USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=25 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= -1.25 K(o=-3,f=-1.7) USER MOD Set 1.2: A 679 THR OG1 : rot 180:sc= -1.76! USER MOD Set 2.1: A 602 THR OG1 : rot 100:sc= 0 USER MOD Set 2.2: A 651 HIS : no HE2:sc= -1.91 K(o=-1.9,f=-7.8!) USER MOD Set 2.3: A 652 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 594 LYS NZ :NH3+ -137:sc= 1.12 (180deg=-2.11!) USER MOD Set 3.2: A 607 ASN : amide:sc= 1.04 K(o=2.2,f=-6.9) USER MOD Single : A 573 LYS NZ :NH3+ 168:sc= -0.048 (180deg=-0.305) USER MOD Single : A 577 HIS : no HD1:sc= -0.0516 X(o=-0.052,f=-0.46) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 584 LYS NZ :NH3+ 172:sc= 1.26 (180deg=1.1) USER MOD Single : A 586 GLN : amide:sc= -1.25 K(o=-1.3,f=-0.052) USER MOD Single : A 587 TYR OH : rot 130:sc= 0.175 USER MOD Single : A 588 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+ 179:sc= 0 (180deg=-0.00279) USER MOD Single : A 608 SER OG : rot 42:sc= 0.175 USER MOD Single : A 610 GLN : amide:sc= -0.54 X(o=-0.54,f=-0.23) USER MOD Single : A 612 TYR OH : rot 180:sc= 0 USER MOD Single : A 613 HIS : no HD1:sc= 0 X(o=0,f=-0.0039) USER MOD Single : A 617 SER OG : rot -167:sc= 1.04 USER MOD Single : A 624 LYS NZ :NH3+ 159:sc= 1.18 (180deg=1.02) USER MOD Single : A 626 GLN : amide:sc= -0.329 X(o=-0.33,f=-0.59) USER MOD Single : A 628 GLN : amide:sc= -1.03 K(o=-1,f=-0.37) USER MOD Single : A 629 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -1.9! K(o=-1.9!,f=0) USER MOD Single : A 640 ASN : amide:sc= -2.98! C(o=-3!,f=-1.8!) USER MOD Single : A 642 LYS NZ :NH3+ -161:sc= 1.22 (180deg=1.21) USER MOD Single : A 644 LYS NZ :NH3+ 166:sc=-0.00564 (180deg=-0.142) USER MOD Single : A 645 THR OG1 : rot 40:sc= 0.239 USER MOD Single : A 646 LYS NZ :NH3+ 144:sc= 0.793 (180deg=-0.144) USER MOD Single : A 649 TYR OH : rot -51:sc= 1.01 USER MOD Single : A 657 TYR OH : rot 24:sc= 0.601 USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 660 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 665 MET CE :methyl -116:sc= -1.79 (180deg=-9.55!) USER MOD Single : A 666 LYS NZ :NH3+ -169:sc= -0.0162 (180deg=-0.154) USER MOD Single : A 669 ASN : amide:sc= -1.33! C(o=-1.3!,f=-7.5!) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 84 N GLU A 568 25.835 -10.066 -1.226 1.00 0.00 N ATOM 85 CA GLU A 568 24.765 -9.786 -0.321 1.00 0.00 C ATOM 86 C GLU A 568 24.161 -8.490 -0.741 1.00 0.00 C ATOM 87 O GLU A 568 24.705 -7.796 -1.607 1.00 0.00 O ATOM 88 CB GLU A 568 25.257 -9.663 1.118 1.00 0.00 C ATOM 89 CG GLU A 568 25.714 -10.954 1.731 1.00 0.00 C ATOM 90 CD GLU A 568 26.277 -10.765 3.106 1.00 0.00 C ATOM 91 OE1 GLU A 568 27.453 -10.399 3.228 1.00 0.00 O ATOM 92 OE2 GLU A 568 25.557 -11.002 4.098 1.00 0.00 O ATOM 0 HA GLU A 568 24.044 -10.603 -0.351 1.00 0.00 H new ATOM 0 HB2 GLU A 568 26.081 -8.950 1.147 1.00 0.00 H new ATOM 0 HB3 GLU A 568 24.455 -9.249 1.729 1.00 0.00 H new ATOM 0 HG2 GLU A 568 24.875 -11.648 1.777 1.00 0.00 H new ATOM 0 HG3 GLU A 568 26.470 -11.409 1.091 1.00 0.00 H new ATOM 99 N CYS A 569 23.089 -8.153 -0.149 1.00 0.00 N ATOM 100 CA CYS A 569 22.417 -6.952 -0.478 1.00 0.00 C ATOM 101 C CYS A 569 22.783 -5.813 0.461 1.00 0.00 C ATOM 102 O CYS A 569 22.637 -5.923 1.663 1.00 0.00 O ATOM 103 CB CYS A 569 20.930 -7.206 -0.457 1.00 0.00 C ATOM 104 SG CYS A 569 20.315 -8.214 -1.844 1.00 0.00 S ATOM 0 H CYS A 569 22.643 -8.702 0.585 1.00 0.00 H new ATOM 0 HA CYS A 569 22.729 -6.642 -1.475 1.00 0.00 H new ATOM 0 HB2 CYS A 569 20.672 -7.703 0.478 1.00 0.00 H new ATOM 0 HB3 CYS A 569 20.411 -6.248 -0.463 1.00 0.00 H new ATOM 109 N GLU A 570 23.290 -4.753 -0.092 1.00 0.00 N ATOM 110 CA GLU A 570 23.550 -3.533 0.638 1.00 0.00 C ATOM 111 C GLU A 570 22.402 -2.622 0.333 1.00 0.00 C ATOM 112 O GLU A 570 21.920 -2.641 -0.787 1.00 0.00 O ATOM 113 CB GLU A 570 24.839 -2.853 0.155 1.00 0.00 C ATOM 114 CG GLU A 570 26.123 -3.593 0.456 1.00 0.00 C ATOM 115 CD GLU A 570 27.321 -2.896 -0.156 1.00 0.00 C ATOM 116 OE1 GLU A 570 27.614 -1.727 0.207 1.00 0.00 O ATOM 117 OE2 GLU A 570 27.974 -3.483 -1.044 1.00 0.00 O ATOM 0 H GLU A 570 23.541 -4.703 -1.079 1.00 0.00 H new ATOM 0 HA GLU A 570 23.661 -3.748 1.701 1.00 0.00 H new ATOM 0 HB2 GLU A 570 24.769 -2.707 -0.923 1.00 0.00 H new ATOM 0 HB3 GLU A 570 24.897 -1.863 0.607 1.00 0.00 H new ATOM 0 HG2 GLU A 570 26.256 -3.668 1.535 1.00 0.00 H new ATOM 0 HG3 GLU A 570 26.057 -4.611 0.071 1.00 0.00 H new ATOM 124 N LEU A 571 21.927 -1.895 1.314 1.00 0.00 N ATOM 125 CA LEU A 571 20.850 -0.944 1.126 1.00 0.00 C ATOM 126 C LEU A 571 21.282 0.092 0.050 1.00 0.00 C ATOM 127 O LEU A 571 22.212 0.871 0.260 1.00 0.00 O ATOM 128 CB LEU A 571 20.532 -0.267 2.480 1.00 0.00 C ATOM 129 CG LEU A 571 19.122 0.338 2.690 1.00 0.00 C ATOM 130 CD1 LEU A 571 18.996 0.852 4.107 1.00 0.00 C ATOM 131 CD2 LEU A 571 18.806 1.458 1.707 1.00 0.00 C ATOM 0 H LEU A 571 22.276 -1.944 2.271 1.00 0.00 H new ATOM 0 HA LEU A 571 19.944 -1.441 0.778 1.00 0.00 H new ATOM 0 HB2 LEU A 571 20.697 -1.004 3.266 1.00 0.00 H new ATOM 0 HB3 LEU A 571 21.261 0.529 2.632 1.00 0.00 H new ATOM 0 HG LEU A 571 18.401 -0.459 2.509 1.00 0.00 H new ATOM 0 HD11 LEU A 571 18.003 1.277 4.253 1.00 0.00 H new ATOM 0 HD12 LEU A 571 19.145 0.030 4.807 1.00 0.00 H new ATOM 0 HD13 LEU A 571 19.749 1.620 4.284 1.00 0.00 H new ATOM 0 HD21 LEU A 571 17.805 1.843 1.903 1.00 0.00 H new ATOM 0 HD22 LEU A 571 19.533 2.262 1.825 1.00 0.00 H new ATOM 0 HD23 LEU A 571 18.853 1.072 0.689 1.00 0.00 H new ATOM 143 N PRO A 572 20.620 0.065 -1.110 1.00 0.00 N ATOM 144 CA PRO A 572 20.964 0.903 -2.254 1.00 0.00 C ATOM 145 C PRO A 572 20.346 2.308 -2.168 1.00 0.00 C ATOM 146 O PRO A 572 19.983 2.783 -1.083 1.00 0.00 O ATOM 147 CB PRO A 572 20.356 0.118 -3.413 1.00 0.00 C ATOM 148 CG PRO A 572 19.156 -0.535 -2.830 1.00 0.00 C ATOM 149 CD PRO A 572 19.468 -0.803 -1.393 1.00 0.00 C ATOM 0 HA PRO A 572 22.036 1.084 -2.337 1.00 0.00 H new ATOM 0 HB2 PRO A 572 20.088 0.775 -4.240 1.00 0.00 H new ATOM 0 HB3 PRO A 572 21.058 -0.618 -3.805 1.00 0.00 H new ATOM 0 HG2 PRO A 572 18.282 0.109 -2.922 1.00 0.00 H new ATOM 0 HG3 PRO A 572 18.926 -1.462 -3.355 1.00 0.00 H new ATOM 0 HD2 PRO A 572 18.621 -0.564 -0.750 1.00 0.00 H new ATOM 0 HD3 PRO A 572 19.709 -1.853 -1.226 1.00 0.00 H new ATOM 157 N LYS A 573 20.226 2.965 -3.300 1.00 0.00 N ATOM 158 CA LYS A 573 19.671 4.289 -3.348 1.00 0.00 C ATOM 159 C LYS A 573 18.167 4.204 -3.344 1.00 0.00 C ATOM 160 O LYS A 573 17.547 4.003 -4.386 1.00 0.00 O ATOM 161 CB LYS A 573 20.142 5.086 -4.598 1.00 0.00 C ATOM 162 CG LYS A 573 21.611 5.538 -4.622 1.00 0.00 C ATOM 163 CD LYS A 573 22.604 4.385 -4.605 1.00 0.00 C ATOM 164 CE LYS A 573 24.035 4.884 -4.704 1.00 0.00 C ATOM 165 NZ LYS A 573 24.367 5.858 -3.640 1.00 0.00 N ATOM 0 H LYS A 573 20.510 2.594 -4.207 1.00 0.00 H new ATOM 0 HA LYS A 573 20.026 4.824 -2.467 1.00 0.00 H new ATOM 0 HB2 LYS A 573 19.962 4.471 -5.480 1.00 0.00 H new ATOM 0 HB3 LYS A 573 19.513 5.971 -4.693 1.00 0.00 H new ATOM 0 HG2 LYS A 573 21.782 6.141 -5.514 1.00 0.00 H new ATOM 0 HG3 LYS A 573 21.799 6.181 -3.762 1.00 0.00 H new ATOM 0 HD2 LYS A 573 22.480 3.810 -3.687 1.00 0.00 H new ATOM 0 HD3 LYS A 573 22.394 3.710 -5.435 1.00 0.00 H new ATOM 0 HE2 LYS A 573 24.718 4.036 -4.643 1.00 0.00 H new ATOM 0 HE3 LYS A 573 24.189 5.348 -5.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 573 25.395 6.015 -3.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 573 23.883 6.758 -3.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 573 24.057 5.486 -2.720 1.00 0.00 H new ATOM 179 N ILE A 574 17.592 4.254 -2.174 1.00 0.00 N ATOM 180 CA ILE A 574 16.155 4.276 -2.048 1.00 0.00 C ATOM 181 C ILE A 574 15.615 5.644 -2.486 1.00 0.00 C ATOM 182 O ILE A 574 15.308 5.859 -3.661 1.00 0.00 O ATOM 183 CB ILE A 574 15.672 3.907 -0.605 1.00 0.00 C ATOM 184 CG1 ILE A 574 16.545 4.598 0.470 1.00 0.00 C ATOM 185 CG2 ILE A 574 15.684 2.399 -0.413 1.00 0.00 C ATOM 186 CD1 ILE A 574 15.950 4.587 1.848 1.00 0.00 C ATOM 0 H ILE A 574 18.097 4.281 -1.288 1.00 0.00 H new ATOM 0 HA ILE A 574 15.752 3.507 -2.707 1.00 0.00 H new ATOM 0 HB ILE A 574 14.650 4.267 -0.488 1.00 0.00 H new ATOM 0 HG12 ILE A 574 17.517 4.107 0.503 1.00 0.00 H new ATOM 0 HG13 ILE A 574 16.720 5.631 0.170 1.00 0.00 H new ATOM 0 HG21 ILE A 574 15.346 2.158 0.595 1.00 0.00 H new ATOM 0 HG22 ILE A 574 15.018 1.934 -1.140 1.00 0.00 H new ATOM 0 HG23 ILE A 574 16.697 2.022 -0.556 1.00 0.00 H new ATOM 0 HD11 ILE A 574 16.625 5.091 2.540 1.00 0.00 H new ATOM 0 HD12 ILE A 574 14.991 5.105 1.834 1.00 0.00 H new ATOM 0 HD13 ILE A 574 15.801 3.557 2.172 1.00 0.00 H new ATOM 193 N ASP A 575 15.548 6.547 -1.565 1.00 0.00 N ATOM 194 CA ASP A 575 15.193 7.907 -1.801 1.00 0.00 C ATOM 195 C ASP A 575 15.715 8.641 -0.610 1.00 0.00 C ATOM 196 O ASP A 575 16.171 8.004 0.344 1.00 0.00 O ATOM 197 CB ASP A 575 13.689 8.089 -1.837 1.00 0.00 C ATOM 198 CG ASP A 575 13.278 9.431 -2.393 1.00 0.00 C ATOM 199 OD1 ASP A 575 13.358 9.643 -3.613 1.00 0.00 O ATOM 200 OD2 ASP A 575 12.952 10.330 -1.598 1.00 0.00 O ATOM 0 H ASP A 575 15.748 6.348 -0.585 1.00 0.00 H new ATOM 0 HA ASP A 575 15.592 8.254 -2.754 1.00 0.00 H new ATOM 0 HB2 ASP A 575 13.246 7.298 -2.442 1.00 0.00 H new ATOM 0 HB3 ASP A 575 13.290 7.980 -0.829 1.00 0.00 H new ATOM 205 N VAL A 576 15.646 9.917 -0.621 1.00 0.00 N ATOM 206 CA VAL A 576 16.069 10.686 0.504 1.00 0.00 C ATOM 207 C VAL A 576 14.933 10.745 1.545 1.00 0.00 C ATOM 208 O VAL A 576 15.174 10.781 2.757 1.00 0.00 O ATOM 209 CB VAL A 576 16.542 12.106 0.081 1.00 0.00 C ATOM 210 CG1 VAL A 576 15.418 12.904 -0.554 1.00 0.00 C ATOM 211 CG2 VAL A 576 17.146 12.860 1.243 1.00 0.00 C ATOM 0 H VAL A 576 15.296 10.467 -1.406 1.00 0.00 H new ATOM 0 HA VAL A 576 16.931 10.199 0.960 1.00 0.00 H new ATOM 0 HB VAL A 576 17.320 11.971 -0.670 1.00 0.00 H new ATOM 0 HG11 VAL A 576 15.786 13.890 -0.836 1.00 0.00 H new ATOM 0 HG12 VAL A 576 15.058 12.383 -1.441 1.00 0.00 H new ATOM 0 HG13 VAL A 576 14.601 13.012 0.159 1.00 0.00 H new ATOM 0 HG21 VAL A 576 17.465 13.848 0.910 1.00 0.00 H new ATOM 0 HG22 VAL A 576 16.403 12.966 2.033 1.00 0.00 H new ATOM 0 HG23 VAL A 576 18.006 12.311 1.625 1.00 0.00 H new ATOM 215 N HIS A 577 13.699 10.672 1.068 1.00 0.00 N ATOM 216 CA HIS A 577 12.532 10.733 1.938 1.00 0.00 C ATOM 217 C HIS A 577 11.990 9.360 2.229 1.00 0.00 C ATOM 218 O HIS A 577 10.988 9.229 2.908 1.00 0.00 O ATOM 219 CB HIS A 577 11.427 11.608 1.333 1.00 0.00 C ATOM 220 CG HIS A 577 11.698 13.075 1.405 1.00 0.00 C ATOM 221 ND1 HIS A 577 12.084 13.822 0.324 1.00 0.00 N ATOM 222 CD2 HIS A 577 11.594 13.943 2.438 1.00 0.00 C ATOM 223 CE1 HIS A 577 12.211 15.076 0.675 1.00 0.00 C ATOM 224 NE2 HIS A 577 11.916 15.185 1.953 1.00 0.00 N ATOM 0 H HIS A 577 13.479 10.570 0.077 1.00 0.00 H new ATOM 0 HA HIS A 577 12.860 11.184 2.875 1.00 0.00 H new ATOM 0 HB2 HIS A 577 11.287 11.327 0.289 1.00 0.00 H new ATOM 0 HB3 HIS A 577 10.490 11.398 1.848 1.00 0.00 H new ATOM 0 HD2 HIS A 577 11.311 13.703 3.452 1.00 0.00 H new ATOM 0 HE1 HIS A 577 12.508 15.886 0.025 1.00 0.00 H new ATOM 0 HE2 HIS A 577 11.925 16.050 2.493 1.00 0.00 H new ATOM 233 N LEU A 578 12.666 8.356 1.738 1.00 0.00 N ATOM 234 CA LEU A 578 12.247 6.976 1.892 1.00 0.00 C ATOM 235 C LEU A 578 12.997 6.411 3.093 1.00 0.00 C ATOM 236 O LEU A 578 14.118 6.839 3.386 1.00 0.00 O ATOM 237 CB LEU A 578 12.618 6.225 0.594 1.00 0.00 C ATOM 238 CG LEU A 578 11.952 4.885 0.237 1.00 0.00 C ATOM 239 CD1 LEU A 578 12.383 3.804 1.102 1.00 0.00 C ATOM 240 CD2 LEU A 578 10.464 4.987 0.166 1.00 0.00 C ATOM 0 H LEU A 578 13.533 8.467 1.213 1.00 0.00 H new ATOM 0 HA LEU A 578 11.174 6.877 2.059 1.00 0.00 H new ATOM 0 HB2 LEU A 578 12.428 6.907 -0.235 1.00 0.00 H new ATOM 0 HB3 LEU A 578 13.693 6.050 0.623 1.00 0.00 H new ATOM 0 HG LEU A 578 12.295 4.636 -0.767 1.00 0.00 H new ATOM 0 HD11 LEU A 578 11.883 2.881 0.807 1.00 0.00 H new ATOM 0 HD12 LEU A 578 13.462 3.676 1.015 1.00 0.00 H new ATOM 0 HD13 LEU A 578 12.128 4.041 2.135 1.00 0.00 H new ATOM 0 HD21 LEU A 578 10.044 4.014 -0.089 1.00 0.00 H new ATOM 0 HD22 LEU A 578 10.075 5.308 1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 578 10.185 5.714 -0.597 1.00 0.00 H new ATOM 252 N VAL A 579 12.373 5.511 3.804 1.00 0.00 N ATOM 253 CA VAL A 579 12.949 4.892 4.973 1.00 0.00 C ATOM 254 C VAL A 579 12.585 3.420 4.946 1.00 0.00 C ATOM 255 O VAL A 579 11.398 3.073 4.887 1.00 0.00 O ATOM 256 CB VAL A 579 12.352 5.446 6.293 1.00 0.00 C ATOM 257 CG1 VAL A 579 13.188 5.047 7.491 1.00 0.00 C ATOM 258 CG2 VAL A 579 12.068 6.939 6.259 1.00 0.00 C ATOM 0 H VAL A 579 11.433 5.180 3.585 1.00 0.00 H new ATOM 0 HA VAL A 579 14.021 5.085 4.949 1.00 0.00 H new ATOM 0 HB VAL A 579 11.375 4.975 6.400 1.00 0.00 H new ATOM 0 HG11 VAL A 579 12.740 5.452 8.398 1.00 0.00 H new ATOM 0 HG12 VAL A 579 13.228 3.960 7.561 1.00 0.00 H new ATOM 0 HG13 VAL A 579 14.198 5.441 7.377 1.00 0.00 H new ATOM 0 HG21 VAL A 579 11.652 7.252 7.217 1.00 0.00 H new ATOM 0 HG22 VAL A 579 12.995 7.481 6.071 1.00 0.00 H new ATOM 0 HG23 VAL A 579 11.353 7.155 5.465 1.00 0.00 H new ATOM 262 N PRO A 580 13.554 2.550 4.939 1.00 0.00 N ATOM 263 CA PRO A 580 13.317 1.125 5.036 1.00 0.00 C ATOM 264 C PRO A 580 12.911 0.697 6.465 1.00 0.00 C ATOM 265 O PRO A 580 13.427 1.207 7.460 1.00 0.00 O ATOM 266 CB PRO A 580 14.655 0.519 4.642 1.00 0.00 C ATOM 267 CG PRO A 580 15.651 1.559 5.009 1.00 0.00 C ATOM 268 CD PRO A 580 14.966 2.878 4.795 1.00 0.00 C ATOM 0 HA PRO A 580 12.491 0.798 4.404 1.00 0.00 H new ATOM 0 HB2 PRO A 580 14.841 -0.415 5.173 1.00 0.00 H new ATOM 0 HB3 PRO A 580 14.691 0.292 3.576 1.00 0.00 H new ATOM 0 HG2 PRO A 580 15.968 1.447 6.046 1.00 0.00 H new ATOM 0 HG3 PRO A 580 16.545 1.479 