1.00 0.00 C ATOM 240 CD2 LEU A 578 10.583 4.706 -0.001 1.00 0.00 C ATOM 0 H LEU A 578 13.537 8.348 1.200 1.00 0.00 H new ATOM 0 HA LEU A 578 11.220 6.664 2.021 1.00 0.00 H new ATOM 0 HB2 LEU A 578 12.429 6.743 -0.283 1.00 0.00 H new ATOM 0 HB3 LEU A 578 13.755 5.952 0.546 1.00 0.00 H new ATOM 0 HG LEU A 578 12.485 4.458 -0.811 1.00 0.00 H new ATOM 0 HD11 LEU A 578 12.067 2.708 0.759 1.00 0.00 H new ATOM 0 HD12 LEU A 578 13.599 3.575 1.022 1.00 0.00 H new ATOM 0 HD13 LEU A 578 12.203 3.895 2.078 1.00 0.00 H new ATOM 0 HD21 LEU A 578 10.238 3.704 -0.257 1.00 0.00 H new ATOM 0 HD22 LEU A 578 10.111 5.026 0.928 1.00 0.00 H new ATOM 0 HD23 LEU A 578 10.316 5.397 -0.800 1.00 0.00 H new ATOM 252 N VAL A 579 12.475 5.387 3.803 1.00 0.00 N ATOM 253 CA VAL A 579 13.121 4.817 4.959 1.00 0.00 C ATOM 254 C VAL A 579 12.758 3.332 5.030 1.00 0.00 C ATOM 255 O VAL A 579 11.591 2.982 5.148 1.00 0.00 O ATOM 256 CB VAL A 579 12.671 5.477 6.295 1.00 0.00 C ATOM 257 CG1 VAL A 579 13.706 5.264 7.375 1.00 0.00 C ATOM 258 CG2 VAL A 579 12.296 6.951 6.159 1.00 0.00 C ATOM 0 H VAL A 579 11.527 5.047 3.641 1.00 0.00 H new ATOM 0 HA VAL A 579 14.192 4.983 4.846 1.00 0.00 H new ATOM 0 HB VAL A 579 11.751 4.971 6.589 1.00 0.00 H new ATOM 0 HG11 VAL A 579 13.370 5.734 8.299 1.00 0.00 H new ATOM 0 HG12 VAL A 579 13.844 4.196 7.541 1.00 0.00 H new ATOM 0 HG13 VAL A 579 14.652 5.709 7.065 1.00 0.00 H new ATOM 0 HG21 VAL A 579 11.993 7.341 7.131 1.00 0.00 H new ATOM 0 HG22 VAL A 579 13.156 7.513 5.795 1.00 0.00 H new ATOM 0 HG23 VAL A 579 11.471 7.053 5.454 1.00 0.00 H new ATOM 262 N PRO A 580 13.738 2.461 4.880 1.00 0.00 N ATOM 263 CA PRO A 580 13.540 1.016 4.991 1.00 0.00 C ATOM 264 C PRO A 580 13.398 0.542 6.460 1.00 0.00 C ATOM 265 O PRO A 580 14.135 0.999 7.348 1.00 0.00 O ATOM 266 CB PRO A 580 14.823 0.443 4.375 1.00 0.00 C ATOM 267 CG PRO A 580 15.850 1.509 4.573 1.00 0.00 C ATOM 268 CD PRO A 580 15.112 2.820 4.555 1.00 0.00 C ATOM 0 HA PRO A 580 12.622 0.694 4.500 1.00 0.00 H new ATOM 0 HB2 PRO A 580 15.117 -0.485 4.865 1.00 0.00 H new ATOM 0 HB3 PRO A 580 14.687 0.216 3.318 1.00 0.00 H new ATOM 0 HG2 PRO A 580 16.375 1.372 5.519 1.00 0.00 H new ATOM 0 HG3 PRO A 580 16.601 1.476 3.784 1.00 0.00 H new ATOM 0 HD2 PRO A 580 15.524 3.519 5.283 1.00 0.00 H new ATOM 0 HD3 PRO A 580 15.178 3.301 3.579 1.00 0.00 H new ATOM 276 N ASP A 581 12.452 -0.362 6.679 1.00 0.00 N ATOM 277 CA ASP A 581 12.162 -1.001 7.986 1.00 0.00 C ATOM 278 C ASP A 581 13.387 -1.672 8.555 1.00 0.00 C ATOM 279 O ASP A 581 13.800 -1.378 9.670 1.00 0.00 O ATOM 280 CB ASP A 581 11.049 -2.062 7.812 1.00 0.00 C ATOM 281 CG ASP A 581 10.839 -2.966 9.024 1.00 0.00 C ATOM 282 OD1 ASP A 581 11.581 -3.955 9.175 1.00 0.00 O ATOM 283 OD2 ASP A 581 9.890 -2.741 9.807 1.00 0.00 O ATOM 0 H ASP A 581 11.836 -0.692 5.936 1.00 0.00 H new ATOM 0 HA ASP A 581 11.840 -0.220 8.674 1.00 0.00 H new ATOM 0 HB2 ASP A 581 10.112 -1.553 7.588 1.00 0.00 H new ATOM 0 HB3 ASP A 581 11.289 -2.683 6.949 1.00 0.00 H new ATOM 288 N ARG A 582 13.958 -2.574 7.766 1.00 0.00 N ATOM 289 CA ARG A 582 15.125 -3.336 8.169 1.00 0.00 C ATOM 290 C ARG A 582 16.276 -2.421 8.497 1.00 0.00 C ATOM 291 O ARG A 582 16.762 -2.419 9.613 1.00 0.00 O ATOM 292 CB ARG A 582 15.538 -4.284 7.058 1.00 0.00 C ATOM 293 CG ARG A 582 14.560 -5.391 6.767 1.00 0.00 C ATOM 294 CD ARG A 582 14.338 -6.245 7.989 1.00 0.00 C ATOM 295 NE ARG A 582 13.445 -7.369 7.716 1.00 0.00 N ATOM 296 CZ ARG A 582 12.225 -7.563 8.246 1.00 0.00 C ATOM 297 NH1 ARG A 582 11.617 -6.602 8.938 1.00 0.00 N ATOM 298 NH2 ARG A 582 11.580 -8.690 8.000 1.00 0.00 N ATOM 0 H ARG A 582 13.622 -2.795 6.829 1.00 0.00 H new ATOM 0 HA ARG A 582 14.864 -3.907 9.060 1.00 0.00 H new ATOM 0 HB2 ARG A 582 15.691 -3.706 6.146 1.00 0.00 H new ATOM 0 HB3 ARG A 582 16.499 -4.728 7.319 1.00 0.00 H new ATOM 0 HG2 ARG A 582 13.612 -4.967 6.437 1.00 0.00 H new ATOM 0 HG3 ARG A 582 14.935 -6.008 5.950 1.00 0.00 H new ATOM 0 HD2 ARG A 582 15.296 -6.622 8.347 1.00 0.00 H new ATOM 0 HD3 ARG A 582 13.918 -5.633 8.787 1.00 0.00 H new ATOM 0 HE ARG A 582 13.780 -8.075 7.060 1.00 0.00 H new ATOM 0 HH11 ARG A 582 12.077 -5.702 9.073 1.00 0.00 H new ATOM 0 HH12 ARG A 582 10.691 -6.766 9.333 1.00 0.00 H new ATOM 0 HH21 ARG A 582 12.008 -9.405 7.412 1.00 0.00 H new ATOM 0 HH22 ARG A 582 10.654 -8.845 8.398 1.00 0.00 H new ATOM 312 N LYS A 583 16.676 -1.643 7.498 1.00 0.00 N ATOM 313 CA LYS A 583 17.763 -0.676 7.591 1.00 0.00 C ATOM 314 C LYS A 583 19.038 -1.333 8.104 1.00 0.00 C ATOM 315 O LYS A 583 19.334 -1.324 9.301 1.00 0.00 O ATOM 316 CB LYS A 583 17.362 0.542 8.430 1.00 0.00 C ATOM 317 CG LYS A 583 18.335 1.700 8.347 1.00 0.00 C ATOM 318 CD LYS A 583 17.888 2.923 9.159 1.00 0.00 C ATOM 319 CE LYS A 583 16.498 3.428 8.756 1.00 0.00 C ATOM 320 NZ LYS A 583 15.402 2.765 9.509 1.00 0.00 N ATOM 0 H LYS A 583 16.241 -1.668 6.576 1.00 0.00 H new ATOM 0 HA LYS A 583 17.972 -0.309 6.586 1.00 0.00 H new ATOM 0 HB2 LYS A 583 16.379 0.884 8.107 1.00 0.00 H new ATOM 0 HB3 LYS A 583 17.266 0.236 9.472 1.00 0.00 H new ATOM 0 HG2 LYS A 583 19.312 1.372 8.703 1.00 0.00 H new ATOM 0 HG3 LYS A 583 18.457 1.990 7.303 1.00 0.00 H new ATOM 0 HD2 LYS A 583 17.884 2.668 10.219 1.00 0.00 H new ATOM 0 HD3 LYS A 583 18.613 3.726 9.027 1.00 0.00 H new ATOM 0 HE2 LYS A 583 16.446 4.504 8.921 1.00 0.00 H new ATOM 0 HE3 LYS A 583 16.352 3.261 7.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 14.871 2.140 8.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 15.805 2.204 10.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 14.762 3.487 9.898 1.00 0.00 H new ATOM 334 N LYS A 584 19.742 -1.945 7.206 1.00 0.00 N ATOM 335 CA LYS A 584 20.934 -2.658 7.546 1.00 0.00 C ATOM 336 C LYS A 584 21.965 -2.491 6.450 1.00 0.00 C ATOM 337 O LYS A 584 21.622 -2.069 5.335 1.00 0.00 O ATOM 338 CB LYS A 584 20.618 -4.141 7.823 1.00 0.00 C ATOM 339 CG LYS A 584 19.931 -4.874 6.674 1.00 0.00 C ATOM 340 CD LYS A 584 19.657 -6.323 7.011 1.00 0.00 C ATOM 341 CE LYS A 584 18.494 -6.416 7.955 1.00 0.00 C ATOM 342 NZ LYS A 584 18.377 -7.742 8.589 1.00 0.00 N ATOM 0 H LYS A 584 19.507 -1.965 6.214 1.00 0.00 H new ATOM 0 HA LYS A 584 21.353 -2.244 8.463 1.00 0.00 H new ATOM 0 HB2 LYS A 584 21.548 -4.658 8.061 1.00 0.00 H new ATOM 0 HB3 LYS A 584 19.983 -4.204 8.707 1.00 0.00 H new ATOM 0 HG2 LYS A 584 18.993 -4.374 6.434 1.00 0.00 H new ATOM 0 HG3 LYS A 584 20.557 -4.821 5.784 1.00 0.00 H new ATOM 0 HD2 LYS A 584 19.444 -6.883 6.101 1.00 0.00 H new ATOM 0 HD3 LYS A 584 20.541 -6.774 7.463 1.00 0.00 H new ATOM 0 HE2 LYS A 584 18.599 -5.656 8.729 1.00 0.00 H new ATOM 0 HE3 LYS A 584 17.574 -6.195 7.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 584 17.670 -7.702 9.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 584 18.081 -8.442 7.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 584 19.297 -8.019 8.986 1.00 0.00 H new ATOM 356 N ASP A 585 23.216 -2.807 6.769 1.00 0.00 N ATOM 357 CA ASP A 585 24.337 -2.655 5.831 1.00 0.00 C ATOM 358 C ASP A 585 24.131 -3.488 4.595 1.00 0.00 C ATOM 359 O ASP A 585 24.135 -2.967 3.477 1.00 0.00 O ATOM 360 CB ASP A 585 25.682 -3.015 6.476 1.00 0.00 C ATOM 361 CG ASP A 585 26.073 -2.100 7.600 1.00 0.00 C ATOM 362 OD1 ASP A 585 26.552 -0.996 7.340 1.00 0.00 O ATOM 363 OD2 ASP A 585 25.924 -2.485 8.777 1.00 0.00 O ATOM 0 H ASP A 585 23.487 -3.175 7.681 1.00 0.00 H new ATOM 0 HA ASP A 585 24.364 -1.602 5.551 1.00 0.00 H new ATOM 0 HB2 ASP A 585 25.634 -4.037 6.851 1.00 0.00 H new ATOM 0 HB3 ASP A 585 26.460 -2.992 5.712 1.00 0.00 H new ATOM 368 N GLN A 586 23.959 -4.770 4.777 1.00 0.00 N ATOM 369 CA GLN A 586 23.698 -5.649 3.674 1.00 0.00 C ATOM 370 C GLN A 586 22.446 -6.410 3.915 1.00 0.00 C ATOM 371 O GLN A 586 22.142 -6.789 5.041 1.00 0.00 O ATOM 372 CB GLN A 586 24.862 -6.604 3.353 1.00 0.00 C ATOM 373 CG GLN A 586 26.087 -5.909 2.785 1.00 0.00 C ATOM 374 CD GLN A 586 27.231 -5.749 3.765 1.00 0.00 C ATOM 375 OE1 GLN A 586 28.390 -5.694 3.354 1.00 0.00 O ATOM 376 NE2 GLN A 586 26.949 -5.735 5.046 1.00 0.00 N ATOM 0 H GLN A 586 23.996 -5.229 5.687 1.00 0.00 H new ATOM 0 HA GLN A 586 23.583 -5.016 2.794 1.00 0.00 H new ATOM 0 HB2 GLN A 586 25.146 -7.134 4.262 1.00 0.00 H new ATOM 0 HB3 GLN A 586 24.518 -7.354 2.641 1.00 0.00 H new ATOM 0 HG2 GLN A 586 26.441 -6.473 1.922 1.00 0.00 H new ATOM 0 HG3 GLN A 586 25.795 -4.923 2.424 1.00 0.00 H new ATOM 0 HE21 GLN A 586 25.978 -5.782 5.355 1.00 0.00 H new ATOM 0 HE22 GLN A 586 27.701 -5.677 5.733 1.00 0.00 H new ATOM 385 N TYR A 587 21.720 -6.615 2.874 1.00 0.00 N ATOM 386 CA TYR A 587 20.491 -7.311 2.939 1.00 0.00 C ATOM 387 C TYR A 587 20.694 -8.688 2.435 1.00 0.00 C ATOM 388 O TYR A 587 21.222 -8.899 1.342 1.00 0.00 O ATOM 389 CB TYR A 587 19.384 -6.580 2.191 1.00 0.00 C ATOM 390 CG TYR A 587 19.036 -5.267 2.828 1.00 0.00 C ATOM 391 CD1 TYR A 587 19.723 -4.105 2.505 1.00 0.00 C ATOM 392 CD2 TYR A 587 18.036 -5.186 3.770 1.00 0.00 C ATOM 393 CE1 TYR A 587 19.414 -2.909 3.114 1.00 0.00 C ATOM 394 CE2 TYR A 587 17.725 -4.013 4.362 1.00 0.00 C ATOM 395 CZ TYR A 587 18.416 -2.870 4.044 1.00 0.00 C ATOM 396 OH TYR A 587 18.099 -1.685 4.656 1.00 0.00 O ATOM 0 H TYR A 587 21.971 -6.297 1.938 1.00 0.00 H new ATOM 0 HA TYR A 587 20.161 -7.361 3.977 1.00 0.00 H new ATOM 0 HB2 TYR A 587 19.696 -6.410 1.161 1.00 0.00 H new ATOM 0 HB3 TYR A 587 18.496 -7.210 2.155 1.00 0.00 H new ATOM 0 HD1 TYR A 587 20.510 -4.139 1.766 1.00 0.00 H new ATOM 0 HD2 TYR A 587 17.490 -6.077 4.041 1.00 0.00 H new ATOM 0 HE1 TYR A 587 19.956 -2.011 2.858 1.00 0.00 H new ATOM 0 HE2 TYR A 587 16.928 -3.974 5.090 1.00 0.00 H new ATOM 0 HH TYR A 587 17.131 -1.539 4.605 1.00 0.00 H new ATOM 406 N LYS A 588 20.301 -9.607 3.235 1.00 0.00 N ATOM 407 CA LYS A 588 20.522 -10.982 2.982 1.00 0.00 C ATOM 408 C LYS A 588 19.486 -11.477 1.987 1.00 0.00 C ATOM 409 O LYS A 588 18.399 -10.925 1.918 1.00 0.00 O ATOM 410 CB LYS A 588 20.402 -11.706 4.309 1.00 0.00 C ATOM 411 CG LYS A 588 21.255 -12.965 4.415 1.00 0.00 C ATOM 412 CD LYS A 588 22.738 -12.642 4.195 1.00 0.00 C ATOM 413 CE LYS A 588 23.263 -11.628 5.211 1.00 0.00 C ATOM 414 NZ LYS A 588 24.648 -11.202 4.915 1.00 0.00 N ATOM 0 H LYS A 588 19.804 -9.420 4.106 1.00 0.00 H new ATOM 0 HA LYS A 588 21.508 -11.163 2.553 1.00 0.00 H new ATOM 0 HB2 LYS A 588 20.683 -11.022 5.110 1.00 0.00 H new ATOM 0 HB3 LYS A 588 19.358 -11.974 4.471 1.00 0.00 H new ATOM 0 HG2 LYS A 588 21.119 -13.419 5.397 1.00 0.00 H new ATOM 0 HG3 LYS A 588 20.925 -13.696 3.677 1.00 0.00 H new ATOM 0 HD2 LYS A 588 23.322 -13.559 4.264 1.00 0.00 H new ATOM 0 HD3 LYS A 588 22.878 -12.250 3.187 1.00 0.00 H new ATOM 0 HE2 LYS A 588 22.611 -10.755 5.220 1.00 0.00 H new ATOM 0 HE3 LYS A 588 23.225 -12.064 6.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 25.084 -10.816 5.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 25.199 -12.019 4.