USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1131 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 624 MET CE :methyl -173:sc= -0.252 (180deg=-0.366) USER MOD Set 1.2: A 644 TYR OH : rot 180:sc= -0.012 USER MOD Set 2.1: A 536 MET CE :methyl -161:sc= -1.54 (180deg=-2.49) USER MOD Set 2.2: A 547 MET CE :methyl 167:sc= -0.0413 (180deg=-0.278) USER MOD Set 2.3: A 605 THR OG1 : rot 149:sc= 1.48 USER MOD Set 2.4: A 606 MET CE :methyl -170:sc= -0.0118 (180deg=-0.175) USER MOD Set 3.1: A 557 MET CE :methyl -123:sc= -4.09 (180deg=-8.76!) USER MOD Set 3.2: A 561 GLN : amide:sc= -4.05! K(o=-8.1!,f=-12) USER MOD Set 4.1: A 550 CYS SG : rot 78:sc= -0.348 USER MOD Set 4.2: A 612 THR OG1 : rot 29:sc= 1.21 USER MOD Set 5.1: A 539 HIS : no HE2:sc= 0.679 K(o=1.6,f=-3.2!) USER MOD Set 5.2: A 543 THR OG1 : rot -56:sc= 0.882 USER MOD Single : A -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -2 HIS : no HD1:sc= -0.0515 X(o=-0.052,f=-0.2) USER MOD Single : A -3 SER OG : rot 180:sc= 0.0498 USER MOD Single : A -4 GLY N :NH3+ -132:sc= 0.215 (180deg=0) USER MOD Single : A 516 SER OG : rot 180:sc= 0 USER MOD Single : A 520 ASN : amide:sc= -0.104 K(o=-0.1,f=-1.8!) USER MOD Single : A 522 LYS NZ :NH3+ -179:sc= 1.17 (180deg=1.16) USER MOD Single : A 528 THR OG1 : rot -143:sc= 0.884 USER MOD Single : A 530 SER OG : rot 57:sc= 0.0735 USER MOD Single : A 532 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 545 LYS NZ :NH3+ 158:sc= 0.394 (180deg=0.27) USER MOD Single : A 551 MET CE :methyl 171:sc= 0 (180deg=-0.132) USER MOD Single : A 559 THR OG1 : rot 180:sc= 0 USER MOD Single : A 563 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 564 TYR OH : rot 30:sc= 0 USER MOD Single : A 565 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 568 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 570 GLN :FLIP amide:sc= -4.22 F(o=-5.6,f=-4.2) USER MOD Single : A 576 TYR OH : rot -30:sc= 0.149 USER MOD Single : A 583 TYR OH : rot 50:sc= -0.0722 USER MOD Single : A 584 THR OG1 : rot 180:sc= 0.0209 USER MOD Single : A 585 SER OG : rot 140:sc= 0 USER MOD Single : A 586 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 591 SER OG : rot -170:sc=-0.000942 USER MOD Single : A 594 THR OG1 : rot 180:sc= 0 USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 597 ASN : amide:sc= -2.89! X(o=-2.9!,f=-3.4) USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD Single : A 600 ASN : amide:sc= -0.718 X(o=-0.72,f=-0.56) USER MOD Single : A 610 TYR OH : rot 180:sc= 0 USER MOD Single : A 613 HIS : +bothHN:sc= 0.712 K(o=0.71,f=-5.8!) USER MOD Single : A 616 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 623 CYS SG : rot -130:sc= 0 USER MOD Single : A 626 SER OG : rot 180:sc= 0 USER MOD Single : A 628 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 634 SER OG : rot 102:sc= 1.22 USER MOD Single : A 636 SER OG : rot 180:sc= 0.0653 USER MOD Single : A 637 SER OG : rot 180:sc= 0 USER MOD Single : A 642 THR OG1 : rot 180:sc= 0 USER MOD Single : A 643 THR OG1 : rot 79:sc= 0.287 USER MOD Single : A 645 ASN : amide:sc= 0.796 K(o=0.8,f=0) USER MOD Single : A 647 TYR OH : rot 180:sc= 0 USER MOD Single : A 649 THR OG1 : rot 180:sc= 0 USER MOD Single : A 650 SER OG : rot 180:sc= 0 USER MOD Single : A 651 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -35.821 2.413 15.937 1.00 0.00 N ATOM 2 CA GLY A -4 -35.653 2.329 14.475 1.00 0.00 C ATOM 3 C GLY A -4 -35.342 3.709 13.925 1.00 0.00 C ATOM 4 O GLY A -4 -34.949 4.572 14.703 1.00 0.00 O ATOM 0 H1 GLY A -4 -35.265 1.663 16.394 1.00 0.00 H new ATOM 0 H2 GLY A -4 -35.492 3.341 16.272 1.00 0.00 H new ATOM 0 H3 GLY A -4 -36.826 2.295 16.178 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -34.847 