4.391 1.00 0.00 H new ATOM 0 HD2 PRO A 580 15.283 3.620 5.528 1.00 0.00 H new ATOM 0 HD3 PRO A 580 15.185 3.290 3.810 1.00 0.00 H new ATOM 276 N ASP A 581 11.982 -0.222 6.521 1.00 0.00 N ATOM 277 CA ASP A 581 11.414 -0.783 7.747 1.00 0.00 C ATOM 278 C ASP A 581 12.461 -1.584 8.507 1.00 0.00 C ATOM 279 O ASP A 581 12.517 -1.547 9.736 1.00 0.00 O ATOM 280 CB ASP A 581 10.230 -1.685 7.371 1.00 0.00 C ATOM 281 CG ASP A 581 9.503 -2.279 8.549 1.00 0.00 C ATOM 282 OD1 ASP A 581 8.553 -1.645 9.050 1.00 0.00 O ATOM 283 OD2 ASP A 581 9.834 -3.400 8.965 1.00 0.00 O ATOM 0 H ASP A 581 11.573 -0.627 5.679 1.00 0.00 H new ATOM 0 HA ASP A 581 11.076 0.027 8.394 1.00 0.00 H new ATOM 0 HB2 ASP A 581 9.523 -1.107 6.777 1.00 0.00 H new ATOM 0 HB3 ASP A 581 10.592 -2.494 6.737 1.00 0.00 H new ATOM 288 N ARG A 582 13.296 -2.303 7.758 1.00 0.00 N ATOM 289 CA ARG A 582 14.388 -3.063 8.356 1.00 0.00 C ATOM 290 C ARG A 582 15.500 -2.126 8.751 1.00 0.00 C ATOM 291 O ARG A 582 15.776 -1.942 9.928 1.00 0.00 O ATOM 292 CB ARG A 582 14.961 -4.113 7.391 1.00 0.00 C ATOM 293 CG ARG A 582 14.045 -5.262 7.064 1.00 0.00 C ATOM 294 CD ARG A 582 13.681 -6.043 8.303 1.00 0.00 C ATOM 295 NE ARG A 582 12.830 -7.183 7.982 1.00 0.00 N ATOM 296 CZ ARG A 582 11.500 -7.249 8.120 1.00 0.00 C ATOM 297 NH1 ARG A 582 10.821 -6.220 8.609 1.00 0.00 N ATOM 298 NH2 ARG A 582 10.857 -8.361 7.771 1.00 0.00 N ATOM 0 H ARG A 582 13.237 -2.374 6.742 1.00 0.00 H new ATOM 0 HA ARG A 582 13.982 -3.579 9.226 1.00 0.00 H new ATOM 0 HB2 ARG A 582 15.236 -3.615 6.461 1.00 0.00 H new ATOM 0 HB3 ARG A 582 15.879 -4.514 7.821 1.00 0.00 H new ATOM 0 HG2 ARG A 582 13.139 -4.884 6.591 1.00 0.00 H new ATOM 0 HG3 ARG A 582 14.529 -5.922 6.344 1.00 0.00 H new ATOM 0 HD2 ARG A 582 14.589 -6.392 8.795 1.00 0.00 H new ATOM 0 HD3 ARG A 582 13.167 -5.390 9.008 1.00 0.00 H new ATOM 0 HE ARG A 582 13.295 -8.014 7.615 1.00 0.00 H new ATOM 0 HH11 ARG A 582 11.312 -5.369 8.884 1.00 0.00 H new ATOM 0 HH12 ARG A 582 9.808 -6.279 8.710 1.00 0.00 H new ATOM 0 HH21 ARG A 582 11.378 -9.156 7.401 1.00 0.00 H new ATOM 0 HH22 ARG A 582 9.844 -8.418 7.874 1.00 0.00 H new ATOM 312 N LYS A 583 16.120 -1.536 7.735 1.00 0.00 N ATOM 313 CA LYS A 583 17.241 -0.630 7.882 1.00 0.00 C ATOM 314 C LYS A 583 18.396 -1.303 8.623 1.00 0.00 C ATOM 315 O LYS A 583 18.572 -1.159 9.843 1.00 0.00 O ATOM 316 CB LYS A 583 16.824 0.723 8.496 1.00 0.00 C ATOM 317 CG LYS A 583 17.950 1.739 8.616 1.00 0.00 C ATOM 318 CD LYS A 583 17.440 3.093 9.099 1.00 0.00 C ATOM 319 CE LYS A 583 16.719 2.992 10.433 1.00 0.00 C ATOM 320 NZ LYS A 583 16.317 4.317 10.945 1.00 0.00 N ATOM 0 H LYS A 583 15.846 -1.682 6.763 1.00 0.00 H new ATOM 0 HA LYS A 583 17.609 -0.389 6.885 1.00 0.00 H new ATOM 0 HB2 LYS A 583 16.028 1.153 7.888 1.00 0.00 H new ATOM 0 HB3 LYS A 583 16.407 0.544 9.487 1.00 0.00 H new ATOM 0 HG2 LYS A 583 18.704 1.366 9.309 1.00 0.00 H new ATOM 0 HG3 LYS A 583 18.437 1.858 7.648 1.00 0.00 H new ATOM 0 HD2 LYS A 583 18.279 3.783 9.192 1.00 0.00 H new ATOM 0 HD3 LYS A 583 16.764 3.512 8.353 1.00 0.00 H new ATOM 0 HE2 LYS A 583 15.836 2.363 10.321 1.00 0.00 H new ATOM 0 HE3 LYS A 583 17.368 2.504 11.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 15.829 4.204 11.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 17.162 4.909 11.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 15.677 4.773 10.264 1.00 0.00 H new ATOM 334 N LYS A 584 19.103 -2.113 7.890 1.00 0.00 N ATOM 335 CA LYS A 584 20.243 -2.826 8.397 1.00 0.00 C ATOM 336 C LYS A 584 21.376 -2.665 7.393 1.00 0.00 C ATOM 337 O LYS A 584 21.162 -2.076 6.320 1.00 0.00 O ATOM 338 CB LYS A 584 19.914 -4.322 8.672 1.00 0.00 C ATOM 339 CG LYS A 584 19.450 -5.106 7.458 1.00 0.00 C ATOM 340 CD LYS A 584 19.278 -6.595 7.734 1.00 0.00 C ATOM 341 CE LYS A 584 18.003 -6.879 8.490 1.00 0.00 C ATOM 342 NZ LYS A 584 17.896 -8.302 8.884 1.00 0.00 N ATOM 0 H LYS A 584 18.902 -2.301 6.908 1.00 0.00 H new ATOM 0 HA LYS A 584 20.543 -2.412 9.360 1.00 0.00 H new ATOM 0 HB2 LYS A 584 20.801 -4.805 9.081 1.00 0.00 H new ATOM 0 HB3 LYS A 584 19.140 -4.374 9.438 1.00 0.00 H new ATOM 0 HG2 LYS A 584 18.502 -4.696 7.109 1.00 0.00 H new ATOM 0 HG3 LYS A 584 20.171 -4.974 6.651 1.00 0.00 H new ATOM 0 HD2 LYS A 584 19.271 -7.142 6.791 1.00 0.00 H new ATOM 0 HD3 LYS A 584 20.130 -6.960 8.308 1.00 0.00 H new ATOM 0 HE2 LYS A 584 17.963 -6.252 9.381 1.00 0.00 H new ATOM 0 HE3 LYS A 584 17.147 -6.609 7.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 584 17.078 -8.427 9.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 584 17.772 -8.889 8.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 584 18.763 -8.591 9.381 1.00 0.00 H new ATOM 356 N ASP A 585 22.540 -3.168 7.713 1.00 0.00 N ATOM 357 CA ASP A 585 23.722 -2.970 6.865 1.00 0.00 C ATOM 358 C ASP A 585 23.705 -3.859 5.645 1.00 0.00 C ATOM 359 O ASP A 585 23.772 -3.374 4.506 1.00 0.00 O ATOM 360 CB ASP A 585 25.018 -3.180 7.650 1.00 0.00 C ATOM 361 CG ASP A 585 25.212 -2.171 8.743 1.00 0.00 C ATOM 362 OD1 ASP A 585 25.736 -1.075 8.470 1.00 0.00 O ATOM 363 OD2 ASP A 585 24.833 -2.445 9.909 1.00 0.00 O ATOM 0 H ASP A 585 22.711 -3.721 8.553 1.00 0.00 H new ATOM 0 HA ASP A 585 23.685 -1.935 6.525 1.00 0.00 H new ATOM 0 HB2 ASP A 585 25.016 -4.180 8.083 1.00 0.00 H new ATOM 0 HB3 ASP A 585 25.864 -3.131 6.964 1.00 0.00 H new ATOM 368 N GLN A 586 23.628 -5.145 5.867 1.00 0.00 N ATOM 369 CA GLN A 586 23.595 -6.096 4.792 1.00 0.00 C ATOM 370 C GLN A 586 22.354 -6.930 4.903 1.00 0.00 C ATOM 371 O GLN A 586 21.926 -7.278 5.996 1.00 0.00 O ATOM 372 CB GLN A 586 24.835 -7.016 4.759 1.00 0.00 C ATOM 373 CG GLN A 586 26.165 -6.307 4.528 1.00 0.00 C ATOM 374 CD GLN A 586 27.015 -6.150 5.789 1.00 0.00 C ATOM 375 OE1 GLN A 586 28.242 -6.121 5.712 1.00 0.00 O ATOM 376 NE2 GLN A 586 26.402 -6.089 6.944 1.00 0.00 N ATOM 0 H GLN A 586 23.587 -5.560 6.798 1.00 0.00 H new ATOM 0 HA GLN A 586 23.597 -5.528 3.862 1.00 0.00 H new ATOM 0 HB2 GLN A 586 24.890 -7.558 5.703 1.00 0.00 H new ATOM 0 HB3 GLN A 586 24.696 -7.758 3.973 1.00 0.00 H new ATOM 0 HG2 GLN A 586 26.736 -6.862 3.784 1.00 0.00 H new ATOM 0 HG3 GLN A 586 25.970 -5.320 4.109 1.00 0.00 H new ATOM 0 HE21 GLN A 586 25.383 -6.115 6.983 1.00 0.00 H new ATOM 0 HE22 GLN A 586 26.943 -6.016 7.805 1.00 0.00 H new ATOM 385 N TYR A 587 21.783 -7.235 3.797 1.00 0.00 N ATOM 386 CA TYR A 587 20.595 -8.015 3.735 1.00 0.00 C ATOM 387 C TYR A 587 20.929 -9.337 3.108 1.00 0.00 C ATOM 388 O TYR A 587 21.568 -9.384 2.045 1.00 0.00 O ATOM 389 CB TYR A 587 19.505 -7.298 2.917 1.00 0.00 C ATOM 390 CG TYR A 587 19.056 -5.962 3.486 1.00 0.00 C ATOM 391 CD1 TYR A 587 19.691 -4.775 3.129 1.00 0.00 C ATOM 392 CD2 TYR A 587 17.986 -5.888 4.371 1.00 0.00 C ATOM 393 CE1 TYR A 587 19.275 -3.559 3.643 1.00 0.00 C ATOM 394 CE2 TYR A 587 17.565 -4.676 4.883 1.00 0.00 C ATOM 395 CZ TYR A 587 18.209 -3.516 4.520 1.00 0.00 C ATOM 396 OH TYR A 587 17.792 -2.306 5.047 1.00 0.00 O ATOM 0 H TYR A 587 22.134 -6.944 2.885 1.00 0.00 H new ATOM 0 HA TYR A 587 20.206 -8.163 4.742 1.00 0.00 H new ATOM 0 HB2 TYR A 587 19.876 -7.139 1.904 1.00 0.00 H new ATOM 0 HB3 TYR A 587 18.638 -7.954 2.840 1.00 0.00 H new ATOM 0 HD1 TYR A 587 20.522 -4.804 2.440 1.00 0.00 H new ATOM 0 HD2 TYR A 587 17.475 -6.794 4.663 1.00 0.00 H new ATOM 0 HE1 TYR A 587 19.782 -2.648 3.360 1.00 0.00 H new ATOM 0 HE2 TYR A 587 16.731 -4.639 5.568 1.00 0.00 H new ATOM 0 HH TYR A 587 16.823 -2.215 4.931 1.00 0.00 H new ATOM 406 N LYS A 588 20.574 -10.389 3.789 1.00 0.00 N ATOM 407 CA LYS A 588 20.763 -11.737 3.295 1.00 0.00 C ATOM 408 C LYS A 588 19.796 -11.960 2.146 1.00 0.00 C ATOM 409 O LYS A 588 18.676 -11.452 2.173 1.00 0.00 O ATOM 410 CB LYS A 588 20.468 -12.749 4.419 1.00 0.00 C ATOM 411 CG LYS A 588 21.338 -12.575 5.653 1.00 0.00 C ATOM 412 CD LYS A 588 20.843 -13.407 6.831 1.00 0.00 C ATOM 413 CE LYS A 588 21.020 -14.900 6.619 1.00 0.00 C ATOM 414 NZ LYS A 588 20.461 -15.677 7.753 1.00 0.00 N ATOM 0 H LYS A 588 20.141 -10.342 4.711 1.00 0.00 H new ATOM 0 HA LYS A 588 21.791 -11.873 2.959 1.00 0.00 H new ATOM 0 HB2 LYS A 588 19.421 -12.659 4.710 1.00 0.00 H new ATOM 0 HB3 LYS A 588 20.605 -13.758 4.030 1.00 0.00 H new ATOM 0 HG2 LYS A 588 22.363 -12.859 5.415 1.00 0.00 H new ATOM 0 HG3 LYS A 588 21.357 -11.523 5.936 1.00 0.00 H new ATOM 0 HD2 LYS A 588 21.380 -13.107 7.731 1.00 0.00 H new ATOM 0 HD3 LYS A 588 19.788 -13.193 7.002 1.00 0.00 H new ATOM 0 HE2 LYS A 588 20.528 -15.199 5.693 1.00 0.00 H new ATOM 0 HE3 LYS A 588 22.079 -15.130 6.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 20.597 -16.693 7.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 20.948 -15.408 8.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 19.445 -15.475 7.845 1.00 0.00 H new ATOM 428 N VAL A 589 20.217 -12.662 1.145 1.00 0.00 N ATOM 429 CA VAL A 589 19.344 -12.953 0.017 1.00 0.00 C ATOM 430 C VAL A 589 18.097 -13.734 0.462 1.00 0.00 C ATOM 431 O VAL A 589 18.177 -14.855 0.984 1.00 0.00 O ATOM 432 CB VAL A 589 20.107 -13.601 -1.171 1.00 0.00 C ATOM 433 CG1 VAL A 589 20.999 -14.679 -0.675 1.00 0.00 C ATOM 434 CG2 VAL A 589 19.160 -14.124 -2.249 1.00 0.00 C ATOM 0 H VAL A 589 21.157 -13.052 1.070 1.00 0.00 H new ATOM 0 HA VAL A 589 18.978 -12.004 -0.375 1.00 0.00 H new ATOM 0 HB VAL A 589 20.714 -12.826 -1.639 1.00 0.00 H new ATOM 0 HG11 VAL A 589 21.530 -15.127 -1.515 1.00 0.00 H new ATOM 0 HG12 VAL A 589 21.720 -14.261 0.028 1.00 0.00 H new ATOM 0 HG13 VAL A 589 20.404 -15.442 -0.173 1.00 0.00 H new ATOM 0 HG21 VAL A 589 19.740 -14.568 -3.058 1.00 0.00 H new ATOM 0 HG22 VAL A 589 18.500 -14.878 -1.819 1.00 0.00 H new ATOM 0 HG23 VAL A 589 18.563 -13.300 -2.640 1.00 0.00 H new ATOM 438 N GLY A 590 16.967 -13.088 0.286 1.00 0.00 N ATOM 439 CA GLY A 590 15.704 -13.588 0.733 1.00 0.00 C ATOM 440 C GLY A 590 15.042 -12.621 1.699 1.00 0.00 C ATOM 441 O GLY A 590 13.824 -12.648 1.858 1.00 0.00 O ATOM 0 H GLY A 590 16.908 -12.184 -0.182 1.00 0.00 H new ATOM 0 HA2 GLY A 590 15.051 -13.754 -0.124 1.00 0.00 H new ATOM 0 HA3 GLY A 590 15.843 -14.554 1.219 1.00 0.00 H new ATOM 445 N GLU A 591 15.856 -11.747 2.336 1.00 0.00 N ATOM 446 CA GLU A 591 15.351 -10.731 3.298 1.00 0.00 C ATOM 447 C GLU A 591 14.348 -9.833 2.633 1.00 0.00 C ATOM 448 O GLU A 591 14.529 -9.466 1.471 1.00 0.00 O ATOM 449 CB GLU A 591 16.492 -9.844 3.819 1.00 0.00 C ATOM 450 CG GLU A 591 17.453 -10.511 4.771 1.00 0.00 C ATOM 451 CD GLU A 591 16.850 -10.807 6.100 1.00 0.00 C ATOM 452 OE1 GLU A 591 16.268 -11.891 6.284 1.00 0.00 O ATOM 453 OE2 GLU A 591 16.960 -9.966 7.004 1.00 0.00 O ATOM 0 H GLU A 591 16.867 -11.723 2.203 1.00 0.00 H new ATOM 0 HA GLU A 591 14.894 -11.274 4.125 1.00 0.00 H new ATOM 0 HB2 GLU A 591 17.056 -9.469 2.965 1.00 0.00 H new ATOM 0 HB3 GLU A 591 16.056 -8.978 4.318 1.00 0.00 H new ATOM 0 HG2 GLU A 591 17.810 -11.440 4.326 1.00 0.00 H new ATOM 0 HG3 GLU A 591 18.323 -9.869 4.909 1.00 0.00 H new ATOM 460 N VAL A 592 13.297 -9.492 3.328 1.00 0.00 N ATOM 461 CA VAL A 592 12.352 -8.579 2.776 1.00 0.00 C ATOM 462 C VAL A 592 12.431 -7.296 3.559 1.00 0.00 C ATOM 463 O VAL A 592 12.585 -7.307 4.787 1.00 0.00 O ATOM 464 CB VAL A 592 10.881 -9.125 2.716 1.00 0.00 C ATOM 465 CG1 VAL A 592 10.849 -10.578 2.301 1.00 0.00 C ATOM 466 CG2 VAL A 592 10.089 -8.890 3.996 1.00 0.00 C ATOM 0 H VAL A 592 13.081 -9.831 4.265 1.00 0.00 H new ATOM 0 HA VAL A 592 12.618 -8.416 1.732 1.00 0.00 H new ATOM 0 HB VAL A 592 10.377 -8.540 1.947 1.00 0.00 H new ATOM 0 HG11 VAL A 592 9.816 -10.925 2.269 1.00 0.00 H new ATOM 0 HG12 VAL A 592 11.298 -10.684 1.313 1.00 0.00 H new ATOM 0 HG13 VAL A 592 11.410 -11.174 3.021 1.00 0.00 H new ATOM 0 HG21 VAL A 592 9.083 -9.293 3.881 1.00 0.00 H new ATOM 0 HG22 VAL A 592 10.586 -9.388 4.828 1.00 0.00 H new ATOM 0 HG23 VAL A 592 10.030 -7.820 4.196 1.00 0.00 H new ATOM 470 N LEU A 593 12.420 -6.216 2.867 1.00 0.00 N ATOM 471 CA LEU A 593 12.472 -4.959 3.471 1.00 0.00 C ATOM 472 C LEU A 593 11.449 -4.034 2.980 1.00 0.00 C ATOM 473 O LEU A 593 11.417 -3.686 1.796 1.00 0.00 O ATOM 474 CB LEU A 593 13.858 -4.317 3.607 1.00 0.00 C ATOM 475 CG LEU A 593 14.994 -4.562 2.636 1.00 0.00 C ATOM 476 CD1 LEU A 593 15.254 -5.983 2.132 1.00 0.00 C ATOM 477 CD2 LEU A 593 15.295 -3.455 1.671 1.00 0.00 C ATOM 0 H LEU A 593 12.374 -6.193 1.848 1.00 0.00 H new ATOM 0 HA LEU A 593 12.217 -5.187 4.506 1.00 0.00 H new ATOM 0 HB2 LEU A 593 13.696 -3.239 3.623 1.00 0.00 H new ATOM 0 HB3 LEU A 593 14.231 -4.598 4.592 1.00 0.00 H new ATOM 0 HG LEU A 593 15.813 -4.500 3.353 1.00 0.00 H new ATOM 0 HD11 LEU A 593 16.102 -5.977 1.447 1.00 0.00 H new ATOM 0 HD12 LEU A 593 15.476 -6.634 2.978 1.00 0.00 H new ATOM 0 HD13 LEU A 593 14.370 -6.352 1.612 1.00 0.00 H new ATOM 0 HD21 LEU A 593 16.126 -3.748 1.029 1.00 0.00 H new ATOM 0 HD22 LEU A 593 14.415 -3.257 1.058 1.00 0.00 H new ATOM 0 HD23 LEU A 593 15.563 -2.554 2.223 1.00 0.00 H new ATOM 489 N LYS A 594 10.546 -3.698 3.869 1.00 0.00 N ATOM 490 CA LYS A 594 9.529 -2.758 3.568 1.00 0.00 C ATOM 491 C LYS A 594 10.100 -1.378 3.595 1.00 0.00 C ATOM 492 O LYS A 594 11.070 -1.121 4.276 1.00 0.00 O ATOM 493 CB LYS A 594 8.329 -2.871 4.506 1.00 0.00 C ATOM 494 CG LYS A 594 7.517 -4.129 4.299 1.00 0.00 C ATOM 495 CD LYS A 594 6.239 -4.092 5.096 1.00 0.00 C ATOM 496 CE LYS A 594 5.322 -5.274 4.788 1.00 0.00 C ATOM 497 NZ LYS A 594 4.867 -5.299 3.372 1.00 0.00 N ATOM 0 H LYS A 594 10.507 -4.076 4.816 1.00 0.00 H new ATOM 0 HA LYS A 594 9.157 -2.979 2.568 1.00 0.00 H new ATOM 0 HB2 LYS A 594 8.680 -2.841 5.537 1.00 0.00 H new ATOM 0 HB3 LYS A 594 7.684 -2.004 4.363 1.00 0.00 H new ATOM 0 HG2 LYS A 594 7.285 -4.245 3.240 1.00 0.00 H new ATOM 0 HG3 LYS A 594 8.106 -4.998 4.593 1.00 0.00 H new ATOM 0 HD2 LYS A 594 6.478 -4.089 6.159 1.00 0.00 H new ATOM 0 HD3 LYS A 594 5.711 -3.162 4.886 1.00 0.00 H new ATOM 0 HE2 LYS A 594 5.847 -6.203 5.012 1.00 0.00 H new ATOM 0 HE3 LYS A 594 4.452 -5.233 5.