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 24.636 -10.470 4.176 1.00 0.00 H new ATOM 428 N VAL A 589 19.823 -12.483 1.213 1.00 0.00 N ATOM 429 CA VAL A 589 18.900 -13.008 0.215 1.00 0.00 C ATOM 430 C VAL A 589 17.630 -13.529 0.899 1.00 0.00 C ATOM 431 O VAL A 589 17.686 -14.446 1.728 1.00 0.00 O ATOM 432 CB VAL A 589 19.545 -14.125 -0.648 1.00 0.00 C ATOM 433 CG1 VAL A 589 18.585 -14.586 -1.734 1.00 0.00 C ATOM 434 CG2 VAL A 589 20.849 -13.637 -1.267 1.00 0.00 C ATOM 0 H VAL A 589 20.725 -12.958 1.250 1.00 0.00 H new ATOM 0 HA VAL A 589 18.642 -12.190 -0.457 1.00 0.00 H new ATOM 0 HB VAL A 589 19.765 -14.973 0.001 1.00 0.00 H new ATOM 0 HG11 VAL A 589 19.056 -15.369 -2.328 1.00 0.00 H new ATOM 0 HG12 VAL A 589 17.676 -14.976 -1.275 1.00 0.00 H new ATOM 0 HG13 VAL A 589 18.333 -13.744 -2.379 1.00 0.00 H new ATOM 0 HG21 VAL A 589 21.287 -14.434 -1.868 1.00 0.00 H new ATOM 0 HG22 VAL A 589 20.650 -12.772 -1.900 1.00 0.00 H new ATOM 0 HG23 VAL A 589 21.544 -13.356 -0.476 1.00 0.00 H new ATOM 438 N GLY A 590 16.516 -12.925 0.566 1.00 0.00 N ATOM 439 CA GLY A 590 15.252 -13.259 1.163 1.00 0.00 C ATOM 440 C GLY A 590 14.801 -12.227 2.181 1.00 0.00 C ATOM 441 O GLY A 590 13.690 -12.321 2.704 1.00 0.00 O ATOM 0 H GLY A 590 16.463 -12.183 -0.132 1.00 0.00 H new ATOM 0 HA2 GLY A 590 14.497 -13.349 0.382 1.00 0.00 H new ATOM 0 HA3 GLY A 590 15.328 -14.233 1.646 1.00 0.00 H new ATOM 445 N GLU A 591 15.661 -11.247 2.467 1.00 0.00 N ATOM 446 CA GLU A 591 15.334 -10.176 3.397 1.00 0.00 C ATOM 447 C GLU A 591 14.272 -9.319 2.751 1.00 0.00 C ATOM 448 O GLU A 591 14.413 -8.947 1.574 1.00 0.00 O ATOM 449 CB GLU A 591 16.602 -9.331 3.683 1.00 0.00 C ATOM 450 CG GLU A 591 16.524 -8.366 4.835 1.00 0.00 C ATOM 451 CD GLU A 591 16.224 -9.022 6.143 1.00 0.00 C ATOM 452 OE1 GLU A 591 15.049 -9.207 6.477 1.00 0.00 O ATOM 453 OE2 GLU A 591 17.166 -9.341 6.876 1.00 0.00 O ATOM 0 H GLU A 591 16.595 -11.178 2.062 1.00 0.00 H new ATOM 0 HA GLU A 591 14.971 -10.580 4.342 1.00 0.00 H new ATOM 0 HB2 GLU A 591 17.432 -10.014 3.866 1.00 0.00 H new ATOM 0 HB3 GLU A 591 16.846 -8.767 2.783 1.00 0.00 H new ATOM 0 HG2 GLU A 591 17.470 -7.831 4.915 1.00 0.00 H new ATOM 0 HG3 GLU A 591 15.754 -7.623 4.625 1.00 0.00 H new ATOM 460 N VAL A 592 13.199 -9.052 3.456 1.00 0.00 N ATOM 461 CA VAL A 592 12.191 -8.214 2.901 1.00 0.00 C ATOM 462 C VAL A 592 12.369 -6.808 3.393 1.00 0.00 C ATOM 463 O VAL A 592 12.370 -6.519 4.599 1.00 0.00 O ATOM 464 CB VAL A 592 10.730 -8.725 3.086 1.00 0.00 C ATOM 465 CG1 VAL A 592 10.590 -10.122 2.532 1.00 0.00 C ATOM 466 CG2 VAL A 592 10.259 -8.656 4.520 1.00 0.00 C ATOM 0 H VAL A 592 13.012 -9.400 4.396 1.00 0.00 H new ATOM 0 HA VAL A 592 12.334 -8.241 1.821 1.00 0.00 H new ATOM 0 HB VAL A 592 10.082 -8.054 2.523 1.00 0.00 H new ATOM 0 HG11 VAL A 592 9.565 -10.466 2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 592 10.834 -10.118 1.470 1.00 0.00 H new ATOM 0 HG13 VAL A 592 11.270 -10.792 3.058 1.00 0.00 H new ATOM 0 HG21 VAL A 592 9.235 -9.025 4.585 1.00 0.00 H new ATOM 0 HG22 VAL A 592 10.907 -9.270 5.146 1.00 0.00 H new ATOM 0 HG23 VAL A 592 10.295 -7.623 4.865 1.00 0.00 H new ATOM 470 N LEU A 593 12.588 -5.950 2.484 1.00 0.00 N ATOM 471 CA LEU A 593 12.808 -4.599 2.795 1.00 0.00 C ATOM 472 C LEU A 593 11.526 -3.871 2.671 1.00 0.00 C ATOM 473 O LEU A 593 11.078 -3.561 1.571 1.00 0.00 O ATOM 474 CB LEU A 593 13.880 -3.948 1.913 1.00 0.00 C ATOM 475 CG LEU A 593 15.313 -4.423 2.035 1.00 0.00 C ATOM 476 CD1 LEU A 593 15.486 -5.864 1.596 1.00 0.00 C ATOM 477 CD2 LEU A 593 16.202 -3.502 1.238 1.00 0.00 C ATOM 0 H LEU A 593 12.620 -6.167 1.488 1.00 0.00 H new ATOM 0 HA LEU A 593 13.184 -4.546 3.817 1.00 0.00 H new ATOM 0 HB2 LEU A 593 13.576 -4.078 0.874 1.00 0.00 H new ATOM 0 HB3 LEU A 593 13.869 -2.877 2.116 1.00 0.00 H new ATOM 0 HG LEU A 593 15.597 -4.393 3.087 1.00 0.00 H new ATOM 0 HD11 LEU A 593 16.531 -6.154 1.703 1.00 0.00 H new ATOM 0 HD12 LEU A 593 14.864 -6.510 2.216 1.00 0.00 H new ATOM 0 HD13 LEU A 593 15.187 -5.965 0.553 1.00 0.00 H new ATOM 0 HD21 LEU A 593 17.237 -3.835 1.319 1.00 0.00 H new ATOM 0 HD22 LEU A 593 15.897 -3.517 0.192 1.00 0.00 H new ATOM 0 HD23 LEU A 593 16.116 -2.487 1.626 1.00 0.00 H new ATOM 489 N LYS A 594 10.890 -3.706 3.781 1.00 0.00 N ATOM 490 CA LYS A 594 9.696 -2.949 3.850 1.00 0.00 C ATOM 491 C LYS A 594 10.081 -1.500 3.905 1.00 0.00 C ATOM 492 O LYS A 594 10.698 -1.062 4.843 1.00 0.00 O ATOM 493 CB LYS A 594 8.870 -3.363 5.065 1.00 0.00 C ATOM 494 CG LYS A 594 8.425 -4.814 5.005 1.00 0.00 C ATOM 495 CD LYS A 594 7.530 -5.197 6.158 1.00 0.00 C ATOM 496 CE LYS A 594 8.266 -5.207 7.484 1.00 0.00 C ATOM 497 NZ LYS A 594 7.381 -5.625 8.591 1.00 0.00 N ATOM 0 H LYS A 594 11.191 -4.099 4.673 1.00 0.00 H new ATOM 0 HA LYS A 594 9.072 -3.127 2.975 1.00 0.00 H new ATOM 0 HB2 LYS A 594 9.457 -3.205 5.969 1.00 0.00 H new ATOM 0 HB3 LYS A 594 7.992 -2.721 5.138 1.00 0.00 H new ATOM 0 HG2 LYS A 594 7.898 -4.990 4.067 1.00 0.00 H new ATOM 0 HG3 LYS A 594 9.303 -5.459 5.002 1.00 0.00 H new ATOM 0 HD2 LYS A 594 6.696 -4.498 6.214 1.00 0.00 H new ATOM 0 HD3 LYS A 594 7.107 -6.184 5.973 1.00 0.00 H new ATOM 0 HE2 LYS A 594 9.119 -5.883 7.423 1.00 0.00 H new ATOM 0 HE3 LYS A 594 8.662 -4.212 7.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 594 7.915 -5.621 9.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 594 6.581 -4.965 8.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 594 7.023 -6.584 8.406 1.00 0.00 H new ATOM 511 N PHE A 595 9.819 -0.812 2.869 1.00 0.00 N ATOM 512 CA PHE A 595 10.135 0.571 2.774 1.00 0.00 C ATOM 513 C PHE A 595 8.966 1.376 3.223 1.00 0.00 C ATOM 514 O PHE A 595 7.842 0.866 3.293 1.00 0.00 O ATOM 515 CB PHE A 595 10.449 0.921 1.347 1.00 0.00 C ATOM 516 CG PHE A 595 11.613 0.176 0.772 1.00 0.00 C ATOM 517 CD1 PHE A 595 12.892 0.372 1.262 1.00 0.00 C ATOM 518 CD2 PHE A 595 11.430 -0.703 -0.258 1.00 0.00 C ATOM 519 CE1 PHE A 595 13.964 -0.300 0.730 1.00 0.00 C ATOM 520 CE2 PHE A 595 12.486 -1.375 -0.802 1.00 0.00 C ATOM 521 CZ PHE A 595 13.763 -1.176 -0.313 1.00 0.00 C ATOM 0 H PHE A 595 9.368 -1.194 2.037 1.00 0.00 H new ATOM 0 HA PHE A 595 10.999 0.786 3.403 1.00 0.00 H new ATOM 0 HB2 PHE A 595 9.569 0.725 0.735 1.00 0.00 H new ATOM 0 HB3 PHE A 595 10.650 1.990 1.283 1.00 0.00 H new ATOM 0 HD1 PHE A 595 13.049 1.065 2.076 1.00 0.00 H new ATOM 0 HD2 PHE A 595 10.436 -0.868 -0.647 1.00 0.00 H new ATOM 0 HE1 PHE A 595 14.956 -0.143 1.126 1.00 0.00 H new ATOM 0 HE2 PHE A 595 12.323 -2.064 -1.617 1.00 0.00 H new ATOM 0 HZ PHE A 595 14.599 -1.705 -0.747 1.00 0.00 H new ATOM 531 N SER A 596 9.208 2.598 3.518 1.00 0.00 N ATOM 532 CA SER A 596 8.215 3.503 3.887 1.00 0.00 C ATOM 533 C SER A 596 8.817 4.852 3.607 1.00 0.00 C ATOM 534 O SER A 596 9.961 4.921 3.187 1.00 0.00 O ATOM 535 CB SER A 596 7.832 3.307 5.379 1.00 0.00 C ATOM 536 OG SER A 596 6.678 4.053 5.755 1.00 0.00 O ATOM 0 H SER A 596 10.145 3.000 3.505 1.00 0.00 H new ATOM 0 HA SER A 596 7.282 3.372 3.338 1.00 0.00 H new ATOM 0 HB2 SER A 596 7.652 2.249 5.567 1.00 0.00 H new ATOM 0 HB3 SER A 596 8.672 3.604 6.007 1.00 0.00 H new ATOM 0 HG SER A 596 6.479 3.893 6.701 1.00 0.00 H new ATOM 542 N CYS A 597 8.094 5.867 3.791 1.00 0.00 N ATOM 543 CA CYS A 597 8.576 7.194 3.550 1.00 0.00 C ATOM 544 C CYS A 597 8.485 8.013 4.814 1.00 0.00 C ATOM 545 O CYS A 597 7.941 7.550 5.825 1.00 0.00 O ATOM 546 CB CYS A 597 7.769 7.859 2.429 1.00 0.00 C ATOM 547 SG CYS A 597 7.992 7.108 0.782 1.00 0.00 S ATOM 0 H CYS A 597 7.129 5.824 4.119 1.00 0.00 H new ATOM 0 HA CYS A 597 9.619 7.137 3.240 1.00 0.00 H new ATOM 0 HB2 CYS A 597 6.711 7.822 2.690 1.00 0.00 H new ATOM 0 HB3 CYS A 597 8.047 8.911 2.374 1.00 0.00 H new ATOM 552 N LYS A 598 9.047 9.205 4.766 1.00 0.00 N ATOM 553 CA LYS A 598 8.990 10.171 5.842 1.00 0.00 C ATOM 554 C LYS A 598 7.559 10.455 6.285 1.00 0.00 C ATOM 555 O LYS A 598 6.606 10.219 5.525 1.00 0.00 O ATOM 556 CB LYS A 598 9.653 11.476 5.408 1.00 0.00 C ATOM 557 CG LYS A 598 11.150 11.428 5.380 1.00 0.00 C ATOM 558 CD LYS A 598 11.721 11.143 6.756 1.00 0.00 C ATOM 559 CE LYS A 598 13.237 11.161 6.756 1.00 0.00 C ATOM 560 NZ LYS A 598 13.776 10.995 8.123 1.00 0.00 N ATOM 0 H LYS A 598 9.570 9.536 3.955 1.00 0.00 H new ATOM 0 HA LYS A 598 9.524 9.742 6.689 1.00 0.00 H new ATOM 0 HB2 LYS A 598 9.291 11.741 4.414 1.00 0.00 H new ATOM 0 HB3 LYS A 598 9.339 12.271 6.084 1.00 0.00 H new ATOM 0 HG2 LYS A 598 11.478 10.658 4.682 1.00 0.00 H new ATOM 0 HG3 LYS A 598 11.539 12.378 5.013 1.00 0.00 H new ATOM 0 HD2 LYS A 598 11.350 11.884 7.463 1.00 0.00 H new ATOM 0 HD3 LYS A 598 11.370 10.170 7.100 1.00 0.00 H new ATOM 0 HE2 LYS A 598 13.612 10.363 6.115 1.00 0.00 H new ATOM 0 HE3 LYS A 598 13.592 12.102 6.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 598 14.815 11.011 8.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 598 13.436 11.771 8.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 598 13.456 10.086 8.514 1.00 0.00 H new ATOM 574 N PRO A 599 7.388 10.986 7.497 1.00 0.00 N ATOM 575 CA PRO A 599 6.080 11.290 8.021 1.00 0.00 C ATOM 576 C PRO A 599 5.486 12.454 7.248 1.00 0.00 C ATOM 577 O PRO A 599 5.990 13.591 7.307 1.00 0.00 O ATOM 578 CB PRO A 599 6.314 11.654 9.494 1.00 0.00 C ATOM 579 CG PRO A 599 7.782 11.902 9.644 1.00 0.00 C ATOM 580 CD PRO A 599 8.469 11.394 8.402 1.00 0.00 C ATOM 0 HA PRO A 599 5.380 10.460 7.930 1.00 0.00 H new ATOM 0 HB2 PRO A 599 5.741 12.539 9.770 1.00 0.00 H new ATOM 0 HB3 PRO A 599 5.988 10.846 10.149 1.00 0.00 H new ATOM 0 HG2 PRO A 599 7.977 12.966 9.779 1.00 0.00 H new ATOM 0 HG3 PRO A 599 8.166 11.393 10.528 1.00 0.00 H new ATOM 0 HD2 PRO A 599 9.088 12.169 7.950 1.00 0.00 H new ATOM 0 HD3 PRO A 599 9.126 10.555 8.632 1.00 0.00 H new ATOM 588 N GLY A 600 4.496 12.158 6.470 1.00 0.00 N ATOM 589 CA GLY A 600 3.892 13.140 5.631 1.00 0.00 C ATOM 590 C GLY A 600 3.951 12.707 4.194 1.00 0.00 C ATOM 591 O GLY A 600 3.212 13.206 3.354 1.00 0.00 O ATOM 0 H GLY A 600 4.083 11.228 6.398 1.00 0.00 H new ATOM 0 HA2 GLY A 600 2.855 13.294 5.929 1.00 0.00 H new ATOM 0 HA3 GLY A 600 4.404 14.095 5.751 1.00 0.00 H new ATOM 595 N PHE A 601 4.813 11.749 3.910 1.00 0.00 N ATOM 596 CA PHE A 601 4.989 11.266 2.575 1.00 0.00 C ATOM 597 C PHE A 601 4.279 9.973 2.337 1.00 0.00 C ATOM 598 O PHE A 601 3.956 9.218 3.265 1.00 0.00 O ATOM 599 CB PHE A 601 6.455 11.099 2.237 1.00 0.00 C ATOM 600 CG PHE A 601 7.151 12.350 1.856 1.00 0.00 C ATOM 601 CD1 PHE A 601 7.407 13.342 2.775 1.00 0.00 C ATOM 602 CD2 PHE A 601 7.556 12.522 0.561 1.00 0.00 C ATOM 603 CE1 PHE A 601 8.063 14.491 2.403 1.00 0.00 C ATOM 604 CE2 PHE A 601 8.215 13.663 0.171 1.00 0.00 C ATOM 605 CZ PHE A 601 8.472 14.652 1.098 1.00 0.00 C ATOM 0 H PHE A 601 5.404 11.292 4.604 1.00 0.00 H new ATOM 0 HA PHE A 601 4.551 12.022 1.923 1.00 0.00 H new ATOM 0 HB2 PHE A 601 6.964 10.664 3.097 1.00 0.00 H new ATOM 0 HB3 PHE A 601 6.546 10.385 1.418 1.00 0.00 H new ATOM 0 HD1 PHE A 601 7.089 13.216 3.799 1.00 0.00 H new ATOM 0 HD2 PHE A 601 7.355 11.749 -0.166 1.00 0.00 H new ATOM 0 HE1 PHE A 601 8.257 15.265 3.131 1.00 0.00 H new ATOM 0 HE2 PHE A 601 8.530 13.785 -0.855 1.00 0.00 H new ATOM 0 HZ PHE A 601 8.993 15.550 0.801 1.00 0.00 H new ATOM 615 N THR A 602 4.030 9.740 1.112 1.00 0.00 N ATOM 616 CA THR A 602 3.433 8.561 0.645 1.00 0.00 C ATOM 617 C THR A 602 4.433 7.715 -0.104 1.00 0.00 C ATOM 618 O THR A 602 5.151 8.217 -0.972 1.00 0.00 O ATOM 619 CB THR A 602 2.273 8.914 -0.274 1.00 0.00 C ATOM 620 OG1 THR A 602 1.193 9.462 0.476 1.00 0.00 O ATOM 621 CG2 THR A 602 1.815 7.743 -1.139 1.00 0.00 C ATOM 0 H THR A 602 4.249 10.403 0.369 1.00 0.00 H new ATOM 0 HA THR A 602 3.070 7.990 1.500 1.00 0.00 H new ATOM 0 HB THR A 602 2.637 9.671 -0.968 1.00 0.00 H new ATOM 0 HG1 THR A 602 1.106 10.417 0.275 1.00 0.00 H new ATOM 0 HG21 THR A 602 0.986 8.060 -1.771 1.00 0.00 H new ATOM 0 HG22 THR A 602 2.642 7.408 -1.766 1.00 0.00 H new ATOM 0 HG23 THR A 602 1.490 6.923 -0.499 1.00 0.00 H new ATOM 629 N ILE A 603 4.487 6.468 0.246 1.00 0.00 N ATOM 630 CA ILE A 603 5.282 5.533 -0.471 1.00 0.00 C ATOM 631 C ILE A 603 4.461 4.996 -1.657 1.00 0.00 C ATOM 632 O ILE A 603 3.338 4.498 -1.488 1.00 0.00 O ATOM 633 CB ILE A 603 5.794 4.379 0.440 1.00 0.00 C ATOM 634 CG1 ILE A 603 6.640 3.410 -0.381 1.00 0.00 C ATOM 635 CG2 ILE A 603 4.642 3.674 1.164 1.00 0.00 C ATOM 636 CD1 ILE A 603 7.218 2.268 0.408 1.00 0.00 C ATOM 0 H ILE A 603 3.979 6.074 1.038 1.00 0.00 H new ATOM 0 HA ILE A 603 6.174 6.038 -0.843 1.00 0.00 H new ATOM 0 HB ILE A 603 6.425 4.803 1.221 1.00 0.00 H new ATOM 0 HG12 ILE A 603 6.028 3.006 -1.187 1.00 0.00 H new ATOM 0 HG13 ILE A 603 7.455 3.963 -0.847 1.00 0.00 H new ATOM 0 HG21 ILE A 603 5.040 2.875 1.790 1.00 0.00 H new ATOM 0 HG22 ILE A 603 4.110 4.393 1.788 1.00 0.00 H new ATOM 0 HG23 ILE A 603 3.955 3.252 0.430 1.00 0.00 H new ATOM 0 HD11 ILE A 603 7.804 1.629 -0.253 1.00 0.00 H new ATOM 0 HD12 ILE A 603 7.860 2.659 1.198 1.00 0.00 H new ATOM 0 HD13 ILE A 603 6.410 1.687 0.852 1.00 0.00 H new ATOM 643 N VAL A 604 4.980 5.172 -2.836 1.00 0.00 N ATOM 644 CA VAL A 604 4.305 4.736 -4.043 1.00 0.00 C ATOM 645 C VAL A 604 5.097 3.605 -4.668 1.00 0.00 C ATOM 646 O VAL A 604 6.315 3.736 -4.879 1.00 0.00 O ATOM 647 CB VAL A 604 4.153 5.900 -5.070 1.00 0.00 C ATOM 648 CG1 VAL A 604 3.396 5.452 -6.318 1.00 0.00 C ATOM 649 CG2 VAL A 604 3.459 7.092 -4.433 1.00 0.00 C ATOM 0 H VAL A 604 5.882 5.620 -2.998 1.00 0.00 H new ATOM 0 HA VAL A 604 3.304 4.398 -3.775 1.00 0.00 H new ATOM 0 HB VAL A 604 5.156 6.199 -5.375 1.00 0.00 H new ATOM 0 HG11 VAL A 604 3.309 6.289 -7.011 1.00 0.00 H new ATOM 0 HG12 VAL A 604 3.937 4.637 -6.799 1.00 0.00 H new ATOM 0 HG13 VAL A 604 2.400 5.110 -6.036 1.00 0.00 