1.637 14.229 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -36.561 1.938 14.015 1.00 0.00 H new ATOM 8 N SER A -3 -35.553 3.919 12.621 1.00 0.00 N ATOM 9 CA SER A -3 -35.085 5.091 11.884 1.00 0.00 C ATOM 10 C SER A -3 -33.548 5.121 11.809 1.00 0.00 C ATOM 11 O SER A -3 -32.875 4.190 12.257 1.00 0.00 O ATOM 12 CB SER A -3 -35.697 6.389 12.448 1.00 0.00 C ATOM 13 OG SER A -3 -35.712 7.376 11.439 1.00 0.00 O ATOM 0 H SER A -3 -36.067 3.260 12.037 1.00 0.00 H new ATOM 0 HA SER A -3 -35.438 5.017 10.855 1.00 0.00 H new ATOM 0 HB2 SER A -3 -36.710 6.202 12.804 1.00 0.00 H new ATOM 0 HB3 SER A -3 -35.117 6.736 13.303 1.00 0.00 H new ATOM 0 HG SER A -3 -36.102 8.202 11.795 1.00 0.00 H new ATOM 19 N HIS A -2 -33.018 6.169 11.181 1.00 0.00 N ATOM 20 CA HIS A -2 -31.613 6.541 11.044 1.00 0.00 C ATOM 21 C HIS A -2 -31.566 8.071 11.014 1.00 0.00 C ATOM 22 O HIS A -2 -32.616 8.710 11.002 1.00 0.00 O ATOM 23 CB HIS A -2 -31.019 5.942 9.752 1.00 0.00 C ATOM 24 CG HIS A -2 -30.585 4.503 9.875 1.00 0.00 C ATOM 25 ND1 HIS A -2 -29.897 3.961 10.946 1.00 0.00 N ATOM 26 CD2 HIS A -2 -30.661 3.553 8.894 1.00 0.00 C ATOM 27 CE1 HIS A -2 -29.556 2.703 10.619 1.00 0.00 C ATOM 28 NE2 HIS A -2 -30.025 2.427 9.386 1.00 0.00 N ATOM 0 H HIS A -2 -33.621 6.843 10.710 1.00 0.00 H new ATOM 0 HA HIS A -2 -31.019 6.154 11.872 1.00 0.00 H new ATOM 0 HB2 HIS A -2 -31.760 6.019 8.956 1.00 0.00 H new ATOM 0 HB3 HIS A -2 -30.162 6.543 9.448 1.00 0.00 H new ATOM 0 HD2 HIS A -2 -31.126 3.661 7.925 1.00 0.00 H new ATOM 0 HE1 HIS A -2 -28.996 2.023 11.244 1.00 0.00 H new ATOM 0 HE2 HIS A -2 -29.927 1.537 8.897 1.00 0.00 H new ATOM 37 N MET A -1 -30.370 8.658 10.985 1.00 0.00 N ATOM 38 CA MET A -1 -30.157 10.084 10.831 1.00 0.00 C ATOM 39 C MET A -1 -28.754 10.212 10.254 1.00 0.00 C ATOM 40 O MET A -1 -27.794 9.739 10.871 1.00 0.00 O ATOM 41 CB MET A -1 -30.302 10.830 12.174 1.00 0.00 C ATOM 42 CG MET A -1 -30.843 12.245 11.936 1.00 0.00 C ATOM 43 SD MET A -1 -32.575 12.261 11.390 1.00 0.00 S ATOM 44 CE MET A -1 -32.728 13.961 10.787 1.00 0.00 C ATOM 0 H MET A -1 -29.500 8.132 11.071 1.00 0.00 H new ATOM 0 HA MET A -1 -30.901 10.539 10.178 1.00 0.00 H new ATOM 0 HB2 MET A -1 -30.975 10.281 12.833 1.00 0.00 H new ATOM 0 HB3 MET A -1 -29.336 10.881 12.676 1.00 0.00 H new ATOM 0 HG2 MET A -1 -30.753 12.822 12.856 1.00 0.00 H new ATOM 0 HG3 MET A -1 -30.227 12.742 11.187 1.00 0.00 H new ATOM 0 HE1 MET A -1 -33.740 14.126 10.417 1.00 0.00 H new ATOM 0 HE2 MET A -1 -32.521 14.656 11.601 1.00 0.00 H new ATOM 0 HE3 MET A -1 -32.015 14.126 9.979 1.00 0.00 H new ATOM 54 N VAL A 513 -28.659 10.718 9.033 1.00 0.00 N ATOM 55 CA VAL A 513 -27.438 11.006 8.281 1.00 0.00 C ATOM 56 C VAL A 513 -27.704 12.262 7.430 1.00 0.00 C ATOM 57 O VAL A 513 -28.861 12.678 7.321 1.00 0.00 O ATOM 58 CB VAL A 513 -27.039 9.749 7.471 1.00 0.00 C ATOM 59 CG1 VAL A 513 -28.045 9.396 6.361 1.00 0.00 C ATOM 60 CG2 VAL A 513 -25.627 9.830 6.877 1.00 0.00 C ATOM 0 H VAL A 513 -29.494 10.957 8.499 1.00 0.00 H new ATOM 0 HA VAL A 513 -26.584 11.227 8.921 1.00 0.00 H new ATOM 0 HB VAL A 513 -27.050 8.947 8.209 1.00 0.00 H new ATOM 0 HG11 VAL A 513 -27.705 8.505 5.832 1.00 0.00 H new ATOM 0 HG12 VAL A 513 -29.023 9.205 6.803 1.00 0.00 H new ATOM 0 HG13 VAL A 513 -28.120 10.228 5.660 1.00 0.00 H new ATOM 0 HG21 VAL A 513 -25.413 8.916 6.322 1.00 0.00 H new ATOM 0 HG22 VAL A 513 -25.564 10.686 6.205 1.00 0.00 H new ATOM 0 HG23 VAL A 513 -24.900 9.945 7.681 1.00 0.00 H new ATOM 70 N LEU A 514 -26.675 12.857 6.818 1.00 0.00 N ATOM 71 CA LEU A 514 -26.774 13.972 5.879 1.00 0.00 C ATOM 72 C LEU A 514 -25.911 13.612 4.662 1.00 0.00 C ATOM 73 O LEU A 514 -25.072 12.714 4.778 1.00 0.00 O ATOM 74 CB LEU A 514 -26.282 15.287 