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 594 3.854 -5.532 3.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 594 5.023 -4.366 2.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 594 5.406 -6.017 2.847 1.00 0.00 H new ATOM 511 N PHE A 595 9.577 -0.557 2.794 1.00 0.00 N ATOM 512 CA PHE A 595 9.947 0.811 2.711 1.00 0.00 C ATOM 513 C PHE A 595 8.775 1.669 2.963 1.00 0.00 C ATOM 514 O PHE A 595 7.647 1.195 2.927 1.00 0.00 O ATOM 515 CB PHE A 595 10.359 1.094 1.313 1.00 0.00 C ATOM 516 CG PHE A 595 11.542 0.351 0.860 1.00 0.00 C ATOM 517 CD1 PHE A 595 12.649 0.230 1.666 1.00 0.00 C ATOM 518 CD2 PHE A 595 11.543 -0.240 -0.363 1.00 0.00 C ATOM 519 CE1 PHE A 595 13.735 -0.470 1.249 1.00 0.00 C ATOM 520 CE2 PHE A 595 12.619 -0.934 -0.794 1.00 0.00 C ATOM 521 CZ PHE A 595 13.723 -1.054 0.008 1.00 0.00 C ATOM 0 H PHE A 595 8.840 -0.817 2.138 1.00 0.00 H new ATOM 0 HA PHE A 595 10.738 1.005 3.435 1.00 0.00 H new ATOM 0 HB2 PHE A 595 9.526 0.863 0.649 1.00 0.00 H new ATOM 0 HB3 PHE A 595 10.558 2.161 1.216 1.00 0.00 H new ATOM 0 HD1 PHE A 595 12.655 0.696 2.640 1.00 0.00 H new ATOM 0 HD2 PHE A 595 10.674 -0.154 -0.998 1.00 0.00 H new ATOM 0 HE1 PHE A 595 14.600 -0.566 1.888 1.00 0.00 H new ATOM 0 HE2 PHE A 595 12.609 -1.394 -1.771 1.00 0.00 H new ATOM 0 HZ PHE A 595 14.584 -1.608 -0.337 1.00 0.00 H new ATOM 531 N SER A 596 9.031 2.925 3.187 1.00 0.00 N ATOM 532 CA SER A 596 8.008 3.899 3.244 1.00 0.00 C ATOM 533 C SER A 596 8.667 5.216 3.356 1.00 0.00 C ATOM 534 O SER A 596 9.780 5.302 3.810 1.00 0.00 O ATOM 535 CB SER A 596 7.023 3.665 4.406 1.00 0.00 C ATOM 536 OG SER A 596 5.842 4.463 4.295 1.00 0.00 O ATOM 0 H SER A 596 9.970 3.295 3.335 1.00 0.00 H new ATOM 0 HA SER A 596 7.401 3.841 2.341 1.00 0.00 H new ATOM 0 HB2 SER A 596 6.744 2.612 4.434 1.00 0.00 H new ATOM 0 HB3 SER A 596 7.521 3.888 5.350 1.00 0.00 H new ATOM 0 HG SER A 596 5.249 4.277 5.053 1.00 0.00 H new ATOM 542 N CYS A 597 8.007 6.198 2.926 1.00 0.00 N ATOM 543 CA CYS A 597 8.521 7.515 2.950 1.00 0.00 C ATOM 544 C CYS A 597 8.194 8.194 4.271 1.00 0.00 C ATOM 545 O CYS A 597 7.527 7.604 5.146 1.00 0.00 O ATOM 546 CB CYS A 597 7.945 8.306 1.787 1.00 0.00 C ATOM 547 SG CYS A 597 8.378 7.628 0.161 1.00 0.00 S ATOM 0 H CYS A 597 7.068 6.122 2.534 1.00 0.00 H new ATOM 0 HA CYS A 597 9.606 7.475 2.852 1.00 0.00 H new ATOM 0 HB2 CYS A 597 6.860 8.336 1.881 1.00 0.00 H new ATOM 0 HB3 CYS A 597 8.299 9.335 1.848 1.00 0.00 H new ATOM 552 N LYS A 598 8.692 9.405 4.420 1.00 0.00 N ATOM 553 CA LYS A 598 8.434 10.245 5.558 1.00 0.00 C ATOM 554 C LYS A 598 6.932 10.458 5.795 1.00 0.00 C ATOM 555 O LYS A 598 6.129 10.238 4.889 1.00 0.00 O ATOM 556 CB LYS A 598 9.174 11.572 5.401 1.00 0.00 C ATOM 557 CG LYS A 598 10.661 11.446 5.595 1.00 0.00 C ATOM 558 CD LYS A 598 11.008 10.892 6.981 1.00 0.00 C ATOM 559 CE LYS A 598 12.504 10.640 7.144 1.00 0.00 C ATOM 560 NZ LYS A 598 13.317 11.867 7.064 1.00 0.00 N ATOM 0 H LYS A 598 9.304 9.839 3.729 1.00 0.00 H new ATOM 0 HA LYS A 598 8.811 9.737 6.446 1.00 0.00 H new ATOM 0 HB2 LYS A 598 8.976 11.976 4.408 1.00 0.00 H new ATOM 0 HB3 LYS A 598 8.779 12.289 6.121 1.00 0.00 H new ATOM 0 HG2 LYS A 598 11.074 10.791 4.828 1.00 0.00 H new ATOM 0 HG3 LYS A 598 11.129 12.422 5.466 1.00 0.00 H new ATOM 0 HD2 LYS A 598 10.674 11.594 7.745 1.00 0.00 H new ATOM 0 HD3 LYS A 598 10.465 9.961 7.145 1.00 0.00 H new ATOM 0 HE2 LYS A 598 12.681 10.158 8.105 1.00 0.00 H new ATOM 0 HE3 LYS A 598 12.834 9.944 6.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 598 14.320 11.628 7.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 598 13.189 12.308 6.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 598 13.016 12.532 7.805 1.00 0.00 H new ATOM 574 N PRO A 599 6.558 10.909 7.015 1.00 0.00 N ATOM 575 CA PRO A 599 5.152 11.073 7.455 1.00 0.00 C ATOM 576 C PRO A 599 4.214 11.720 6.419 1.00 0.00 C ATOM 577 O PRO A 599 3.082 11.242 6.199 1.00 0.00 O ATOM 578 CB PRO A 599 5.275 11.972 8.683 1.00 0.00 C ATOM 579 CG PRO A 599 6.605 11.638 9.257 1.00 0.00 C ATOM 580 CD PRO A 599 7.498 11.301 8.092 1.00 0.00 C ATOM 0 HA PRO A 599 4.697 10.099 7.634 1.00 0.00 H new ATOM 0 HB2 PRO A 599 5.213 13.026 8.411 1.00 0.00 H new ATOM 0 HB3 PRO A 599 4.475 11.780 9.398 1.00 0.00 H new ATOM 0 HG2 PRO A 599 7.006 12.479 9.823 1.00 0.00 H new ATOM 0 HG3 PRO A 599 6.531 10.796 9.946 1.00 0.00 H new ATOM 0 HD2 PRO A 599 8.108 12.155 7.797 1.00 0.00 H new ATOM 0 HD3 PRO A 599 8.183 10.490 8.337 1.00 0.00 H new ATOM 588 N GLY A 600 4.677 12.769 5.779 1.00 0.00 N ATOM 589 CA GLY A 600 3.850 13.478 4.832 1.00 0.00 C ATOM 590 C GLY A 600 3.948 12.930 3.425 1.00 0.00 C ATOM 591 O GLY A 600 3.143 13.279 2.563 1.00 0.00 O ATOM 0 H GLY A 600 5.617 13.148 5.896 1.00 0.00 H new ATOM 0 HA2 GLY A 600 2.812 13.432 5.161 1.00 0.00 H new ATOM 0 HA3 GLY A 600 4.136 14.530 4.826 1.00 0.00 H new ATOM 595 N PHE A 601 4.894 12.055 3.191 1.00 0.00 N ATOM 596 CA PHE A 601 5.120 11.535 1.879 1.00 0.00 C ATOM 597 C PHE A 601 4.466 10.208 1.673 1.00 0.00 C ATOM 598 O PHE A 601 4.206 9.456 2.616 1.00 0.00 O ATOM 599 CB PHE A 601 6.601 11.401 1.582 1.00 0.00 C ATOM 600 CG PHE A 601 7.283 12.662 1.215 1.00 0.00 C ATOM 601 CD1 PHE A 601 7.661 13.567 2.169 1.00 0.00 C ATOM 602 CD2 PHE A 601 7.568 12.919 -0.101 1.00 0.00 C ATOM 603 CE1 PHE A 601 8.315 14.720 1.818 1.00 0.00 C ATOM 604 CE2 PHE A 601 8.220 14.072 -0.472 1.00 0.00 C ATOM 605 CZ PHE A 601 8.596 14.978 0.491 1.00 0.00 C ATOM 0 H PHE A 601 5.523 11.689 3.906 1.00 0.00 H new ATOM 0 HA PHE A 601 4.673 12.255 1.193 1.00 0.00 H new ATOM 0 HB2 PHE A 601 7.095 10.980 2.458 1.00 0.00 H new ATOM 0 HB3 PHE A 601 6.730 10.686 0.769 1.00 0.00 H new ATOM 0 HD1 PHE A 601 7.442 13.371 3.208 1.00 0.00 H new ATOM 0 HD2 PHE A 601 7.276 12.206 -0.858 1.00 0.00 H new ATOM 0 HE1 PHE A 601 8.610 15.426 2.580 1.00 0.00 H new ATOM 0 HE2 PHE A 601 8.435 14.264 -1.513 1.00 0.00 H new ATOM 0 HZ PHE A 601 9.108 15.887 0.211 1.00 0.00 H new ATOM 615 N THR A 602 4.206 9.939 0.450 1.00 0.00 N ATOM 616 CA THR A 602 3.692 8.710 0.013 1.00 0.00 C ATOM 617 C THR A 602 4.763 7.939 -0.719 1.00 0.00 C ATOM 618 O THR A 602 5.422 8.475 -1.619 1.00 0.00 O ATOM 619 CB THR A 602 2.492 8.939 -0.912 1.00 0.00 C ATOM 620 OG1 THR A 602 1.350 9.366 -0.155 1.00 0.00 O ATOM 621 CG2 THR A 602 2.172 7.719 -1.766 1.00 0.00 C ATOM 0 H THR A 602 4.355 10.607 -0.306 1.00 0.00 H new ATOM 0 HA THR A 602 3.365 8.135 0.880 1.00 0.00 H new ATOM 0 HB THR A 602 2.763 9.734 -1.607 1.00 0.00 H new ATOM 0 HG1 THR A 602 1.255 10.339 -0.227 1.00 0.00 H new ATOM 0 HG21 THR A 602 1.314 7.935 -2.402 1.00 0.00 H new ATOM 0 HG22 THR A 602 3.033 7.474 -2.388 1.00 0.00 H new ATOM 0 HG23 THR A 602 1.940 6.873 -1.119 1.00 0.00 H new ATOM 629 N ILE A 603 4.968 6.736 -0.294 1.00 0.00 N ATOM 630 CA ILE A 603 5.833 5.837 -0.975 1.00 0.00 C ATOM 631 C ILE A 603 5.142 5.347 -2.250 1.00 0.00 C ATOM 632 O ILE A 603 4.057 4.757 -2.207 1.00 0.00 O ATOM 633 CB ILE A 603 6.253 4.644 -0.078 1.00 0.00 C ATOM 634 CG1 ILE A 603 7.076 3.653 -0.889 1.00 0.00 C ATOM 635 CG2 ILE A 603 5.048 3.975 0.599 1.00 0.00 C ATOM 636 CD1 ILE A 603 7.476 2.422 -0.134 1.00 0.00 C ATOM 0 H ILE A 603 4.535 6.348 0.544 1.00 0.00 H new ATOM 0 HA ILE A 603 6.749 6.367 -1.236 1.00 0.00 H new ATOM 0 HB ILE A 603 6.875 5.027 0.731 1.00 0.00 H new ATOM 0 HG12 ILE A 603 6.504 3.356 -1.768 1.00 0.00 H new ATOM 0 HG13 ILE A 603 7.975 4.153 -1.248 1.00 0.00 H new ATOM 0 HG21 ILE A 603 5.392 3.145 1.217 1.00 0.00 H new ATOM 0 HG22 ILE A 603 4.531 4.703 1.224 1.00 0.00 H new ATOM 0 HG23 ILE A 603 4.364 3.601 -0.163 1.00 0.00 H new ATOM 0 HD11 ILE A 603 8.059 1.770 -0.784 1.00 0.00 H new ATOM 0 HD12 ILE A 603 8.077 2.704 0.730 1.00 0.00 H new ATOM 0 HD13 ILE A 603 6.583 1.895 0.202 1.00 0.00 H new ATOM 643 N VAL A 604 5.733 5.635 -3.358 1.00 0.00 N ATOM 644 CA VAL A 604 5.179 5.253 -4.624 1.00 0.00 C ATOM 645 C VAL A 604 6.062 4.196 -5.251 1.00 0.00 C ATOM 646 O VAL A 604 7.218 4.461 -5.607 1.00 0.00 O ATOM 647 CB VAL A 604 5.016 6.479 -5.566 1.00 0.00 C ATOM 648 CG1 VAL A 604 4.439 6.079 -6.914 1.00 0.00 C ATOM 649 CG2 VAL A 604 4.134 7.527 -4.917 1.00 0.00 C ATOM 0 H VAL A 604 6.616 6.143 -3.419 1.00 0.00 H new ATOM 0 HA VAL A 604 4.182 4.842 -4.466 1.00 0.00 H new ATOM 0 HB VAL A 604 6.008 6.896 -5.736 1.00 0.00 H new ATOM 0 HG11 VAL A 604 4.340 6.963 -7.544 1.00 0.00 H new ATOM 0 HG12 VAL A 604 5.104 5.362 -7.396 1.00 0.00 H new ATOM 0 HG13 VAL A 604 3.459 5.625 -6.770 1.00 0.00 H new ATOM 0 HG21 VAL A 604 4.029 8.380 -5.588 1.00 0.00 H new ATOM 0 HG22 VAL A 604 3.151 7.101 -4.715 1.00 0.00 H new ATOM 0 HG23 VAL A 604 4.587 7.855 -3.981 1.00 0.00 H new ATOM 653 N GLY A 605 5.547 3.007 -5.318 1.00 0.00 N ATOM 654 CA GLY A 605 6.266 1.916 -5.875 1.00 0.00 C ATOM 655 C GLY A 605 6.158 0.710 -4.988 1.00 0.00 C ATOM 656 O GLY A 605 5.189 0.590 -4.229 1.00 0.00 O ATOM 0 H GLY A 605 4.612 2.771 -4.985 1.00 0.00 H new ATOM 0 HA2 GLY A 605 5.875 1.683 -6.866 1.00 0.00 H new ATOM 0 HA3 GLY A 605 7.314 2.189 -6.002 1.00 0.00 H new ATOM 660 N PRO A 606 7.123 -0.194 -5.050 1.00 0.00 N ATOM 661 CA PRO A 606 7.139 -1.394 -4.222 1.00 0.00 C ATOM 662 C PRO A 606 7.494 -1.091 -2.770 1.00 0.00 C ATOM 663 O PRO A 606 8.543 -0.518 -2.463 1.00 0.00 O ATOM 664 CB PRO A 606 8.234 -2.239 -4.856 1.00 0.00 C ATOM 665 CG PRO A 606 9.154 -1.238 -5.442 1.00 0.00 C ATOM 666 CD PRO A 606 8.286 -0.137 -5.949 1.00 0.00 C ATOM 0 HA PRO A 606 6.163 -1.878 -4.188 1.00 0.00 H new ATOM 0 HB2 PRO A 606 8.738 -2.862 -4.117 1.00 0.00 H new ATOM 0 HB3 PRO A 606 7.833 -2.909 -5.617 1.00 0.00 H new ATOM 0 HG2 PRO A 606 9.858 -0.869 -4.696 1.00 0.00 H new ATOM 0 HG3 PRO A 606 9.744 -1.674 -6.248 1.00 0.00 H new ATOM 0 HD2 PRO A 606 8.788 0.829 -5.899 1.00 0.00 H new ATOM 0 HD3 PRO A 606 8.001 -0.294 -6.989 1.00 0.00 H new ATOM 674 N ASN A 607 6.619 -1.459 -1.901 1.00 0.00 N ATOM 675 CA ASN A 607 6.826 -1.292 -0.490 1.00 0.00 C ATOM 676 C ASN A 607 7.719 -2.352 0.086 1.00 0.00 C ATOM 677 O ASN A 607 8.518 -2.071 0.925 1.00 0.00 O ATOM 678 CB ASN A 607 5.486 -1.206 0.245 1.00 0.00 C ATOM 679 CG ASN A 607 5.487 -1.650 1.713 1.00 0.00 C ATOM 680 OD1 ASN A 607 5.263 -2.835 2.039 1.00 0.00 O ATOM 681 ND2 ASN A 607 5.718 -0.730 2.593 1.00 0.00 N ATOM 0 H ASN A 607 5.727 -1.890 -2.144 1.00 0.00 H new ATOM 0 HA ASN A 607 7.349 -0.347 -0.344 1.00 0.00 H new ATOM 0 HB2 ASN A 607 5.136 -0.175 0.200 1.00 0.00 H new ATOM 0 HB3 ASN A 607 4.760 -1.813 -0.296 1.00 0.00 H new ATOM 0 HD21 ASN A 607 5.721 -0.963 3.586 1.00 0.00 H new ATOM 0 HD22 ASN A 607 5.897 0.228 2.294 1.00 0.00 H new ATOM 688 N SER A 608 7.621 -3.544 -0.383 1.00 0.00 N ATOM 689 CA SER A 608 8.378 -4.596 0.199 1.00 0.00 C ATOM 690 C SER A 608 9.220 -5.329 -0.836 1.00 0.00 C ATOM 691 O SER A 608 8.715 -6.154 -1.607 1.00 0.00 O ATOM 692 CB SER A 608 7.424 -5.511 0.960 1.00 0.00 C ATOM 693 OG SER A 608 6.367 -5.982 0.134 1.00 0.00 O ATOM 0 H SER A 608 7.026 -3.816 -1.166 1.00 0.00 H new ATOM 0 HA SER A 608 9.101 -4.188 0.905 1.00 0.00 H new ATOM 0 HB2 SER A 608 7.978 -6.360 1.360 1.00 0.00 H new ATOM 0 HB3 SER A 608 7.007 -4.973 1.811 1.00 0.00 H new ATOM 0 HG SER A 608 6.724 -6.232 -0.744 1.00 0.00 H new ATOM 699 N VAL A 609 10.492 -5.001 -0.880 1.00 0.00 N ATOM 700 CA VAL A 609 11.385 -5.642 -1.810 1.00 0.00 C ATOM 701 C VAL A 609 12.136 -6.748 -1.101 1.00 0.00 C ATOM 702 O VAL A 609 12.176 -6.792 0.141 1.00 0.00 O ATOM 703 CB VAL A 609 12.394 -4.664 -2.471 1.00 0.00 C ATOM 704 CG1 VAL A 609 11.683 -3.491 -3.125 1.00 0.00 C ATOM 705 CG2 VAL A 609 13.463 -4.194 -1.495 1.00 0.00 C ATOM 0 H VAL A 609 10.927 -4.297 -0.284 1.00 0.00 H new ATOM 0 HA VAL A 609 10.770 -6.044 -2.615 1.00 0.00 H new ATOM 0 HB VAL A 609 12.906 -5.220 -3.256 1.00 0.00 H new ATOM 0 HG11 VAL A 609 12.419 -2.826 -3.578 1.00 0.00 H new ATOM 0 HG12 VAL A 609 11.005 -3.860 -3.895 1.00 0.00 H new ATOM 0 HG13 VAL A 609 11.115 -2.944 -2.372 1.00 0.00 H new ATOM 0 HG21 VAL A 609 14.145 -3.512 -2.003 1.00 0.00 H new ATOM 0 HG22 VAL A 609 12.991 -3.679 -0.659 1.00 0.00 H new ATOM 0 HG23 VAL A 609 14.020 -5.054 -1.123 1.00 0.00 H new ATOM 709 N GLN A 610 12.682 -7.649 -1.857 1.00 0.00 N ATOM 710 CA GLN A 610 13.413 -8.743 -1.314 1.00 0.00 C ATOM 711 C GLN A 610 14.828 -8.648 -1.738 1.00 0.00 C ATOM 712 O GLN A 610 15.148 -7.987 -2.733 1.00 0.00 O ATOM 713 CB GLN A 610 12.908 -10.092 -1.824 1.00 0.00 C ATOM 714 CG GLN A 610 11.551 -10.553 -1.368 1.00 0.00 C ATOM 715 CD GLN A 610 10.349 -9.749 -1.882 1.00 0.00 C ATOM 716 OE1 GLN A 610 9.803 -10.035 -2.939 1.00 0.00 O ATOM 717 NE2 GLN A 610 9.908 -8.780 -1.125 1.00 0.00 N ATOM 0 H GLN A 610 12.631 -7.643 -2.876 1.00 0.00 H new ATOM 0 HA GLN A 610 13.292 -8.689 -0.232 1.00 0.00 H new ATOM 0 HB2 GLN A 610 12.900 -10.056 -2.913 1.00 0.00 H new ATOM 0 HB3 GLN A 610 13.634 -10.852 -1.535 1.00 0.00 H new ATOM 0 HG2 GLN A 610 11.423 -11.592 -1.673 1.00 0.00 H new ATOM 0 HG3 GLN A 610 11.533 -10.536 -0.278 1.00 0.00 H new ATOM 0 HE21 GLN A 610 10.382 -8.562 -0.248 1.00 0.00 H new ATOM 0 HE22 GLN A 610 9.090 -8.242 -1.411 1.00 0.00 H new ATOM 726 N CYS A 611 15.680 -9.284 -1.013 1.00 0.00 N ATOM 727 CA CYS A 611 17.010 -9.412 -1.484 1.00 0.00 C ATOM 728 C CYS A 611 17.043 -10.542 -2.472 1.00 0.00 C ATOM 729 O CYS A 611 16.899 -11.705 -2.100 1.00 0.00 O ATOM 730 CB CYS A 611 18.054 -9.631 -0.375 1.00 0.00 C ATOM 731 SG CYS A 611 19.755 -9.954 -0.969 1.00 0.00 S ATOM 0 H CYS A 611 15.484 -9.715 -0.110 1.00 0.00 H new ATOM 0 HA CYS A 611 17.290 -8.466 -1.948 1.00 0.00 H new ATOM 0 HB2 CYS A 611 18.070 -8.750 0.267 1.00 0.00 H new ATOM 