H new ATOM 0 HG21 VAL A 604 3.363 7.892 -5.167 1.00 0.00 H new ATOM 0 HG22 VAL A 604 2.468 6.795 -4.089 1.00 0.00 H new ATOM 0 HG23 VAL A 604 4.047 7.445 -3.586 1.00 0.00 H new ATOM 653 N GLY A 605 4.431 2.511 -4.937 1.00 0.00 N ATOM 654 CA GLY A 605 5.070 1.368 -5.513 1.00 0.00 C ATOM 655 C GLY A 605 5.093 0.219 -4.538 1.00 0.00 C ATOM 656 O GLY A 605 4.385 0.262 -3.530 1.00 0.00 O ATOM 0 H GLY A 605 3.433 2.393 -4.761 1.00 0.00 H new ATOM 0 HA2 GLY A 605 4.544 1.070 -6.420 1.00 0.00 H new ATOM 0 HA3 GLY A 605 6.089 1.624 -5.805 1.00 0.00 H new ATOM 660 N PRO A 606 5.888 -0.822 -4.806 1.00 0.00 N ATOM 661 CA PRO A 606 6.026 -1.978 -3.905 1.00 0.00 C ATOM 662 C PRO A 606 6.642 -1.557 -2.577 1.00 0.00 C ATOM 663 O PRO A 606 7.701 -0.919 -2.543 1.00 0.00 O ATOM 664 CB PRO A 606 6.991 -2.897 -4.659 1.00 0.00 C ATOM 665 CG PRO A 606 7.720 -1.984 -5.578 1.00 0.00 C ATOM 666 CD PRO A 606 6.722 -0.968 -6.005 1.00 0.00 C ATOM 0 HA PRO A 606 5.071 -2.447 -3.669 1.00 0.00 H new ATOM 0 HB2 PRO A 606 7.674 -3.404 -3.977 1.00 0.00 H new ATOM 0 HB3 PRO A 606 6.456 -3.672 -5.209 1.00 0.00 H new ATOM 0 HG2 PRO A 606 8.566 -1.515 -5.076 1.00 0.00 H new ATOM 0 HG3 PRO A 606 8.119 -2.527 -6.435 1.00 0.00 H new ATOM 0 HD2 PRO A 606 7.195 -0.028 -6.288 1.00 0.00 H new ATOM 0 HD3 PRO A 606 6.142 -1.304 -6.865 1.00 0.00 H new ATOM 674 N ASN A 607 5.993 -1.881 -1.495 1.00 0.00 N ATOM 675 CA ASN A 607 6.495 -1.458 -0.207 1.00 0.00 C ATOM 676 C ASN A 607 7.509 -2.447 0.324 1.00 0.00 C ATOM 677 O ASN A 607 8.505 -2.057 0.897 1.00 0.00 O ATOM 678 CB ASN A 607 5.374 -1.212 0.827 1.00 0.00 C ATOM 679 CG ASN A 607 4.242 -0.295 0.347 1.00 0.00 C ATOM 680 OD1 ASN A 607 3.102 -0.416 0.793 1.00 0.00 O ATOM 681 ND2 ASN A 607 4.524 0.593 -0.573 1.00 0.00 N ATOM 0 H ASN A 607 5.131 -2.426 -1.471 1.00 0.00 H new ATOM 0 HA ASN A 607 6.986 -0.498 -0.365 1.00 0.00 H new ATOM 0 HB2 ASN A 607 4.947 -2.173 1.113 1.00 0.00 H new ATOM 0 HB3 ASN A 607 5.816 -0.780 1.725 1.00 0.00 H new ATOM 0 HD21 ASN A 607 3.791 1.203 -0.935 1.00 0.00 H new ATOM 0 HD22 ASN A 607 5.477 0.675 -0.928 1.00 0.00 H new ATOM 688 N SER A 608 7.278 -3.719 0.113 1.00 0.00 N ATOM 689 CA SER A 608 8.204 -4.722 0.575 1.00 0.00 C ATOM 690 C SER A 608 8.841 -5.453 -0.594 1.00 0.00 C ATOM 691 O SER A 608 8.163 -6.164 -1.347 1.00 0.00 O ATOM 692 CB SER A 608 7.511 -5.686 1.546 1.00 0.00 C ATOM 693 OG SER A 608 6.320 -6.240 0.999 1.00 0.00 O ATOM 0 H SER A 608 6.459 -4.083 -0.374 1.00 0.00 H new ATOM 0 HA SER A 608 9.009 -4.229 1.120 1.00 0.00 H new ATOM 0 HB2 SER A 608 8.197 -6.492 1.807 1.00 0.00 H new ATOM 0 HB3 SER A 608 7.273 -5.159 2.470 1.00 0.00 H new ATOM 0 HG SER A 608 6.453 -6.425 0.046 1.00 0.00 H new ATOM 699 N VAL A 609 10.111 -5.239 -0.793 1.00 0.00 N ATOM 700 CA VAL A 609 10.816 -5.939 -1.838 1.00 0.00 C ATOM 701 C VAL A 609 11.671 -7.016 -1.197 1.00 0.00 C ATOM 702 O VAL A 609 12.025 -6.911 -0.023 1.00 0.00 O ATOM 703 CB VAL A 609 11.706 -5.000 -2.714 1.00 0.00 C ATOM 704 CG1 VAL A 609 10.893 -3.841 -3.278 1.00 0.00 C ATOM 705 CG2 VAL A 609 12.932 -4.498 -1.960 1.00 0.00 C ATOM 0 H VAL A 609 10.680 -4.589 -0.250 1.00 0.00 H new ATOM 0 HA VAL A 609 10.076 -6.371 -2.512 1.00 0.00 H new ATOM 0 HB VAL A 609 12.071 -5.597 -3.550 1.00 0.00 H new ATOM 0 HG11 VAL A 609 11.538 -3.204 -3.883 1.00 0.00 H new ATOM 0 HG12 VAL A 609 10.085 -4.231 -3.897 1.00 0.00 H new ATOM 0 HG13 VAL A 609 10.474 -3.258 -2.458 1.00 0.00 H new ATOM 0 HG21 VAL A 609 13.519 -3.849 -2.610 1.00 0.00 H new ATOM 0 HG22 VAL A 609 12.614 -3.938 -1.080 1.00 0.00 H new ATOM 0 HG23 VAL A 609 13.541 -5.347 -1.649 1.00 0.00 H new ATOM 709 N GLN A 610 11.960 -8.053 -1.920 1.00 0.00 N ATOM 710 CA GLN A 610 12.809 -9.102 -1.405 1.00 0.00 C ATOM 711 C GLN A 610 14.187 -8.902 -1.924 1.00 0.00 C ATOM 712 O GLN A 610 14.382 -8.366 -3.023 1.00 0.00 O ATOM 713 CB GLN A 610 12.362 -10.515 -1.837 1.00 0.00 C ATOM 714 CG GLN A 610 11.407 -11.279 -0.922 1.00 0.00 C ATOM 715 CD GLN A 610 9.935 -10.809 -0.872 1.00 0.00 C ATOM 716 OE1 GLN A 610 9.041 -11.619 -0.679 1.00 0.00 O ATOM 717 NE2 GLN A 610 9.672 -9.537 -0.995 1.00 0.00 N ATOM 0 H GLN A 610 11.624 -8.203 -2.871 1.00 0.00 H new ATOM 0 HA GLN A 610 12.754 -9.042 -0.318 1.00 0.00 H new ATOM 0 HB2 GLN A 610 11.890 -10.431 -2.816 1.00 0.00 H new ATOM 0 HB3 GLN A 610 13.257 -11.123 -1.966 1.00 0.00 H new ATOM 0 HG2 GLN A 610 11.415 -12.326 -1.226 1.00 0.00 H new ATOM 0 HG3 GLN A 610 11.807 -11.238 0.091 1.00 0.00 H new ATOM 0 HE21 GLN A 610 10.429 -8.873 -1.156 1.00 0.00 H new ATOM 0 HE22 GLN A 610 8.709 -9.207 -0.930 1.00 0.00 H new ATOM 726 N CYS A 611 15.128 -9.274 -1.148 1.00 0.00 N ATOM 727 CA CYS A 611 16.462 -9.319 -1.628 1.00 0.00 C ATOM 728 C CYS A 611 16.665 -10.620 -2.348 1.00 0.00 C ATOM 729 O CYS A 611 16.398 -11.680 -1.796 1.00 0.00 O ATOM 730 CB CYS A 611 17.471 -9.191 -0.507 1.00 0.00 C ATOM 731 SG CYS A 611 19.173 -9.510 -1.052 1.00 0.00 S ATOM 0 H CYS A 611 15.006 -9.554 -0.175 1.00 0.00 H new ATOM 0 HA CYS A 611 16.618 -8.476 -2.301 1.00 0.00 H new ATOM 0 HB2 CYS A 611 17.412 -8.188 -0.084 1.00 0.00 H new ATOM 0 HB3 CYS A 611 17.213 -9.889 0.290 1.00 0.00 H new ATOM 736 N TYR A 612 17.077 -10.554 -3.562 1.00 0.00 N ATOM 737 CA TYR A 612 17.354 -11.729 -4.318 1.00 0.00 C ATOM 738 C TYR A 612 18.847 -11.813 -4.532 1.00 0.00 C ATOM 739 O TYR A 612 19.559 -10.854 -4.267 1.00 0.00 O ATOM 740 CB TYR A 612 16.635 -11.682 -5.657 1.00 0.00 C ATOM 741 CG TYR A 612 15.136 -11.796 -5.548 1.00 0.00 C ATOM 742 CD1 TYR A 612 14.528 -13.033 -5.569 1.00 0.00 C ATOM 743 CD2 TYR A 612 14.334 -10.679 -5.415 1.00 0.00 C ATOM 744 CE1 TYR A 612 13.168 -13.158 -5.457 1.00 0.00 C ATOM 745 CE2 TYR A 612 12.968 -10.797 -5.307 1.00 0.00 C ATOM 746 CZ TYR A 612 12.391 -12.038 -5.327 1.00 0.00 C ATOM 747 OH TYR A 612 11.027 -12.161 -5.204 1.00 0.00 O ATOM 0 H TYR A 612 17.234 -9.681 -4.065 1.00 0.00 H new ATOM 0 HA TYR A 612 17.001 -12.608 -3.778 1.00 0.00 H new ATOM 0 HB2 TYR A 612 16.883 -10.747 -6.159 1.00 0.00 H new ATOM 0 HB3 TYR A 612 17.007 -12.490 -6.287 1.00 0.00 H new ATOM 0 HD1 TYR A 612 15.135 -13.920 -5.676 1.00 0.00 H new ATOM 0 HD2 TYR A 612 14.786 -9.699 -5.396 1.00 0.00 H new ATOM 0 HE1 TYR A 612 12.711 -14.136 -5.471 1.00 0.00 H new ATOM 0 HE2 TYR A 612 12.353 -9.915 -5.207 1.00 0.00 H new ATOM 0 HH TYR A 612 10.625 -11.271 -5.120 1.00 0.00 H new ATOM 757 N HIS A 613 19.328 -12.916 -5.071 1.00 0.00 N ATOM 758 CA HIS A 613 20.781 -13.087 -5.281 1.00 0.00 C ATOM 759 C HIS A 613 21.328 -12.265 -6.459 1.00 0.00 C ATOM 760 O HIS A 613 22.476 -12.418 -6.850 1.00 0.00 O ATOM 761 CB HIS A 613 21.214 -14.575 -5.370 1.00 0.00 C ATOM 762 CG HIS A 613 20.529 -15.412 -6.419 1.00 0.00 C ATOM 763 ND1 HIS A 613 20.140 -16.704 -6.193 1.00 0.00 N ATOM 764 CD2 HIS A 613 20.188 -15.146 -7.699 1.00 0.00 C ATOM 765 CE1 HIS A 613 19.587 -17.195 -7.275 1.00 0.00 C ATOM 766 NE2 HIS A 613 19.601 -16.270 -8.205 1.00 0.00 N ATOM 0 H HIS A 613 18.757 -13.705 -5.373 1.00 0.00 H new ATOM 0 HA HIS A 613 21.241 -12.680 -4.381 1.00 0.00 H new ATOM 0 HB2 HIS A 613 22.288 -14.608 -5.555 1.00 0.00 H new ATOM 0 HB3 HIS A 613 21.044 -15.039 -4.398 1.00 0.00 H new ATOM 0 HD2 HIS A 613 20.350 -14.216 -8.225 1.00 0.00 H new ATOM 0 HE1 HIS A 613 19.187 -18.193 -7.383 1.00 0.00 H new ATOM 0 HE2 HIS A 613 19.234 -16.373 -9.151 1.00 0.00 H new ATOM 775 N PHE A 614 20.497 -11.421 -7.025 1.00 0.00 N ATOM 776 CA PHE A 614 20.931 -10.502 -8.054 1.00 0.00 C ATOM 777 C PHE A 614 20.741 -9.077 -7.572 1.00 0.00 C ATOM 778 O PHE A 614 21.208 -8.122 -8.199 1.00 0.00 O ATOM 779 CB PHE A 614 20.194 -10.732 -9.384 1.00 0.00 C ATOM 780 CG PHE A 614 18.715 -10.504 -9.341 1.00 0.00 C ATOM 781 CD1 PHE A 614 18.189 -9.257 -9.608 1.00 0.00 C ATOM 782 CD2 PHE A 614 17.859 -11.536 -9.052 1.00 0.00 C ATOM 783 CE1 PHE A 614 16.839 -9.045 -9.584 1.00 0.00 C ATOM 784 CE2 PHE A 614 16.507 -11.338 -9.024 1.00 0.00 C ATOM 785 CZ PHE A 614 15.988 -10.090 -9.291 1.00 0.00 C ATOM 0 H PHE A 614 19.507 -11.351 -6.788 1.00 0.00 H new ATOM 0 HA PHE A 614 21.989 -10.683 -8.246 1.00 0.00 H new ATOM 0 HB2 PHE A 614 20.625 -10.074 -10.138 1.00 0.00 H new ATOM 0 HB3 PHE A 614 20.378 -11.755 -9.711 1.00 0.00 H new ATOM 0 HD1 PHE A 614 18.853 -8.437 -9.839 1.00 0.00 H new ATOM 0 HD2 PHE A 614 18.258 -12.518 -8.844 1.00 0.00 H new ATOM 0 HE1 PHE A 614 16.440 -8.063 -9.794 1.00 0.00 H new ATOM 0 HE2 PHE A 614 15.846 -12.160 -8.793 1.00 0.00 H new ATOM 0 HZ PHE A 614 14.920 -9.931 -9.271 1.00 0.00 H new ATOM 795 N GLY A 615 20.074 -8.944 -6.449 1.00 0.00 N ATOM 796 CA GLY A 615 19.761 -7.662 -5.911 1.00 0.00 C ATOM 797 C GLY A 615 18.318 -7.602 -5.495 1.00 0.00 C ATOM 798 O GLY A 615 17.617 -8.616 -5.549 1.00 0.00 O ATOM 0 H GLY A 615 19.738 -9.728 -5.891 1.00 0.00 H new ATOM 0 HA2 GLY A 615 20.401 -7.455 -5.054 1.00 0.00 H new ATOM 0 HA3 GLY A 615 19.964 -6.890 -6.654 1.00 0.00 H new ATOM 802 N LEU A 616 17.876 -6.445 -5.091 1.00 0.00 N ATOM 803 CA LEU A 616 16.514 -6.233 -4.646 1.00 0.00 C ATOM 804 C LEU A 616 15.541 -6.299 -5.800 1.00 0.00 C ATOM 805 O LEU A 616 15.816 -5.769 -6.896 1.00 0.00 O ATOM 806 CB LEU A 616 16.375 -4.867 -3.989 1.00 0.00 C ATOM 807 CG LEU A 616 17.177 -4.637 -2.726 1.00 0.00 C ATOM 808 CD1 LEU A 616 16.935 -3.235 -2.221 1.00 0.00 C ATOM 809 CD2 LEU A 616 16.804 -5.662 -1.681 1.00 0.00 C ATOM 0 H LEU A 616 18.455 -5.606 -5.058 1.00 0.00 H new ATOM 0 HA LEU A 616 16.285 -7.024 -3.931 1.00 0.00 H new ATOM 0 HB2 LEU A 616 16.661 -4.108 -4.717 1.00 0.00 H new ATOM 0 HB3 LEU A 616 15.322 -4.706 -3.758 1.00 0.00 H new ATOM 0 HG LEU A 616 18.239 -4.748 -2.944 1.00 0.00 H new ATOM 0 HD11 LEU A 616 17.513 -3.071 -1.312 1.00 0.00 H new ATOM 0 HD12 LEU A 616 17.242 -2.516 -2.981 1.00 0.00 H new ATOM 0 HD13 LEU A 616 15.875 -3.104 -2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 616 17.387 -5.488 -0.776 1.00 0.00 H new ATOM 0 HD22 LEU A 616 15.742 -5.577 -1.451 1.00 0.00 H new ATOM 0 HD23 LEU A 616 17.014 -6.662 -2.061 1.00 0.00 H new ATOM 821 N SER A 617 14.428 -6.929 -5.567 1.00 0.00 N ATOM 822 CA SER A 617 13.380 -7.010 -6.527 1.00 0.00 C ATOM 823 C SER A 617 12.042 -7.169 -5.794 1.00 0.00 C ATOM 824 O SER A 617 11.969 -7.836 -4.748 1.00 0.00 O ATOM 825 CB SER A 617 13.648 -8.133 -7.539 1.00 0.00 C ATOM 826 OG SER A 617 12.615 -8.271 -8.493 1.00 0.00 O ATOM 0 H SER A 617 14.225 -7.407 -4.689 1.00 0.00 H new ATOM 0 HA SER A 617 13.335 -6.090 -7.110 1.00 0.00 H new ATOM 0 HB2 SER A 617 14.588 -7.934 -8.054 1.00 0.00 H new ATOM 0 HB3 SER A 617 13.771 -9.075 -7.005 1.00 0.00 H new ATOM 0 HG SER A 617 12.837 -8.997 -9.113 1.00 0.00 H new ATOM 832 N PRO A 618 10.978 -6.522 -6.287 1.00 0.00 N ATOM 833 CA PRO A 618 11.036 -5.684 -7.499 1.00 0.00 C ATOM 834 C PRO A 618 11.770 -4.343 -7.277 1.00 0.00 C ATOM 835 O PRO A 618 12.404 -4.131 -6.238 1.00 0.00 O ATOM 836 CB PRO A 618 9.569 -5.452 -7.832 1.00 0.00 C ATOM 837 CG PRO A 618 8.862 -5.555 -6.526 1.00 0.00 C ATOM 838 CD PRO A 618 9.627 -6.557 -5.710 1.00 0.00 C ATOM 0 HA PRO A 618 11.600 -6.167 -8.297 1.00 0.00 H new ATOM 0 HB2 PRO A 618 9.417 -4.474 -8.288 1.00 0.00 H new ATOM 0 HB3 PRO A 618 9.202 -6.195 -8.540 1.00 0.00 H new ATOM 0 HG2 PRO A 618 8.830 -4.588 -6.024 1.00 0.00 H new ATOM 0 HG3 PRO A 618 7.830 -5.875 -6.667 1.00 0.00 H new ATOM 0 HD2 PRO A 618 9.636 -6.289 -4.654 1.00 0.00 H new ATOM 0 HD3 PRO A 618 9.187 -7.552 -5.783 1.00 0.00 H new ATOM 846 N ASP A 619 11.716 -3.477 -8.272 1.00 0.00 N ATOM 847 CA ASP A 619 12.357 -2.162 -8.184 1.00 0.00 C ATOM 848 C ASP A 619 11.740 -1.319 -7.071 1.00 0.00 C ATOM 849 O ASP A 619 10.561 -1.467 -6.738 1.00 0.00 O ATOM 850 CB ASP A 619 12.357 -1.405 -9.530 1.00 0.00 C ATOM 851 CG ASP A 619 10.993 -0.955 -10.000 1.00 0.00 C ATOM 852 OD1 ASP A 619 10.232 -1.794 -10.536 1.00 0.00 O ATOM 853 OD2 ASP A 619 10.673 0.245 -9.883 1.00 0.00 O ATOM 0 H ASP A 619 11.236 -3.653 -9.155 1.00 0.00 H new ATOM 0 HA ASP A 619 13.402 -2.342 -7.932 1.00 0.00 H new ATOM 0 HB2 ASP A 619 13.002 -0.531 -9.440 1.00 0.00 H new ATOM 0 HB3 ASP A 619 12.796 -2.048 -10.293 1.00 0.00 H new ATOM 858 N LEU A 620 12.551 -0.441 -6.537 1.00 0.00 N ATOM 859 CA LEU A 620 12.261 0.344 -5.341 1.00 0.00 C ATOM 860 C LEU A 620 11.139 1.362 -5.511 1.00 0.00 C ATOM 861 O LEU A 620 10.957 1.952 -6.574 1.00 0.00 O ATOM 862 CB LEU A 620 13.541 