6.526 1.00 0.00 C ATOM 75 CG LEU A 514 -27.283 15.935 7.507 1.00 0.00 C ATOM 76 CD1 LEU A 514 -27.083 15.458 8.953 1.00 0.00 C ATOM 77 CD2 LEU A 514 -27.144 17.461 7.487 1.00 0.00 C ATOM 0 H LEU A 514 -25.711 12.560 6.972 1.00 0.00 H new ATOM 0 HA LEU A 514 -27.811 14.133 5.586 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -25.350 15.089 7.056 1.00 0.00 H new ATOM 0 HB3 LEU A 514 -26.053 16.002 5.736 1.00 0.00 H new ATOM 0 HG LEU A 514 -28.275 15.632 7.172 1.00 0.00 H new ATOM 0 HD11 LEU A 514 -27.812 15.944 9.601 1.00 0.00 H new ATOM 0 HD12 LEU A 514 -27.218 14.377 9.002 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -26.076 15.713 9.284 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -27.857 17.900 8.184 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -26.132 17.738 7.781 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -27.344 17.831 6.482 1.00 0.00 H new ATOM 89 N PRO A 515 -26.078 14.270 3.500 1.00 0.00 N ATOM 90 CA PRO A 515 -25.178 14.097 2.368 1.00 0.00 C ATOM 91 C PRO A 515 -23.808 14.700 2.707 1.00 0.00 C ATOM 92 O PRO A 515 -23.548 15.878 2.439 1.00 0.00 O ATOM 93 CB PRO A 515 -25.873 14.762 1.174 1.00 0.00 C ATOM 94 CG PRO A 515 -26.781 15.808 1.819 1.00 0.00 C ATOM 95 CD PRO A 515 -27.170 15.170 3.152 1.00 0.00 C ATOM 0 HA PRO A 515 -24.981 13.053 2.126 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -25.153 15.220 0.496 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -26.445 14.040 0.591 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -26.262 16.755 1.964 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -27.656 16.015 1.203 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -27.310 15.929 3.922 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -28.111 14.627 3.065 1.00 0.00 H new ATOM 103 N SER A 516 -22.948 13.921 3.355 1.00 0.00 N ATOM 104 CA SER A 516 -21.636 14.333 3.836 1.00 0.00 C ATOM 105 C SER A 516 -20.540 13.687 2.983 1.00 0.00 C ATOM 106 O SER A 516 -19.922 12.695 3.383 1.00 0.00 O ATOM 107 CB SER A 516 -21.573 14.021 5.337 1.00 0.00 C ATOM 108 OG SER A 516 -22.626 14.722 5.985 1.00 0.00 O ATOM 0 H SER A 516 -23.156 12.945 3.568 1.00 0.00 H new ATOM 0 HA SER A 516 -21.466 15.404 3.728 1.00 0.00 H new ATOM 0 HB2 SER A 516 -21.671 12.949 5.506 1.00 0.00 H new ATOM 0 HB3 SER A 516 -20.609 14.322 5.747 1.00 0.00 H new ATOM 0 HG SER A 516 -22.602 14.533 6.946 1.00 0.00 H new ATOM 114 N GLU A 517 -20.336 14.250 1.789 1.00 0.00 N ATOM 115 CA GLU A 517 -19.328 13.872 0.802 1.00 0.00 C ATOM 116 C GLU A 517 -18.917 15.152 0.057 1.00 0.00 C ATOM 117 O GLU A 517 -19.673 16.136 0.063 1.00 0.00 O ATOM 118 CB GLU A 517 -19.915 12.802 -0.144 1.00 0.00 C ATOM 119 CG GLU A 517 -19.024 11.562 -0.349 1.00 0.00 C ATOM 120 CD GLU A 517 -18.054 11.650 -1.533 1.00 0.00 C ATOM 121 OE1 GLU A 517 -17.514 12.735 -1.807 1.00 0.00 O ATOM 122 OE2 GLU A 517 -17.768 10.583 -2.134 1.00 0.00 O ATOM 0 H GLU A 517 -20.908 15.031 1.468 1.00 0.00 H new ATOM 0 HA GLU A 517 -18.445 13.433 1.266 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -20.879 12.479 0.250 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -20.105 13.260 -1.115 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -18.448 11.392 0.561 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -19.665 10.691 -0.488 1.00 0.00 H new ATOM 129 N ALA A 518 -17.731 15.170 -0.552 1.00 0.00 N ATOM 130 CA ALA A 518 -17.201 16.242 -1.385 1.00 0.00 C ATOM 131 C ALA A 518 -16.063 15.684 -2.262 1.00 0.00 C ATOM 132 O ALA A 518 -14.931 15.583 -1.777 1.00 0.00 O ATOM 133 CB ALA A 518 -16.695 17.395 -0.508 1.00 0.00 C ATOM 0 H ALA A 518 -17.079 14.390 -0.470 1.00 0.00 H new ATOM 0 HA ALA A 518 -17.991 16.630 -2.028 1.00 0.00 H new ATOM 0 