0 HB3 CYS A 611 17.735 -10.470 0.243 1.00 0.00 H new ATOM 736 N TYR A 612 17.117 -10.209 -3.717 1.00 0.00 N ATOM 737 CA TYR A 612 17.273 -11.196 -4.734 1.00 0.00 C ATOM 738 C TYR A 612 18.759 -11.421 -4.878 1.00 0.00 C ATOM 739 O TYR A 612 19.546 -10.604 -4.393 1.00 0.00 O ATOM 740 CB TYR A 612 16.677 -10.728 -6.064 1.00 0.00 C ATOM 741 CG TYR A 612 15.157 -10.753 -6.150 1.00 0.00 C ATOM 742 CD1 TYR A 612 14.360 -10.123 -5.213 1.00 0.00 C ATOM 743 CD2 TYR A 612 14.526 -11.441 -7.178 1.00 0.00 C ATOM 744 CE1 TYR A 612 12.988 -10.172 -5.297 1.00 0.00 C ATOM 745 CE2 TYR A 612 13.152 -11.497 -7.264 1.00 0.00 C ATOM 746 CZ TYR A 612 12.389 -10.856 -6.318 1.00 0.00 C ATOM 747 OH TYR A 612 11.012 -10.919 -6.381 1.00 0.00 O ATOM 0 H TYR A 612 17.071 -9.249 -4.058 1.00 0.00 H new ATOM 0 HA TYR A 612 16.749 -12.113 -4.463 1.00 0.00 H new ATOM 0 HB2 TYR A 612 17.017 -9.710 -6.256 1.00 0.00 H new ATOM 0 HB3 TYR A 612 17.078 -11.354 -6.861 1.00 0.00 H new ATOM 0 HD1 TYR A 612 14.823 -9.583 -4.400 1.00 0.00 H new ATOM 0 HD2 TYR A 612 15.124 -11.942 -7.925 1.00 0.00 H new ATOM 0 HE1 TYR A 612 12.384 -9.670 -4.556 1.00 0.00 H new ATOM 0 HE2 TYR A 612 12.679 -12.040 -8.068 1.00 0.00 H new ATOM 0 HH TYR A 612 10.744 -11.441 -7.166 1.00 0.00 H new ATOM 757 N HIS A 613 19.177 -12.451 -5.575 1.00 0.00 N ATOM 758 CA HIS A 613 20.622 -12.729 -5.649 1.00 0.00 C ATOM 759 C HIS A 613 21.364 -11.757 -6.576 1.00 0.00 C ATOM 760 O HIS A 613 22.581 -11.855 -6.746 1.00 0.00 O ATOM 761 CB HIS A 613 20.969 -14.212 -5.957 1.00 0.00 C ATOM 762 CG HIS A 613 20.639 -14.720 -7.330 1.00 0.00 C ATOM 763 ND1 HIS A 613 21.589 -14.945 -8.306 1.00 0.00 N ATOM 764 CD2 HIS A 613 19.473 -15.111 -7.858 1.00 0.00 C ATOM 765 CE1 HIS A 613 21.011 -15.456 -9.366 1.00 0.00 C ATOM 766 NE2 HIS A 613 19.727 -15.575 -9.123 1.00 0.00 N ATOM 0 H HIS A 613 18.577 -13.098 -6.087 1.00 0.00 H new ATOM 0 HA HIS A 613 20.990 -12.551 -4.639 1.00 0.00 H new ATOM 0 HB2 HIS A 613 22.038 -14.351 -5.793 1.00 0.00 H new ATOM 0 HB3 HIS A 613 20.451 -14.839 -5.231 1.00 0.00 H new ATOM 0 HD2 HIS A 613 18.508 -15.069 -7.375 1.00 0.00 H new ATOM 0 HE1 HIS A 613 21.508 -15.732 -10.284 1.00 0.00 H new ATOM 0 HE2 HIS A 613 19.032 -15.951 -9.769 1.00 0.00 H new ATOM 775 N PHE A 614 20.634 -10.828 -7.166 1.00 0.00 N ATOM 776 CA PHE A 614 21.248 -9.794 -7.965 1.00 0.00 C ATOM 777 C PHE A 614 20.997 -8.416 -7.338 1.00 0.00 C ATOM 778 O PHE A 614 21.317 -7.380 -7.929 1.00 0.00 O ATOM 779 CB PHE A 614 20.804 -9.852 -9.440 1.00 0.00 C ATOM 780 CG PHE A 614 19.408 -9.397 -9.728 1.00 0.00 C ATOM 781 CD1 PHE A 614 18.322 -10.066 -9.224 1.00 0.00 C ATOM 782 CD2 PHE A 614 19.195 -8.300 -10.535 1.00 0.00 C ATOM 783 CE1 PHE A 614 17.053 -9.658 -9.508 1.00 0.00 C ATOM 784 CE2 PHE A 614 17.926 -7.879 -10.824 1.00 0.00 C ATOM 785 CZ PHE A 614 16.845 -8.558 -10.311 1.00 0.00 C ATOM 0 H PHE A 614 19.617 -10.772 -7.105 1.00 0.00 H new ATOM 0 HA PHE A 614 22.324 -9.971 -7.971 1.00 0.00 H new ATOM 0 HB2 PHE A 614 21.491 -9.244 -10.029 1.00 0.00 H new ATOM 0 HB3 PHE A 614 20.908 -10.879 -9.789 1.00 0.00 H new ATOM 0 HD1 PHE A 614 18.475 -10.929 -8.593 1.00 0.00 H new ATOM 0 HD2 PHE A 614 20.040 -7.766 -10.944 1.00 0.00 H new ATOM 0 HE1 PHE A 614 16.210 -10.198 -9.103 1.00 0.00 H new ATOM 0 HE2 PHE A 614 17.773 -7.015 -11.454 1.00 0.00 H new ATOM 0 HZ PHE A 614 15.841 -8.231 -10.536 1.00 0.00 H new ATOM 795 N GLY A 615 20.427 -8.408 -6.145 1.00 0.00 N ATOM 796 CA GLY A 615 20.218 -7.168 -5.436 1.00 0.00 C ATOM 797 C GLY A 615 18.817 -7.023 -4.907 1.00 0.00 C ATOM 798 O GLY A 615 17.954 -7.873 -5.188 1.00 0.00 O ATOM 0 H GLY A 615 20.105 -9.242 -5.654 1.00 0.00 H new ATOM 0 HA2 GLY A 615 20.922 -7.107 -4.606 1.00 0.00 H new ATOM 0 HA3 GLY A 615 20.437 -6.333 -6.102 1.00 0.00 H new ATOM 802 N LEU A 616 18.580 -5.953 -4.143 1.00 0.00 N ATOM 803 CA LEU A 616 17.254 -5.668 -3.579 1.00 0.00 C ATOM 804 C LEU A 616 16.304 -5.419 -4.722 1.00 0.00 C ATOM 805 O LEU A 616 16.420 -4.422 -5.420 1.00 0.00 O ATOM 806 CB LEU A 616 17.240 -4.425 -2.627 1.00 0.00 C ATOM 807 CG LEU A 616 18.043 -4.499 -1.314 1.00 0.00 C ATOM 808 CD1 LEU A 616 17.711 -5.759 -0.539 1.00 0.00 C ATOM 809 CD2 LEU A 616 19.515 -4.387 -1.581 1.00 0.00 C ATOM 0 H LEU A 616 19.293 -5.265 -3.899 1.00 0.00 H new ATOM 0 HA LEU A 616 16.958 -6.528 -2.978 1.00 0.00 H new ATOM 0 HB2 LEU A 616 17.607 -3.569 -3.193 1.00 0.00 H new ATOM 0 HB3 LEU A 616 16.202 -4.215 -2.370 1.00 0.00 H new ATOM 0 HG LEU A 616 17.754 -3.651 -0.693 1.00 0.00 H new ATOM 0 HD11 LEU A 616 18.293 -5.783 0.382 1.00 0.00 H new ATOM 0 HD12 LEU A 616 16.648 -5.768 -0.297 1.00 0.00 H new ATOM 0 HD13 LEU A 616 17.953 -6.633 -1.144 1.00 0.00 H new ATOM 0 HD21 LEU A 616 20.061 -4.442 -0.639 1.00 0.00 H new ATOM 0 HD22 LEU A 616 19.830 -5.203 -2.231 1.00 0.00 H new ATOM 0 HD23 LEU A 616 19.725 -3.434 -2.067 1.00 0.00 H new ATOM 821 N SER A 617 15.412 -6.324 -4.939 1.00 0.00 N ATOM 822 CA SER A 617 14.526 -6.234 -6.051 1.00 0.00 C ATOM 823 C SER A 617 13.089 -6.386 -5.573 1.00 0.00 C ATOM 824 O SER A 617 12.837 -7.089 -4.582 1.00 0.00 O ATOM 825 CB SER A 617 14.895 -7.299 -7.079 1.00 0.00 C ATOM 826 OG SER A 617 16.269 -7.202 -7.415 1.00 0.00 O ATOM 0 H SER A 617 15.275 -7.147 -4.352 1.00 0.00 H new ATOM 0 HA SER A 617 14.617 -5.258 -6.528 1.00 0.00 H new ATOM 0 HB2 SER A 617 14.680 -8.290 -6.679 1.00 0.00 H new ATOM 0 HB3 SER A 617 14.285 -7.177 -7.974 1.00 0.00 H new ATOM 0 HG SER A 617 16.449 -7.739 -8.215 1.00 0.00 H new ATOM 832 N PRO A 618 12.125 -5.738 -6.240 1.00 0.00 N ATOM 833 CA PRO A 618 12.375 -4.900 -7.432 1.00 0.00 C ATOM 834 C PRO A 618 13.042 -3.532 -7.100 1.00 0.00 C ATOM 835 O PRO A 618 13.484 -3.311 -5.971 1.00 0.00 O ATOM 836 CB PRO A 618 10.973 -4.710 -8.010 1.00 0.00 C ATOM 837 CG PRO A 618 10.068 -4.793 -6.834 1.00 0.00 C ATOM 838 CD PRO A 618 10.697 -5.773 -5.887 1.00 0.00 C ATOM 0 HA PRO A 618 13.081 -5.367 -8.119 1.00 0.00 H new ATOM 0 HB2 PRO A 618 10.879 -3.749 -8.515 1.00 0.00 H new ATOM 0 HB3 PRO A 618 10.740 -5.480 -8.745 1.00 0.00 H new ATOM 0 HG2 PRO A 618 9.952 -3.817 -6.363 1.00 0.00 H new ATOM 0 HG3 PRO A 618 9.073 -5.124 -7.132 1.00 0.00 H new ATOM 0 HD2 PRO A 618 10.535 -5.485 -4.848 1.00 0.00 H new ATOM 0 HD3 PRO A 618 10.279 -6.772 -6.010 1.00 0.00 H new ATOM 846 N ASP A 619 13.134 -2.646 -8.100 1.00 0.00 N ATOM 847 CA ASP A 619 13.769 -1.320 -7.931 1.00 0.00 C ATOM 848 C ASP A 619 13.088 -0.519 -6.830 1.00 0.00 C ATOM 849 O ASP A 619 11.899 -0.685 -6.573 1.00 0.00 O ATOM 850 CB ASP A 619 13.805 -0.509 -9.248 1.00 0.00 C ATOM 851 CG ASP A 619 12.448 -0.038 -9.736 1.00 0.00 C ATOM 852 OD1 ASP A 619 11.679 -0.856 -10.276 1.00 0.00 O ATOM 853 OD2 ASP A 619 12.129 1.162 -9.609 1.00 0.00 O ATOM 0 H ASP A 619 12.777 -2.819 -9.040 1.00 0.00 H new ATOM 0 HA ASP A 619 14.802 -1.507 -7.638 1.00 0.00 H new ATOM 0 HB2 ASP A 619 14.448 0.360 -9.107 1.00 0.00 H new ATOM 0 HB3 ASP A 619 14.263 -1.122 -10.024 1.00 0.00 H new ATOM 858 N LEU A 620 13.852 0.347 -6.209 1.00 0.00 N ATOM 859 CA LEU A 620 13.426 1.111 -5.034 1.00 0.00 C ATOM 860 C LEU A 620 12.326 2.100 -5.378 1.00 0.00 C ATOM 861 O LEU A 620 12.366 2.760 -6.423 1.00 0.00 O ATOM 862 CB LEU A 620 14.617 1.859 -4.381 1.00 0.00 C ATOM 863 CG LEU A 620 15.842 1.029 -3.916 1.00 0.00 C ATOM 864 CD1 LEU A 620 15.434 -0.159 -3.062 1.00 0.00 C ATOM 865 CD2 LEU A 620 16.737 0.606 -5.080 1.00 0.00 C ATOM 0 H LEU A 620 14.807 0.553 -6.502 1.00 0.00 H new ATOM 0 HA LEU A 620 13.032 0.390 -4.318 1.00 0.00 H new ATOM 0 HB2 LEU A 620 14.972 2.604 -5.093 1.00 0.00 H new ATOM 0 HB3 LEU A 620 14.235 2.401 -3.516 1.00 0.00 H new ATOM 0 HG LEU A 620 16.438 1.690 -3.286 1.00 0.00 H new ATOM 0 HD11 LEU A 620 16.323 -0.712 -2.759 1.00 0.00 H new ATOM 0 HD12 LEU A 620 14.906 0.194 -2.176 1.00 0.00 H new ATOM 0 HD13 LEU A 620 14.779 -0.813 -3.638 1.00 0.00 H new ATOM 0 HD21 LEU A 620 17.579 0.028 -4.700 1.00 0.00 H new ATOM 0 HD22 LEU A 620 16.163 -0.004 -5.777 1.00 0.00 H new ATOM 0 HD23 LEU A 620 17.108 1.492 -5.594 1.00 0.00 H new ATOM 877 N PRO A 621 11.316 2.187 -4.514 1.00 0.00 N ATOM 878 CA PRO A 621 10.190 3.104 -4.670 1.00 0.00 C ATOM 879 C PRO A 621 10.623 4.560 -4.564 1.00 0.00 C ATOM 880 O PRO A 621 11.767 4.865 -4.191 1.00 0.00 O ATOM 881 CB PRO A 621 9.298 2.767 -3.476 1.00 0.00 C ATOM 882 CG PRO A 621 10.216 2.168 -2.496 1.00 0.00 C ATOM 883 CD PRO A 621 11.184 1.387 -3.300 1.00 0.00 C ATOM 0 HA PRO A 621 9.711 2.995 -5.643 1.00 0.00 H new ATOM 0 HB2 PRO A 621 8.815 3.658 -3.076 1.00 0.00 H new ATOM 0 HB3 PRO A 621 8.505 2.073 -3.755 1.00 0.00 H new ATOM 0 HG2 PRO A 621 10.720 2.935 -1.908 1.00 0.00 H new ATOM 0 HG3 PRO A 621 9.681 1.529 -1.794 1.00 0.00 H new ATOM 0 HD2 PRO A 621 12.138 1.273 -2.785 1.00 0.00 H new ATOM 0 HD3 PRO A 621 10.815 0.384 -3.515 1.00 0.00 H new ATOM 891 N ILE A 622 9.727 5.439 -4.872 1.00 0.00 N ATOM 892 CA ILE A 622 9.985 6.858 -4.804 1.00 0.00 C ATOM 893 C ILE A 622 9.082 7.478 -3.739 1.00 0.00 C ATOM 894 O ILE A 622 8.261 6.779 -3.136 1.00 0.00 O ATOM 895 CB ILE A 622 9.694 7.568 -6.151 1.00 0.00 C ATOM 896 CG1 ILE A 622 8.211 7.439 -6.493 1.00 0.00 C ATOM 897 CG2 ILE A 622 10.563 6.993 -7.267 1.00 0.00 C ATOM 898 CD1 ILE A 622 7.745 8.337 -7.616 1.00 0.00 C ATOM 0 H ILE A 622 8.785 5.201 -5.182 1.00 0.00 H new ATOM 0 HA ILE A 622 11.040 6.989 -4.563 1.00 0.00 H new ATOM 0 HB ILE A 622 9.940 8.625 -6.052 1.00 0.00 H new ATOM 0 HG12 ILE A 622 8.002 6.404 -6.763 1.00 0.00 H new ATOM 0 HG13 ILE A 622 7.625 7.660 -5.601 1.00 0.00 H new ATOM 0 HG21 ILE A 622 10.341 7.507 -8.202 1.00 0.00 H new ATOM 0 HG22 ILE A 622 11.615 7.132 -7.017 1.00 0.00 H new ATOM 0 HG23 ILE A 622 10.354 5.929 -7.379 1.00 0.00 H new ATOM 0 HD11 ILE A 622 6.681 8.179 -7.791 1.00 0.00 H new ATOM 0 HD12 ILE A 622 7.917 9.378 -7.344 1.00 0.00 H new ATOM 0 HD13 ILE A 622 8.300 8.102 -8.524 1.00 0.00 H new ATOM 905 N CYS A 623 9.196 8.763 -3.550 1.00 0.00 N ATOM 906 CA CYS A 623 8.393 9.472 -2.597 1.00 0.00 C ATOM 907 C CYS A 623 7.640 10.610 -3.261 1.00 0.00 C ATOM 908 O CYS A 623 8.225 11.425 -3.968 1.00 0.00 O ATOM 909 CB CYS A 623 9.259 10.014 -1.469 1.00 0.00 C ATOM 910 SG CYS A 623 9.982 8.727 -0.423 1.00 0.00 S ATOM 0 H CYS A 623 9.855 9.352 -4.059 1.00 0.00 H new ATOM 0 HA CYS A 623 7.668 8.771 -2.183 1.00 0.00 H new ATOM 0 HB2 CYS A 623 10.061 10.616 -1.896 1.00 0.00 H new ATOM 0 HB3 CYS A 623 8.658 10.679 -0.849 1.00 0.00 H new ATOM 915 N LYS A 624 6.353 10.636 -3.069 1.00 0.00 N ATOM 916 CA LYS A 624 5.509 11.712 -3.545 1.00 0.00 C ATOM 917 C LYS A 624 4.756 12.280 -2.382 1.00 0.00 C ATOM 918 O LYS A 624 4.060 11.549 -1.695 1.00 0.00 O ATOM 919 CB LYS A 624 4.517 11.220 -4.602 1.00 0.00 C ATOM 920 CG LYS A 624 5.110 10.968 -5.981 1.00 0.00 C ATOM 921 CD LYS A 624 4.036 10.526 -6.970 1.00 0.00 C ATOM 922 CE LYS A 624 2.926 11.564 -7.092 1.00 0.00 C ATOM 923 NZ LYS A 624 1.855 11.125 -7.998 1.00 0.00 N ATOM 0 H LYS A 624 5.846 9.904 -2.571 1.00 0.00 H new ATOM 0 HA LYS A 624 6.140 12.473 -4.006 1.00 0.00 H new ATOM 0 HB2 LYS A 624 4.060 10.296 -4.246 1.00 0.00 H new ATOM 0 HB3 LYS A 624 3.718 11.955 -4.697 1.00 0.00 H new ATOM 0 HG2 LYS A 624 5.591 11.876 -6.344 1.00 0.00 H new ATOM 0 HG3 LYS A 624 5.883 10.203 -5.913 1.00 0.00 H new ATOM 0 HD2 LYS A 624 4.488 10.358 -7.948 1.00 0.00 H new ATOM 0 HD3 LYS A 624 3.612 9.575 -6.647 1.00 0.00 H new ATOM 0 HE2 LYS A 624 2.507 11.763 -6.106 1.00 0.00 H new ATOM 0 HE3 LYS A 624 3.346 12.502 -7.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 624 0.986 11.657 -7.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 624 2.141 11.298 -8.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 624 1.680 10.109 -7.862 1.00 0.00 H new ATOM 937 N GLU A 625 4.908 13.554 -2.117 1.00 0.00 N ATOM 938 CA GLU A 625 4.199 14.144 -1.006 1.00 0.00 C ATOM 939 C GLU A 625 2.775 14.453 -1.452 1.00 0.00 C ATOM 940 O GLU A 625 1.834 14.417 -0.665 1.00 0.00 O ATOM 941 CB GLU A 625 4.897 15.417 -0.506 1.00 0.00 C ATOM 942 CG GLU A 625 4.606 15.731 0.954 1.00 0.00 C ATOM 943 CD GLU A 625 5.116 17.078 1.394 1.00 0.00 C ATOM 944 OE1 GLU A 625 6.295 17.195 1.779 1.00 0.00 O ATOM 945 OE2 GLU A 625 4.335 18.060 1.375 1.00 0.00 O ATOM 0 H GLU A 625 5.504 14.193 -2.643 1.00 0.00 H new ATOM 0 HA GLU A 625 4.186 13.440 -0.174 1.00 0.00 H new ATOM 0 HB2 GLU A 625 5.973 15.309 -0.639 1.00 0.00 H new ATOM 0 HB3 GLU A 625 4.583 16.260 -1.121 1.00 0.00 H new ATOM 0 HG2 GLU A 625 3.529 15.688 1.119 1.00 0.00 H new ATOM 0 HG3 GLU A 625 5.055 14.960 1.579 1.00 0.00 H new ATOM 952 N GLN A 626 2.624 14.701 -2.734 1.00 0.00 N ATOM 953 CA GLN A 626 1.346 15.027 -3.294 1.00 0.00 C ATOM 954 C GLN A 626 0.722 13.839 -3.977 1.00 0.00 C ATOM 955 O GLN A 626 1.210 13.352 -5.001 1.00 0.00 O ATOM 956 CB GLN A 626 1.428 16.215 -4.240 1.00 0.00 C ATOM 957 CG GLN A 626 1.781 17.508 -3.570 1.00 0.00 C ATOM 958 CD GLN A 626 0.786 17.825 -2.515 1.00 0.00 C ATOM 959 OE1 GLN A 626 0.965 17.497 -1.343 1.00 0.00 O ATOM 960 NE2 GLN A 626 -0.301 18.373 -2.922 1.00 0.00 N ATOM 0 H GLN A 626 3.387 14.681 -3.411 1.00 0.00 H new ATOM 0 HA GLN A 626 0.701 15.313 -2.463 1.00 0.00 H new ATOM 0 HB2 GLN A 626 2.170 16.002 -5.009 1.00 0.00 H new ATOM 0 HB3 GLN A 626 0.469 16.330 -4.745 1.00 0.00 H new ATOM 0 HG2 GLN A 626 2.777 17.440 -3.132 1.00 0.00 H new ATOM 0 HG3 GLN A 626 1.811 18.312 -4.306 1.00 0.00 H new ATOM 0 HE21 GLN A 626 -0.407 18.629 -3.904 1.00 0.00 H new ATOM 0 HE22 GLN A 626 -1.059 18.553 -2.264 1.00 0.00 H new ATOM 969 N VAL A 627 -0.330 13.368 -3.386 1.00 0.00 N ATOM 970 CA VAL A 627 -1.102 12.250 -3.872 1.00 0.00 C ATOM 971 C VAL A 627 -2.557 12.623 -3.878 1.00 0.00 C ATOM 972 O VAL A 627 -2.937 13.682 -3.347 1.00 0.00 O ATOM 973 CB VAL A 627 -0.888 10.986 -3.003 1.00 0.00 C ATOM 974 