1.038 -4.831 1.00 0.00 C ATOM 863 CG LEU A 620 14.664 0.124 -4.293 1.00 0.00 C ATOM 864 CD1 LEU A 620 15.386 -0.644 -5.395 1.00 0.00 C ATOM 865 CD2 LEU A 620 15.635 0.927 -3.485 1.00 0.00 C ATOM 0 H LEU A 620 13.470 -0.238 -6.931 1.00 0.00 H new ATOM 0 HA LEU A 620 11.901 -0.371 -4.601 1.00 0.00 H new ATOM 0 HB2 LEU A 620 13.951 1.635 -5.646 1.00 0.00 H new ATOM 0 HB3 LEU A 620 13.259 1.731 -4.038 1.00 0.00 H new ATOM 0 HG LEU A 620 14.191 -0.624 -3.657 1.00 0.00 H new ATOM 0 HD11 LEU A 620 16.163 -1.268 -4.954 1.00 0.00 H new ATOM 0 HD12 LEU A 620 14.673 -1.274 -5.927 1.00 0.00 H new ATOM 0 HD13 LEU A 620 15.839 0.060 -6.093 1.00 0.00 H new ATOM 0 HD21 LEU A 620 16.423 0.274 -3.110 1.00 0.00 H new ATOM 0 HD22 LEU A 620 16.074 1.704 -4.111 1.00 0.00 H new ATOM 0 HD23 LEU A 620 15.115 1.388 -2.645 1.00 0.00 H new ATOM 877 N PRO A 621 10.368 1.562 -4.443 1.00 0.00 N ATOM 878 CA PRO A 621 9.280 2.541 -4.392 1.00 0.00 C ATOM 879 C PRO A 621 9.804 3.985 -4.395 1.00 0.00 C ATOM 880 O PRO A 621 11.025 4.224 -4.339 1.00 0.00 O ATOM 881 CB PRO A 621 8.632 2.258 -3.036 1.00 0.00 C ATOM 882 CG PRO A 621 9.696 1.631 -2.234 1.00 0.00 C ATOM 883 CD PRO A 621 10.485 0.817 -3.187 1.00 0.00 C ATOM 0 HA PRO A 621 8.613 2.454 -5.250 1.00 0.00 H new ATOM 0 HB2 PRO A 621 8.274 3.176 -2.570 1.00 0.00 H new ATOM 0 HB3 PRO A 621 7.772 1.596 -3.139 1.00 0.00 H new ATOM 0 HG2 PRO A 621 10.319 2.384 -1.752 1.00 0.00 H new ATOM 0 HG3 PRO A 621 9.276 1.011 -1.442 1.00 0.00 H new ATOM 0 HD2 PRO A 621 11.524 0.722 -2.871 1.00 0.00 H new ATOM 0 HD3 PRO A 621 10.086 -0.193 -3.280 1.00 0.00 H new ATOM 891 N ILE A 622 8.901 4.925 -4.449 1.00 0.00 N ATOM 892 CA ILE A 622 9.247 6.337 -4.397 1.00 0.00 C ATOM 893 C ILE A 622 8.425 7.011 -3.301 1.00 0.00 C ATOM 894 O ILE A 622 7.520 6.385 -2.732 1.00 0.00 O ATOM 895 CB ILE A 622 8.971 7.081 -5.732 1.00 0.00 C ATOM 896 CG1 ILE A 622 7.473 7.063 -6.064 1.00 0.00 C ATOM 897 CG2 ILE A 622 9.794 6.485 -6.875 1.00 0.00 C ATOM 898 CD1 ILE A 622 7.082 8.039 -7.148 1.00 0.00 C ATOM 0 H ILE A 622 7.901 4.744 -4.530 1.00 0.00 H new ATOM 0 HA ILE A 622 10.317 6.393 -4.198 1.00 0.00 H new ATOM 0 HB ILE A 622 9.278 8.120 -5.609 1.00 0.00 H new ATOM 0 HG12 ILE A 622 7.190 6.057 -6.373 1.00 0.00 H new ATOM 0 HG13 ILE A 622 6.907 7.290 -5.161 1.00 0.00 H new ATOM 0 HG21 ILE A 622 9.581 7.025 -7.797 1.00 0.00 H new ATOM 0 HG22 ILE A 622 10.855 6.570 -6.642 1.00 0.00 H new ATOM 0 HG23 ILE A 622 9.533 5.434 -7.002 1.00 0.00 H new ATOM 0 HD11 ILE A 622 6.009 7.971 -7.329 1.00 0.00 H new ATOM 0 HD12 ILE A 622 7.333 9.052 -6.833 1.00 0.00 H new ATOM 0 HD13 ILE A 622 7.621 7.800 -8.065 1.00 0.00 H new ATOM 905 N CYS A 623 8.706 8.266 -3.043 1.00 0.00 N ATOM 906 CA CYS A 623 8.001 9.023 -2.032 1.00 0.00 C ATOM 907 C CYS A 623 7.345 10.262 -2.620 1.00 0.00 C ATOM 908 O CYS A 623 8.009 11.102 -3.229 1.00 0.00 O ATOM 909 CB CYS A 623 8.952 9.432 -0.924 1.00 0.00 C ATOM 910 SG CYS A 623 9.633 8.039 0.027 1.00 0.00 S ATOM 0 H CYS A 623 9.431 8.794 -3.528 1.00 0.00 H new ATOM 0 HA CYS A 623 7.220 8.381 -1.626 1.00 0.00 H new ATOM 0 HB2 CYS A 623 9.776 9.998 -1.358 1.00 0.00 H new ATOM 0 HB3 CYS A 623 8.430 10.102 -0.241 1.00 0.00 H new ATOM 915 N LYS A 624 6.052 10.354 -2.455 1.00 0.00 N ATOM 916 CA LYS A 624 5.276 11.506 -2.884 1.00 0.00 C ATOM 917 C LYS A 624 4.615 12.110 -1.679 1.00 0.00 C ATOM 918 O LYS A 624 3.946 11.417 -0.942 1.00 0.00 O ATOM 919 CB LYS A 624 4.188 11.105 -3.876 1.00 0.00 C ATOM 920 CG LYS A 624 4.683 10.643 -5.233 1.00 0.00 C ATOM 921 CD LYS A 624 3.517 10.363 -6.169 1.00 0.00 C ATOM 922 CE LYS A 624 2.672 11.612 -6.408 1.00 0.00 C ATOM 923 NZ LYS A 624 1.511 11.347 -7.284 1.00 0.00 N ATOM 0 H LYS A 624 5.493 9.624 -2.013 1.00 0.00 H new ATOM 0 HA LYS A 624 5.948 12.214 -3.369 1.00 0.00 H new ATOM 0 HB2 LYS A 624 3.593 10.306 -3.434 1.00 0.00 H new ATOM 0 HB3 LYS A 624 3.521 11.955 -4.021 1.00 0.00 H new ATOM 0 HG2 LYS A 624 5.329 11.406 -5.668 1.00 0.00 H new ATOM 0 HG3 LYS A 624 5.286 9.743 -5.117 1.00 0.00 H new ATOM 0 HD2 LYS A 624 3.896 9.992 -7.121 1.00 0.00 H new ATOM 0 HD3 LYS A 624 2.892 9.576 -5.747 1.00 0.00 H new ATOM 0 HE2 LYS A 624 2.321 11.999 -5.451 1.00 0.00 H new ATOM 0 HE3 LYS A 624 3.293 12.387 -6.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 624 1.641 11.838 -8.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 624 1.430 10.324 -7.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 624 0.644 11.692 -6.825 1.00 0.00 H new ATOM 937 N GLU A 625 4.812 13.367 -1.453 1.00 0.00 N ATOM 938 CA GLU A 625 4.203 14.011 -0.312 1.00 0.00 C ATOM 939 C GLU A 625 2.770 14.409 -0.650 1.00 0.00 C ATOM 940 O GLU A 625 1.852 14.260 0.158 1.00 0.00 O ATOM 941 CB GLU A 625 4.995 15.246 0.102 1.00 0.00 C ATOM 942 CG GLU A 625 4.606 15.779 1.459 1.00 0.00 C ATOM 943 CD GLU A 625 5.113 17.171 1.714 1.00 0.00 C ATOM 944 OE1 GLU A 625 4.711 18.111 0.989 1.00 0.00 O ATOM 945 OE2 GLU A 625 5.887 17.366 2.667 1.00 0.00 O ATOM 0 H GLU A 625 5.387 13.976 -2.035 1.00 0.00 H new ATOM 0 HA GLU A 625 4.201 13.307 0.520 1.00 0.00 H new ATOM 0 HB2 GLU A 625 6.058 15.003 0.106 1.00 0.00 H new ATOM 0 HB3 GLU A 625 4.850 16.028 -0.643 1.00 0.00 H new ATOM 0 HG2 GLU A 625 3.520 15.773 1.547 1.00 0.00 H new ATOM 0 HG3 GLU A 625 4.992 15.111 2.229 1.00 0.00 H new ATOM 952 N GLN A 626 2.585 14.883 -1.844 1.00 0.00 N ATOM 953 CA GLN A 626 1.291 15.349 -2.289 1.00 0.00 C ATOM 954 C GLN A 626 0.638 14.323 -3.167 1.00 0.00 C ATOM 955 O GLN A 626 0.965 14.173 -4.354 1.00 0.00 O ATOM 956 CB GLN A 626 1.390 16.710 -2.967 1.00 0.00 C ATOM 957 CG GLN A 626 1.787 17.825 -2.040 1.00 0.00 C ATOM 958 CD GLN A 626 0.784 18.012 -0.955 1.00 0.00 C ATOM 959 OE1 GLN A 626 -0.157 18.795 -1.087 1.00 0.00 O ATOM 960 NE2 GLN A 626 0.946 17.296 0.101 1.00 0.00 N ATOM 0 H GLN A 626 3.323 14.961 -2.544 1.00 0.00 H new ATOM 0 HA GLN A 626 0.655 15.486 -1.414 1.00 0.00 H new ATOM 0 HB2 GLN A 626 2.116 16.649 -3.778 1.00 0.00 H new ATOM 0 HB3 GLN A 626 0.427 16.951 -3.418 1.00 0.00 H new ATOM 0 HG2 GLN A 626 2.762 17.608 -1.603 1.00 0.00 H new ATOM 0 HG3 GLN A 626 1.891 18.751 -2.606 1.00 0.00 H new ATOM 0 HE21 GLN A 626 1.740 16.660 0.169 1.00 0.00 H new ATOM 0 HE22 GLN A 626 0.280 17.364 0.871 1.00 0.00 H new ATOM 969 N VAL A 627 -0.253 13.603 -2.571 1.00 0.00 N ATOM 970 CA VAL A 627 -0.917 12.503 -3.203 1.00 0.00 C ATOM 971 C VAL A 627 -2.350 12.806 -3.531 1.00 0.00 C ATOM 972 O VAL A 627 -2.891 13.859 -3.153 1.00 0.00 O ATOM 973 CB VAL A 627 -0.823 11.230 -2.342 1.00 0.00 C ATOM 974 CG1 VAL A 627 0.571 10.701 -2.416 1.00 0.00 C ATOM 975 CG2 VAL A 627 -1.177 11.540 -0.890 1.00 0.00 C ATOM 0 H VAL A 627 -0.549 13.764 -1.608 1.00 0.00 H new ATOM 0 HA VAL A 627 -0.399 12.330 -4.146 1.00 0.00 H new ATOM 0 HB VAL A 627 -1.527 10.488 -2.718 1.00 0.00 H new ATOM 0 HG11 VAL A 627 0.650 9.799 -1.810 1.00 0.00 H new ATOM 0 HG12 VAL A 627 0.816 10.465 -3.452 1.00 0.00 H new ATOM 0 HG13 VAL A 627 1.266 11.452 -2.041 1.00 0.00 H new ATOM 0 HG21 VAL A 627 -1.105 10.629 -0.296 1.00 0.00 H new ATOM 0 HG22 VAL A 627 -0.484 12.285 -0.498 1.00 0.00 H new ATOM 0 HG23 VAL A 627 -2.194 11.928 -0.838 1.00 0.00 H new ATOM 979 N GLN A 628 -2.956 11.881 -4.212 1.00 0.00 N ATOM 980 CA GLN A 628 -4.301 12.008 -4.652 1.00 0.00 C ATOM 981 C GLN A 628 -5.182 11.259 -3.693 1.00 0.00 C ATOM 982 O GLN A 628 -4.792 10.204 -3.179 1.00 0.00 O ATOM 983 CB GLN A 628 -4.452 11.457 -6.064 1.00 0.00 C ATOM 984 CG GLN A 628 -3.465 12.058 -7.051 1.00 0.00 C ATOM 985 CD GLN A 628 -3.551 13.578 -7.172 1.00 0.00 C ATOM 986 OE1 GLN A 628 -2.543 14.246 -7.406 1.00 0.00 O ATOM 987 NE2 GLN A 628 -4.738 14.124 -7.073 1.00 0.00 N ATOM 0 H GLN A 628 -2.515 11.001 -4.480 1.00 0.00 H new ATOM 0 HA GLN A 628 -4.590 13.059 -4.675 1.00 0.00 H new ATOM 0 HB2 GLN A 628 -4.319 10.375 -6.041 1.00 0.00 H new ATOM 0 HB3 GLN A 628 -5.467 11.646 -6.414 1.00 0.00 H new ATOM 0 HG2 GLN A 628 -2.454 11.785 -6.749 1.00 0.00 H new ATOM 0 HG3 GLN A 628 -3.635 11.616 -8.033 1.00 0.00 H new ATOM 0 HE21 GLN A 628 -5.553 13.542 -6.878 1.00 0.00 H new ATOM 0 HE22 GLN A 628 -4.847 15.131 -7.191 1.00 0.00 H new ATOM 996 N SER A 629 -6.339 11.784 -3.458 1.00 0.00 N ATOM 997 CA SER A 629 -7.231 11.241 -2.474 1.00 0.00 C ATOM 998 C SER A 629 -8.299 10.320 -3.077 1.00 0.00 C ATOM 999 O SER A 629 -9.140 9.775 -2.342 1.00 0.00 O ATOM 1000 CB SER A 629 -7.849 12.388 -1.701 1.00 0.00 C ATOM 1001 OG SER A 629 -6.820 13.188 -1.124 1.00 0.00 O ATOM 0 H SER A 629 -6.699 12.606 -3.943 1.00 0.00 H new ATOM 0 HA SER A 629 -6.658 10.606 -1.799 1.00 0.00 H new ATOM 0 HB2 SER A 629 -8.466 12.995 -2.363 1.00 0.00 H new ATOM 0 HB3 SER A 629 -8.504 12.002 -0.920 1.00 0.00 H new ATOM 0 HG SER A 629 -7.223 13.930 -0.626 1.00 0.00 H new ATOM 1007 N CYS A 630 -8.286 10.185 -4.414 1.00 0.00 N ATOM 1008 CA CYS A 630 -9.169 9.282 -5.183 1.00 0.00 C ATOM 1009 C CYS A 630 -10.602 9.775 -5.288 1.00 0.00 C ATOM 1010 O CYS A 630 -11.226 9.696 -6.364 1.00 0.00 O ATOM 1011 CB CYS A 630 -9.137 7.851 -4.648 1.00 0.00 C ATOM 1012 SG CYS A 630 -7.583 6.948 -4.921 1.00 0.00 S ATOM 0 H CYS A 630 -7.646 10.713 -5.008 1.00 0.00 H new ATOM 0 HA CYS A 630 -8.759 9.284 -6.193 1.00 0.00 H new ATOM 0 HB2 CYS A 630 -9.338 7.877 -3.577 1.00 0.00 H new ATOM 0 HB3 CYS A 630 -9.949 7.290 -5.111 1.00 0.00 H new ATOM 1017 N GLY A 631 -11.117 10.263 -4.206 1.00 0.00 N ATOM 1018 CA GLY A 631 -12.465 10.696 -4.162 1.00 0.00 C ATOM 1019 C GLY A 631 -13.275 9.689 -3.409 1.00 0.00 C ATOM 1020 O GLY A 631 -12.792 9.151 -2.399 1.00 0.00 O ATOM 0 H GLY A 631 -10.608 10.370 -3.328 1.00 0.00 H new ATOM 0 HA2 GLY A 631 -12.532 11.671 -3.679 1.00 0.00 H new ATOM 0 HA3 GLY A 631 -12.856 10.814 -5.173 1.00 0.00 H new ATOM 1024 N PRO A 632 -14.491 9.418 -3.837 1.00 0.00 N ATOM 1025 CA PRO A 632 -15.301 8.386 -3.246 1.00 0.00 C ATOM 1026 C PRO A 632 -14.889 6.996 -3.773 1.00 0.00 C ATOM 1027 O PRO A 632 -14.590 6.824 -4.969 1.00 0.00 O ATOM 1028 CB PRO A 632 -16.723 8.737 -3.671 1.00 0.00 C ATOM 1029 CG PRO A 632 -16.582 9.558 -4.910 1.00 0.00 C ATOM 1030 CD PRO A 632 -15.185 10.122 -4.927 1.00 0.00 C ATOM 0 HA PRO A 632 -15.193 8.337 -2.162 1.00 0.00 H new ATOM 0 HB2 PRO A 632 -17.308 7.837 -3.862 1.00 0.00 H new ATOM 0 HB3 PRO A 632 -17.240 9.293 -2.889 1.00 0.00 H new ATOM 0 HG2 PRO A 632 -16.759 8.948 -5.796 1.00 0.00 H new ATOM 0 HG3 PRO A 632 -17.319 10.361 -4.923 1.00 0.00 H new ATOM 0 HD2 PRO A 632 -14.698 9.947 -5.886 1.00 0.00 H new ATOM 0 HD3 PRO A 632 -15.190 11.200 -4.764 1.00 0.00 H new ATOM 1038 N PRO A 633 -14.854 6.004 -2.897 1.00 0.00 N ATOM 1039 CA PRO A 633 -14.436 4.642 -3.241 1.00 0.00 C ATOM 1040 C PRO A 633 -15.428 3.936 -4.170 1.00 0.00 C ATOM 1041 O PRO A 633 -16.585 4.364 -4.300 1.00 0.00 O ATOM 1042 CB PRO A 633 -14.395 3.944 -1.877 1.00 0.00 C ATOM 1043 CG PRO A 633 -15.361 4.699 -1.053 1.00 0.00 C ATOM 1044 CD PRO A 633 -15.238 6.116 -1.490 1.00 0.00 C ATOM 0 HA PRO A 633 -13.490 4.629 -3.782 1.00 0.00 H new ATOM 0 HB2 PRO A 633 -14.676 2.894 -1.959 1.00 0.00 H new ATOM 0 HB3 PRO A 633 -13.395 3.973 -1.445 1.00 0.00 H new ATOM 0 HG2 PRO A 633 -16.376 4.330 -1.201 1.00 0.00 H new ATOM 0 HG3 PRO A 633 -15.136 4.595 0.008 1.00 0.00 H new ATOM 0 HD2 PRO A 633 -16.177 6.656 -1.372 1.00 0.00 H new ATOM 0 HD3 PRO A 633 -14.487 6.652 -0.910 1.00 0.00 H new ATOM 1052 N PRO A 634 -14.981 2.863 -4.843 1.00 0.00 N ATOM 1053 CA PRO A 634 -15.835 2.062 -5.719 1.00 0.00 C ATOM 1054 C PRO A 634 -16.885 1.281 -4.925 1.00 0.00 C ATOM 1055 O PRO A 634 -16.911 1.320 -3.682 1.00 0.00 O ATOM 1056 CB PRO A 634 -14.853 1.080 -6.373 1.00 0.00 C ATOM 1057 CG PRO A 634 -13.714 0.996 -5.428 1.00 0.00 C ATOM 1058 CD PRO A 634 -13.599 2.348 -4.803 1.00 0.00 C ATOM 0 HA PRO A 634 -16.386 2.679 -6.428 1.00 0.00 H new ATOM 0 HB2 PRO A 634 -15.313 0.104 -6.526 1.00 0.00 H new ATOM 0 HB3 PRO A 634 -14.530 1.436 -7.351 1.00 0.00 H new ATOM 0 HG2 PRO A 634 -13.889 0.230 -4.672 1.00 0.00 H new ATOM 0 HG3 PRO A 634 -12.795 0.727 -5.948 1.00 0.00 H new ATOM 0 HD2 PRO A 634 -13.222 2.288 -3.782 1.00 0.00 H new ATOM 0 HD3 PRO A 634 -12.915 2.990 -5.358 1.00 0.00 H new ATOM 1066 N GLU A 635 -17.738 0.594 -5.625 1.00 0.00 N ATOM 1067 CA GLU A 635 -18.721 -0.229 -4.986 1.00 0.00 C ATOM 1068 C GLU A 635 -18.161 -1.632 -4.804 1.00 0.00 C ATOM 1069 O GLU A 635 -17.167 -2.014 -5.446 1.00 0.00 O ATOM 1070 CB GLU A 635 -20.011 -0.276 -5.809 1.00 0.00 C ATOM 1071 CG GLU A 635 -19.847 -0.887 -7.188 1.00 0.00 C ATOM 1072 CD GLU A 635 -21.124 -0.885 -7.977 1.00 0.00 C ATOM 1073 OE1 GLU A 635 -21.594 0.194 -8.377 1.00 0.00 O ATOM 1074 OE2 GLU A 635 -21.677 -1.969 -8.223 1.00 0.00 O ATOM 0 H GLU A 635 -17.773 0.587 -6.644 1.00 0.00 H new ATOM 0 HA GLU A 635 -18.960 0.198 -4.012 1.00 0.00 H new ATOM 0 HB2 GLU A 635 -20.760 -0.846 -5.258 1.00 0.00 H new ATOM 0 HB3 GLU A 635 -20.397 0.738 -5.917 1.00 0.00 H new ATOM 0 HG2 GLU A 635 -19.084 -0.335 -7.737 1.00 0.00 H new ATOM 0 HG3 GLU A 635 -19.489 -1.911 -7.087 1.00 0.00 H new ATOM 1081 N LEU A 636 -18.782 -2.391 -3.952 1.00 0.00 N ATOM 1082 CA LEU A 636 -18.379 -3.750 -3.725 1.00 0.00 C ATOM 1083 C LEU A 636 -19.143 -4.597 -4.680 1.00 0.00 C ATOM 1084 O LEU A 636 -20.227 -4.205 -5.116 1.00 0.00 O ATOM 1085 CB LEU A 636 -18.768 -4.172 -2.349 1.00 0.00 C ATOM 1086 CG LEU A 636 -18.288 -5.520 -1.868 1.00 0.00 C ATOM 1087 CD1 LEU A 636 -16.840 -5.832 -2.231 1.00 0.00 C ATOM 1088 CD2 LEU A 636 -18.565 -5.795 -0.488 1.00 0.00 C ATOM 0 H LEU A 636 -19.581 -2.088 -3.395 1.00 0.00 H new ATOM 0 HA LEU A 636 -17.301 -3.846 -3.851 1.00 0.00 H new ATOM 0 HB2 LEU A 636 -18.404 -3.418 -1.651 1.00 0.00 H new ATOM 0 HB3 LEU A 636 -19.856 -4.163 -2.290 1.00 0.00 H new ATOM 0 HG LEU A 636 -18.903 -6.217 -2.437 1.00 0.00 H new ATOM 0 HD11 LEU A 636 -16.573 -6.818 -1.849 1.00 0.00 H new ATOM 0 HD12 LEU A 636 -16.726 -5.820 -3.315 1.00 0.00 H new ATOM 0 HD13 LEU A 636 -16.184 -5.082 -1.789 1.00 0.00 H new ATOM 0 HD21 LEU A 636 -18.185 -6.784 -0.231 1.00 0.00 H new ATOM 0 HD22 LEU A 636 -18.079 -5.046 0.137 1.00 0.00 H new ATOM 0 HD23 LEU A 636 -19.642 -5.765 -0.320 1.00 0.00 H new ATOM 1100 N LEU A 637 -18.639 -5.746 -4.984 1.00 0.00 N ATOM 1101 CA LEU A 637 -19.325 -6.553 -5.908 1.00 0.00 C ATOM 1102 C LEU A 637 -20.532 -7.253 -5.319 1.00 0.00 C ATOM 1103 O LEU A 637 -21.602 -7.260 -5.904 1.00 0.00 O ATOM 1104 CB LEU A 637 -18.451 -7.495 -6.755 1.00 0.00 C ATOM 1105 CG LEU A 637 -17.698 -8.646 -6.055 1.00 0.00 C ATOM 1106 CD1 LEU A 637 -17.067 -9.560 -7.090 1.00 0.00 C ATOM 1107 CD2 LEU A 637 -16.625 -8.151 -5.101 1.00 0.00 C ATOM 0 H LEU A 637 -17.772 -6.133 -4.610 1.00 0.00 H new ATOM 0 HA LEU A 637 -19.701 -5.827 -6.628 1.00 0.00 H new ATOM 0 HB2 LEU A 637 -19.089 -7.936 -7.521 1.00 0.00 H new ATOM 0 HB3 LEU A 637 -17.711 -6.883 -7.271 1.00 0.00 H new ATOM 0 HG LEU A 637 -18.435 -9.192 -5.466 1.00 0.00 H new ATOM 0 HD11 LEU A 637 -16.538 -10.369 -6.587 1.00 0.00 H new ATOM 0 HD12 LEU A 637 -17.845 -9.978 -7.729 1.00 0.00 H new ATOM 0 HD13 LEU A 637 -16.365 -8.990 -7.698 1.00 0.00 H new ATOM 0 HD21 LEU A 637 -16.129 -9.004 -4.638 1.00 0.00 H new ATOM 0 HD22 LEU A 637 -15.893 -7.560 -5.652 1.00 0.00 H new ATOM 0 HD23 LEU A 637 -17.082 -7.533 -4.328 1.00 0.00 H new ATOM 1119 N ASN A 638 -20.367 -7.818 -4.164 1.00 0.00 N ATOM 1120 CA ASN A 638 -21.451 -8.549 -3.546 1.00 0.00 C ATOM 1121 C ASN A 638 -21.721 -8.038 -2.166 1.00 0.00 C ATOM 1122 O ASN A 638 -22.086 -8.795 -1.253 1.00 0.00 O ATOM 1123 CB ASN A 638 -21.188 -10.058 -3.554 1.00 0.00 C ATOM 1124 CG ASN A 638 -21.422 -10.696 -4.919 1.00 0.00 C ATOM 1125 OD1 ASN A 638 -22.538 -11.086 -5.242 1.00 0.00 O ATOM 1126 ND2 ASN A 638 -20.375 -10.836 -5.708 1.00 0.00 N ATOM 0 H ASN A 638 -19.501 -7.793 -3.625 1.00 0.00 H new ATOM 0 HA ASN A 638 -22.349 -8.382 -4.140 1.00 0.00 H new ATOM 0 HB2 ASN A 638 -20.160 -10.244 -3.244 1.00 0.00 H new ATOM 0 HB3 ASN A 638 -21.834 -10.538 -2.819 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -20.479 -11.281 -6.620 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -19.461 -10.499 -5.407 1.00 0.00 H new ATOM 1133 N GLY A 639 -21.530 -6.759 -2.007 1.00 0.00 N ATOM 1134 CA GLY A 639 -21.840 -6.097 -0.794 1.00 0.00 C ATOM 1135 C GLY A 639 -21.971 -4.633 -1.017 1.00 0.00 C ATOM 1136 O GLY A 639 -22.453 -4.198 -2.062 1.00 0.00 O ATOM 0 H GLY A 639 -21.150 -6.149 -2.731 1.00 0.00 H new ATOM 0 HA2 GLY A 639 -22.769 -6.493 -0.384 1.00 0.00 H new ATOM 0 HA3 GLY A 639 -21.060 -6.290 -0.058 1.00 0.00 H new ATOM 1140 N ASN A 640 -21.481 -3.884 -0.085 1.00 0.00 N ATOM 1141 CA ASN A 640 -21.457 -2.450 -0.146 1.00 0.00 C ATOM 1142 C ASN A 640 -20.380 -1.962 0.779 1.00 0.00 C ATOM 1143 O ASN A 640 -19.584 -2.757 1.287 1.00 0.00 O ATOM 1144 CB ASN A 640 -22.806 -1.830 0.257 1.00 0.00 C ATOM 1145 CG ASN A 640 -23.563 -1.140 -0.883 1.00 0.00 C ATOM 1146 OD1 ASN A 640 -24.785 -1.099 -0.876 1.00 0.00 O ATOM 1147 ND2 ASN A 640 -22.867 -0.572 -1.841 1.00 0.00 N ATOM 0 H ASN A 640 -21.072 -4.260 0.770 1.00 0.00 H new ATOM 0 HA ASN A 640 -21.260 -2.147 -1.174 1.00 0.00 H new ATOM 0 HB2 ASN A 640 -23.440 -2.613 0.673 1.00 0.00 H new ATOM 0 HB3 ASN A 640 -22.633 -1.104 1.051 1.00 0.00 H new ATOM 0 HD21 ASN A 640 -23.345 -0.085 -2.599 1.00 0.00 H new ATOM 0 HD22 ASN A 640 -21.848 -0.618 -1.827 1.00 0.00 H new ATOM 1154 N VAL A 641 -20.355 -0.697 1.001 1.00 0.00 N ATOM 1155 CA VAL A 641 -19.392 -0.086 1.860 1.00 0.00 C ATOM 1156 C VAL A 641 -20.077 0.238 3.203 1.00 0.00 C ATOM 1157 O VAL A 641 -21.190 0.758 3.217 1.00 0.00 O ATOM 1158 CB VAL A 641 -18.820 1.195 1.174 1.00 0.00 C ATOM 1159 CG1 VAL A 641 -19.918 2.160 0.794 1.00 0.00 C ATOM 1160 CG2 VAL A 641 -17.774 1.866 2.030 1.00 0.00 C ATOM 0 H VAL A 641 -21.015 -0.040 0.585 1.00 0.00 H new ATOM 0 HA VAL A 641 -18.554 -0.757 2.049 1.00 0.00 H new ATOM 0 HB VAL A 641 -18.332 0.874 0.254 1.00 0.00 H new ATOM 0 HG11 VAL A 641 -19.482 3.039 0.319 1.00 0.00 H new ATOM 0 HG12 VAL A 641 -20.604 1.675 0.099 1.00 0.00 H new ATOM 0 HG13 VAL A 641 -20.462 2.463 1.689 1.00 0.00 H new ATOM 0 HG21 VAL A 641 -17.400 2.753 1.519 1.00 0.00 H new ATOM 0 HG22 VAL A 641 -18.215 2.156 2.984 1.00 0.00 H new ATOM 0 HG23 VAL A 641 -16.950 1.175 2.207 1.00 0.00 H new ATOM 1164 N LYS A 642 -19.446 -0.111 4.313 1.00 0.00 N ATOM 1165 CA LYS A 642 -20.046 0.131 5.641 1.00 0.00 C ATOM 1166 C LYS A 642 -19.693 1.522 6.131 1.00 0.00 C ATOM 1167 O LYS A 642 -20.276 2.044 7.092 1.00 0.00 O ATOM 1168 CB LYS A 642 -19.602 -0.942 6.662 1.00 0.00 C ATOM 1169 CG LYS A 642 -18.103 -1.135 6.702 1.00 0.00 C ATOM 1170 CD LYS A 642 -17.622 -2.091 7.780 1.00 0.00 C ATOM 1171 CE LYS A 642 -17.849 -1.531 9.167 1.00 0.00 C ATOM 1172 NZ LYS A 642 -17.040 -2.235 10.180 1.00 0.00 N ATOM 0 H LYS A 642 -18.529 -0.558 4.335 1.00 0.00 H new ATOM 0 HA LYS A 642 -21.129 0.061 5.542 1.00 0.00 H new ATOM 0 HB2 LYS A 642 -19.953 -0.659 7.654 1.00 0.00 H new ATOM 0 HB3 LYS A 642 -20.078 -1.891 6.414 1.00 0.00 H new ATOM 0 HG2 LYS A 642 -17.770 -1.504 5.732 1.00 0.00 H new ATOM 0 HG3 LYS A 642 -17.628 -0.166 6.855 1.00 0.00 H new ATOM 0 HD2 LYS A 642 -18.144 -3.043 7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 642 -16.560 -2.294 7.639 1.00 0.00 H new ATOM 0 HE2 LYS A 642 -17.600 -0.470 9.176 1.00 0.00 H new ATOM 0 HE3 LYS A 642 -18.905 -1.613 9.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 -17.469 -2.105 11.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 -17.005 -3.249 9.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 -16.075 -1.848 10.184 1.00 0.00 H new ATOM 1186 N GLU A 643 -18.740 2.106 5.469 1.00 0.00 N ATOM 1187 CA GLU A 643 -18.282 3.429 5.765 1.00 0.00 C ATOM 1188 C GLU A 643 -19.066 4.474 5.016 1.00 0.00 C ATOM 1189 O GLU A 643 -19.459 4.257 3.862 1.00 0.00 O ATOM 1190 CB GLU A 643 -16.810 3.564 5.416 1.00 0.00 C ATOM 1191 CG GLU A 643 -15.904 2.924 6.417 1.00 0.00 C ATOM 1192 CD GLU A 643 -16.045 3.595 7.742 1.00 0.00 C ATOM 1193 OE1 GLU A 643 -15.554 4.731 7.890 1.00 0.00 O ATOM 1194 OE2 GLU A 643 -16.681 3.026 8.649 1.00 0.00 O ATOM 0 H GLU A 643 -18.249 1.666 4.691 1.00 0.00 H new ATOM 0 HA GLU A 643 -18.429 3.591 6.833 1.00 0.00 H new ATOM 0 HB2 GLU A 643 -16.633 3.117 4.438 1.00 0.00 H new ATOM 0 HB3 GLU A 643 -16.559 4.621 5.333 1.00 0.00 H new ATOM 0 HG2 GLU A 643 -16.143 1.865 6.510 1.00 0.00 H new ATOM 0 HG3 GLU A 643 -14.871 2.988 6.077 1.00 0.00 H new ATOM 1201 N LYS A 644 -19.344 5.563 5.698 1.00 0.00 N ATOM 1202 CA LYS A 644 -19.929 6.749 5.099 1.00 0.00 C ATOM 1203 C LYS A 644 -19.030 7.206 3.931 1.00 0.00 C ATOM 1204 O LYS A 644 -17.832 7.475 4.115 1.00 0.00 O ATOM 1205 CB LYS A 644 -20.072 7.896 6.148 1.00 0.00 C ATOM 1206 CG LYS A 644 -18.750 8.432 6.707 1.00 0.00 C ATOM 1207 CD LYS A 644 -18.093 7.485 7.705 1.00 0.00 C ATOM 1208 CE LYS A 644 -16.612 7.763 7.832 1.00 0.00 C ATOM 1209 NZ LYS A 644 -15.848 7.218 6.683 1.00 0.00 N ATOM 0 H LYS A 644 -19.169 5.654 6.699 1.00 0.00 H new ATOM 0 HA LYS A 644 -20.927 6.510 4.733 1.00 0.00 H new ATOM 0 HB2 LYS A 644 -20.616 8.722 5.689 1.00 0.00 H new ATOM 0 HB3 LYS A 644 -20.680 7.535 6.978 1.00 0.00 H new ATOM 0 HG2 LYS A 644 -18.062 8.615 5.882 1.00 0.00 H new ATOM 0 HG3 LYS A 644 -18.930 9.392 7.191 1.00 0.00 H new ATOM 0 HD2 LYS A 644 -18.570 7.592 8.679 1.00 0.00 H new ATOM 0 HD3 LYS A 644 -18.246 6.454 7.386 1.00 0.00 H new ATOM 0 HE2 LYS A 644 -16.449 8.839 7.900 1.00 0.00 H new ATOM 0 HE3 LYS A 644 -16.238 7.325 8.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 -14.990 7.787 6.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 -15.581 6.232 6.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 -16.437 7.252 5.827 1.00 0.00 H new ATOM 1223 N THR A 645 -19.574 7.270 2.765 1.00 0.00 N ATOM 1224 CA THR A 645 -18.798 7.573 1.606 1.00 0.00 C ATOM 1225 C THR A 645 -18.807 9.042 1.239 1.00 0.00 C ATOM 1226 O THR A 645 -19.777 9.562 0.668 1.00 0.00 O ATOM 1227 CB THR A 645 -19.206 6.699 0.414 1.00 0.00 C ATOM 1228 OG1 THR A 645 -20.640 6.565 0.379 1.00 0.00 O ATOM 1229 CG2 THR A 645 -18.552 5.332 0.498 1.00 0.00 C ATOM 0 H THR A 645 -20.566 7.115 2.585 1.00 0.00 H new ATOM 0 HA THR A 645 -17.767 7.336 1.869 1.00 0.00 H new ATOM 0 HB THR A 645 -18.867 7.180 -0.504 1.00 0.00 H new ATOM 0 HG1 THR A 645 -20.898 6.008 -0.385 1.00 0.00 H new ATOM 0 HG21 THR A 645 -18.856 4.730 -0.358 1.00 0.00 H new ATOM 0 HG22 THR A 645 -17.468 5.446 0.494 1.00 0.00 H new ATOM 0 HG23 THR A 645 -18.861 4.837 1.418 1.00 0.00 H new ATOM 1237 N LYS A 646 -17.752 9.715 1.624 1.00 0.00 N ATOM 1238 CA LYS A 646 -17.547 11.089 1.250 1.00 0.00 C ATOM 1239 C LYS A 646 -16.928 11.146 -0.144 1.00 0.00 C ATOM 1240 O LYS A 646 -16.457 10.120 -0.655 1.00 0.00 O ATOM 1241 CB LYS A 646 -16.683 11.807 2.285 1.00 0.00 C ATOM 1242 CG LYS A 646 -15.391 11.115 2.624 1.00 0.00 C ATOM 1243 CD LYS A 646 -14.623 11.922 3.632 1.00 0.00 C ATOM 1244 CE LYS A 646 -13.376 11.205 4.074 1.00 0.00 C ATOM 1245 NZ LYS A 646 -12.560 12.049 4.971 1.00 0.00 N ATOM 0 H LYS A 646 -17.011 9.324 2.206 1.00 0.00 H new ATOM 0 HA LYS A 646 -18.506 11.607 1.222 1.00 0.00 H new ATOM 0 HB2 LYS A 646 -16.456 12.807 1.916 1.00 0.00 H new ATOM 0 HB3 LYS A 646 -17.264 11.929 3.199 1.00 0.00 H new ATOM 0 HG2 LYS A 646 -15.595 10.121 3.022 1.00 0.00 H new ATOM 0 HG3 LYS A 646 -14.794 10.981 1.722 1.00 0.00 H new ATOM 0 HD2 LYS A 646 -14.356 12.887 3.201 1.00 0.00 H new ATOM 0 HD3 LYS A 646 -15.255 12.123 4.497 1.00 0.00 H new ATOM 0 HE2 LYS A 646 -13.647 10.282 4.587 1.00 0.00 H new ATOM 0 HE3 LYS A 646 -12.787 10.923 3.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 -11.708 11.527 5.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 -12.282 12.918 4.