HB1 ALA A 518 -16.302 18.189 -1.143 1.00 0.00 H new ATOM 0 HB2 ALA A 518 -17.518 17.784 0.092 1.00 0.00 H new ATOM 0 HB3 ALA A 518 -15.906 17.032 0.150 1.00 0.00 H new ATOM 139 N PRO A 519 -16.306 15.316 -3.533 1.00 0.00 N ATOM 140 CA PRO A 519 -15.258 14.921 -4.468 1.00 0.00 C ATOM 141 C PRO A 519 -14.454 16.161 -4.884 1.00 0.00 C ATOM 142 O PRO A 519 -14.926 16.990 -5.668 1.00 0.00 O ATOM 143 CB PRO A 519 -15.992 14.262 -5.639 1.00 0.00 C ATOM 144 CG PRO A 519 -17.358 14.951 -5.643 1.00 0.00 C ATOM 145 CD PRO A 519 -17.612 15.247 -4.166 1.00 0.00 C ATOM 0 HA PRO A 519 -14.534 14.225 -4.044 1.00 0.00 H new ATOM 0 HB2 PRO A 519 -15.464 14.415 -6.580 1.00 0.00 H new ATOM 0 HB3 PRO A 519 -16.087 13.185 -5.498 1.00 0.00 H new ATOM 0 HG2 PRO A 519 -17.346 15.864 -6.239 1.00 0.00 H new ATOM 0 HG3 PRO A 519 -18.131 14.307 -6.062 1.00 0.00 H new ATOM 0 HD2 PRO A 519 -18.153 16.186 -4.045 1.00 0.00 H new ATOM 0 HD3 PRO A 519 -18.223 14.467 -3.713 1.00 0.00 H new ATOM 153 N ASN A 520 -13.253 16.334 -4.329 1.00 0.00 N ATOM 154 CA ASN A 520 -12.482 17.561 -4.421 1.00 0.00 C ATOM 155 C ASN A 520 -11.025 17.188 -4.598 1.00 0.00 C ATOM 156 O ASN A 520 -10.396 16.634 -3.696 1.00 0.00 O ATOM 157 CB ASN A 520 -12.717 18.457 -3.193 1.00 0.00 C ATOM 158 CG ASN A 520 -13.841 19.445 -3.472 1.00 0.00 C ATOM 159 OD1 ASN A 520 -14.916 19.375 -2.883 1.00 0.00 O ATOM 160 ND2 ASN A 520 -13.635 20.398 -4.365 1.00 0.00 N ATOM 0 H ASN A 520 -12.785 15.604 -3.792 1.00 0.00 H new ATOM 0 HA ASN A 520 -12.803 18.149 -5.281 1.00 0.00 H new ATOM 0 HB2 ASN A 520 -12.969 17.843 -2.328 1.00 0.00 H new ATOM 0 HB3 ASN A 520 -11.802 18.996 -2.946 1.00 0.00 H new ATOM 0 HD21 ASN A 520 -14.370 21.077 -4.565 1.00 0.00 H new ATOM 0 HD22 ASN A 520 -12.741 20.455 -4.853 1.00 0.00 H new ATOM 167 N ALA A 521 -10.515 17.434 -5.801 1.00 0.00 N ATOM 168 CA ALA A 521 -9.130 17.165 -6.154 1.00 0.00 C ATOM 169 C ALA A 521 -8.163 18.080 -5.396 1.00 0.00 C ATOM 170 O ALA A 521 -8.457 19.258 -5.147 1.00 0.00 O ATOM 171 CB ALA A 521 -8.927 17.310 -7.662 1.00 0.00 C ATOM 0 H ALA A 521 -11.061 17.831 -6.566 1.00 0.00 H new ATOM 0 HA ALA A 521 -8.910 16.138 -5.862 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -7.886 17.106 -7.910 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -9.570 16.603 -8.185 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -9.180 18.325 -7.967 1.00 0.00 H new ATOM 177 N LYS A 522 -6.975 17.558 -5.095 1.00 0.00 N ATOM 178 CA LYS A 522 -5.839 18.290 -4.543 1.00 0.00 C ATOM 179 C LYS A 522 -4.586 17.990 -5.369 1.00 0.00 C ATOM 180 O LYS A 522 -4.649 17.251 -6.356 1.00 0.00 O ATOM 181 CB LYS A 522 -5.700 17.969 -3.044 1.00 0.00 C ATOM 182 CG LYS A 522 -6.933 18.432 -2.247 1.00 0.00 C ATOM 183 CD LYS A 522 -6.614 18.915 -0.827 1.00 0.00 C ATOM 184 CE LYS A 522 -6.228 20.407 -0.790 1.00 0.00 C ATOM 185 NZ LYS A 522 -4.772 20.669 -0.823 1.00 0.00 N ATOM 0 H LYS A 522 -6.770 16.569 -5.236 1.00 0.00 H new ATOM 0 HA LYS A 522 -5.994 19.367 -4.610 1.00 0.00 H new ATOM 0 HB2 LYS A 522 -5.564 16.896 -2.913 1.00 0.00 H new ATOM 0 HB3 LYS A 522 -4.808 18.454 -2.649 1.00 0.00 H new ATOM 0 HG2 LYS A 522 -7.423 19.239 -2.792 1.00 0.00 H new ATOM 0 HG3 LYS A 522 -7.645 17.609 -2.188 1.00 0.00 H new ATOM 0 HD2 LYS A 522 -7.480 18.750 -0.186 1.00 0.00 H new ATOM 0 HD3 LYS A 522 -5.797 18.320 -0.418 1.00 0.00 H new ATOM 0 HE2 LYS A 522 -6.693 20.910 -1.638 1.00 0.00 H new ATOM 0 HE3 LYS A 522 -6.644 20.854 0.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 522 -4.603 21.694 -0.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 522 -4.318 20.207 -0.