CG1 VAL A 627 0.479 10.421 -3.265 1.00 0.00 C ATOM 975 CG2 VAL A 627 -1.043 11.321 -1.519 1.00 0.00 C ATOM 0 H VAL A 627 -0.695 13.761 -2.518 1.00 0.00 H new ATOM 0 HA VAL A 627 -0.768 12.016 -4.883 1.00 0.00 H new ATOM 0 HB VAL A 627 -1.642 10.245 -3.267 1.00 0.00 H new ATOM 0 HG11 VAL A 627 0.629 9.532 -2.653 1.00 0.00 H new ATOM 0 HG12 VAL A 627 0.567 10.156 -4.319 1.00 0.00 H new ATOM 0 HG13 VAL A 627 1.235 11.165 -3.014 1.00 0.00 H new ATOM 0 HG21 VAL A 627 -0.889 10.420 -0.925 1.00 0.00 H new ATOM 0 HG22 VAL A 627 -0.306 12.072 -1.237 1.00 0.00 H new ATOM 0 HG23 VAL A 627 -2.045 11.709 -1.336 1.00 0.00 H new ATOM 979 N GLN A 628 -3.364 11.770 -4.424 1.00 0.00 N ATOM 980 CA GLN A 628 -4.765 12.020 -4.539 1.00 0.00 C ATOM 981 C GLN A 628 -5.446 11.352 -3.381 1.00 0.00 C ATOM 982 O GLN A 628 -4.836 10.527 -2.688 1.00 0.00 O ATOM 983 CB GLN A 628 -5.290 11.472 -5.868 1.00 0.00 C ATOM 984 CG GLN A 628 -4.606 12.082 -7.084 1.00 0.00 C ATOM 985 CD GLN A 628 -5.056 11.485 -8.404 1.00 0.00 C ATOM 986 OE1 GLN A 628 -4.279 11.417 -9.361 1.00 0.00 O ATOM 987 NE2 GLN A 628 -6.293 11.068 -8.482 1.00 0.00 N ATOM 0 H GLN A 628 -3.066 10.872 -4.806 1.00 0.00 H new ATOM 0 HA GLN A 628 -4.967 13.091 -4.521 1.00 0.00 H new ATOM 0 HB2 GLN A 628 -5.152 10.391 -5.887 1.00 0.00 H new ATOM 0 HB3 GLN A 628 -6.362 11.658 -5.932 1.00 0.00 H new ATOM 0 HG2 GLN A 628 -4.798 13.155 -7.097 1.00 0.00 H new ATOM 0 HG3 GLN A 628 -3.528 11.952 -6.986 1.00 0.00 H new ATOM 0 HE21 GLN A 628 -6.907 11.140 -7.671 1.00 0.00 H new ATOM 0 HE22 GLN A 628 -6.643 10.671 -9.354 1.00 0.00 H new ATOM 996 N SER A 629 -6.655 11.720 -3.130 1.00 0.00 N ATOM 997 CA SER A 629 -7.394 11.143 -2.060 1.00 0.00 C ATOM 998 C SER A 629 -8.525 10.278 -2.609 1.00 0.00 C ATOM 999 O SER A 629 -9.298 9.680 -1.849 1.00 0.00 O ATOM 1000 CB SER A 629 -7.902 12.258 -1.160 1.00 0.00 C ATOM 1001 OG SER A 629 -6.802 13.048 -0.699 1.00 0.00 O ATOM 0 H SER A 629 -7.160 12.430 -3.661 1.00 0.00 H new ATOM 0 HA SER A 629 -6.758 10.488 -1.465 1.00 0.00 H new ATOM 0 HB2 SER A 629 -8.608 12.884 -1.705 1.00 0.00 H new ATOM 0 HB3 SER A 629 -8.440 11.836 -0.311 1.00 0.00 H new ATOM 0 HG SER A 629 -7.135 13.766 -0.121 1.00 0.00 H new ATOM 1007 N CYS A 630 -8.628 10.256 -3.946 1.00 0.00 N ATOM 1008 CA CYS A 630 -9.588 9.441 -4.707 1.00 0.00 C ATOM 1009 C CYS A 630 -11.040 9.902 -4.591 1.00 0.00 C ATOM 1010 O CYS A 630 -11.777 9.884 -5.576 1.00 0.00 O ATOM 1011 CB CYS A 630 -9.435 7.944 -4.420 1.00 0.00 C ATOM 1012 SG CYS A 630 -7.928 7.182 -5.123 1.00 0.00 S ATOM 0 H CYS A 630 -8.028 10.822 -4.546 1.00 0.00 H new ATOM 0 HA CYS A 630 -9.323 9.604 -5.752 1.00 0.00 H new ATOM 0 HB2 CYS A 630 -9.432 7.793 -3.340 1.00 0.00 H new ATOM 0 HB3 CYS A 630 -10.307 7.421 -4.813 1.00 0.00 H new ATOM 1017 N GLY A 631 -11.434 10.322 -3.426 1.00 0.00 N ATOM 1018 CA GLY A 631 -12.779 10.757 -3.214 1.00 0.00 C ATOM 1019 C GLY A 631 -13.559 9.669 -2.547 1.00 0.00 C ATOM 1020 O GLY A 631 -12.997 8.965 -1.702 1.00 0.00 O ATOM 0 H GLY A 631 -10.835 10.372 -2.602 1.00 0.00 H new ATOM 0 HA2 GLY A 631 -12.788 11.656 -2.597 1.00 0.00 H new ATOM 0 HA3 GLY A 631 -13.241 11.019 -4.166 1.00 0.00 H new ATOM 1024 N PRO A 632 -14.838 9.498 -2.877 1.00 0.00 N ATOM 1025 CA PRO A 632 -15.628 8.408 -2.344 1.00 0.00 C ATOM 1026 C PRO A 632 -15.195 7.089 -2.990 1.00 0.00 C ATOM 1027 O PRO A 632 -14.836 7.059 -4.174 1.00 0.00 O ATOM 1028 CB PRO A 632 -17.066 8.765 -2.741 1.00 0.00 C ATOM 1029 CG PRO A 632 -16.928 9.635 -3.938 1.00 0.00 C ATOM 1030 CD PRO A 632 -15.616 10.351 -3.792 1.00 0.00 C ATOM 0 HA PRO A 632 -15.516 8.281 -1.267 1.00 0.00 H new ATOM 0 HB2 PRO A 632 -17.647 7.871 -2.967 1.00 0.00 H new ATOM 0 HB3 PRO A 632 -17.582 9.284 -1.933 1.00 0.00 H new ATOM 0 HG2 PRO A 632 -16.948 9.043 -4.853 1.00 0.00 H new ATOM 0 HG3 PRO A 632 -17.753 10.345 -4.000 1.00 0.00 H new ATOM 0 HD2 PRO A 632 -15.115 10.464 -4.753 1.00 0.00 H new ATOM 0 HD3 PRO A 632 -15.752 11.352 -3.384 1.00 0.00 H new ATOM 1038 N PRO A 633 -15.183 6.004 -2.237 1.00 0.00 N ATOM 1039 CA PRO A 633 -14.774 4.704 -2.749 1.00 0.00 C ATOM 1040 C PRO A 633 -15.832 4.079 -3.654 1.00 0.00 C ATOM 1041 O PRO A 633 -17.004 4.516 -3.670 1.00 0.00 O ATOM 1042 CB PRO A 633 -14.608 3.875 -1.478 1.00 0.00 C ATOM 1043 CG PRO A 633 -15.551 4.480 -0.516 1.00 0.00 C ATOM 1044 CD PRO A 633 -15.565 5.943 -0.821 1.00 0.00 C ATOM 0 HA PRO A 633 -13.875 4.766 -3.363 1.00 0.00 H new ATOM 0 HB2 PRO A 633 -14.841 2.825 -1.656 1.00 0.00 H new ATOM 0 HB3 PRO A 633 -13.583 3.916 -1.109 1.00 0.00 H new ATOM 0 HG2 PRO A 633 -16.547 4.049 -0.622 1.00 0.00 H new ATOM 0 HG3 PRO A 633 -15.232 4.298 0.510 1.00 0.00 H new ATOM 0 HD2 PRO A 633 -16.550 6.378 -0.652 1.00 0.00 H new ATOM 0 HD3 PRO A 633 -14.863 6.490 -0.192 1.00 0.00 H new ATOM 1052 N PRO A 634 -15.436 3.076 -4.443 1.00 0.00 N ATOM 1053 CA PRO A 634 -16.354 2.333 -5.288 1.00 0.00 C ATOM 1054 C PRO A 634 -17.362 1.527 -4.451 1.00 0.00 C ATOM 1055 O PRO A 634 -17.262 1.465 -3.210 1.00 0.00 O ATOM 1056 CB PRO A 634 -15.433 1.387 -6.085 1.00 0.00 C ATOM 1057 CG PRO A 634 -14.183 1.294 -5.294 1.00 0.00 C ATOM 1058 CD PRO A 634 -14.042 2.603 -4.588 1.00 0.00 C ATOM 0 HA PRO A 634 -16.953 2.986 -5.923 1.00 0.00 H new ATOM 0 HB2 PRO A 634 -15.892 0.406 -6.211 1.00 0.00 H new ATOM 0 HB3 PRO A 634 -15.238 1.778 -7.083 1.00 0.00 H new ATOM 0 HG2 PRO A 634 -14.233 0.470 -4.582 1.00 0.00 H new ATOM 0 HG3 PRO A 634 -13.326 1.105 -5.940 1.00 0.00 H new ATOM 0 HD2 PRO A 634 -13.557 2.485 -3.619 1.00 0.00 H new ATOM 0 HD3 PRO A 634 -13.439 3.305 -5.163 1.00 0.00 H new ATOM 1066 N GLU A 635 -18.315 0.932 -5.111 1.00 0.00 N ATOM 1067 CA GLU A 635 -19.315 0.135 -4.445 1.00 0.00 C ATOM 1068 C GLU A 635 -18.810 -1.298 -4.369 1.00 0.00 C ATOM 1069 O GLU A 635 -17.879 -1.673 -5.102 1.00 0.00 O ATOM 1070 CB GLU A 635 -20.642 0.199 -5.223 1.00 0.00 C ATOM 1071 CG GLU A 635 -20.587 -0.440 -6.609 1.00 0.00 C ATOM 1072 CD GLU A 635 -21.846 -0.231 -7.404 1.00 0.00 C ATOM 1073 OE1 GLU A 635 -22.890 -0.836 -7.079 1.00 0.00 O ATOM 1074 OE2 GLU A 635 -21.829 0.570 -8.355 1.00 0.00 O ATOM 0 H GLU A 635 -18.424 0.983 -6.124 1.00 0.00 H new ATOM 0 HA GLU A 635 -19.494 0.516 -3.440 1.00 0.00 H new ATOM 0 HB2 GLU A 635 -21.417 -0.295 -4.638 1.00 0.00 H new ATOM 0 HB3 GLU A 635 -20.939 1.243 -5.328 1.00 0.00 H new ATOM 0 HG2 GLU A 635 -19.743 -0.026 -7.160 1.00 0.00 H new ATOM 0 HG3 GLU A 635 -20.404 -1.509 -6.503 1.00 0.00 H new ATOM 1081 N LEU A 636 -19.387 -2.102 -3.511 1.00 0.00 N ATOM 1082 CA LEU A 636 -18.975 -3.475 -3.447 1.00 0.00 C ATOM 1083 C LEU A 636 -19.867 -4.248 -4.356 1.00 0.00 C ATOM 1084 O LEU A 636 -20.912 -3.742 -4.768 1.00 0.00 O ATOM 1085 CB LEU A 636 -19.123 -4.057 -2.064 1.00 0.00 C ATOM 1086 CG LEU A 636 -18.448 -5.410 -1.864 1.00 0.00 C ATOM 1087 CD1 LEU A 636 -16.998 -5.426 -2.303 1.00 0.00 C ATOM 1088 CD2 LEU A 636 -18.671 -6.091 -0.618 1.00 0.00 C ATOM 0 H LEU A 636 -20.127 -1.835 -2.862 1.00 0.00 H new ATOM 0 HA LEU A 636 -17.923 -3.531 -3.728 1.00 0.00 H new ATOM 0 HB2 LEU A 636 -18.712 -3.351 -1.342 1.00 0.00 H new ATOM 0 HB3 LEU A 636 -20.185 -4.160 -1.840 1.00 0.00 H new ATOM 0 HG LEU A 636 -19.007 -6.037 -2.558 1.00 0.00 H new ATOM 0 HD11 LEU A 636 -16.578 -6.417 -2.134 1.00 0.00 H new ATOM 0 HD12 LEU A 636 -16.936 -5.182 -3.363 1.00 0.00 H new ATOM 0 HD13 LEU A 636 -16.436 -4.690 -1.728 1.00 0.00 H new ATOM 0 HD21 LEU A 636 -18.130 -7.037 -0.619 1.00 0.00 H new ATOM 0 HD22 LEU A 636 -18.316 -5.470 0.205 1.00 0.00 H new ATOM 0 HD23 LEU A 636 -19.737 -6.283 -0.494 1.00 0.00 H new ATOM 1100 N LEU A 637 -19.513 -5.465 -4.655 1.00 0.00 N ATOM 1101 CA LEU A 637 -20.353 -6.206 -5.511 1.00 0.00 C ATOM 1102 C LEU A 637 -21.523 -6.859 -4.789 1.00 0.00 C ATOM 1103 O LEU A 637 -22.677 -6.738 -5.201 1.00 0.00 O ATOM 1104 CB LEU A 637 -19.648 -7.161 -6.498 1.00 0.00 C ATOM 1105 CG LEU A 637 -18.850 -8.356 -5.940 1.00 0.00 C ATOM 1106 CD1 LEU A 637 -18.427 -9.263 -7.075 1.00 0.00 C ATOM 1107 CD2 LEU A 637 -17.619 -7.922 -5.158 1.00 0.00 C ATOM 0 H LEU A 637 -18.674 -5.942 -4.325 1.00 0.00 H new ATOM 0 HA LEU A 637 -20.771 -5.438 -6.162 1.00 0.00 H new ATOM 0 HB2 LEU A 637 -20.408 -7.558 -7.171 1.00 0.00 H new ATOM 0 HB3 LEU A 637 -18.966 -6.564 -7.104 1.00 0.00 H new ATOM 0 HG LEU A 637 -19.507 -8.887 -5.251 1.00 0.00 H new ATOM 0 HD11 LEU A 637 -17.863 -10.106 -6.676 1.00 0.00 H new ATOM 0 HD12 LEU A 637 -19.311 -9.631 -7.595 1.00 0.00 H new ATOM 0 HD13 LEU A 637 -17.801 -8.706 -7.772 1.00 0.00 H new ATOM 0 HD21 LEU A 637 -17.094 -8.803 -4.788 1.00 0.00 H new ATOM 0 HD22 LEU A 637 -16.957 -7.352 -5.809 1.00 0.00 H new ATOM 0 HD23 LEU A 637 -17.923 -7.300 -4.316 1.00 0.00 H new ATOM 1119 N ASN A 638 -21.235 -7.508 -3.706 1.00 0.00 N ATOM 1120 CA ASN A 638 -22.257 -8.203 -2.960 1.00 0.00 C ATOM 1121 C ASN A 638 -22.260 -7.730 -1.534 1.00 0.00 C ATOM 1122 O ASN A 638 -22.507 -8.491 -0.601 1.00 0.00 O ATOM 1123 CB ASN A 638 -22.080 -9.725 -3.071 1.00 0.00 C ATOM 1124 CG ASN A 638 -22.512 -10.279 -4.424 1.00 0.00 C ATOM 1125 OD1 ASN A 638 -23.680 -10.624 -4.620 1.00 0.00 O ATOM 1126 ND2 ASN A 638 -21.590 -10.402 -5.348 1.00 0.00 N ATOM 0 H ASN A 638 -20.298 -7.576 -3.310 1.00 0.00 H new ATOM 0 HA ASN A 638 -23.233 -7.972 -3.388 1.00 0.00 H new ATOM 0 HB2 ASN A 638 -21.034 -9.977 -2.899 1.00 0.00 H new ATOM 0 HB3 ASN A 638 -22.658 -10.211 -2.285 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -21.830 -10.792 -6.259 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -20.633 -10.108 -5.156 1.00 0.00 H new ATOM 1133 N GLY A 639 -21.959 -6.461 -1.384 1.00 0.00 N ATOM 1134 CA GLY A 639 -22.019 -5.797 -0.126 1.00 0.00 C ATOM 1135 C GLY A 639 -22.114 -4.322 -0.334 1.00 0.00 C ATOM 1136 O GLY A 639 -22.759 -3.862 -1.293 1.00 0.00 O ATOM 0 H GLY A 639 -21.662 -5.861 -2.153 1.00 0.00 H new ATOM 0 HA2 GLY A 639 -22.881 -6.149 0.440 1.00 0.00 H new ATOM 0 HA3 GLY A 639 -21.133 -6.034 0.463 1.00 0.00 H new ATOM 1140 N ASN A 640 -21.408 -3.595 0.491 1.00 0.00 N ATOM 1141 CA ASN A 640 -21.365 -2.154 0.438 1.00 0.00 C ATOM 1142 C ASN A 640 -20.160 -1.718 1.216 1.00 0.00 C ATOM 1143 O ASN A 640 -19.354 -2.554 1.648 1.00 0.00 O ATOM 1144 CB ASN A 640 -22.589 -1.579 1.122 1.00 0.00 C ATOM 1145 CG ASN A 640 -22.912 -0.116 0.790 1.00 0.00 C ATOM 1146 OD1 ASN A 640 -23.481 0.597 1.610 1.00 0.00 O ATOM 1147 ND2 ASN A 640 -22.544 0.340 -0.379 1.00 0.00 N ATOM 0 H ASN A 640 -20.835 -3.994 1.234 1.00 0.00 H new ATOM 0 HA ASN A 640 -21.330 -1.816 -0.598 1.00 0.00 H new ATOM 0 HB2 ASN A 640 -23.451 -2.191 0.858 1.00 0.00 H new ATOM 0 HB3 ASN A 640 -22.455 -1.666 2.200 1.00 0.00 H new ATOM 0 HD21 ASN A 640 -22.729 1.312 -0.629 1.00 0.00 H new ATOM 0 HD22 ASN A 640 -22.072 -0.276 -1.041 1.00 0.00 H new ATOM 1154 N VAL A 641 -20.049 -0.452 1.422 1.00 0.00 N ATOM 1155 CA VAL A 641 -19.013 0.095 2.202 1.00 0.00 C ATOM 1156 C VAL A 641 -19.582 0.287 3.610 1.00 0.00 C ATOM 1157 O VAL A 641 -20.628 0.921 3.774 1.00 0.00 O ATOM 1158 CB VAL A 641 -18.556 1.460 1.636 1.00 0.00 C ATOM 1159 CG1 VAL A 641 -17.270 1.925 2.278 1.00 0.00 C ATOM 1160 CG2 VAL A 641 -18.434 1.423 0.123 1.00 0.00 C ATOM 0 H VAL A 641 -20.694 0.241 1.041 1.00 0.00 H new ATOM 0 HA VAL A 641 -18.146 -0.566 2.202 1.00 0.00 H new ATOM 0 HB VAL A 641 -19.328 2.187 1.886 1.00 0.00 H new ATOM 0 HG11 VAL A 641 -16.980 2.887 1.856 1.00 0.00 H new ATOM 0 HG12 VAL A 641 -17.417 2.030 3.353 1.00 0.00 H new ATOM 0 HG13 VAL A 641 -16.484 1.194 2.089 1.00 0.00 H new ATOM 0 HG21 VAL A 641 -18.111 2.399 -0.240 1.00 0.00 H new ATOM 0 HG22 VAL A 641 -17.702 0.668 -0.165 1.00 0.00 H new ATOM 0 HG23 VAL A 641 -19.401 1.175 -0.314 1.00 0.00 H new ATOM 1164 N LYS A 642 -18.948 -0.295 4.601 1.00 0.00 N ATOM 1165 CA LYS A 642 -19.426 -0.165 5.981 1.00 0.00 C ATOM 1166 C LYS A 642 -19.004 1.174 6.549 1.00 0.00 C ATOM 1167 O LYS A 642 -19.626 1.699 7.463 1.00 0.00 O ATOM 1168 CB LYS A 642 -18.951 -1.330 6.869 1.00 0.00 C ATOM 1169 CG LYS A 642 -17.485 -1.618 6.732 1.00 0.00 C ATOM 1170 CD LYS A 642 -16.967 -2.654 7.714 1.00 0.00 C ATOM 1171 CE LYS A 642 -17.024 -2.143 9.139 1.00 0.00 C ATOM 1172 NZ LYS A 642 -16.261 -3.006 10.062 1.00 0.00 N ATOM 0 H LYS A 642 -18.106 -0.861 4.492 1.00 0.00 H new ATOM 0 HA LYS A 642 -20.515 -0.211 5.968 1.00 0.00 H new ATOM 0 HB2 LYS A 642 -19.173 -1.098 7.911 1.00 0.00 H new ATOM 0 HB3 LYS A 642 -19.516 -2.226 6.614 1.00 0.00 H new ATOM 0 HG2 LYS A 642 -17.286 -1.962 5.717 1.00 0.00 H new ATOM 0 HG3 LYS A 642 -16.928 -0.691 6.869 1.00 0.00 H new ATOM 0 HD2 LYS A 642 -17.558 -3.566 7.629 1.00 0.00 H new ATOM 0 HD3 LYS A 642 -15.940 -2.916 7.461 1.00 0.00 H new ATOM 0 HE2 LYS A 642 -16.627 -1.129 9.178 1.00 0.00 H new ATOM 0 HE3 LYS A 642 -18.063 -2.091 9.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 -16.572 -2.831 11.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 -16.425 -4.004 9.