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 -13.115 12.297 5.815 1.00 0.00 H new ATOM 1259 N GLU A 647 -16.906 12.317 -0.744 1.00 0.00 N ATOM 1260 CA GLU A 647 -16.458 12.458 -2.123 1.00 0.00 C ATOM 1261 C GLU A 647 -14.958 12.691 -2.246 1.00 0.00 C ATOM 1262 O GLU A 647 -14.453 12.873 -3.345 1.00 0.00 O ATOM 1263 CB GLU A 647 -17.240 13.549 -2.852 1.00 0.00 C ATOM 1264 CG GLU A 647 -18.733 13.277 -2.925 1.00 0.00 C ATOM 1265 CD GLU A 647 -19.468 14.327 -3.705 1.00 0.00 C ATOM 1266 OE1 GLU A 647 -19.873 15.349 -3.122 1.00 0.00 O ATOM 1267 OE2 GLU A 647 -19.657 14.159 -4.924 1.00 0.00 O ATOM 0 H GLU A 647 -17.193 13.190 -0.302 1.00 0.00 H new ATOM 0 HA GLU A 647 -16.663 11.502 -2.605 1.00 0.00 H new ATOM 0 HB2 GLU A 647 -17.076 14.501 -2.348 1.00 0.00 H new ATOM 0 HB3 GLU A 647 -16.847 13.652 -3.864 1.00 0.00 H new ATOM 0 HG2 GLU A 647 -18.900 12.303 -3.385 1.00 0.00 H new ATOM 0 HG3 GLU A 647 -19.140 13.227 -1.915 1.00 0.00 H new ATOM 1274 N GLU A 648 -14.254 12.701 -1.137 1.00 0.00 N ATOM 1275 CA GLU A 648 -12.812 12.784 -1.172 1.00 0.00 C ATOM 1276 C GLU A 648 -12.245 12.104 0.057 1.00 0.00 C ATOM 1277 O GLU A 648 -12.410 12.591 1.173 1.00 0.00 O ATOM 1278 CB GLU A 648 -12.317 14.240 -1.276 1.00 0.00 C ATOM 1279 CG GLU A 648 -10.814 14.354 -1.516 1.00 0.00 C ATOM 1280 CD GLU A 648 -10.334 15.775 -1.704 1.00 0.00 C ATOM 1281 OE1 GLU A 648 -10.676 16.404 -2.733 1.00 0.00 O ATOM 1282 OE2 GLU A 648 -9.555 16.272 -0.878 1.00 0.00 O ATOM 0 H GLU A 648 -14.656 12.653 -0.201 1.00 0.00 H new ATOM 0 HA GLU A 648 -12.459 12.273 -2.068 1.00 0.00 H new ATOM 0 HB2 GLU A 648 -12.846 14.739 -2.088 1.00 0.00 H new ATOM 0 HB3 GLU A 648 -12.572 14.769 -0.358 1.00 0.00 H new ATOM 0 HG2 GLU A 648 -10.286 13.910 -0.672 1.00 0.00 H new ATOM 0 HG3 GLU A 648 -10.551 13.771 -2.399 1.00 0.00 H new ATOM 1289 N TYR A 649 -11.640 10.954 -0.140 1.00 0.00 N ATOM 1290 CA TYR A 649 -11.050 10.215 0.956 1.00 0.00 C ATOM 1291 C TYR A 649 -9.634 10.667 1.304 1.00 0.00 C ATOM 1292 O TYR A 649 -9.448 11.632 2.053 1.00 0.00 O ATOM 1293 CB TYR A 649 -11.122 8.706 0.727 1.00 0.00 C ATOM 1294 CG TYR A 649 -12.328 8.058 1.352 1.00 0.00 C ATOM 1295 CD1 TYR A 649 -13.619 8.320 0.914 1.00 0.00 C ATOM 1296 CD2 TYR A 649 -12.164 7.195 2.410 1.00 0.00 C ATOM 1297 CE1 TYR A 649 -14.702 7.722 1.523 1.00 0.00 C ATOM 1298 CE2 TYR A 649 -13.226 6.598 3.023 1.00 0.00 C ATOM 1299 CZ TYR A 649 -14.491 6.857 2.586 1.00 0.00 C ATOM 1300 OH TYR A 649 -15.549 6.243 3.203 1.00 0.00 O ATOM 0 H TYR A 649 -11.543 10.508 -1.052 1.00 0.00 H new ATOM 0 HA TYR A 649 -11.658 10.448 1.830 1.00 0.00 H new ATOM 0 HB2 TYR A 649 -11.129 8.510 -0.345 1.00 0.00 H new ATOM 0 HB3 TYR A 649 -10.221 8.243 1.130 1.00 0.00 H new ATOM 0 HD1 TYR A 649 -13.777 8.998 0.089 1.00 0.00 H new ATOM 0 HD2 TYR A 649 -11.166 6.984 2.765 1.00 0.00 H new ATOM 0 HE1 TYR A 649 -15.704 7.925 1.176 1.00 0.00 H new ATOM 0 HE2 TYR A 649 -13.066 5.923 3.851 1.00 0.00 H new ATOM 0 HH TYR A 649 -16.230 6.911 3.427 1.00 0.00 H new ATOM 1310 N GLY A 650 -8.656 10.014 0.743 1.00 0.00 N ATOM 1311 CA GLY A 650 -7.288 10.326 1.039 1.00 0.00 C ATOM 1312 C GLY A 650 -6.436 9.114 0.866 1.00 0.00 C ATOM 1313 O GLY A 650 -6.964 7.998 0.833 1.00 0.00 O ATOM 0 H GLY A 650 -8.783 9.256 0.073 1.00 0.00 H new ATOM 0 HA2 GLY A 650 -6.938 11.122 0.382 1.00 0.00 H new ATOM 0 HA3 GLY A 650 -7.204 10.696 2.061 1.00 0.00 H new ATOM 1317 N HIS A 651 -5.149 9.316 0.698 1.00 0.00 N ATOM 1318 CA HIS A 651 -4.200 8.232 0.546 1.00 0.00 C ATOM 1319 C HIS A 651 -4.285 7.156 1.640 1.00 0.00 C ATOM 1320 O HIS A 651 -4.514 5.980 1.352 1.00 0.00 O ATOM 1321 CB HIS A 651 -2.762 8.762 0.422 1.00 0.00 C ATOM 1322 CG HIS A 651 -1.722 7.682 0.502 1.00 0.00 C ATOM 1323 ND1 HIS A 651 -1.653 6.654 -0.394 1.00 0.00 N ATOM 1324 CD2 HIS A 651 -0.782 7.436 1.422 1.00 0.00 C ATOM 1325 CE1 HIS A 651 -0.715 5.820 -0.041 1.00 0.00 C ATOM 1326 NE2 HIS A 651 -0.166 6.262 1.068 1.00 0.00 N ATOM 0 H HIS A 651 -4.726 10.244 0.662 1.00 0.00 H new ATOM 0 HA HIS A 651 -4.484 7.737 -0.383 1.00 0.00 H new ATOM 0 HB2 HIS A 651 -2.657 9.289 -0.527 1.00 0.00 H new ATOM 0 HB3 HIS A 651 -2.581 9.490 1.213 1.00 0.00 H new ATOM 0 HD2 HIS A 651 -0.551 8.047 2.282 1.00 0.00 H new ATOM 0 HE1 HIS A 651 -0.437 4.920 -0.570 1.00 0.00 H new ATOM 0 HE2 HIS A 651 0.591 5.809 1.580 1.00 0.00 H new ATOM 1335 N SER A 652 -4.099 7.547 2.853 1.00 0.00 N ATOM 1336 CA SER A 652 -4.016 6.608 3.943 1.00 0.00 C ATOM 1337 C SER A 652 -5.386 6.381 4.562 1.00 0.00 C ATOM 1338 O SER A 652 -5.509 5.885 5.684 1.00 0.00 O ATOM 1339 CB SER A 652 -3.015 7.137 4.965 1.00 0.00 C ATOM 1340 OG SER A 652 -1.748 7.361 4.342 1.00 0.00 O ATOM 0 H SER A 652 -3.999 8.524 3.128 1.00 0.00 H new ATOM 0 HA SER A 652 -3.672 5.641 3.578 1.00 0.00 H new ATOM 0 HB2 SER A 652 -3.384 8.066 5.400 1.00 0.00 H new ATOM 0 HB3 SER A 652 -2.906 6.424 5.782 1.00 0.00 H new ATOM 0 HG SER A 652 -1.113 7.702 5.006 1.00 0.00 H new ATOM 1346 N GLU A 653 -6.401 6.683 3.797 1.00 0.00 N ATOM 1347 CA GLU A 653 -7.736 6.550 4.243 1.00 0.00 C ATOM 1348 C GLU A 653 -8.314 5.313 3.602 1.00 0.00 C ATOM 1349 O GLU A 653 -8.439 5.229 2.370 1.00 0.00 O ATOM 1350 CB GLU A 653 -8.546 7.785 3.872 1.00 0.00 C ATOM 1351 CG GLU A 653 -9.837 7.930 4.646 1.00 0.00 C ATOM 1352 CD GLU A 653 -9.610 8.004 6.128 1.00 0.00 C ATOM 1353 OE1 GLU A 653 -9.088 9.035 6.608 1.00 0.00 O ATOM 1354 OE2 GLU A 653 -9.976 7.051 6.842 1.00 0.00 O ATOM 0 H GLU A 653 -6.310 7.030 2.842 1.00 0.00 H new ATOM 0 HA GLU A 653 -7.768 6.456 5.328 1.00 0.00 H new ATOM 0 HB2 GLU A 653 -7.934 8.671 4.038 1.00 0.00 H new ATOM 0 HB3 GLU A 653 -8.775 7.750 2.807 1.00 0.00 H new ATOM 0 HG2 GLU A 653 -10.357 8.829 4.315 1.00 0.00 H new ATOM 0 HG3 GLU A 653 -10.488 7.085 4.423 1.00 0.00 H new ATOM 1361 N VAL A 654 -8.593 4.345 4.416 1.00 0.00 N ATOM 1362 CA VAL A 654 -9.139 3.106 3.959 1.00 0.00 C ATOM 1363 C VAL A 654 -10.636 3.166 4.066 1.00 0.00 C ATOM 1364 O VAL A 654 -11.193 3.986 4.809 1.00 0.00 O ATOM 1365 CB VAL A 654 -8.632 1.948 4.793 1.00 0.00 C ATOM 1366 CG1 VAL A 654 -9.206 1.855 6.156 1.00 0.00 C ATOM 1367 CG2 VAL A 654 -8.675 0.705 4.080 1.00 0.00 C ATOM 0 H VAL A 654 -8.447 4.392 5.424 1.00 0.00 H new ATOM 0 HA VAL A 654 -8.832 2.950 2.925 1.00 0.00 H new ATOM 0 HB VAL A 654 -7.582 2.179 4.972 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -8.780 0.995 6.672 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -8.973 2.763 6.712 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -10.288 1.739 6.088 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -8.302 -0.095 4.720 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -9.703 0.487 3.790 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -8.053 0.776 3.188 1.00 0.00 H new ATOM 1371 N VAL A 655 -11.280 2.329 3.336 1.00 0.00 N ATOM 1372 CA VAL A 655 -12.680 2.269 3.355 1.00 0.00 C ATOM 1373 C VAL A 655 -13.099 0.865 3.694 1.00 0.00 C ATOM 1374 O VAL A 655 -12.793 -0.053 2.952 1.00 0.00 O ATOM 1375 CB VAL A 655 -13.257 2.605 1.983 1.00 0.00 C ATOM 1376 CG1 VAL A 655 -14.666 2.999 2.093 1.00 0.00 C ATOM 1377 CG2 VAL A 655 -12.448 3.640 1.285 1.00 0.00 C ATOM 0 H VAL A 655 -10.836 1.662 2.704 1.00 0.00 H new ATOM 0 HA VAL A 655 -13.046 2.986 4.090 1.00 0.00 H new ATOM 0 HB VAL A 655 -13.211 1.704 1.372 1.00 0.00 H new ATOM 0 HG11 VAL A 655 -15.056 3.234 1.103 1.00 0.00 H new ATOM 0 HG12 VAL A 655 -15.240 2.179 2.524 1.00 0.00 H new ATOM 0 HG13 VAL A 655 -14.749 3.877 2.734 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -12.890 3.852 0.312 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -12.430 4.552 1.882 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -11.430 3.275 1.149 1.00 0.00 H new ATOM 1381 N GLU A 656 -13.713 0.698 4.828 1.00 0.00 N ATOM 1382 CA GLU A 656 -14.266 -0.586 5.220 1.00 0.00 C ATOM 1383 C GLU A 656 -15.523 -0.944 4.402 1.00 0.00 C ATOM 1384 O GLU A 656 -16.470 -0.140 4.276 1.00 0.00 O ATOM 1385 CB GLU A 656 -14.612 -0.602 6.709 1.00 0.00 C ATOM 1386 CG GLU A 656 -13.465 -0.930 7.622 1.00 0.00 C ATOM 1387 CD GLU A 656 -13.796 -0.745 9.079 1.00 0.00 C ATOM 1388 OE1 GLU A 656 -14.524 -1.588 9.645 1.00 0.00 O ATOM 1389 OE2 GLU A 656 -13.306 0.226 9.698 1.00 0.00 O ATOM 0 H GLU A 656 -13.850 1.440 5.514 1.00 0.00 H new ATOM 0 HA GLU A 656 -13.498 -1.332 5.018 1.00 0.00 H new ATOM 0 HB2 GLU A 656 -15.009 0.375 6.985 1.00 0.00 H new ATOM 0 HB3 GLU A 656 -15.408 -1.328 6.874 1.00 0.00 H new ATOM 0 HG2 GLU A 656 -13.159 -1.962 7.454 1.00 0.00 H new ATOM 0 HG3 GLU A 656 -12.614 -0.299 7.366 1.00 0.00 H new ATOM 1396 N TYR A 657 -15.516 -2.116 3.846 1.00 0.00 N ATOM 1397 CA TYR A 657 -16.658 -2.674 3.117 1.00 0.00 C ATOM 1398 C TYR A 657 -17.291 -3.809 3.896 1.00 0.00 C ATOM 1399 O TYR A 657 -16.739 -4.265 4.903 1.00 0.00 O ATOM 1400 CB TYR A 657 -16.231 -3.219 1.750 1.00 0.00 C ATOM 1401 CG TYR A 657 -15.878 -2.180 0.732 1.00 0.00 C ATOM 1402 CD1 TYR A 657 -14.699 -1.478 0.807 1.00 0.00 C ATOM 1403 CD2 TYR A 657 -16.728 -1.923 -0.323 1.00 0.00 C ATOM 1404 CE1 TYR A 657 -14.372 -0.543 -0.133 1.00 0.00 C ATOM 1405 CE2 TYR A 657 -16.414 -0.985 -1.273 1.00 0.00 C ATOM 1406 CZ TYR A 657 -15.229 -0.295 -1.172 1.00 0.00 C ATOM 1407 OH TYR A 657 -14.888 0.628 -2.121 1.00 0.00 O ATOM 0 H TYR A 657 -14.709 -2.739 3.876 1.00 0.00 H new ATOM 0 HA TYR A 657 -17.375 -1.864 2.983 1.00 0.00 H new ATOM 0 HB2 TYR A 657 -15.371 -3.874 1.890 1.00 0.00 H new ATOM 0 HB3 TYR A 657 -17.039 -3.834 1.353 1.00 0.00 H new ATOM 0 HD1 TYR A 657 -14.019 -1.669 1.624 1.00 0.00 H new ATOM 0 HD2 TYR A 657 -17.656 -2.469 -0.402 1.00 0.00 H new ATOM 0 HE1 TYR A 657 -13.441 -0.001 -0.057 1.00 0.00 H new ATOM 0 HE2 TYR A 657 -17.091 -0.790 -2.092 1.00 0.00 H new ATOM 0 HH TYR A 657 -15.699 1.051 -2.472 1.00 0.00 H new ATOM 1417 N TYR A 658 -18.440 -4.259 3.427 1.00 0.00 N ATOM 1418 CA TYR A 658 -19.123 -5.399 3.996 1.00 0.00 C ATOM 1419 C TYR A 658 -19.871 -6.097 2.870 1.00 0.00 C ATOM 1420 O TYR A 658 -20.514 -5.433 2.041 1.00 0.00 O ATOM 1421 CB TYR A 658 -20.112 -4.977 5.122 1.00 0.00 C ATOM 1422 CG TYR A 658 -21.371 -4.259 4.654 1.00 0.00 C ATOM 1423 CD1 TYR A 658 -21.347 -2.929 4.291 1.00 0.00 C ATOM 1424 CD2 TYR A 658 -22.583 -4.935 4.568 1.00 0.00 C ATOM 1425 CE1 TYR A 658 -22.487 -2.284 3.857 1.00 0.00 C ATOM 1426 CE2 TYR A 658 -23.726 -4.298 4.136 1.00 0.00 C ATOM 1427 CZ TYR A 658 -23.671 -2.972 3.781 1.00 0.00 C ATOM 1428 OH TYR A 658 -24.814 -2.332 3.356 1.00 0.00 O ATOM 0 H TYR A 658 -18.926 -3.839 2.635 1.00 0.00 H new ATOM 0 HA TYR A 658 -18.394 -6.068 4.453 1.00 0.00 H new ATOM 0 HB2 TYR A 658 -20.408 -5.869 5.675 1.00 0.00 H new ATOM 0 HB3 TYR A 658 -19.584 -4.329 5.821 1.00 0.00 H new ATOM 0 HD1 TYR A 658 -20.418 -2.381 4.347 1.00 0.00 H new ATOM 0 HD2 TYR A 658 -22.629 -5.978 4.845 1.00 0.00 H new ATOM 0 HE1 TYR A 658 -22.447 -1.241 3.578 1.00 0.00 H new ATOM 0 HE2 TYR A 658 -24.659 -4.838 4.077 1.00 0.00 H new ATOM 0 HH TYR A 658 -25.563 -2.964 3.360 1.00 0.00 H new ATOM 1438 N CYS A 659 -19.748 -7.384 2.770 1.00 0.00 N ATOM 1439 CA CYS A 659 -20.487 -8.107 1.771 1.00 0.00 C ATOM 1440 C CYS A 659 -21.743 -8.689 2.379 1.00 0.00 C ATOM 1441 O CYS A 659 -21.944 -8.604 3.590 1.00 0.00 O ATOM 1442 CB CYS A 659 -19.651 -9.192 1.121 1.00 0.00 C ATOM 1443 SG CYS A 659 -18.266 -8.668 0.139 1.00 0.00 S ATOM 0 H CYS A 659 -19.147 -7.957 3.362 1.00 0.00 H new ATOM 0 HA CYS A 659 -20.763 -7.404 0.985 1.00 0.00 H new ATOM 0 HB2 CYS A 659 -19.279 -9.849 1.907 1.00 0.00 H new ATOM 0 HB3 CYS A 659 -20.307 -9.791 0.489 1.00 0.00 H new ATOM 1448 N ASN A 660 -22.598 -9.253 1.547 1.00 0.00 N ATOM 1449 CA ASN A 660 -23.824 -9.871 2.023 1.00 0.00 C ATOM 1450 C ASN A 660 -23.522 -11.080 2.896 1.00 0.00 C ATOM 1451 O ASN A 660 -22.491 -11.744 2.702 1.00 0.00 O ATOM 1452 CB ASN A 660 -24.770 -10.258 0.876 1.00 0.00 C ATOM 1453 CG ASN A 660 -25.406 -9.069 0.174 1.00 0.00 C ATOM 1454 OD1 ASN A 660 -26.453 -8.592 0.589 1.00 0.00 O ATOM 1455 ND2 ASN A 660 -24.800 -8.602 -0.882 1.00 0.00 N ATOM 0 H ASN A 660 -22.467 -9.297 0.536 1.00 0.00 H new ATOM 0 HA ASN A 660 -24.338 -9.122 2.626 1.00 0.00 H new ATOM 0 HB2 ASN A 660 -24.216 -10.846 0.144 1.00 0.00 H new ATOM 0 HB3 ASN A 660 -25.559 -10.900 1.269 1.00 0.00 H new ATOM 0 HD21 ASN A 660 -25.198 -7.813 -1.391 1.00 0.00 H new ATOM 0 HD22 ASN A 660 -23.928 -9.026 -1.199 1.00 0.00 H new ATOM 1462 N PRO A 661 -24.441 -11.414 3.837 1.00 0.00 N ATOM 1463 CA PRO A 661 -24.271 -12.516 4.837 1.00 0.00 C ATOM 1464 C PRO A 661 -24.378 -13.921 4.229 1.00 0.00 C ATOM 1465 O PRO A 661 -24.829 -14.878 4.861 1.00 0.00 O ATOM 1466 CB PRO A 661 -25.418 -12.260 5.812 1.00 0.00 C ATOM 1467 CG PRO A 661 -26.471 -11.617 4.984 1.00 0.00 C ATOM 1468 CD PRO A 661 -25.740 -10.731 4.023 1.00 0.00 C ATOM 0 HA PRO A 661 -23.279 -12.503 5.289 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -25.775 -13.188 6.258 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -25.106 -11.612 6.631 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -27.065 -12.363 4.456 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -27.159 -11.041 5.603 1.00 0.00 H new ATOM 0 HD2 PRO A 661 -26.279 -10.631 3.081 1.00 0.00 H new ATOM 0 HD3 PRO A 661 -25.610 -9.726 4.424 1.00 0.00 H new ATOM 1476 N ARG A 662 -23.896 -14.028 3.046 1.00 0.00 N