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 522 -4.371 20.291 -1.705 1.00 0.00 H new ATOM 199 N GLU A 523 -3.436 18.538 -4.978 1.00 0.00 N ATOM 200 CA GLU A 523 -2.127 18.078 -5.428 1.00 0.00 C ATOM 201 C GLU A 523 -1.944 16.594 -5.076 1.00 0.00 C ATOM 202 O GLU A 523 -2.798 16.005 -4.405 1.00 0.00 O ATOM 203 CB GLU A 523 -1.005 18.963 -4.849 1.00 0.00 C ATOM 204 CG GLU A 523 -0.823 18.902 -3.320 1.00 0.00 C ATOM 205 CD GLU A 523 -1.665 19.918 -2.533 1.00 0.00 C ATOM 206 OE1 GLU A 523 -2.913 19.920 -2.636 1.00 0.00 O ATOM 207 OE2 GLU A 523 -1.076 20.682 -1.742 1.00 0.00 O ATOM 0 H GLU A 523 -3.389 19.325 -4.331 1.00 0.00 H new ATOM 0 HA GLU A 523 -2.067 18.169 -6.513 1.00 0.00 H new ATOM 0 HB2 GLU A 523 -0.064 18.678 -5.319 1.00 0.00 H new ATOM 0 HB3 GLU A 523 -1.202 19.997 -5.131 1.00 0.00 H new ATOM 0 HG2 GLU A 523 -1.075 17.898 -2.977 1.00 0.00 H new ATOM 0 HG3 GLU A 523 0.229 19.064 -3.086 1.00 0.00 H new ATOM 214 N GLU A 524 -0.844 15.967 -5.502 1.00 0.00 N ATOM 215 CA GLU A 524 -0.593 14.556 -5.236 1.00 0.00 C ATOM 216 C GLU A 524 0.758 14.330 -4.586 1.00 0.00 C ATOM 217 O GLU A 524 1.775 14.913 -4.965 1.00 0.00 O ATOM 218 CB GLU A 524 -0.782 13.663 -6.469 1.00 0.00 C ATOM 219 CG GLU A 524 0.084 13.960 -7.704 1.00 0.00 C ATOM 220 CD GLU A 524 -0.177 15.294 -8.405 1.00 0.00 C ATOM 221 OE1 GLU A 524 -1.351 15.694 -8.602 1.00 0.00 O ATOM 222 OE2 GLU A 524 0.821 15.905 -8.857 1.00 0.00 O ATOM 0 H GLU A 524 -0.107 16.425 -6.039 1.00 0.00 H new ATOM 0 HA GLU A 524 -1.357 14.252 -4.521 1.00 0.00 H new ATOM 0 HB2 GLU A 524 -0.596 12.632 -6.168 1.00 0.00 H new ATOM 0 HB3 GLU A 524 -1.828 13.723 -6.770 1.00 0.00 H new ATOM 0 HG2 GLU A 524 1.131 13.930 -7.404 1.00 0.00 H new ATOM 0 HG3 GLU A 524 -0.064 13.158 -8.427 1.00 0.00 H new ATOM 229 N ILE A 525 0.730 13.468 -3.574 1.00 0.00 N ATOM 230 CA ILE A 525 1.853 13.197 -2.699 1.00 0.00 C ATOM 231 C ILE A 525 2.734 12.149 -3.363 1.00 0.00 C ATOM 232 O ILE A 525 2.240 11.287 -4.112 1.00 0.00 O ATOM 233 CB ILE A 525 1.354 12.756 -1.311 1.00 0.00 C ATOM 234 CG1 ILE A 525 0.193 13.646 -0.822 1.00 0.00 C ATOM 235 CG2 ILE A 525 2.474 12.759 -0.256 1.00 0.00 C ATOM 236 CD1 ILE A 525 0.322 15.160 -1.032 1.00 0.00 C ATOM 0 H ILE A 525 -0.101 12.926 -3.338 1.00 0.00 H new ATOM 0 HA ILE A 525 2.447 14.097 -2.541 1.00 0.00 H new ATOM 0 HB ILE A 525 1.000 11.732 -1.431 1.00 0.00 H new ATOM 0 HG12 ILE A 525 -0.718 13.314 -1.320 1.00 0.00 H new ATOM 0 HG13 ILE A 525 0.057 13.465 0.244 1.00 0.00 H new ATOM 0 HG21 ILE A 525 2.070 12.440 0.705 1.00 0.00 H new ATOM 0 HG22 ILE A 525 3.264 12.074 -0.562 1.00 0.00 H new ATOM 0 HG23 ILE A 525 2.883 13.765 -0.162 1.00 0.00 H new ATOM 0 HD11 ILE A 525 -0.565 15.658 -0.641 1.00 0.00 H new ATOM 0 HD12 ILE A 525 1.205 15.526 -0.508 1.00 0.00 H new ATOM 0 HD13 ILE A 525 0.418 15.373 -2.097 1.00 0.00 H new ATOM 248 N LEU A 526 4.017 12.206 -3.022 1.00 0.00 N ATOM 249 CA LEU A 526 5.067 11.325 -3.479 1.00 0.00 C ATOM 250 C LEU A 526 6.054 11.117 -2.330 1.00 0.00 C ATOM 251 O LEU A 526 6.049 11.871 -1.352 1.00 0.00 O ATOM 252 CB LEU A 526 5.744 11.969 -4.693 1.00 0.00 C ATOM 253 CG LEU A 526 6.169 10.921 -5.725 1.00 0.00 C ATOM 254 CD1 LEU A 526 4.948 10.412 -6.507 1.00 0.00 C ATOM 255 CD2 LEU A 526 7.176 11.532 -6.694 1.00 0.00 C ATOM 0 H LEU A 526 4.365 12.916 -2.378 1.00 0.00 H new ATOM 0 HA LEU A 526 4.675 10.353 -3.778 1.00 0.00 H new ATOM 0 HB2 LEU A 526 5.060 12.680 -5.157 1.00 0.00 H new ATOM 0 HB3 LEU A 526 6.617 12.533 -4.366 1.00 0.00 H new ATOM 0 HG LEU A 526 6.627 10.082 -5.202 1.00 0.00 H new ATOM 0 HD11 LEU A 526 5.268 9.668 -7.236 1.00 0.00 H new ATOM 0 HD12 LEU A 526 4.236 9.961 -5.816 1.00 0.00 H new ATOM 0 HD13 LEU A 526 4.473 11.246 -7.024 1.00 0.00 H new ATOM 0 HD21 LEU A 526 7.476 10.783 -7.427 1.00 0.00 H new ATOM 0 HD22 LEU A 526 6.720 12.379 -7.207 1.00 0.00 