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 -15.247 -2.792 9.979 1.00 0.00 H new ATOM 1186 N GLU A 643 -17.959 1.720 5.977 1.00 0.00 N ATOM 1187 CA GLU A 643 -17.495 3.041 6.309 1.00 0.00 C ATOM 1188 C GLU A 643 -18.384 4.044 5.596 1.00 0.00 C ATOM 1189 O GLU A 643 -18.961 3.719 4.547 1.00 0.00 O ATOM 1190 CB GLU A 643 -16.059 3.205 5.828 1.00 0.00 C ATOM 1191 CG GLU A 643 -15.077 2.307 6.531 1.00 0.00 C ATOM 1192 CD GLU A 643 -14.893 2.670 7.975 1.00 0.00 C ATOM 1193 OE1 GLU A 643 -15.663 2.197 8.825 1.00 0.00 O ATOM 1194 OE2 GLU A 643 -13.957 3.441 8.280 1.00 0.00 O ATOM 0 H GLU A 643 -17.402 1.254 5.261 1.00 0.00 H new ATOM 0 HA GLU A 643 -17.532 3.200 7.387 1.00 0.00 H new ATOM 0 HB2 GLU A 643 -16.019 3.004 4.757 1.00 0.00 H new ATOM 0 HB3 GLU A 643 -15.754 4.242 5.969 1.00 0.00 H new ATOM 0 HG2 GLU A 643 -15.420 1.275 6.461 1.00 0.00 H new ATOM 0 HG3 GLU A 643 -14.115 2.359 6.022 1.00 0.00 H new ATOM 1201 N LYS A 644 -18.529 5.228 6.142 1.00 0.00 N ATOM 1202 CA LYS A 644 -19.326 6.231 5.485 1.00 0.00 C ATOM 1203 C LYS A 644 -18.532 6.876 4.378 1.00 0.00 C ATOM 1204 O LYS A 644 -17.468 7.455 4.618 1.00 0.00 O ATOM 1205 CB LYS A 644 -19.871 7.295 6.451 1.00 0.00 C ATOM 1206 CG LYS A 644 -20.579 8.443 5.721 1.00 0.00 C ATOM 1207 CD LYS A 644 -21.760 7.943 4.881 1.00 0.00 C ATOM 1208 CE LYS A 644 -22.961 7.546 5.720 1.00 0.00 C ATOM 1209 NZ LYS A 644 -23.591 8.721 6.353 1.00 0.00 N ATOM 0 H LYS A 644 -18.111 5.516 7.027 1.00 0.00 H new ATOM 0 HA LYS A 644 -20.195 5.724 5.065 1.00 0.00 H new ATOM 0 HB2 LYS A 644 -20.567 6.827 7.147 1.00 0.00 H new ATOM 0 HB3 LYS A 644 -19.050 7.697 7.044 1.00 0.00 H new ATOM 0 HG2 LYS A 644 -20.934 9.172 6.449 1.00 0.00 H new ATOM 0 HG3 LYS A 644 -19.867 8.957 5.076 1.00 0.00 H new ATOM 0 HD2 LYS A 644 -22.056 8.724 4.180 1.00 0.00 H new ATOM 0 HD3 LYS A 644 -21.440 7.087 4.288 1.00 0.00 H new ATOM 0 HE2 LYS A 644 -23.691 7.034 5.093 1.00 0.00 H new ATOM 0 HE3 LYS A 644 -22.651 6.839 6.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 -24.529 8.458 6.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 -22.995 9.053 7.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 -23.693 9.481 5.650 1.00 0.00 H new ATOM 1223 N THR A 645 -19.057 6.785 3.184 1.00 0.00 N ATOM 1224 CA THR A 645 -18.424 7.301 2.023 1.00 0.00 C ATOM 1225 C THR A 645 -18.367 8.838 2.014 1.00 0.00 C ATOM 1226 O THR A 645 -19.367 9.531 1.742 1.00 0.00 O ATOM 1227 CB THR A 645 -19.133 6.778 0.768 1.00 0.00 C ATOM 1228 OG1 THR A 645 -20.548 7.030 0.873 1.00 0.00 O ATOM 1229 CG2 THR A 645 -18.907 5.286 0.607 1.00 0.00 C ATOM 0 H THR A 645 -19.956 6.339 3.000 1.00 0.00 H new ATOM 0 HA THR A 645 -17.391 6.952 2.031 1.00 0.00 H new ATOM 0 HB THR A 645 -18.723 7.294 -0.100 1.00 0.00 H new ATOM 0 HG1 THR A 645 -20.694 7.913 1.273 1.00 0.00 H new ATOM 0 HG21 THR A 645 -19.418 4.935 -0.289 1.00 0.00 H new ATOM 0 HG22 THR A 645 -17.839 5.087 0.517 1.00 0.00 H new ATOM 0 HG23 THR A 645 -19.301 4.762 1.478 1.00 0.00 H new ATOM 1237 N LYS A 646 -17.237 9.360 2.390 1.00 0.00 N ATOM 1238 CA LYS A 646 -16.998 10.774 2.317 1.00 0.00 C ATOM 1239 C LYS A 646 -16.421 11.108 0.950 1.00 0.00 C ATOM 1240 O LYS A 646 -15.893 10.233 0.267 1.00 0.00 O ATOM 1241 CB LYS A 646 -16.087 11.259 3.461 1.00 0.00 C ATOM 1242 CG LYS A 646 -14.791 10.515 3.585 1.00 0.00 C ATOM 1243 CD LYS A 646 -13.930 11.078 4.687 1.00 0.00 C ATOM 1244 CE LYS A 646 -12.688 10.246 4.836 1.00 0.00 C ATOM 1245 NZ LYS A 646 -11.712 10.813 5.785 1.00 0.00 N ATOM 0 H LYS A 646 -16.454 8.819 2.756 1.00 0.00 H new ATOM 0 HA LYS A 646 -17.943 11.303 2.441 1.00 0.00 H new ATOM 0 HB2 LYS A 646 -15.871 12.317 3.312 1.00 0.00 H new ATOM 0 HB3 LYS A 646 -16.631 11.174 4.402 1.00 0.00 H new ATOM 0 HG2 LYS A 646 -14.993 9.462 3.782 1.00 0.00 H new ATOM 0 HG3 LYS A 646 -14.251 10.564 2.640 1.00 0.00 H new ATOM 0 HD2 LYS A 646 -13.663 12.110 4.461 1.00 0.00 H new ATOM 0 HD3 LYS A 646 -14.485 11.091 5.625 1.00 0.00 H new ATOM 0 HE2 LYS A 646 -12.967 9.246 5.168 1.00 0.00 H new ATOM 0 HE3 LYS A 646 -12.214 10.137 3.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 -11.243 10.042 6.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 -11.000 11.363 5.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 -12.204 11.434 6.459 1.00 0.00 H new ATOM 1259 N GLU A 647 -16.505 12.355 0.571 1.00 0.00 N ATOM 1260 CA GLU A 647 -16.099 12.810 -0.765 1.00 0.00 C ATOM 1261 C GLU A 647 -14.607 12.971 -0.931 1.00 0.00 C ATOM 1262 O GLU A 647 -14.131 13.255 -2.037 1.00 0.00 O ATOM 1263 CB GLU A 647 -16.780 14.116 -1.121 1.00 0.00 C ATOM 1264 CG GLU A 647 -18.257 13.994 -1.303 1.00 0.00 C ATOM 1265 CD GLU A 647 -18.597 13.012 -2.374 1.00 0.00 C ATOM 1266 OE1 GLU A 647 -18.441 13.345 -3.567 1.00 0.00 O ATOM 1267 OE2 GLU A 647 -19.038 11.914 -2.051 1.00 0.00 O ATOM 0 H GLU A 647 -16.857 13.101 1.171 1.00 0.00 H new ATOM 0 HA GLU A 647 -16.414 12.018 -1.444 1.00 0.00 H new ATOM 0 HB2 GLU A 647 -16.579 14.846 -0.337 1.00 0.00 H new ATOM 0 HB3 GLU A 647 -16.341 14.506 -2.039 1.00 0.00 H new ATOM 0 HG2 GLU A 647 -18.716 13.684 -0.364 1.00 0.00 H new ATOM 0 HG3 GLU A 647 -18.675 14.968 -1.555 1.00 0.00 H new ATOM 1274 N GLU A 648 -13.886 12.812 0.128 1.00 0.00 N ATOM 1275 CA GLU A 648 -12.468 12.938 0.099 1.00 0.00 C ATOM 1276 C GLU A 648 -11.868 11.971 1.084 1.00 0.00 C ATOM 1277 O GLU A 648 -11.995 12.156 2.287 1.00 0.00 O ATOM 1278 CB GLU A 648 -12.064 14.382 0.425 1.00 0.00 C ATOM 1279 CG GLU A 648 -10.569 14.626 0.505 1.00 0.00 C ATOM 1280 CD GLU A 648 -10.247 16.075 0.746 1.00 0.00 C ATOM 1281 OE1 GLU A 648 -10.582 16.607 1.826 1.00 0.00 O ATOM 1282 OE2 GLU A 648 -9.689 16.725 -0.164 1.00 0.00 O ATOM 0 H GLU A 648 -14.269 12.589 1.047 1.00 0.00 H new ATOM 0 HA GLU A 648 -12.093 12.702 -0.897 1.00 0.00 H new ATOM 0 HB2 GLU A 648 -12.485 15.041 -0.334 1.00 0.00 H new ATOM 0 HB3 GLU A 648 -12.515 14.664 1.377 1.00 0.00 H new ATOM 0 HG2 GLU A 648 -10.146 14.022 1.308 1.00 0.00 H new ATOM 0 HG3 GLU A 648 -10.098 14.299 -0.422 1.00 0.00 H new ATOM 1289 N TYR A 649 -11.306 10.900 0.585 1.00 0.00 N ATOM 1290 CA TYR A 649 -10.626 9.966 1.434 1.00 0.00 C ATOM 1291 C TYR A 649 -9.151 10.301 1.580 1.00 0.00 C ATOM 1292 O TYR A 649 -8.808 11.346 2.135 1.00 0.00 O ATOM 1293 CB TYR A 649 -10.878 8.512 1.037 1.00 0.00 C ATOM 1294 CG TYR A 649 -12.042 7.902 1.757 1.00 0.00 C ATOM 1295 CD1 TYR A 649 -13.349 8.057 1.322 1.00 0.00 C ATOM 1296 CD2 TYR A 649 -11.814 7.171 2.892 1.00 0.00 C ATOM 1297 CE1 TYR A 649 -14.395 7.483 2.022 1.00 0.00 C ATOM 1298 CE2 TYR A 649 -12.822 6.595 3.596 1.00 0.00 C ATOM 1299 CZ TYR A 649 -14.122 6.751 3.163 1.00 0.00 C ATOM 1300 OH TYR A 649 -15.144 6.157 3.840 1.00 0.00 O ATOM 0 H TYR A 649 -11.308 10.656 -0.405 1.00 0.00 H new ATOM 0 HA TYR A 649 -11.062 10.071 2.428 1.00 0.00 H new ATOM 0 HB2 TYR A 649 -11.055 8.460 -0.037 1.00 0.00 H new ATOM 0 HB3 TYR A 649 -9.983 7.925 1.242 1.00 0.00 H new ATOM 0 HD1 TYR A 649 -13.552 8.630 0.430 1.00 0.00 H new ATOM 0 HD2 TYR A 649 -10.799 7.048 3.239 1.00 0.00 H new ATOM 0 HE1 TYR A 649 -15.413 7.605 1.681 1.00 0.00 H new ATOM 0 HE2 TYR A 649 -12.608 6.021 4.485 1.00 0.00 H new ATOM 0 HH TYR A 649 -15.846 6.817 4.018 1.00 0.00 H new ATOM 1310 N GLY A 650 -8.291 9.491 1.035 1.00 0.00 N ATOM 1311 CA GLY A 650 -6.898 9.728 1.168 1.00 0.00 C ATOM 1312 C GLY A 650 -6.129 8.549 0.713 1.00 0.00 C ATOM 1313 O GLY A 650 -6.691 7.454 0.600 1.00 0.00 O ATOM 0 H GLY A 650 -8.538 8.662 0.495 1.00 0.00 H new ATOM 0 HA2 GLY A 650 -6.614 10.603 0.584 1.00 0.00 H new ATOM 0 HA3 GLY A 650 -6.658 9.948 2.208 1.00 0.00 H new ATOM 1317 N HIS A 651 -4.871 8.763 0.421 1.00 0.00 N ATOM 1318 CA HIS A 651 -3.976 7.713 -0.017 1.00 0.00 C ATOM 1319 C HIS A 651 -3.945 6.529 0.939 1.00 0.00 C ATOM 1320 O HIS A 651 -4.224 5.404 0.554 1.00 0.00 O ATOM 1321 CB HIS A 651 -2.547 8.255 -0.253 1.00 0.00 C ATOM 1322 CG HIS A 651 -1.518 7.175 -0.493 1.00 0.00 C ATOM 1323 ND1 HIS A 651 -1.542 6.356 -1.579 1.00 0.00 N ATOM 1324 CD2 HIS A 651 -0.487 6.762 0.259 1.00 0.00 C ATOM 1325 CE1 HIS A 651 -0.565 5.479 -1.495 1.00 0.00 C ATOM 1326 NE2 HIS A 651 0.088 5.704 -0.386 1.00 0.00 N ATOM 0 H HIS A 651 -4.431 9.681 0.480 1.00 0.00 H new ATOM 0 HA HIS A 651 -4.373 7.350 -0.965 1.00 0.00 H new ATOM 0 HB2 HIS A 651 -2.561 8.928 -1.110 1.00 0.00 H new ATOM 0 HB3 HIS A 651 -2.245 8.846 0.612 1.00 0.00 H new ATOM 0 HD1 HIS A 651 -2.216 6.413 -2.343 1.00 0.00 H new ATOM 0 HD2 HIS A 651 -0.170 7.187 1.200 1.00 0.00 H new ATOM 0 HE1 HIS A 651 -0.342 4.707 -2.217 1.00 0.00 H new ATOM 1335 N SER A 652 -3.618 6.786 2.155 1.00 0.00 N ATOM 1336 CA SER A 652 -3.447 5.738 3.109 1.00 0.00 C ATOM 1337 C SER A 652 -4.748 5.413 3.838 1.00 0.00 C ATOM 1338 O SER A 652 -4.754 4.612 4.771 1.00 0.00 O ATOM 1339 CB SER A 652 -2.344 6.131 4.080 1.00 0.00 C ATOM 1340 OG SER A 652 -1.142 6.423 3.368 1.00 0.00 O ATOM 0 H SER A 652 -3.461 7.725 2.521 1.00 0.00 H new ATOM 0 HA SER A 652 -3.158 4.827 2.586 1.00 0.00 H new ATOM 0 HB2 SER A 652 -2.653 7.001 4.660 1.00 0.00 H new ATOM 0 HB3 SER A 652 -2.168 5.322 4.789 1.00 0.00 H new ATOM 0 HG SER A 652 -0.439 6.676 4.002 1.00 0.00 H new ATOM 1346 N GLU A 653 -5.843 5.992 3.390 1.00 0.00 N ATOM 1347 CA GLU A 653 -7.109 5.766 4.026 1.00 0.00 C ATOM 1348 C GLU A 653 -7.844 4.637 3.347 1.00 0.00 C ATOM 1349 O GLU A 653 -8.132 4.680 2.149 1.00 0.00 O ATOM 1350 CB GLU A 653 -7.939 7.039 4.080 1.00 0.00 C ATOM 1351 CG GLU A 653 -9.139 6.915 5.005 1.00 0.00 C ATOM 1352 CD GLU A 653 -9.796 8.234 5.316 1.00 0.00 C ATOM 1353 OE1 GLU A 653 -9.741 9.152 4.501 1.00 0.00 O ATOM 1354 OE2 GLU A 653 -10.374 8.380 6.405 1.00 0.00 O ATOM 0 H GLU A 653 -5.874 6.621 2.588 1.00 0.00 H new ATOM 0 HA GLU A 653 -6.928 5.469 5.059 1.00 0.00 H new ATOM 0 HB2 GLU A 653 -7.311 7.864 4.415 1.00 0.00 H new ATOM 0 HB3 GLU A 653 -8.283 7.287 3.076 1.00 0.00 H new ATOM 0 HG2 GLU A 653 -9.873 6.251 4.548 1.00 0.00 H new ATOM 0 HG3 GLU A 653 -8.823 6.447 5.937 1.00 0.00 H new ATOM 1361 N VAL A 654 -8.083 3.612 4.116 1.00 0.00 N ATOM 1362 CA VAL A 654 -8.774 2.438 3.651 1.00 0.00 C ATOM 1363 C VAL A 654 -10.243 2.556 3.848 1.00 0.00 C ATOM 1364 O VAL A 654 -10.728 3.253 4.762 1.00 0.00 O ATOM 1365 CB VAL A 654 -8.303 1.135 4.331 1.00 0.00 C ATOM 1366 CG1 VAL A 654 -6.971 0.671 3.807 1.00 0.00 C ATOM 1367 CG2 VAL A 654 -8.270 1.290 5.833 1.00 0.00 C ATOM 0 H VAL A 654 -7.801 3.566 5.095 1.00 0.00 H new ATOM 0 HA VAL A 654 -8.534 2.378 2.589 1.00 0.00 H new ATOM 0 HB VAL A 654 -9.031 0.363 4.082 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -6.681 -0.249 4.315 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -7.046 0.486 2.735 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -6.220 1.439 3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -7.935 0.358 6.288 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -7.582 2.092 6.101 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -9.269 1.532 6.196 1.00 0.00 H new ATOM 1371 N VAL A 655 -10.945 1.893 3.005 1.00 0.00 N ATOM 1372 CA VAL A 655 -12.360 1.842 3.079 1.00 0.00 C ATOM 1373 C VAL A 655 -12.830 0.428 3.334 1.00 0.00 C ATOM 1374 O VAL A 655 -12.731 -0.434 2.473 1.00 0.00 O ATOM 1375 CB VAL A 655 -13.039 2.448 1.817 1.00 0.00 C ATOM 1376 CG1 VAL A 655 -12.742 3.900 1.735 1.00 0.00 C ATOM 1377 CG2 VAL A 655 -12.552 1.797 0.542 1.00 0.00 C ATOM 0 H VAL A 655 -10.547 1.361 2.231 1.00 0.00 H new ATOM 0 HA VAL A 655 -12.664 2.461 3.923 1.00 0.00 H new ATOM 0 HB VAL A 655 -14.110 2.271 1.915 1.00 0.00 H new ATOM 0 HG11 VAL A 655 -13.220 4.320 0.850 1.00 0.00 H new ATOM 0 HG12 VAL A 655 -13.124 4.400 2.625 1.00 0.00 H new ATOM 0 HG13 VAL A 655 -11.664 4.048 1.670 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -13.053 2.251 -0.313 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -11.475 1.939 0.449 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -12.776 0.731 0.569 1.00 0.00 H new ATOM 1381 N GLU A 656 -13.227 0.175 4.552 1.00 0.00 N ATOM 1382 CA GLU A 656 -13.804 -1.085 4.910 1.00 0.00 C ATOM 1383 C GLU A 656 -15.129 -1.309 4.210 1.00 0.00 C ATOM 1384 O GLU A 656 -16.062 -0.487 4.276 1.00 0.00 O ATOM 1385 CB GLU A 656 -14.015 -1.204 6.404 1.00 0.00 C ATOM 1386 CG GLU A 656 -12.820 -1.657 7.192 1.00 0.00 C ATOM 1387 CD GLU A 656 -13.097 -1.608 8.666 1.00 0.00 C ATOM 1388 OE1 GLU A 656 -13.702 -2.565 9.210 1.00 0.00 O ATOM 1389 OE2 GLU A 656 -12.736 -0.607 9.323 1.00 0.00 O ATOM 0 H GLU A 656 -13.158 0.840 5.322 1.00 0.00 H new ATOM 0 HA GLU A 656 -13.093 -1.846 4.590 1.00 0.00 H new ATOM 0 HB2 GLU A 656 -14.334 -0.235 6.786 1.00 0.00 H new ATOM 0 HB3 GLU A 656 -14.832 -1.902 6.583 1.00 0.00 H new ATOM 0 HG2 GLU A 656 -12.553 -2.673 6.902 1.00 0.00 H new ATOM 0 HG3 GLU A 656 -11.964 -1.024 6.958 1.00 0.00 H new ATOM 1396 N TYR A 657 -15.180 -2.375 3.540 1.00 0.00 N ATOM 1397 CA TYR A 657 -16.329 -2.876 2.901 1.00 0.00 C ATOM 1398 C TYR A 657 -16.884 -3.990 3.731 1.00 0.00 C ATOM 1399 O TYR A 657 -16.208 -4.499 4.637 1.00 0.00 O ATOM 1400 CB TYR A 657 -15.938 -3.442 1.544 1.00 0.00 C ATOM 1401 CG TYR A 657 -15.652 -2.416 0.499 1.00 0.00 C ATOM 1402 CD1 TYR A 657 -16.672 -1.897 -0.261 1.00 0.00 C ATOM 1403 CD2 TYR A 657 -14.369 -1.965 0.271 1.00 0.00 C ATOM 1404 CE1 TYR A 657 -16.428 -0.959 -1.219 1.00 0.00 C ATOM 1405 CE2 TYR A 657 -14.111 -1.024 -0.684 1.00 0.00 C ATOM 1406 CZ TYR A 657 -15.141 -0.524 -1.428 1.00 0.00 C ATOM 1407 OH TYR A 657 -14.890 0.414 -2.372 1.00 0.00 O ATOM 0 H TYR A 657 -14.364 -2.972 3.408 1.00 0.00 H new ATOM 0 HA TYR A 657 -17.064 -2.080 2.779 1.00 0.00 H new ATOM 0 HB2 TYR A 657 -15.056 -4.070 1.668 1.00 0.00 H new ATOM 0 HB3 TYR A 657 -16.742 -4.088 1.190 1.00 0.00 H new ATOM 0 HD1 TYR A 657 -17.684 -2.238 -0.097 1.00 0.00 H new ATOM 0 HD2 TYR A 657 -13.554 -2.363 0.858 1.00 0.00 H new ATOM 0 HE1 TYR A 657 -17.240 -0.560 -1.810 1.00 0.00 H new ATOM 0 HE2 TYR A 657 -13.101 -0.678 -0.849 1.00 0.00 H new ATOM 0 HH TYR A 657 -15.701 0.939 -2.536 1.00 0.00 H new ATOM 1417 N TYR A 658 -18.084 -4.363 3.441 1.00 0.00 N ATOM 1418 CA TYR A 658 -18.691 -5.494 4.051 1.00 0.00 C ATOM 1419 C TYR A 658 -19.593 -6.105 3.014 1.00 0.00 C ATOM 1420 O TYR A 658 -20.237 -5.376 2.259 1.00 0.00 O ATOM 1421 CB TYR A 658 -19.484 -5.104 5.325 1.00 0.00 C ATOM 1422 CG TYR A 658 -20.837 -4.446 5.098 1.00 0.00 C ATOM 1423 CD1 TYR A 658 -20.952 -3.163 4.585 1.00 0.00 C ATOM 1424 CD2 TYR A 658 -21.998 -5.118 5.427 1.00 0.00 C ATOM 1425 CE1 TYR A 658 -22.176 -2.575 4.409 1.00 0.00 C ATOM 1426 CE2 TYR A 658 -23.229 -4.541 5.247 1.00 0.00 C ATOM 1427 CZ TYR A 658 -23.316 -3.268 4.737 1.00 0.00 C ATOM 1428 OH TYR A 658 -24.555 -2.679 4.576 1.00 