ATOM 1477 CA ARG A 662 -23.990 -15.206 2.242 1.00 0.00 C ATOM 1478 C ARG A 662 -22.790 -15.313 1.321 1.00 0.00 C ATOM 1479 O ARG A 662 -22.768 -16.104 0.381 1.00 0.00 O ATOM 1480 CB ARG A 662 -25.301 -15.129 1.479 1.00 0.00 C ATOM 1481 CG ARG A 662 -25.598 -13.730 0.997 1.00 0.00 C ATOM 1482 CD ARG A 662 -27.009 -13.576 0.550 1.00 0.00 C ATOM 1483 NE ARG A 662 -27.244 -14.251 -0.718 1.00 0.00 N ATOM 1484 CZ ARG A 662 -27.744 -13.657 -1.801 1.00 0.00 C ATOM 1485 NH1 ARG A 662 -28.406 -12.507 -1.693 1.00 0.00 N ATOM 1486 NH2 ARG A 662 -27.653 -14.257 -2.968 1.00 0.00 N ATOM 0 H ARG A 662 -23.401 -13.265 2.584 1.00 0.00 H new ATOM 0 HA ARG A 662 -23.983 -16.107 2.855 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -25.263 -15.805 0.625 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -26.113 -15.471 2.120 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -25.393 -13.020 1.799 1.00 0.00 H new ATOM 0 HG3 ARG A 662 -24.929 -13.482 0.173 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -27.678 -13.982 1.309 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -27.246 -12.517 0.449 1.00 0.00 H new ATOM 0 HE ARG A 662 -27.011 -15.242 -0.782 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -28.533 -12.076 -0.777 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -28.786 -12.057 -2.526 1.00 0.00 H new ATOM 0 HH21 ARG A 662 -27.203 -15.169 -3.039 1.00 0.00 H new ATOM 0 HH22 ARG A 662 -28.033 -13.810 -3.802 1.00 0.00 H new ATOM 1500 N PHE A 663 -21.781 -14.509 1.603 1.00 0.00 N ATOM 1501 CA PHE A 663 -20.553 -14.521 0.845 1.00 0.00 C ATOM 1502 C PHE A 663 -19.376 -14.506 1.779 1.00 0.00 C ATOM 1503 O PHE A 663 -19.493 -14.076 2.931 1.00 0.00 O ATOM 1504 CB PHE A 663 -20.450 -13.335 -0.138 1.00 0.00 C ATOM 1505 CG PHE A 663 -21.523 -13.314 -1.181 1.00 0.00 C ATOM 1506 CD1 PHE A 663 -22.749 -12.723 -0.943 1.00 0.00 C ATOM 1507 CD2 PHE A 663 -21.298 -13.903 -2.394 1.00 0.00 C ATOM 1508 CE1 PHE A 663 -23.728 -12.732 -1.911 1.00 0.00 C ATOM 1509 CE2 PHE A 663 -22.256 -13.922 -3.364 1.00 0.00 C ATOM 1510 CZ PHE A 663 -23.485 -13.336 -3.127 1.00 0.00 C ATOM 0 H PHE A 663 -21.794 -13.831 2.365 1.00 0.00 H new ATOM 0 HA PHE A 663 -20.552 -15.436 0.252 1.00 0.00 H new ATOM 0 HB2 PHE A 663 -20.489 -12.404 0.427 1.00 0.00 H new ATOM 0 HB3 PHE A 663 -19.479 -13.369 -0.631 1.00 0.00 H new ATOM 0 HD1 PHE A 663 -22.941 -12.251 0.009 1.00 0.00 H new ATOM 0 HD2 PHE A 663 -20.341 -14.363 -2.588 1.00 0.00 H new ATOM 0 HE1 PHE A 663 -24.684 -12.267 -1.719 1.00 0.00 H new ATOM 0 HE2 PHE A 663 -22.055 -14.394 -4.315 1.00 0.00 H new ATOM 0 HZ PHE A 663 -24.250 -13.351 -3.889 1.00 0.00 H new ATOM 1520 N LEU A 664 -18.280 -14.977 1.292 1.00 0.00 N ATOM 1521 CA LEU A 664 -17.041 -15.011 2.006 1.00 0.00 C ATOM 1522 C LEU A 664 -16.203 -13.862 1.510 1.00 0.00 C ATOM 1523 O LEU A 664 -16.250 -13.536 0.320 1.00 0.00 O ATOM 1524 CB LEU A 664 -16.314 -16.334 1.744 1.00 0.00 C ATOM 1525 CG LEU A 664 -17.072 -17.609 2.118 1.00 0.00 C ATOM 1526 CD1 LEU A 664 -16.276 -18.836 1.709 1.00 0.00 C ATOM 1527 CD2 LEU A 664 -17.362 -17.643 3.608 1.00 0.00 C ATOM 0 H LEU A 664 -18.215 -15.365 0.351 1.00 0.00 H new ATOM 0 HA LEU A 664 -17.218 -14.929 3.078 1.00 0.00 H new ATOM 0 HB2 LEU A 664 -16.064 -16.383 0.684 1.00 0.00 H new ATOM 0 HB3 LEU A 664 -15.373 -16.322 2.293 1.00 0.00 H new ATOM 0 HG LEU A 664 -18.021 -17.613 1.582 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -16.828 -19.735 1.982 1.00 0.00 H new ATOM 0 HD12 LEU A 664 -16.114 -18.822 0.631 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -15.313 -18.832 2.220 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -17.902 -18.558 3.853 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -16.424 -17.616 4.162 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -17.969 -16.780 3.880 1.00 0.00 H new ATOM 1539 N MET A 665 -15.464 -13.252 2.382 1.00 0.00 N ATOM 1540 CA MET A 665 -14.676 -12.104 2.020 1.00 0.00 C ATOM 1541 C MET A 665 -13.219 -12.525 1.994 1.00 0.00 C ATOM 1542 O MET A 665 -12.624 -12.818 3.039 1.00 0.00 O ATOM 1543 CB MET A 665 -14.938 -10.971 3.027 1.00 0.00 C ATOM 1544 CG MET A 665 -14.936 -9.577 2.418 1.00 0.00 C ATOM 1545 SD MET A 665 -15.809 -8.370 3.448 1.00 0.00 S ATOM 1546 CE MET A 665 -16.176 -7.083 2.232 1.00 0.00 C ATOM 0 H MET A 665 -15.386 -13.529 3.361 1.00 0.00 H new ATOM 0 HA MET A 665 -14.945 -11.728 1.033 1.00 0.00 H new ATOM 0 HB2 MET A 665 -15.901 -11.143 3.507 1.00 0.00 H new ATOM 0 HB3 MET A 665 -14.180 -11.014 3.809 1.00 0.00 H new ATOM 0 HG2 MET A 665 -13.907 -9.249 2.272 1.00 0.00 H new ATOM 0 HG3 MET A 665 -15.401 -9.614 1.433 1.00 0.00 H new ATOM 0 HE1 MET A 665 -15.623 -6.178 2.482 1.00 0.00 H new ATOM 0 HE2 MET A 665 -15.882 -7.425 1.240 1.00 0.00 H new ATOM 0 HE3 MET A 665 -17.245 -6.869 2.240 1.00 0.00 H new ATOM 1556 N LYS A 666 -12.663 -12.603 0.809 1.00 0.00 N ATOM 1557 CA LYS A 666 -11.315 -13.116 0.619 1.00 0.00 C ATOM 1558 C LYS A 666 -10.250 -12.084 0.970 1.00 0.00 C ATOM 1559 O LYS A 666 -9.413 -12.307 1.853 1.00 0.00 O ATOM 1560 CB LYS A 666 -11.135 -13.592 -0.827 1.00 0.00 C ATOM 1561 CG LYS A 666 -9.751 -14.152 -1.134 1.00 0.00 C ATOM 1562 CD LYS A 666 -9.627 -14.596 -2.582 1.00 0.00 C ATOM 1563 CE LYS A 666 -10.596 -15.719 -2.907 1.00 0.00 C ATOM 1564 NZ LYS A 666 -10.454 -16.172 -4.298 1.00 0.00 N ATOM 0 H LYS A 666 -13.126 -12.315 -0.053 1.00 0.00 H new ATOM 0 HA LYS A 666 -11.186 -13.957 1.300 1.00 0.00 H new ATOM 0 HB2 LYS A 666 -11.880 -14.358 -1.041 1.00 0.00 H new ATOM 0 HB3 LYS A 666 -11.334 -12.758 -1.500 1.00 0.00 H new ATOM 0 HG2 LYS A 666 -8.997 -13.394 -0.921 1.00 0.00 H new ATOM 0 HG3 LYS A 666 -9.547 -14.997 -0.477 1.00 0.00 H new ATOM 0 HD2 LYS A 666 -9.817 -13.749 -3.241 1.00 0.00 H new ATOM 0 HD3 LYS A 666 -8.607 -14.927 -2.775 1.00 0.00 H new ATOM 0 HE2 LYS A 666 -10.422 -16.557 -2.232 1.00 0.00 H new ATOM 0 HE3 LYS A 666 -11.618 -15.379 -2.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 -11.131 -16.939 -4.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 -10.644 -15.378 -4.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 -9.486 -16.519 -4.453 1.00 0.00 H new ATOM 1578 N GLY A 667 -10.304 -10.964 0.315 1.00 0.00 N ATOM 1579 CA GLY A 667 -9.304 -9.964 0.492 1.00 0.00 C ATOM 1580 C GLY A 667 -9.620 -9.016 1.618 1.00 0.00 C ATOM 1581 O GLY A 667 -10.591 -9.229 2.367 1.00 0.00 O ATOM 0 H GLY A 667 -11.037 -10.722 -0.351 1.00 0.00 H new ATOM 0 HA2 GLY A 667 -8.346 -10.445 0.687 1.00 0.00 H new ATOM 0 HA3 GLY A 667 -9.195 -9.398 -0.433 1.00 0.00 H new ATOM 1585 N PRO A 668 -8.799 -7.981 1.779 1.00 0.00 N ATOM 1586 CA PRO A 668 -8.988 -6.945 2.797 1.00 0.00 C ATOM 1587 C PRO A 668 -10.329 -6.270 2.635 1.00 0.00 C ATOM 1588 O PRO A 668 -10.629 -5.765 1.563 1.00 0.00 O ATOM 1589 CB PRO A 668 -7.880 -5.919 2.477 1.00 0.00 C ATOM 1590 CG PRO A 668 -7.429 -6.256 1.100 1.00 0.00 C ATOM 1591 CD PRO A 668 -7.597 -7.726 0.973 1.00 0.00 C ATOM 0 HA PRO A 668 -8.947 -7.350 3.808 1.00 0.00 H new ATOM 0 HB2 PRO A 668 -8.260 -4.899 2.529 1.00 0.00 H new ATOM 0 HB3 PRO A 668 -7.058 -5.990 3.190 1.00 0.00 H new ATOM 0 HG2 PRO A 668 -8.022 -5.728 0.353 1.00 0.00 H new ATOM 0 HG3 PRO A 668 -6.390 -5.966 0.946 1.00 0.00 H new ATOM 0 HD2 PRO A 668 -7.732 -8.031 -0.065 1.00 0.00 H new ATOM 0 HD3 PRO A 668 -6.731 -8.268 1.354 1.00 0.00 H new ATOM 1599 N ASN A 669 -11.125 -6.228 3.700 1.00 0.00 N ATOM 1600 CA ASN A 669 -12.450 -5.590 3.656 1.00 0.00 C ATOM 1601 C ASN A 669 -12.323 -4.113 3.463 1.00 0.00 C ATOM 1602 O ASN A 669 -13.281 -3.439 3.172 1.00 0.00 O ATOM 1603 CB ASN A 669 -13.272 -5.831 4.939 1.00 0.00 C ATOM 1604 CG ASN A 669 -12.576 -5.402 6.220 1.00 0.00 C ATOM 1605 OD1 ASN A 669 -11.355 -5.468 6.348 1.00 0.00 O ATOM 1606 ND2 ASN A 669 -13.336 -4.958 7.168 1.00 0.00 N ATOM 0 H ASN A 669 -10.881 -6.626 4.607 1.00 0.00 H new ATOM 0 HA ASN A 669 -12.970 -6.047 2.814 1.00 0.00 H new ATOM 0 HB2 ASN A 669 -14.217 -5.295 4.856 1.00 0.00 H new ATOM 0 HB3 ASN A 669 -13.512 -6.892 5.008 1.00 0.00 H new ATOM 0 HD21 ASN A 669 -12.925 -4.651 8.050 1.00 0.00 H new ATOM 0 HD22 ASN A 669 -14.346 -4.915 7.034 1.00 0.00 H new ATOM 1613 N LYS A 670 -11.146 -3.623 3.630 1.00 0.00 N ATOM 1614 CA LYS A 670 -10.910 -2.243 3.549 1.00 0.00 C ATOM 1615 C LYS A 670 -9.939 -1.985 2.407 1.00 0.00 C ATOM 1616 O LYS A 670 -9.091 -2.836 2.111 1.00 0.00 O ATOM 1617 CB LYS A 670 -10.291 -1.768 4.840 1.00 0.00 C ATOM 1618 CG LYS A 670 -10.858 -2.336 6.100 1.00 0.00 C ATOM 1619 CD LYS A 670 -9.817 -2.519 7.196 1.00 0.00 C ATOM 1620 CE LYS A 670 -9.132 -1.222 7.532 1.00 0.00 C ATOM 1621 NZ LYS A 670 -8.285 -1.323 8.734 1.00 0.00 N ATOM 0 H LYS A 670 -10.317 -4.183 3.828 1.00 0.00 H new ATOM 0 HA LYS A 670 -11.846 -1.712 3.376 1.00 0.00 H new ATOM 0 HB2 LYS A 670 -9.226 -1.997 4.812 1.00 0.00 H new ATOM 0 HB3 LYS A 670 -10.383 -0.683 4.883 1.00 0.00 H new ATOM 0 HG2 LYS A 670 -11.648 -1.679 6.464 1.00 0.00 H new ATOM 0 HG3 LYS A 670 -11.320 -3.299 5.882 1.00 0.00 H new ATOM 0 HD2 LYS A 670 -10.295 -2.921 8.089 1.00 0.00 H new ATOM 0 HD3 LYS A 670 -9.075 -3.250 6.875 1.00 0.00 H new ATOM 0 HE2 LYS A 670 -8.520 -0.909 6.686 1.00 0.00 H new ATOM 0 HE3 LYS A 670 -9.884 -0.448 7.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 -7.837 -0.403 8.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 -8.870 -1.595 9.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 -7.549 -2.042 8.581 1.00 0.00 H new ATOM 1635 N ILE A 671 -10.023 -0.815 1.792 1.00 0.00 N ATOM 1636 CA ILE A 671 -9.134 -0.465 0.699 1.00 0.00 C ATOM 1637 C ILE A 671 -8.704 0.972 0.861 1.00 0.00 C ATOM 1638 O ILE A 671 -9.498 1.800 1.286 1.00 0.00 O ATOM 1639 CB ILE A 671 -9.756 -0.642 -0.715 1.00 0.00 C ATOM 1640 CG1 ILE A 671 -10.904 0.341 -0.934 1.00 0.00 C ATOM 1641 CG2 ILE A 671 -10.245 -2.058 -0.906 1.00 0.00 C ATOM 1642 CD1 ILE A 671 -11.453 0.330 -2.326 1.00 0.00 C ATOM 0 H ILE A 671 -10.700 -0.091 2.033 1.00 0.00 H new ATOM 0 HA ILE A 671 -8.293 -1.156 0.756 1.00 0.00 H new ATOM 0 HB ILE A 671 -8.979 -0.435 -1.451 1.00 0.00 H new ATOM 0 HG12 ILE A 671 -11.707 0.108 -0.235 1.00 0.00 H new ATOM 0 HG13 ILE A 671 -10.558 1.347 -0.698 1.00 0.00 H new ATOM 0 HG21 ILE A 671 -10.677 -2.163 -1.901 1.00 0.00 H new ATOM 0 HG22 ILE A 671 -9.409 -2.749 -0.799 1.00 0.00 H new ATOM 0 HG23 ILE A 671 -11.002 -2.286 -0.156 1.00 0.00 H new ATOM 0 HD11 ILE A 671 -12.264 1.054 -2.403 1.00 0.00 H new ATOM 0 HD12 ILE A 671 -10.664 0.593 -3.030 1.00 0.00 H new ATOM 0 HD13 ILE A 671 -11.831 -0.665 -2.560 1.00 0.00 H new ATOM 1649 N GLN A 672 -7.482 1.259 0.567 1.00 0.00 N ATOM 1650 CA GLN A 672 -6.983 2.591 0.721 1.00 0.00 C ATOM 1651 C GLN A 672 -6.483 3.133 -0.583 1.00 0.00 C ATOM 1652 O GLN A 672 -6.058 2.377 -1.464 1.00 0.00 O ATOM 1653 CB GLN A 672 -5.949 2.752 1.856 1.00 0.00 C ATOM 1654 CG GLN A 672 -4.728 1.845 1.822 1.00 0.00 C ATOM 1655 CD GLN A 672 -4.996 0.417 2.311 1.00 0.00 C ATOM 1656 OE1 GLN A 672 -4.916 0.142 3.500 1.00 0.00 O ATOM 1657 NE2 GLN A 672 -5.247 -0.505 1.411 1.00 0.00 N ATOM 0 H GLN A 672 -6.801 0.586 0.215 1.00 0.00 H new ATOM 0 HA GLN A 672 -7.834 3.195 1.037 1.00 0.00 H new ATOM 0 HB2 GLN A 672 -5.602 3.785 1.852 1.00 0.00 H new ATOM 0 HB3 GLN A 672 -6.462 2.592 2.804 1.00 0.00 H new ATOM 0 HG2 GLN A 672 -4.348 1.803 0.801 1.00 0.00 H new ATOM 0 HG3 GLN A 672 -3.943 2.287 2.436 1.00 0.00 H new ATOM 0 HE21 GLN A 672 -5.309 -0.252 0.425 1.00 0.00 H new ATOM 0 HE22 GLN A 672 -5.380 -1.475 1.698 1.00 0.00 H new ATOM 1666 N CYS A 673 -6.550 4.419 -0.712 1.00 0.00 N ATOM 1667 CA CYS A 673 -6.202 5.091 -1.936 1.00 0.00 C ATOM 1668 C CYS A 673 -4.701 5.288 -2.063 1.00 0.00 C ATOM 1669 O CYS A 673 -4.127 6.204 -1.489 1.00 0.00 O ATOM 1670 CB CYS A 673 -6.933 6.433 -2.009 1.00 0.00 C ATOM 1671 SG CYS A 673 -6.404 7.511 -3.373 1.00 0.00 S ATOM 0 H CYS A 673 -6.851 5.045 0.035 1.00 0.00 H new ATOM 0 HA CYS A 673 -6.514 4.464 -2.771 1.00 0.00 H new ATOM 0 HB2 CYS A 673 -8.002 6.244 -2.106 1.00 0.00 H new ATOM 0 HB3 CYS A 673 -6.787 6.963 -1.068 1.00 0.00 H new ATOM 1676 N VAL A 674 -4.037 4.457 -2.808 1.00 0.00 N ATOM 1677 CA VAL A 674 -2.631 4.633 -2.934 1.00 0.00 C ATOM 1678 C VAL A 674 -2.274 5.563 -4.075 1.00 0.00 C ATOM 1679 O VAL A 674 -1.948 5.148 -5.175 1.00 0.00 O ATOM 1680 CB VAL A 674 -1.793 3.327 -2.902 1.00 0.00 C