H new ATOM 0 HD23 LEU A 526 8.053 11.871 -6.142 1.00 0.00 H new ATOM 267 N GLY A 527 6.940 10.137 -2.474 1.00 0.00 N ATOM 268 CA GLY A 527 7.982 9.850 -1.494 1.00 0.00 C ATOM 269 C GLY A 527 7.451 9.267 -0.182 1.00 0.00 C ATOM 270 O GLY A 527 6.275 8.908 -0.072 1.00 0.00 O ATOM 0 H GLY A 527 6.955 9.514 -3.281 1.00 0.00 H new ATOM 0 HA2 GLY A 527 8.695 9.150 -1.930 1.00 0.00 H new ATOM 0 HA3 GLY A 527 8.528 10.768 -1.278 1.00 0.00 H new ATOM 274 N THR A 528 8.330 9.098 0.806 1.00 0.00 N ATOM 275 CA THR A 528 7.960 8.582 2.112 1.00 0.00 C ATOM 276 C THR A 528 7.231 9.691 2.873 1.00 0.00 C ATOM 277 O THR A 528 7.504 10.877 2.673 1.00 0.00 O ATOM 278 CB THR A 528 9.222 8.078 2.846 1.00 0.00 C ATOM 279 OG1 THR A 528 10.084 7.397 1.955 1.00 0.00 O ATOM 280 CG2 THR A 528 8.919 7.113 3.999 1.00 0.00 C ATOM 0 H THR A 528 9.322 9.318 0.716 1.00 0.00 H new ATOM 0 HA THR A 528 7.286 7.729 2.029 1.00 0.00 H new ATOM 0 HB THR A 528 9.687 8.977 3.251 1.00 0.00 H new ATOM 0 HG1 THR A 528 10.505 6.644 2.419 1.00 0.00 H new ATOM 0 HG21 THR A 528 9.853 6.801 4.467 1.00 0.00 H new ATOM 0 HG22 THR A 528 8.292 7.613 4.737 1.00 0.00 H new ATOM 0 HG23 THR A 528 8.397 6.238 3.613 1.00 0.00 H new ATOM 288 N VAL A 529 6.311 9.307 3.745 1.00 0.00 N ATOM 289 CA VAL A 529 5.477 10.177 4.567 1.00 0.00 C ATOM 290 C VAL A 529 5.164 9.452 5.881 1.00 0.00 C ATOM 291 O VAL A 529 5.239 8.220 5.964 1.00 0.00 O ATOM 292 CB VAL A 529 4.182 10.553 3.806 1.00 0.00 C ATOM 293 CG1 VAL A 529 4.388 11.737 2.853 1.00 0.00 C ATOM 294 CG2 VAL A 529 3.577 9.386 3.002 1.00 0.00 C ATOM 0 H VAL A 529 6.113 8.320 3.909 1.00 0.00 H new ATOM 0 HA VAL A 529 6.004 11.105 4.789 1.00 0.00 H new ATOM 0 HB VAL A 529 3.482 10.829 4.595 1.00 0.00 H new ATOM 0 HG11 VAL A 529 3.451 11.961 2.344 1.00 0.00 H new ATOM 0 HG12 VAL A 529 4.710 12.610 3.421 1.00 0.00 H new ATOM 0 HG13 VAL A 529 5.150 11.483 2.116 1.00 0.00 H new ATOM 0 HG21 VAL A 529 2.673 9.723 2.496 1.00 0.00 H new ATOM 0 HG22 VAL A 529 4.300 9.040 2.263 1.00 0.00 H new ATOM 0 HG23 VAL A 529 3.330 8.568 3.678 1.00 0.00 H new ATOM 304 N SER A 530 4.789 10.191 6.928 1.00 0.00 N ATOM 305 CA SER A 530 4.495 9.625 8.242 1.00 0.00 C ATOM 306 C SER A 530 3.033 9.186 8.273 1.00 0.00 C ATOM 307 O SER A 530 2.219 9.748 9.014 1.00 0.00 O ATOM 308 CB SER A 530 4.843 10.654 9.324 1.00 0.00 C ATOM 309 OG SER A 530 4.209 11.900 9.075 1.00 0.00 O ATOM 0 H SER A 530 4.681 11.204 6.885 1.00 0.00 H new ATOM 0 HA SER A 530 5.101 8.741 8.441 1.00 0.00 H new ATOM 0 HB2 SER A 530 4.537 10.276 10.300 1.00 0.00 H new ATOM 0 HB3 SER A 530 5.923 10.794 9.361 1.00 0.00 H new ATOM 0 HG SER A 530 3.240 11.768 9.017 1.00 0.00 H new ATOM 315 N TRP A 531 2.667 8.255 7.395 1.00 0.00 N ATOM 316 CA TRP A 531 1.305 7.779 7.229 1.00 0.00 C ATOM 317 C TRP A 531 1.230 6.383 7.809 1.00 0.00 C ATOM 318 O TRP A 531 2.228 5.661 7.802 1.00 0.00 O ATOM 319 CB TRP A 531 0.923 7.779 5.755 1.00 0.00 C ATOM 320 CG TRP A 531 0.748 9.113 5.116 1.00 0.00 C ATOM 321 CD1 TRP A 531 1.022 10.327 5.652 1.00 0.00 C ATOM 322 CD2 TRP A 531 0.291 9.364 3.761 1.00 0.00 C ATOM 323 NE1 TRP A 531 0.741 11.308 4.730 1.00 0.00 N ATOM 324 CE2 TRP A 531 0.354 10.767 3.526 1.00 0.00 C ATOM 325 CE3 TRP A 531 -0.100 8.533 2.691 1.00 0.00 C ATOM 326 CZ2 TRP A 531 0.078 11.323 2.275 1.00 0.00 C ATOM 327 CZ3 TRP A 531 -0.363 9.089 1.425 1.00 0.00 C ATOM 328 CH2 TRP A 531 -0.274 10.478 1.213 1.00 0.00 C ATOM 0 H TRP A 531 3.330 7.802 6.766 1.00 0.00 H new ATOM 0 HA TRP A 531 0.604 8.433 7.747 1.00 0.00 H new ATOM 0 HB2 TRP A 531 1.689 7.234 5.204 1.00 0.00 H new ATOM 0 HB3 TRP A 531 -0.007 7.222 5.643 1.00 0.00 H new ATOM 0 HD1 TRP A 531 1.402 10.498 6.648 1.00 0.00 H new ATOM 0 HE1 TRP A 531 0.811 12.309 