0.00 O ATOM 0 H TYR A 658 -18.678 -3.884 2.764 1.00 0.00 H new ATOM 0 HA TYR A 658 -17.933 -6.205 4.380 1.00 0.00 H new ATOM 0 HB2 TYR A 658 -19.636 -6.003 5.923 1.00 0.00 H new ATOM 0 HB3 TYR A 658 -18.869 -4.427 5.918 1.00 0.00 H new ATOM 0 HD1 TYR A 658 -20.059 -2.617 4.319 1.00 0.00 H new ATOM 0 HD2 TYR A 658 -21.935 -6.117 5.834 1.00 0.00 H new ATOM 0 HE1 TYR A 658 -22.245 -1.572 4.015 1.00 0.00 H new ATOM 0 HE2 TYR A 658 -24.126 -5.085 5.505 1.00 0.00 H new ATOM 0 HH TYR A 658 -25.254 -3.307 4.854 1.00 0.00 H new ATOM 1438 N CYS A 659 -19.588 -7.386 2.909 1.00 0.00 N ATOM 1439 CA CYS A 659 -20.463 -8.061 2.000 1.00 0.00 C ATOM 1440 C CYS A 659 -21.654 -8.512 2.803 1.00 0.00 C ATOM 1441 O CYS A 659 -21.633 -8.461 4.043 1.00 0.00 O ATOM 1442 CB CYS A 659 -19.761 -9.266 1.360 1.00 0.00 C ATOM 1443 SG CYS A 659 -18.192 -8.989 0.470 1.00 0.00 S ATOM 0 H CYS A 659 -18.979 -8.002 3.448 1.00 0.00 H new ATOM 0 HA CYS A 659 -20.763 -7.399 1.188 1.00 0.00 H new ATOM 0 HB2 CYS A 659 -19.571 -9.995 2.147 1.00 0.00 H new ATOM 0 HB3 CYS A 659 -20.461 -9.725 0.662 1.00 0.00 H new ATOM 1448 N ASN A 660 -22.691 -8.892 2.129 1.00 0.00 N ATOM 1449 CA ASN A 660 -23.888 -9.365 2.770 1.00 0.00 C ATOM 1450 C ASN A 660 -23.587 -10.639 3.537 1.00 0.00 C ATOM 1451 O ASN A 660 -22.722 -11.425 3.129 1.00 0.00 O ATOM 1452 CB ASN A 660 -24.976 -9.588 1.728 1.00 0.00 C ATOM 1453 CG ASN A 660 -25.365 -8.286 1.045 1.00 0.00 C ATOM 1454 OD1 ASN A 660 -25.463 -7.236 1.690 1.00 0.00 O ATOM 1455 ND2 ASN A 660 -25.491 -8.308 -0.243 1.00 0.00 N ATOM 0 H ASN A 660 -22.737 -8.885 1.110 1.00 0.00 H new ATOM 0 HA ASN A 660 -24.247 -8.619 3.479 1.00 0.00 H new ATOM 0 HB2 ASN A 660 -24.627 -10.302 0.982 1.00 0.00 H new ATOM 0 HB3 ASN A 660 -25.853 -10.027 2.204 1.00 0.00 H new ATOM 0 HD21 ASN A 660 -25.676 -7.444 -0.752 1.00 0.00 H new ATOM 0 HD22 ASN A 660 -25.405 -9.190 -0.749 1.00 0.00 H new ATOM 1462 N PRO A 661 -24.320 -10.886 4.626 1.00 0.00 N ATOM 1463 CA PRO A 661 -24.070 -12.013 5.561 1.00 0.00 C ATOM 1464 C PRO A 661 -24.258 -13.408 4.945 1.00 0.00 C ATOM 1465 O PRO A 661 -24.042 -14.425 5.594 1.00 0.00 O ATOM 1466 CB PRO A 661 -25.092 -11.771 6.675 1.00 0.00 C ATOM 1467 CG PRO A 661 -26.170 -10.975 6.027 1.00 0.00 C ATOM 1468 CD PRO A 661 -25.474 -10.077 5.061 1.00 0.00 C ATOM 0 HA PRO A 661 -23.031 -12.023 5.889 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -25.477 -12.711 7.072 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -24.647 -11.230 7.511 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -26.884 -11.622 5.517 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -26.731 -10.400 6.764 1.00 0.00 H new ATOM 0 HD2 PRO A 661 -26.118 -9.810 4.223 1.00 0.00 H new ATOM 0 HD3 PRO A 661 -25.159 -9.145 5.531 1.00 0.00 H new ATOM 1476 N ARG A 662 -24.593 -13.438 3.688 1.00 0.00 N ATOM 1477 CA ARG A 662 -24.863 -14.667 2.978 1.00 0.00 C ATOM 1478 C ARG A 662 -23.627 -15.062 2.199 1.00 0.00 C ATOM 1479 O ARG A 662 -23.606 -16.076 1.493 1.00 0.00 O ATOM 1480 CB ARG A 662 -25.988 -14.419 1.977 1.00 0.00 C ATOM 1481 CG ARG A 662 -27.131 -13.584 2.522 1.00 0.00 C ATOM 1482 CD ARG A 662 -27.768 -14.219 3.726 1.00 0.00 C ATOM 1483 NE ARG A 662 -28.278 -15.564 3.453 1.00 0.00 N ATOM 1484 CZ ARG A 662 -27.896 -16.662 4.116 1.00 0.00 C ATOM 1485 NH1 ARG A 662 -27.171 -16.547 5.219 1.00 0.00 N ATOM 1486 NH2 ARG A 662 -28.290 -17.854 3.702 1.00 0.00 N ATOM 0 H ARG A 662 -24.689 -12.601 3.114 1.00 0.00 H new ATOM 0 HA ARG A 662 -25.140 -15.449 3.685 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -25.575 -13.921 1.099 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -26.381 -15.379 1.644 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -26.762 -12.593 2.787 1.00 0.00 H new ATOM 0 HG3 ARG A 662 -27.882 -13.446 1.744 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -27.038 -14.269 4.534 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -28.586 -13.588 4.074 1.00 0.00 H new ATOM 0 HE ARG A 662 -28.969 -15.671 2.710 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -26.905 -15.623 5.561 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -26.878 -17.382 5.726 1.00 0.00 H new ATOM 0 HH21 ARG A 662 -28.885 -17.937 2.878 1.00 0.00 H new ATOM 0 HH22 ARG A 662 -27.999 -18.691 4.207 1.00 0.00 H new ATOM 1500 N PHE A 663 -22.612 -14.244 2.298 1.00 0.00 N ATOM 1501 CA PHE A 663 -21.434 -14.419 1.512 1.00 0.00 C ATOM 1502 C PHE A 663 -20.203 -14.364 2.391 1.00 0.00 C ATOM 1503 O PHE A 663 -20.274 -14.002 3.570 1.00 0.00 O ATOM 1504 CB PHE A 663 -21.329 -13.299 0.440 1.00 0.00 C ATOM 1505 CG PHE A 663 -22.481 -13.196 -0.535 1.00 0.00 C ATOM 1506 CD1 PHE A 663 -23.747 -12.720 -0.150 1.00 0.00 C ATOM 1507 CD2 PHE A 663 -22.287 -13.550 -1.848 1.00 0.00 C ATOM 1508 CE1 PHE A 663 -24.762 -12.622 -1.071 1.00 0.00 C ATOM 1509 CE2 PHE A 663 -23.301 -13.454 -2.763 1.00 0.00 C ATOM 1510 CZ PHE A 663 -24.540 -12.993 -2.379 1.00 0.00 C ATOM 0 H PHE A 663 -22.585 -13.441 2.927 1.00 0.00 H new ATOM 0 HA PHE A 663 -21.495 -15.392 1.024 1.00 0.00 H new ATOM 0 HB2 PHE A 663 -21.228 -12.343 0.953 1.00 0.00 H new ATOM 0 HB3 PHE A 663 -20.412 -13.454 -0.129 1.00 0.00 H new ATOM 0 HD1 PHE A 663 -23.923 -12.430 0.875 1.00 0.00 H new ATOM 0 HD2 PHE A 663 -21.319 -13.910 -2.164 1.00 0.00 H new ATOM 0 HE1 PHE A 663 -25.732 -12.255 -0.770 1.00 0.00 H new ATOM 0 HE2 PHE A 663 -23.128 -13.741 -3.790 1.00 0.00 H new ATOM 0 HZ PHE A 663 -25.338 -12.922 -3.103 1.00 0.00 H new ATOM 1520 N LEU A 664 -19.104 -14.730 1.807 1.00 0.00 N ATOM 1521 CA LEU A 664 -17.809 -14.655 2.408 1.00 0.00 C ATOM 1522 C LEU A 664 -17.060 -13.538 1.703 1.00 0.00 C ATOM 1523 O LEU A 664 -17.449 -13.137 0.589 1.00 0.00 O ATOM 1524 CB LEU A 664 -17.059 -15.981 2.211 1.00 0.00 C ATOM 1525 CG LEU A 664 -17.737 -17.232 2.776 1.00 0.00 C ATOM 1526 CD1 LEU A 664 -16.920 -18.470 2.456 1.00 0.00 C ATOM 1527 CD2 LEU A 664 -17.940 -17.103 4.276 1.00 0.00 C ATOM 0 H LEU A 664 -19.085 -15.105 0.859 1.00 0.00 H new ATOM 0 HA LEU A 664 -17.889 -14.465 3.478 1.00 0.00 H new ATOM 0 HB2 LEU A 664 -16.901 -16.130 1.143 1.00 0.00 H new ATOM 0 HB3 LEU A 664 -16.074 -15.889 2.669 1.00 0.00 H new ATOM 0 HG LEU A 664 -18.715 -17.331 2.306 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -17.417 -19.350 2.865 1.00 0.00 H new ATOM 0 HD12 LEU A 664 -16.827 -18.575 1.375 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -15.928 -18.375 2.898 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -18.423 -18.003 4.656 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -16.974 -16.976 4.764 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -18.569 -16.238 4.485 1.00 0.00 H new ATOM 1539 N MET A 665 -16.026 -13.039 2.315 1.00 0.00 N ATOM 1540 CA MET A 665 -15.253 -11.963 1.745 1.00 0.00 C ATOM 1541 C MET A 665 -13.852 -12.482 1.522 1.00 0.00 C ATOM 1542 O MET A 665 -13.164 -12.821 2.475 1.00 0.00 O ATOM 1543 CB MET A 665 -15.271 -10.800 2.720 1.00 0.00 C ATOM 1544 CG MET A 665 -15.115 -9.449 2.083 1.00 0.00 C ATOM 1545 SD MET A 665 -15.711 -8.155 3.171 1.00 0.00 S ATOM 1546 CE MET A 665 -16.067 -6.883 1.980 1.00 0.00 C ATOM 0 H MET A 665 -15.691 -13.363 3.222 1.00 0.00 H new ATOM 0 HA MET A 665 -15.659 -11.618 0.794 1.00 0.00 H new ATOM 0 HB2 MET A 665 -16.210 -10.821 3.273 1.00 0.00 H new ATOM 0 HB3 MET A 665 -14.471 -10.939 3.447 1.00 0.00 H new ATOM 0 HG2 MET A 665 -14.066 -9.274 1.844 1.00 0.00 H new ATOM 0 HG3 MET A 665 -15.665 -9.421 1.142 1.00 0.00 H new ATOM 0 HE1 MET A 665 -15.415 -6.027 2.156 1.00 0.00 H new ATOM 0 HE2 MET A 665 -15.897 -7.268 0.975 1.00 0.00 H new ATOM 0 HE3 MET A 665 -17.107 -6.573 2.079 1.00 0.00 H new ATOM 1556 N LYS A 666 -13.458 -12.591 0.277 1.00 0.00 N ATOM 1557 CA LYS A 666 -12.202 -13.234 -0.083 1.00 0.00 C ATOM 1558 C LYS A 666 -10.976 -12.438 0.368 1.00 0.00 C ATOM 1559 O LYS A 666 -10.206 -12.888 1.231 1.00 0.00 O ATOM 1560 CB LYS A 666 -12.147 -13.476 -1.599 1.00 0.00 C ATOM 1561 CG LYS A 666 -10.902 -14.213 -2.081 1.00 0.00 C ATOM 1562 CD LYS A 666 -10.874 -14.339 -3.603 1.00 0.00 C ATOM 1563 CE LYS A 666 -12.035 -15.169 -4.138 1.00 0.00 C ATOM 1564 NZ LYS A 666 -11.997 -16.554 -3.637 1.00 0.00 N ATOM 0 H LYS A 666 -13.991 -12.240 -0.519 1.00 0.00 H new ATOM 0 HA LYS A 666 -12.172 -14.187 0.444 1.00 0.00 H new ATOM 0 HB2 LYS A 666 -13.028 -14.046 -1.895 1.00 0.00 H new ATOM 0 HB3 LYS A 666 -12.204 -12.514 -2.109 1.00 0.00 H new ATOM 0 HG2 LYS A 666 -10.012 -13.683 -1.743 1.00 0.00 H new ATOM 0 HG3 LYS A 666 -10.871 -15.206 -1.633 1.00 0.00 H new ATOM 0 HD2 LYS A 666 -10.906 -13.344 -4.048 1.00 0.00 H new ATOM 0 HD3 LYS A 666 -9.933 -14.795 -3.910 1.00 0.00 H new ATOM 0 HE2 LYS A 666 -12.977 -14.704 -3.849 1.00 0.00 H new ATOM 0 HE3 LYS A 666 -12.004 -15.176 -5.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 -12.684 -17.132 -4.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 -11.043 -16.945 -3.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 -12.237 -16.564 -2.625 1.00 0.00 H new ATOM 1578 N GLY A 667 -10.820 -11.263 -0.178 1.00 0.00 N ATOM 1579 CA GLY A 667 -9.639 -10.488 0.058 1.00 0.00 C ATOM 1580 C GLY A 667 -9.828 -9.361 1.042 1.00 0.00 C ATOM 1581 O GLY A 667 -10.767 -9.384 1.851 1.00 0.00 O ATOM 0 H GLY A 667 -11.503 -10.821 -0.793 1.00 0.00 H new ATOM 0 HA2 GLY A 667 -8.852 -11.147 0.424 1.00 0.00 H new ATOM 0 HA3 GLY A 667 -9.293 -10.075 -0.889 1.00 0.00 H new ATOM 1585 N PRO A 668 -8.950 -8.353 0.979 1.00 0.00 N ATOM 1586 CA PRO A 668 -8.968 -7.199 1.883 1.00 0.00 C ATOM 1587 C PRO A 668 -10.251 -6.409 1.752 1.00 0.00 C ATOM 1588 O PRO A 668 -10.575 -5.911 0.676 1.00 0.00 O ATOM 1589 CB PRO A 668 -7.777 -6.351 1.406 1.00 0.00 C ATOM 1590 CG PRO A 668 -7.543 -6.794 0.006 1.00 0.00 C ATOM 1591 CD PRO A 668 -7.858 -8.248 -0.006 1.00 0.00 C ATOM 0 HA PRO A 668 -8.904 -7.495 2.930 1.00 0.00 H new ATOM 0 HB2 PRO A 668 -8.004 -5.286 1.453 1.00 0.00 H new ATOM 0 HB3 PRO A 668 -6.897 -6.517 2.027 1.00 0.00 H new ATOM 0 HG2 PRO A 668 -8.180 -6.248 -0.690 1.00 0.00 H new ATOM 0 HG3 PRO A 668 -6.512 -6.613 -0.296 1.00 0.00 H new ATOM 0 HD2 PRO A 668 -8.170 -8.586 -0.994 1.00 0.00 H new ATOM 0 HD3 PRO A 668 -6.996 -8.851 0.280 1.00 0.00 H new ATOM 1599 N ASN A 669 -10.975 -6.273 2.846 1.00 0.00 N ATOM 1600 CA ASN A 669 -12.252 -5.589 2.829 1.00 0.00 C ATOM 1601 C ASN A 669 -12.062 -4.108 2.842 1.00 0.00 C ATOM 1602 O ASN A 669 -12.958 -3.381 2.607 1.00 0.00 O ATOM 1603 CB ASN A 669 -13.150 -5.999 4.014 1.00 0.00 C ATOM 1604 CG ASN A 669 -12.522 -5.806 5.388 1.00 0.00 C ATOM 1605 OD1 ASN A 669 -11.313 -5.989 5.578 1.00 0.00 O ATOM 1606 ND2 ASN A 669 -13.328 -5.422 6.341 1.00 0.00 N ATOM 0 H ASN A 669 -10.699 -6.629 3.761 1.00 0.00 H new ATOM 0 HA ASN A 669 -12.751 -5.886 1.906 1.00 0.00 H new ATOM 0 HB2 ASN A 669 -14.074 -5.422 3.968 1.00 0.00 H new ATOM 0 HB3 ASN A 669 -13.423 -7.048 3.899 1.00 0.00 H new ATOM 0 HD21 ASN A 669 -12.966 -5.262 7.281 1.00 0.00 H new ATOM 0 HD22 ASN A 669 -14.319 -5.282 6.145 1.00 0.00 H new ATOM 1613 N LYS A 670 -10.887 -3.700 3.098 1.00 0.00 N ATOM 1614 CA LYS A 670 -10.531 -2.318 3.230 1.00 0.00 C ATOM 1615 C LYS A 670 -9.399 -2.004 2.307 1.00 0.00 C ATOM 1616 O LYS A 670 -8.288 -2.508 2.468 1.00 0.00 O ATOM 1617 CB LYS A 670 -10.219 -2.040 4.694 1.00 0.00 C ATOM 1618 CG LYS A 670 -9.706 -3.274 5.379 1.00 0.00 C ATOM 1619 CD LYS A 670 -9.405 -3.095 6.839 1.00 0.00 C ATOM 1620 CE LYS A 670 -8.425 -1.957 7.061 1.00 0.00 C ATOM 1621 NZ LYS A 670 -8.047 -1.787 8.485 1.00 0.00 N ATOM 0 H LYS A 670 -10.099 -4.334 3.230 1.00 0.00 H new ATOM 0 HA LYS A 670 -11.352 -1.661 2.941 1.00 0.00 H new ATOM 0 HB2 LYS A 670 -9.477 -1.245 4.767 1.00 0.00 H new ATOM 0 HB3 LYS A 670 -11.117 -1.686 5.200 1.00 0.00 H new ATOM 0 HG2 LYS A 670 -10.443 -4.069 5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 670 -8.800 -3.606 4.872 1.00 0.00 H new ATOM 0 HD2 LYS A 670 -10.329 -2.894 7.382 1.00 0.00 H new ATOM 0 HD3 LYS A 670 -8.992 -4.019 7.244 1.00 0.00 H new ATOM 0 HE2 LYS A 670 -7.526 -2.139 6.471 1.00 0.00 H new ATOM 0 HE3 LYS A 670 -8.865 -1.029 6.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 -7.377 -0.997 8.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 -8.898 -1.585 9.