ATOM 1681 CG1 VAL A 674 -2.085 2.582 -1.642 1.00 0.00 C ATOM 1682 CG2 VAL A 674 -2.017 2.440 -4.100 1.00 0.00 C ATOM 0 H VAL A 674 -4.436 3.672 -3.323 1.00 0.00 H new ATOM 0 HA VAL A 674 -2.327 5.134 -2.015 1.00 0.00 H new ATOM 0 HB VAL A 674 -0.743 3.619 -2.936 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -1.497 1.664 -1.617 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -1.825 3.202 -0.784 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -3.146 2.335 -1.603 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -1.400 1.546 -4.011 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -3.067 2.153 -4.149 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -1.746 2.979 -5.008 1.00 0.00 H new ATOM 1686 N ASP A 675 -2.486 6.848 -3.803 1.00 0.00 N ATOM 1687 CA ASP A 675 -2.123 7.920 -4.709 1.00 0.00 C ATOM 1688 C ASP A 675 -2.918 7.822 -6.001 1.00 0.00 C ATOM 1689 O ASP A 675 -2.414 7.441 -7.046 1.00 0.00 O ATOM 1690 CB ASP A 675 -0.601 7.935 -4.959 1.00 0.00 C ATOM 1691 CG ASP A 675 -0.148 9.053 -5.880 1.00 0.00 C ATOM 1692 OD1 ASP A 675 -0.406 10.229 -5.580 1.00 0.00 O ATOM 1693 OD2 ASP A 675 0.535 8.777 -6.894 1.00 0.00 O ATOM 0 H ASP A 675 -2.919 7.171 -2.938 1.00 0.00 H new ATOM 0 HA ASP A 675 -2.379 8.872 -4.245 1.00 0.00 H new ATOM 0 HB2 ASP A 675 -0.085 8.031 -4.004 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -0.302 6.979 -5.388 1.00 0.00 H new ATOM 1698 N GLY A 676 -4.208 8.021 -5.881 1.00 0.00 N ATOM 1699 CA GLY A 676 -5.066 7.987 -7.044 1.00 0.00 C ATOM 1700 C GLY A 676 -5.583 6.595 -7.365 1.00 0.00 C ATOM 1701 O GLY A 676 -6.617 6.448 -8.030 1.00 0.00 O ATOM 0 H GLY A 676 -4.685 8.207 -4.999 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -5.913 8.654 -6.882 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -4.517 8.371 -7.904 1.00 0.00 H new ATOM 1705 N GLU A 677 -4.917 5.572 -6.866 1.00 0.00 N ATOM 1706 CA GLU A 677 -5.309 4.235 -7.155 1.00 0.00 C ATOM 1707 C GLU A 677 -5.704 3.491 -5.919 1.00 0.00 C ATOM 1708 O GLU A 677 -4.881 3.271 -5.044 1.00 0.00 O ATOM 1709 CB GLU A 677 -4.200 3.512 -7.855 1.00 0.00 C ATOM 1710 CG GLU A 677 -3.996 4.010 -9.256 1.00 0.00 C ATOM 1711 CD GLU A 677 -5.252 3.928 -10.094 1.00 0.00 C ATOM 1712 OE1 GLU A 677 -5.800 2.812 -10.249 1.00 0.00 O ATOM 1713 OE2 GLU A 677 -5.716 4.961 -10.611 1.00 0.00 O ATOM 0 H GLU A 677 -4.102 5.657 -6.259 1.00 0.00 H new ATOM 0 HA GLU A 677 -6.181 4.282 -7.807 1.00 0.00 H new ATOM 0 HB2 GLU A 677 -3.276 3.633 -7.290 1.00 0.00 H new ATOM 0 HB3 GLU A 677 -4.422 2.445 -7.879 1.00 0.00 H new ATOM 0 HG2 GLU A 677 -3.653 5.044 -9.223 1.00 0.00 H new ATOM 0 HG3 GLU A 677 -3.208 3.428 -9.733 1.00 0.00 H new ATOM 1720 N TRP A 678 -6.957 3.134 -5.814 1.00 0.00 N ATOM 1721 CA TRP A 678 -7.403 2.327 -4.695 1.00 0.00 C ATOM 1722 C TRP A 678 -6.767 0.955 -4.768 1.00 0.00 C ATOM 1723 O TRP A 678 -6.413 0.474 -5.864 1.00 0.00 O ATOM 1724 CB TRP A 678 -8.910 2.158 -4.690 1.00 0.00 C ATOM 1725 CG TRP A 678 -9.695 3.398 -4.394 1.00 0.00 C ATOM 1726 CD1 TRP A 678 -10.310 4.220 -5.284 1.00 0.00 C ATOM 1727 CD2 TRP A 678 -9.958 3.938 -3.100 1.00 0.00 C ATOM 1728 NE1 TRP A 678 -10.945 5.240 -4.622 1.00 0.00 N ATOM 1729 CE2 TRP A 678 -10.736 5.092 -3.274 1.00 0.00 C ATOM 1730 CE3 TRP A 678 -9.604 3.554 -1.816 1.00 0.00 C ATOM 1731 CZ2 TRP A 678 -11.168 5.866 -2.194 1.00 0.00 C ATOM 1732 CZ3 TRP A 678 -10.029 4.310 -0.756 1.00 0.00 C ATOM 1733 CH2 TRP A 678 -10.801 5.453 -0.949 1.00 0.00 C ATOM 0 H TRP A 678 -7.687 3.384 -6.481 1.00 0.00 H new ATOM 0 HA TRP A 678 -7.105 2.843 -3.782 1.00 0.00 H new ATOM 0 HB2 TRP A 678 -9.219 1.777 -5.663 1.00 0.00 H new ATOM 0 HB3 TRP A 678 -9.171 1.399 -3.953 1.00 0.00 H new ATOM 0 HD1 TRP A 678 -10.300 4.089 -6.356 1.00 0.00 H new ATOM 0 HE1 TRP A 678 -11.484 5.987 -5.060 1.00 0.00 H new ATOM 0 HE3 TRP A 678 -9.002 2.672 -1.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 -11.767 6.753 -2.340 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 -9.761 4.015 0.248 1.00 0.00 H new ATOM 0 HH2 TRP A 678 -11.117 6.026 -0.090 1.00 0.00 H new ATOM 1744 N THR A 679 -6.591 0.349 -3.631 1.00 0.00 N ATOM 1745 CA THR A 679 -6.049 -0.962 -3.558 1.00 0.00 C ATOM 1746 C THR A 679 -7.099 -2.011 -3.923 1.00 0.00 C ATOM 1747 O THR A 679 -8.280 -1.686 -4.129 1.00 0.00 O ATOM 1748 CB THR A 679 -5.455 -1.218 -2.164 1.00 0.00 C ATOM 1749 OG1 THR A 679 -6.395 -0.821 -1.148 1.00 0.00 O ATOM 1750 CG2 THR A 679 -4.170 -0.436 -1.995 1.00 0.00 C ATOM 0 H THR A 679 -6.823 0.759 -2.726 1.00 0.00 H new ATOM 0 HA THR A 679 -5.243 -1.045 -4.287 1.00 0.00 H new ATOM 0 HB THR A 679 -5.244 -2.283 -2.064 1.00 0.00 H new ATOM 0 HG1 THR A 679 -6.623 -1.596 -0.592 1.00 0.00 H new ATOM 0 HG21 THR A 679 -3.757 -0.624 -1.004 1.00 0.00 H new ATOM 0 HG22 THR A 679 -3.452 -0.749 -2.753 1.00 0.00 H new ATOM 0 HG23 THR A 679 -4.375 0.629 -2.106 1.00 0.00 H new ATOM 1758 N THR A 680 -6.666 -3.241 -4.013 1.00 0.00 N ATOM 1759 CA THR A 680 -7.504 -4.333 -4.403 1.00 0.00 C ATOM 1760 C THR A 680 -8.643 -4.545 -3.395 1.00 0.00 C ATOM 1761 O THR A 680 -8.413 -4.616 -2.176 1.00 0.00 O ATOM 1762 CB THR A 680 -6.637 -5.595 -4.521 1.00 0.00 C ATOM 1763 OG1 THR A 680 -5.420 -5.244 -5.223 1.00 0.00 O ATOM 1764 CG2 THR A 680 -7.363 -6.679 -5.304 1.00 0.00 C ATOM 0 H THR A 680 -5.703 -3.512 -3.813 1.00 0.00 H new ATOM 0 HA THR A 680 -7.965 -4.111 -5.365 1.00 0.00 H new ATOM 0 HB THR A 680 -6.419 -5.976 -3.523 1.00 0.00 H new ATOM 0 HG1 THR A 680 -4.851 -6.037 -5.307 1.00 0.00 H new ATOM 0 HG21 THR A 680 -6.729 -7.563 -5.375 1.00 0.00 H new ATOM 0 HG22 THR A 680 -8.291 -6.937 -4.793 1.00 0.00 H new ATOM 0 HG23 THR A 680 -7.590 -6.314 -6.306 1.00 0.00 H new ATOM 1772 N LEU A 681 -9.857 -4.602 -3.922 1.00 0.00 N ATOM 1773 CA LEU A 681 -11.055 -4.798 -3.131 1.00 0.00 C ATOM 1774 C LEU A 681 -11.100 -6.147 -2.426 1.00 0.00 C ATOM 1775 O LEU A 681 -10.392 -7.087 -2.809 1.00 0.00 O ATOM 1776 CB LEU A 681 -12.330 -4.580 -3.963 1.00 0.00 C ATOM 1777 CG LEU A 681 -12.924 -3.182 -3.887 1.00 0.00 C ATOM 1778 CD1 LEU A 681 -12.045 -2.162 -4.548 1.00 0.00 C ATOM 1779 CD2 LEU A 681 -14.317 -3.158 -4.431 1.00 0.00 C ATOM 0 H LEU A 681 -10.036 -4.512 -4.922 1.00 0.00 H new ATOM 0 HA LEU A 681 -11.015 -4.037 -2.351 1.00 0.00 H new ATOM 0 HB2 LEU A 681 -12.107 -4.806 -5.006 1.00 0.00 H new ATOM 0 HB3 LEU A 681 -13.084 -5.296 -3.636 1.00 0.00 H new ATOM 0 HG LEU A 681 -12.980 -2.907 -2.834 1.00 0.00 H new ATOM 0 HD11 LEU A 681 -12.507 -1.178 -4.470 1.00 0.00 H new ATOM 0 HD12 LEU A 681 -11.073 -2.146 -4.056 1.00 0.00 H new ATOM 0 HD13 LEU A 681 -11.915 -2.420 -5.599 1.00 0.00 H new ATOM 0 HD21 LEU A 681 -14.716 -2.146 -4.364 1.00 0.00 H new ATOM 0 HD22 LEU A 681 -14.306 -3.475 -5.474 1.00 0.00 H new ATOM 0 HD23 LEU A 681 -14.945 -3.835 -3.852 1.00 0.00 H new ATOM 1791 N PRO A 682 -11.960 -6.261 -1.389 1.00 0.00 N ATOM 1792 CA PRO A 682 -12.101 -7.487 -0.582 1.00 0.00 C ATOM 1793 C PRO A 682 -12.582 -8.698 -1.340 1.00 0.00 C ATOM 1794 O PRO A 682 -12.442 -9.804 -0.850 1.00 0.00 O ATOM 1795 CB PRO A 682 -13.100 -7.110 0.493 1.00 0.00 C ATOM 1796 CG PRO A 682 -13.809 -5.907 -0.024 1.00 0.00 C ATOM 1797 CD PRO A 682 -12.827 -5.172 -0.864 1.00 0.00 C ATOM 0 HA PRO A 682 -11.125 -7.793 -0.205 1.00 0.00 H new ATOM 0 HB2 PRO A 682 -13.798 -7.925 0.683 1.00 0.00 H new ATOM 0 HB3 PRO A 682 -12.598 -6.894 1.436 1.00 0.00 H new ATOM 0 HG2 PRO A 682 -14.684 -6.193 -0.608 1.00 0.00 H new ATOM 0 HG3 PRO A 682 -14.164 -5.282 0.796 1.00 0.00 H new ATOM 0 HD2 PRO A 682 -13.315 -4.621 -1.668 1.00 0.00 H new ATOM 0 HD3 PRO A 682 -12.258 -4.448 -0.281 1.00 0.00 H new ATOM 1805 N VAL A 683 -13.160 -8.464 -2.504 1.00 0.00 N ATOM 1806 CA VAL A 683 -13.620 -9.507 -3.432 1.00 0.00 C ATOM 1807 C VAL A 683 -14.333 -10.725 -2.780 1.00 0.00 C ATOM 1808 O VAL A 683 -13.713 -11.696 -2.335 1.00 0.00 O ATOM 1809 CB VAL A 683 -12.544 -9.941 -4.475 1.00 0.00 C ATOM 1810 CG1 VAL A 683 -12.209 -8.791 -5.411 1.00 0.00 C ATOM 1811 CG2 VAL A 683 -11.265 -10.497 -3.836 1.00 0.00 C ATOM 0 H VAL A 683 -13.332 -7.520 -2.849 1.00 0.00 H new ATOM 0 HA VAL A 683 -14.408 -8.997 -3.986 1.00 0.00 H new ATOM 0 HB VAL A 683 -12.987 -10.758 -5.045 1.00 0.00 H new ATOM 0 HG11 VAL A 683 -11.457 -9.115 -6.130 1.00 0.00 H new ATOM 0 HG12 VAL A 683 -13.109 -8.480 -5.942 1.00 0.00 H new ATOM 0 HG13 VAL A 683 -11.821 -7.952 -4.833 1.00 0.00 H new ATOM 0 HG21 VAL A 683 -10.560 -10.779 -4.618 1.00 0.00 H new ATOM 0 HG22 VAL A 683 -10.815 -9.735 -3.200 1.00 0.00 H new ATOM 0 HG23 VAL A 683 -11.510 -11.373 -3.235 1.00 0.00 H new ATOM 1815 N CYS A 684 -15.632 -10.656 -2.732 1.00 0.00 N ATOM 1816 CA CYS A 684 -16.410 -11.697 -2.114 1.00 0.00 C ATOM 1817 C CYS A 684 -16.867 -12.745 -3.071 1.00 0.00 C ATOM 1818 O CYS A 684 -17.024 -12.487 -4.270 1.00 0.00 O ATOM 1819 CB CYS A 684 -17.573 -11.129 -1.379 1.00 0.00 C ATOM 1820 SG CYS A 684 -17.066 -10.284 0.092 1.00 0.00 S ATOM 0 H CYS A 684 -16.180 -9.886 -3.115 1.00 0.00 H new ATOM 0 HA CYS A 684 -15.741 -12.189 -1.408 1.00 0.00 H new ATOM 0 HB2 CYS A 684 -18.112 -10.439 -2.028 1.00 0.00 H new ATOM 0 HB3 CYS A 684 -18.266 -11.929 -1.119 1.00 0.00 H new ATOM 1825 N ILE A 685 -17.104 -13.908 -2.529 1.00 0.00 N ATOM 1826 CA ILE A 685 -17.504 -15.075 -3.258 1.00 0.00 C ATOM 1827 C ILE A 685 -18.543 -15.805 -2.460 1.00 0.00 C ATOM 1828 O ILE A 685 -18.562 -15.683 -1.250 1.00 0.00 O ATOM 1829 CB ILE A 685 -16.326 -16.050 -3.594 1.00 0.00 C ATOM 1830 CG1 ILE A 685 -15.439 -16.378 -2.342 1.00 0.00 C ATOM 1831 CG2 ILE A 685 -15.486 -15.540 -4.756 1.00 0.00 C ATOM 1832 CD1 ILE A 685 -14.458 -15.295 -1.921 1.00 0.00 C ATOM 0 H ILE A 685 -17.020 -14.073 -1.526 1.00 0.00 H new ATOM 0 HA ILE A 685 -17.897 -14.733 -4.216 1.00 0.00 H new ATOM 0 HB ILE A 685 -16.783 -16.989 -3.906 1.00 0.00 H new ATOM 0 HG12 ILE A 685 -16.098 -16.592 -1.500 1.00 0.00 H new ATOM 0 HG13 ILE A 685 -14.878 -17.290 -2.547 1.00 0.00 H new ATOM 0 HG21 ILE A 685 -14.679 -16.244 -4.958 1.00 0.00 H new ATOM 0 HG22 ILE A 685 -16.113 -15.442 -5.642 1.00 0.00 H new ATOM 0 HG23 ILE A 685 -15.064 -14.568 -4.501 1.00 0.00 H new ATOM 0 HD11 ILE A 685 -13.899 -15.630 -1.047 1.00 0.00 H new ATOM 0 HD12 ILE A 685 -13.766 -15.093 -2.739 1.00 0.00 H new ATOM 0 HD13 ILE A 685 -15.005 -14.385 -1.675 1.00 0.00 H new ATOM 1839 N VAL A 686 -19.406 -16.529 -3.132 1.00 0.00 N ATOM 1840 CA VAL A 686 -20.524 -17.219 -2.497 1.00 0.00 C ATOM 1841 C VAL A 686 -20.071 -18.192 -1.387 1.00 0.00 C ATOM 1842 O VAL A 686 -19.065 -18.915 -1.530 1.00 0.00 O ATOM 1843 CB VAL A 686 -21.428 -17.934 -3.545 1.00 0.00 C ATOM 1844 CG1 VAL A 686 -20.703 -19.062 -4.262 1.00 0.00 C ATOM 1845 CG2 VAL A 686 -22.724 -18.416 -2.921 1.00 0.00 C ATOM 0 H VAL A 686 -19.359 -16.662 -4.142 1.00 0.00 H new ATOM 0 HA VAL A 686 -21.123 -16.449 -2.011 1.00 0.00 H new ATOM 0 HB VAL A 686 -21.679 -17.191 -4.302 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -21.376 -19.528 -4.982 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -19.834 -18.662 -4.784 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -20.378 -19.806 -3.535 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -23.331 -18.910 -3.679 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -22.502 -19.120 -2.119 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -23.271 -17.565 -2.516 1.00 0.00 H new ATOM 1849 N GLU A 687 -20.790 -18.162 -0.288 1.00 0.00 N ATOM 1850 CA GLU A 687 -20.517 -18.994 0.850 1.00 0.00 C ATOM 1851 C GLU A 687 -21.160 -20.361 0.618 1.00 0.00 C ATOM 1852 O GLU A 687 -20.478 -21.278 0.137 1.00 0.00 O ATOM 1853 CB GLU A 687 -21.106 -18.338 2.097 1.00 0.00 C ATOM 1854 CG GLU A 687 -20.785 -19.026 3.401 1.00 0.00 C ATOM 1855 CD GLU A 687 -21.607 -18.477 4.531 1.00 0.00 C ATOM 1856 OE1 GLU A 687 -21.219 -17.459 5.140 1.00 0.00 O ATOM 1857 OE2 GLU A 687 -22.673 -19.068 4.826 1.00 0.00 O ATOM 1858 OXT GLU A 687 -22.366 -20.517 0.873 1.00 0.00 O ATOM 0 H GLU A 687 -21.594 -17.546 -0.163 1.00 0.00 H new ATOM 0 HA GLU A 687 -19.443 -19.118 0.988 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -20.748 -17.310 2.150 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -22.189 -18.293 1.986 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -20.968 -20.096 3.303 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -19.726 -18.903 3.627 1.00 0.00 H new