4.915 1.00 0.00 H new ATOM 0 HE3 TRP A 531 -0.198 7.468 2.843 1.00 0.00 H new ATOM 0 HZ2 TRP A 531 0.135 12.391 2.127 1.00 0.00 H new ATOM 0 HZ3 TRP A 531 -0.637 8.441 0.605 1.00 0.00 H new ATOM 0 HH2 TRP A 531 -0.476 10.891 0.236 1.00 0.00 H new ATOM 339 N ASN A 532 0.048 5.987 8.278 1.00 0.00 N ATOM 340 CA ASN A 532 -0.110 4.710 8.962 1.00 0.00 C ATOM 341 C ASN A 532 -0.908 3.785 8.064 1.00 0.00 C ATOM 342 O ASN A 532 -0.317 2.971 7.359 1.00 0.00 O ATOM 343 CB ASN A 532 -0.675 4.890 10.378 1.00 0.00 C ATOM 344 CG ASN A 532 0.384 5.491 11.287 1.00 0.00 C ATOM 345 OD1 ASN A 532 1.101 4.777 11.972 1.00 0.00 O ATOM 346 ND2 ASN A 532 0.524 6.807 11.286 1.00 0.00 N ATOM 0 H ASN A 532 -0.810 6.532 8.196 1.00 0.00 H new ATOM 0 HA ASN A 532 0.857 4.238 9.133 1.00 0.00 H new ATOM 0 HB2 ASN A 532 -1.551 5.537 10.349 1.00 0.00 H new ATOM 0 HB3 ASN A 532 -1.002 3.928 10.773 1.00 0.00 H new ATOM 0 HD21 ASN A 532 1.241 7.244 11.865 1.00 0.00 H new ATOM 0 HD22 ASN A 532 -0.085 7.384 10.707 1.00 0.00 H new ATOM 353 N LEU A 533 -2.237 3.909 8.027 1.00 0.00 N ATOM 354 CA LEU A 533 -3.051 3.072 7.141 1.00 0.00 C ATOM 355 C LEU A 533 -4.289 3.817 6.663 1.00 0.00 C ATOM 356 O LEU A 533 -4.613 3.759 5.484 1.00 0.00 O ATOM 357 CB LEU A 533 -3.382 1.733 7.839 1.00 0.00 C ATOM 358 CG LEU A 533 -3.743 0.519 6.955 1.00 0.00 C ATOM 359 CD1 LEU A 533 -5.202 0.496 6.505 1.00 0.00 C ATOM 360 CD2 LEU A 533 -2.822 0.350 5.740 1.00 0.00 C ATOM 0 H LEU A 533 -2.767 4.572 8.592 1.00 0.00 H new ATOM 0 HA LEU A 533 -2.480 2.837 6.243 1.00 0.00 H new ATOM 0 HB2 LEU A 533 -2.524 1.456 8.451 1.00 0.00 H new ATOM 0 HB3 LEU A 533 -4.215 1.909 8.519 1.00 0.00 H new ATOM 0 HG LEU A 533 -3.587 -0.332 7.618 1.00 0.00 H new ATOM 0 HD11 LEU A 533 -5.379 -0.385 5.889 1.00 0.00 H new ATOM 0 HD12 LEU A 533 -5.852 0.464 7.379 1.00 0.00 H new ATOM 0 HD13 LEU A 533 -5.418 1.393 5.925 1.00 0.00 H new ATOM 0 HD21 LEU A 533 -3.134 -0.522 5.165 1.00 0.00 H new ATOM 0 HD22 LEU A 533 -2.881 1.239 5.112 1.00 0.00 H new ATOM 0 HD23 LEU A 533 -1.795 0.212 6.078 1.00 0.00 H new ATOM 372 N ARG A 534 -4.970 4.570 7.523 1.00 0.00 N ATOM 373 CA ARG A 534 -6.115 5.360 7.077 1.00 0.00 C ATOM 374 C ARG A 534 -5.712 6.575 6.246 1.00 0.00 C ATOM 375 O ARG A 534 -6.393 6.847 5.257 1.00 0.00 O ATOM 376 CB ARG A 534 -6.937 5.792 8.289 1.00 0.00 C ATOM 377 CG ARG A 534 -7.634 4.590 8.934 1.00 0.00 C ATOM 378 CD ARG A 534 -8.873 5.088 9.664 1.00 0.00 C ATOM 379 NE ARG A 534 -9.409 4.071 10.567 1.00 0.00 N ATOM 380 CZ ARG A 534 -10.535 4.198 11.262 1.00 0.00 C ATOM 381 NH1 ARG A 534 -11.359 5.221 11.062 1.00 0.00 N ATOM 382 NH2 ARG A 534 -10.834 3.262 12.146 1.00 0.00 N ATOM 0 H ARG A 534 -4.754 4.650 8.517 1.00 0.00 H new ATOM 0 HA ARG A 534 -6.715 4.726 6.424 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -6.289 6.276 9.019 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -7.681 6.529 7.985 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -7.910 3.859 8.174 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -6.960 4.089 9.629 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -8.626 5.986 10.231 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -9.636 5.369 8.938 1.00 0.00 H new ATOM 0 HE ARG A 534 -8.882 3.204 10.671 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -11.133 5.929 10.363 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -12.218 5.298 11.607 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -10.207 2.469 12.280 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -11.691 3.333 12.694 1.00 0.00 H new ATOM 396 N GLU A 535 -4.609 7.255 6.588 1.00 0.00 N ATOM 397 CA GLU A 535 -4.064 8.344 5.773 1.00 0.00 C ATOM 398 C GLU A 535 -3.842 7.824 4.343 1.00 0.00 C ATOM 399 