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 -7.601 -2.660 8.832 1.00 0.00 H new ATOM 1635 N ILE A 671 -9.700 -1.208 1.318 1.00 0.00 N ATOM 1636 CA ILE A 671 -8.761 -0.894 0.278 1.00 0.00 C ATOM 1637 C ILE A 671 -8.336 0.557 0.427 1.00 0.00 C ATOM 1638 O ILE A 671 -9.112 1.355 0.945 1.00 0.00 O ATOM 1639 CB ILE A 671 -9.387 -1.105 -1.137 1.00 0.00 C ATOM 1640 CG1 ILE A 671 -10.530 -0.117 -1.399 1.00 0.00 C ATOM 1641 CG2 ILE A 671 -9.899 -2.531 -1.270 1.00 0.00 C ATOM 1642 CD1 ILE A 671 -11.127 -0.197 -2.782 1.00 0.00 C ATOM 0 H ILE A 671 -10.609 -0.757 1.211 1.00 0.00 H new ATOM 0 HA ILE A 671 -7.903 -1.560 0.371 1.00 0.00 H new ATOM 0 HB ILE A 671 -8.608 -0.924 -1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 671 -11.318 -0.292 -0.667 1.00 0.00 H new ATOM 0 HG13 ILE A 671 -10.162 0.896 -1.235 1.00 0.00 H new ATOM 0 HG21 ILE A 671 -10.334 -2.671 -2.260 1.00 0.00 H new ATOM 0 HG22 ILE A 671 -9.072 -3.228 -1.136 1.00 0.00 H new ATOM 0 HG23 ILE A 671 -10.658 -2.717 -0.510 1.00 0.00 H new ATOM 0 HD11 ILE A 671 -11.927 0.537 -2.876 1.00 0.00 H new ATOM 0 HD12 ILE A 671 -10.356 0.010 -3.524 1.00 0.00 H new ATOM 0 HD13 ILE A 671 -11.530 -1.196 -2.947 1.00 0.00 H new ATOM 1649 N GLN A 672 -7.140 0.908 0.007 1.00 0.00 N ATOM 1650 CA GLN A 672 -6.710 2.294 0.130 1.00 0.00 C ATOM 1651 C GLN A 672 -6.404 2.905 -1.224 1.00 0.00 C ATOM 1652 O GLN A 672 -6.174 2.187 -2.210 1.00 0.00 O ATOM 1653 CB GLN A 672 -5.528 2.495 1.107 1.00 0.00 C ATOM 1654 CG GLN A 672 -4.176 1.951 0.669 1.00 0.00 C ATOM 1655 CD GLN A 672 -4.079 0.443 0.659 1.00 0.00 C ATOM 1656 OE1 GLN A 672 -3.733 -0.172 1.663 1.00 0.00 O ATOM 1657 NE2 GLN A 672 -4.343 -0.159 -0.465 1.00 0.00 N ATOM 0 H GLN A 672 -6.459 0.275 -0.413 1.00 0.00 H new ATOM 0 HA GLN A 672 -7.557 2.823 0.566 1.00 0.00 H new ATOM 0 HB2 GLN A 672 -5.420 3.563 1.294 1.00 0.00 H new ATOM 0 HB3 GLN A 672 -5.790 2.030 2.057 1.00 0.00 H new ATOM 0 HG2 GLN A 672 -3.956 2.323 -0.332 1.00 0.00 H new ATOM 0 HG3 GLN A 672 -3.407 2.347 1.332 1.00 0.00 H new ATOM 0 HE21 GLN A 672 -4.628 0.384 -1.280 1.00 0.00 H new ATOM 0 HE22 GLN A 672 -4.265 -1.174 -0.531 1.00 0.00 H new ATOM 1666 N CYS A 673 -6.394 4.209 -1.261 1.00 0.00 N ATOM 1667 CA CYS A 673 -6.174 4.969 -2.478 1.00 0.00 C ATOM 1668 C CYS A 673 -4.703 5.101 -2.799 1.00 0.00 C ATOM 1669 O CYS A 673 -4.020 6.003 -2.364 1.00 0.00 O ATOM 1670 CB CYS A 673 -6.890 6.329 -2.391 1.00 0.00 C ATOM 1671 SG CYS A 673 -6.500 7.522 -3.726 1.00 0.00 S ATOM 0 H CYS A 673 -6.540 4.791 -0.436 1.00 0.00 H new ATOM 0 HA CYS A 673 -6.610 4.422 -3.313 1.00 0.00 H new ATOM 0 HB2 CYS A 673 -7.966 6.153 -2.390 1.00 0.00 H new ATOM 0 HB3 CYS A 673 -6.641 6.789 -1.435 1.00 0.00 H new ATOM 1676 N VAL A 674 -4.245 4.200 -3.577 1.00 0.00 N ATOM 1677 CA VAL A 674 -2.872 4.126 -3.965 1.00 0.00 C ATOM 1678 C VAL A 674 -2.589 5.120 -5.105 1.00 0.00 C ATOM 1679 O VAL A 674 -3.087 4.958 -6.219 1.00 0.00 O ATOM 1680 CB VAL A 674 -2.525 2.685 -4.364 1.00 0.00 C ATOM 1681 CG1 VAL A 674 -1.136 2.598 -4.892 1.00 0.00 C ATOM 1682 CG2 VAL A 674 -2.684 1.776 -3.165 1.00 0.00 C ATOM 0 H VAL A 674 -4.825 3.464 -3.981 1.00 0.00 H new ATOM 0 HA VAL A 674 -2.237 4.404 -3.124 1.00 0.00 H new ATOM 0 HB VAL A 674 -3.206 2.369 -5.154 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -0.915 1.567 -5.167 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -1.040 3.237 -5.770 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -0.434 2.927 -4.126 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -2.438 0.753 -3.449 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -2.015 2.103 -2.369 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -3.714 1.816 -2.812 1.00 0.00 H new ATOM 1686 N ASP A 675 -1.759 6.125 -4.783 1.00 0.00 N ATOM 1687 CA ASP A 675 -1.420 7.298 -5.628 1.00 0.00 C ATOM 1688 C ASP A 675 -2.650 8.097 -6.041 1.00 0.00 C ATOM 1689 O ASP A 675 -2.840 9.234 -5.582 1.00 0.00 O ATOM 1690 CB ASP A 675 -0.535 6.947 -6.834 1.00 0.00 C ATOM 1691 CG ASP A 675 -0.110 8.175 -7.625 1.00 0.00 C ATOM 1692 OD1 ASP A 675 0.919 8.776 -7.304 1.00 0.00 O ATOM 1693 OD2 ASP A 675 -0.813 8.578 -8.578 1.00 0.00 O ATOM 0 H ASP A 675 -1.279 6.150 -3.883 1.00 0.00 H new ATOM 0 HA ASP A 675 -0.818 7.945 -4.990 1.00 0.00 H new ATOM 0 HB2 ASP A 675 0.353 6.418 -6.487 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -1.076 6.266 -7.491 1.00 0.00 H new ATOM 1698 N GLY A 676 -3.466 7.526 -6.895 1.00 0.00 N ATOM 1699 CA GLY A 676 -4.686 8.157 -7.302 1.00 0.00 C ATOM 1700 C GLY A 676 -5.687 7.156 -7.822 1.00 0.00 C ATOM 1701 O GLY A 676 -6.539 7.490 -8.663 1.00 0.00 O ATOM 0 H GLY A 676 -3.299 6.615 -7.322 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -5.116 8.696 -6.458 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -4.473 8.894 -8.076 1.00 0.00 H new ATOM 1705 N GLU A 677 -5.578 5.926 -7.348 1.00 0.00 N ATOM 1706 CA GLU A 677 -6.485 4.842 -7.708 1.00 0.00 C ATOM 1707 C GLU A 677 -6.661 3.965 -6.495 1.00 0.00 C ATOM 1708 O GLU A 677 -5.763 3.856 -5.692 1.00 0.00 O ATOM 1709 CB GLU A 677 -5.878 3.957 -8.784 1.00 0.00 C ATOM 1710 CG GLU A 677 -5.466 4.645 -10.050 1.00 0.00 C ATOM 1711 CD GLU A 677 -4.812 3.686 -10.980 1.00 0.00 C ATOM 1712 OE1 GLU A 677 -3.627 3.337 -10.750 1.00 0.00 O ATOM 1713 OE2 GLU A 677 -5.472 3.226 -11.926 1.00 0.00 O ATOM 0 H GLU A 677 -4.848 5.646 -6.693 1.00 0.00 H new ATOM 0 HA GLU A 677 -7.419 5.277 -8.063 1.00 0.00 H new ATOM 0 HB2 GLU A 677 -5.004 3.458 -8.365 1.00 0.00 H new ATOM 0 HB3 GLU A 677 -6.599 3.179 -9.035 1.00 0.00 H new ATOM 0 HG2 GLU A 677 -6.339 5.087 -10.530 1.00 0.00 H new ATOM 0 HG3 GLU A 677 -4.781 5.461 -9.820 1.00 0.00 H new ATOM 1720 N TRP A 678 -7.774 3.330 -6.371 1.00 0.00 N ATOM 1721 CA TRP A 678 -7.982 2.407 -5.279 1.00 0.00 C ATOM 1722 C TRP A 678 -7.364 1.049 -5.637 1.00 0.00 C ATOM 1723 O TRP A 678 -6.928 0.837 -6.778 1.00 0.00 O ATOM 1724 CB TRP A 678 -9.463 2.239 -5.003 1.00 0.00 C ATOM 1725 CG TRP A 678 -10.158 3.472 -4.493 1.00 0.00 C ATOM 1726 CD1 TRP A 678 -10.833 4.406 -5.225 1.00 0.00 C ATOM 1727 CD2 TRP A 678 -10.247 3.886 -3.135 1.00 0.00 C ATOM 1728 NE1 TRP A 678 -11.341 5.380 -4.396 1.00 0.00 N ATOM 1729 CE2 TRP A 678 -10.986 5.084 -3.100 1.00 0.00 C ATOM 1730 CE3 TRP A 678 -9.766 3.357 -1.947 1.00 0.00 C ATOM 1731 CZ2 TRP A 678 -11.254 5.756 -1.904 1.00 0.00 C ATOM 1732 CZ3 TRP A 678 -10.028 4.013 -0.774 1.00 0.00 C ATOM 1733 CH2 TRP A 678 -10.764 5.202 -0.756 1.00 0.00 C ATOM 0 H TRP A 678 -8.565 3.424 -7.008 1.00 0.00 H new ATOM 0 HA TRP A 678 -7.504 2.803 -4.383 1.00 0.00 H new ATOM 0 HB2 TRP A 678 -9.954 1.917 -5.921 1.00 0.00 H new ATOM 0 HB3 TRP A 678 -9.593 1.439 -4.274 1.00 0.00 H new ATOM 0 HD1 TRP A 678 -10.951 4.384 -6.298 1.00 0.00 H new ATOM 0 HE1 TRP A 678 -11.889 6.187 -4.693 1.00 0.00 H new ATOM 0 HE3 TRP A 678 -9.193 2.441 -1.947 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 -11.824 6.673 -1.888 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 -9.659 3.604 0.155 1.00 0.00 H new ATOM 0 HH2 TRP A 678 -10.949 5.693 0.188 1.00 0.00 H new ATOM 1744 N THR A 679 -7.297 0.152 -4.687 1.00 0.00 N ATOM 1745 CA THR A 679 -6.769 -1.161 -4.938 1.00 0.00 C ATOM 1746 C THR A 679 -7.871 -2.163 -5.317 1.00 0.00 C ATOM 1747 O THR A 679 -9.039 -1.781 -5.518 1.00 0.00 O ATOM 1748 CB THR A 679 -5.959 -1.664 -3.730 1.00 0.00 C ATOM 1749 OG1 THR A 679 -6.634 -1.339 -2.502 1.00 0.00 O ATOM 1750 CG2 THR A 679 -4.570 -1.075 -3.733 1.00 0.00 C ATOM 0 H THR A 679 -7.604 0.310 -3.727 1.00 0.00 H new ATOM 0 HA THR A 679 -6.099 -1.083 -5.794 1.00 0.00 H new ATOM 0 HB THR A 679 -5.873 -2.748 -3.807 1.00 0.00 H new ATOM 0 HG1 THR A 679 -6.108 -1.666 -1.743 1.00 0.00 H new ATOM 0 HG21 THR A 679 -4.016 -1.445 -2.870 1.00 0.00 H new ATOM 0 HG22 THR A 679 -4.053 -1.366 -4.648 1.00 0.00 H new ATOM 0 HG23 THR A 679 -4.636 0.012 -3.683 1.00 0.00 H new ATOM 1758 N THR A 680 -7.487 -3.415 -5.454 1.00 0.00 N ATOM 1759 CA THR A 680 -8.391 -4.482 -5.795 1.00 0.00 C ATOM 1760 C THR A 680 -9.362 -4.765 -4.638 1.00 0.00 C ATOM 1761 O THR A 680 -8.946 -4.883 -3.473 1.00 0.00 O ATOM 1762 CB THR A 680 -7.570 -5.739 -6.139 1.00 0.00 C ATOM 1763 OG1 THR A 680 -6.588 -5.386 -7.147 1.00 0.00 O ATOM 1764 CG2 THR A 680 -8.459 -6.839 -6.679 1.00 0.00 C ATOM 0 H THR A 680 -6.522 -3.720 -5.329 1.00 0.00 H new ATOM 0 HA THR A 680 -8.988 -4.190 -6.659 1.00 0.00 H new ATOM 0 HB THR A 680 -7.085 -6.103 -5.233 1.00 0.00 H new ATOM 0 HG1 THR A 680 -6.055 -6.176 -7.376 1.00 0.00 H new ATOM 0 HG21 THR A 680 -7.853 -7.714 -6.913 1.00 0.00 H new ATOM 0 HG22 THR A 680 -9.205 -7.104 -5.930 1.00 0.00 H new ATOM 0 HG23 THR A 680 -8.960 -6.492 -7.583 1.00 0.00 H new ATOM 1772 N LEU A 681 -10.636 -4.838 -4.973 1.00 0.00 N ATOM 1773 CA LEU A 681 -11.704 -5.059 -4.022 1.00 0.00 C ATOM 1774 C LEU A 681 -11.693 -6.449 -3.378 1.00 0.00 C ATOM 1775 O LEU A 681 -11.156 -7.412 -3.936 1.00 0.00 O ATOM 1776 CB LEU A 681 -13.079 -4.749 -4.629 1.00 0.00 C ATOM 1777 CG LEU A 681 -13.613 -3.340 -4.382 1.00 0.00 C ATOM 1778 CD1 LEU A 681 -12.827 -2.290 -5.121 1.00 0.00 C ATOM 1779 CD2 LEU A 681 -15.074 -3.267 -4.693 1.00 0.00 C ATOM 0 H LEU A 681 -10.962 -4.743 -5.935 1.00 0.00 H new ATOM 0 HA LEU A 681 -11.511 -4.353 -3.214 1.00 0.00 H new ATOM 0 HB2 LEU A 681 -13.025 -4.913 -5.705 1.00 0.00 H new ATOM 0 HB3 LEU A 681 -13.800 -5.465 -4.233 1.00 0.00 H new ATOM 0 HG LEU A 681 -13.484 -3.123 -3.322 1.00 0.00 H new ATOM 0 HD11 LEU A 681 -13.247 -1.306 -4.912 1.00 0.00 H new ATOM 0 HD12 LEU A 681 -11.787 -2.317 -4.795 1.00 0.00 H new ATOM 0 HD13 LEU A 681 -12.877 -2.485 -6.192 1.00 0.00 H new ATOM 0 HD21 LEU A 681 -15.435 -2.255 -4.510 1.00 0.00 H new ATOM 0 HD22 LEU A 681 -15.237 -3.527 -5.739 1.00 0.00 H new ATOM 0 HD23 LEU A 681 -15.617 -3.966 -4.057 1.00 0.00 H new ATOM 1791 N PRO A 682 -12.335 -6.554 -2.182 1.00 0.00 N ATOM 1792 CA PRO A 682 -12.374 -7.785 -1.360 1.00 0.00 C ATOM 1793 C PRO A 682 -13.053 -8.975 -1.989 1.00 0.00 C ATOM 1794 O PRO A 682 -12.799 -10.090 -1.571 1.00 0.00 O ATOM 1795 CB PRO A 682 -13.149 -7.367 -0.119 1.00 0.00 C ATOM 1796 CG PRO A 682 -13.893 -6.143 -0.510 1.00 0.00 C ATOM 1797 CD PRO A 682 -13.048 -5.441 -1.501 1.00 0.00 C ATOM 0 HA PRO A 682 -11.355 -8.131 -1.189 1.00 0.00 H new ATOM 0 HB2 PRO A 682 -13.830 -8.155 0.202 1.00 0.00 H new ATOM 0 HB3 PRO A 682 -12.476 -7.168 0.715 1.00 0.00 H new ATOM 0 HG2 PRO A 682 -14.863 -6.398 -0.937 1.00 0.00 H new ATOM 0 HG3 PRO A 682 -14.083 -5.510 0.357 1.00 0.00 H new ATOM 0 HD2 PRO A 682 -13.647 -4.858 -2.200 1.00 0.00 H new ATOM 0 HD3 PRO A 682 -12.354 -4.750 -1.022 1.00 0.00 H new ATOM 1805 N VAL A 683 -13.901 -8.725 -2.966 1.00 0.00 N ATOM 1806 CA VAL A 683 -14.676 -9.751 -3.685 1.00 0.00 C ATOM 1807 C VAL A 683 -15.455 -10.773 -2.815 1.00 0.00 C ATOM 1808 O VAL A 683 -14.895 -11.646 -2.140 1.00 0.00 O ATOM 1809 CB VAL A 683 -13.948 -10.416 -4.890 1.00 0.00 C ATOM 1810 CG1 VAL A 683 -13.737 -9.402 -5.991 1.00 0.00 C ATOM 1811 CG2 VAL A 683 -12.620 -11.075 -4.517 1.00 0.00 C ATOM 0 H VAL A 683 -14.085 -7.779 -3.301 1.00 0.00 H new ATOM 0 HA VAL A 683 -15.459 -9.131 -4.122 1.00 0.00 H new ATOM 0 HB VAL A 683 -14.599 -11.218 -5.238 1.00 0.00 H new ATOM 0 HG11 VAL A 683 -13.227 -9.876 -6.830 1.00 0.00 H new ATOM 0 HG12 VAL A 683 -14.702 -9.019 -6.323 1.00 0.00 H new ATOM 0 HG13 VAL A 683 -13.129 -8.579 -5.616 1.00 0.00 H new ATOM 0 HG21 VAL A 683 -12.171 -11.517 -5.406 1.00 0.00 H new ATOM 0 HG22 VAL A 683 -11.945 -10.325 -4.104 1.00 0.00 H new ATOM 0 HG23 VAL A 683 -12.796 -11.853 -3.775 1.00 0.00 H new ATOM 1815 N CYS A 684 -16.751 -10.638 -2.848 1.00 0.00 N ATOM 1816 CA CYS A 684 -17.653 -11.489 -2.090 1.00 0.00 C ATOM 1817 C CYS A 684 -17.991 -12.704 -2.896 1.00 0.00 C ATOM 1818 O CYS A 684 -18.069 -12.634 -4.124 1.00 0.00 O ATOM 1819 CB CYS A 684 -18.942 -10.745 -1.836 1.00 0.00 C ATOM 1820 SG CYS A 684 -18.716 -9.025 -1.489 1.00 0.00 S ATOM 0 H CYS A 684 -17.226 -9.928 -3.406 1.00 0.00 H new ATOM 0 HA CYS A 684 -17.171 -11.769 -1.153 1.00 0.00 H new ATOM 0 HB2 CYS A 684 -19.588 -10.849 -2.708 1.00 0.00 H new ATOM 0 HB3 CYS A 684 -19.460 -11.210 -0.998 1.00 0.00 H new ATOM 1825 N ILE A 685 -18.193 -13.791 -2.216 1.00 0.00 N ATOM 1826 CA ILE A 685 -18.589 -15.035 -2.821 1.00 0.00 C ATOM 1827 C ILE A 685 -19.541 -15.733 -1.900 1.00 0.00 C ATOM 1828 O ILE A 685 -19.475 -15.536 -0.700 1.00 0.00 O ATOM 1829 CB ILE A 685 -17.405 -16.001 -3.161 1.00 0.00 C ATOM 1830 CG1 ILE A 685 -16.430 -16.190 -1.958 1.00 0.00 C ATOM 1831 CG2 ILE A 685 -16.675 -15.585 -4.432 1.00 0.00 C ATOM 1832 CD1 ILE A 685 -15.457 -15.051 -1.706 1.00 0.00 C ATOM 0 H ILE A 685 -18.086 -13.844 -1.203 1.00 0.00 H new ATOM 0 HA ILE A 685 -19.050 -14.780 -3.775 1.00 0.00 H new ATOM 0 HB ILE A 685 -17.847 -16.978 -3.357 1.00 0.00 H new ATOM 0 HG12 ILE A 685 -17.022 -16.342 -1.056 1.00 0.00 H new ATOM 0 HG13 ILE A 685 -15.857 -17.103 -2.120 1.00 0.00 H new ATOM 0 HG21 ILE A 685 -15.862 -16.283 -4.629 1.00 0.00 H new ATOM 0 HG22 ILE A 685 -17.371 -15.593 -5.271 1.00 0.00 H new ATOM 0 HG23 ILE A 685 -16.269 -14.581 -4.307 1.00 0.00 H new ATOM 0 HD11 ILE A 685 -14.830 -15.291 -0.847 1.00 0.00 H new ATOM 0 HD12 ILE A 685 -14.829 -14.908 -2.585 1.00 0.00 H new ATOM 0 HD13 ILE A 685 -16.013 -14.135 -1.504 1.00 0.00 H new ATOM 1839 N VAL A 686 -20.419 -16.529 -2.445 1.00 0.00 N ATOM 1840 CA VAL A 686 -21.400 -17.242 -1.655 1.00 0.00 C ATOM 1841 C VAL A 686 -20.694 -18.312 -0.843 1.00 0.00 C ATOM 1842 O VAL A 686 -19.729 -18.899 -1.324 1.00 0.00 O ATOM 1843 CB VAL A 686 -22.491 -17.893 -2.561 1.00 0.00 C ATOM 1844 CG1 VAL A 686 -23.529 -18.658 -1.747 1.00 0.00 C ATOM 1845 CG2 VAL A 686 -23.172 -16.839 -3.402 1.00 0.00 C ATOM 0 H VAL A 686 -20.480 -16.706 -3.448 1.00 0.00 H new ATOM 0 HA VAL A 686 -21.898 -16.535 -0.991 1.00 0.00 H new ATOM 0 HB VAL A 686 -21.987 -18.608 -3.211 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -24.269 -19.094 -2.418 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -23.037 -19.451 -1.184 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -24.024 -17.976 -1.056 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -23.931 -17.308 -4.029 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -23.644 -16.103 -2.751 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -22.434 -16.345 -4.034 1.00 0.00 H new ATOM 1849 N GLU A 687 -21.142 -18.505 0.388 1.00 0.00 N ATOM 1850 CA GLU A 687 -20.600 -19.504 1.299 1.00 0.00 C ATOM 1851 C GLU A 687 -20.640 -20.899 0.658 1.00 0.00 C ATOM 1852 O GLU A 687 -21.682 -21.587 0.785 1.00 0.00 O ATOM 1853 CB GLU A 687 -21.445 -19.548 2.557 1.00 0.00 C ATOM 1854 CG GLU A 687 -21.512 -18.290 3.381 1.00 0.00 C ATOM 1855 CD GLU A 687 -22.374 -18.524 4.592 1.00 0.00 C ATOM 1856 OE1 GLU A 687 -23.627 -18.525 4.461 1.00 0.00 O ATOM 1857 OE2 GLU A 687 -21.824 -18.797 5.678 1.00 0.00 O ATOM 1858 OXT GLU A 687 -19.656 -21.315 0.021 1.00 0.00 O ATOM 0 H GLU A 687 -21.906 -17.962 0.790 1.00 0.00 H new ATOM 0 HA GLU A 687 -19.570 -19.233 1.529 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -22.461 -19.821 2.273 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -21.066 -20.349 3.192 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -20.510 -17.991 3.688 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -21.920 -17.474 2.784 1.00 0.00 H new