O GLU A 535 -4.185 8.469 3.351 1.00 0.00 O ATOM 400 CB GLU A 535 -2.734 8.866 6.361 1.00 0.00 C ATOM 401 CG GLU A 535 -2.845 9.588 7.725 1.00 0.00 C ATOM 402 CD GLU A 535 -1.972 10.853 7.882 1.00 0.00 C ATOM 403 OE1 GLU A 535 -1.740 11.602 6.905 1.00 0.00 O ATOM 404 OE2 GLU A 535 -1.505 11.098 9.023 1.00 0.00 O ATOM 0 H GLU A 535 -4.073 7.065 7.435 1.00 0.00 H new ATOM 0 HA GLU A 535 -4.771 9.174 5.765 1.00 0.00 H new ATOM 0 HB2 GLU A 535 -2.050 8.024 6.470 1.00 0.00 H new ATOM 0 HB3 GLU A 535 -2.284 9.551 5.643 1.00 0.00 H new ATOM 0 HG2 GLU A 535 -3.887 9.865 7.886 1.00 0.00 H new ATOM 0 HG3 GLU A 535 -2.577 8.883 8.512 1.00 0.00 H new ATOM 411 N MET A 536 -3.302 6.606 4.257 1.00 0.00 N ATOM 412 CA MET A 536 -2.955 5.921 3.033 1.00 0.00 C ATOM 413 C MET A 536 -4.203 5.645 2.217 1.00 0.00 C ATOM 414 O MET A 536 -4.223 5.975 1.038 1.00 0.00 O ATOM 415 CB MET A 536 -2.264 4.600 3.363 1.00 0.00 C ATOM 416 CG MET A 536 -1.073 4.738 4.307 1.00 0.00 C ATOM 417 SD MET A 536 0.479 4.928 3.444 1.00 0.00 S ATOM 418 CE MET A 536 0.650 3.205 2.943 1.00 0.00 C ATOM 0 H MET A 536 -3.089 6.053 5.087 1.00 0.00 H new ATOM 0 HA MET A 536 -2.282 6.553 2.454 1.00 0.00 H new ATOM 0 HB2 MET A 536 -2.992 3.924 3.811 1.00 0.00 H new ATOM 0 HB3 MET A 536 -1.927 4.137 2.436 1.00 0.00 H new ATOM 0 HG2 MET A 536 -1.229 5.599 4.957 1.00 0.00 H new ATOM 0 HG3 MET A 536 -1.021 3.859 4.949 1.00 0.00 H new ATOM 0 HE1 MET A 536 1.689 3.003 2.684 1.00 0.00 H new ATOM 0 HE2 MET A 536 0.348 2.555 3.765 1.00 0.00 H new ATOM 0 HE3 MET A 536 0.016 3.013 2.077 1.00 0.00 H new ATOM 428 N LEU A 537 -5.229 5.039 2.824 1.00 0.00 N ATOM 429 CA LEU A 537 -6.465 4.671 2.139 1.00 0.00 C ATOM 430 C LEU A 537 -7.159 5.902 1.571 1.00 0.00 C ATOM 431 O LEU A 537 -7.719 5.828 0.474 1.00 0.00 O ATOM 432 CB LEU A 537 -7.430 3.949 3.098 1.00 0.00 C ATOM 433 CG LEU A 537 -7.026 2.517 3.481 1.00 0.00 C ATOM 434 CD1 LEU A 537 -8.002 1.943 4.515 1.00 0.00 C ATOM 435 CD2 LEU A 537 -6.995 1.576 2.282 1.00 0.00 C ATOM 0 H LEU A 537 -5.221 4.790 3.813 1.00 0.00 H new ATOM 0 HA LEU A 537 -6.197 4.000 1.323 1.00 0.00 H new ATOM 0 HB2 LEU A 537 -7.520 4.540 4.010 1.00 0.00 H new ATOM 0 HB3 LEU A 537 -8.418 3.920 2.639 1.00 0.00 H new ATOM 0 HG LEU A 537 -6.020 2.585 3.895 1.00 0.00 H new ATOM 0 HD11 LEU A 537 -7.701 0.928 4.775 1.00 0.00 H new ATOM 0 HD12 LEU A 537 -7.992 2.565 5.410 1.00 0.00 H new ATOM 0 HD13 LEU A 537 -9.008 1.927 4.096 1.00 0.00 H new ATOM 0 HD21 LEU A 537 -6.704 0.578 2.610 1.00 0.00 H new ATOM 0 HD22 LEU A 537 -7.985 1.534 1.827 1.00 0.00 H new ATOM 0 HD23 LEU A 537 -6.275 1.942 1.551 1.00 0.00 H new ATOM 447 N ALA A 538 -7.116 7.027 2.294 1.00 0.00 N ATOM 448 CA ALA A 538 -7.747 8.247 1.830 1.00 0.00 C ATOM 449 C ALA A 538 -6.971 8.769 0.633 1.00 0.00 C ATOM 450 O ALA A 538 -7.566 9.001 -0.413 1.00 0.00 O ATOM 451 CB ALA A 538 -7.811 9.276 2.960 1.00 0.00 C ATOM 0 H ALA A 538 -6.650 7.108 3.198 1.00 0.00 H new ATOM 0 HA ALA A 538 -8.774 8.048 1.523 1.00 0.00 H new ATOM 0 HB1 ALA A 538 -8.287 10.187 2.596 1.00 0.00 H new ATOM 0 HB2 ALA A 538 -8.390 8.870 3.789 1.00 0.00 H new ATOM 0 HB3 ALA A 538 -6.801 9.506 3.300 1.00 0.00 H new ATOM 457 N HIS A 539 -5.643 8.887 0.737 1.00 0.00 N ATOM 458 CA HIS A 539 -4.834 9.332 -0.391 1.00 0.00 C ATOM 459 C HIS A 539 -4.941 8.395 -1.600 1.00 0.00 C ATOM 460 O HIS A 539 -4.912 8.847 -2.749 1.00 0.00 O ATOM 461 CB HIS A 539 -3.372 9.479 0.024 1.00 0.00 C ATOM 462 CG HIS A 539 -2.586 10.038 -1.133 1.00 0.00 C ATOM 463 ND1 HIS A 539 -2.771 11.293 -1.678 1.00 0.00 N ATOM 464 CD2 HIS A 539 -1.790 9.322 -1.985 1.00 0.00 C ATOM 465 CE1 HIS A 539 -2.116 11.329 -2.847 1.00 0.00 C ATOM 466 NE2 HIS A 539 -1.496 10.153 -3.048 1.00 0.00 N ATOM 0 H HIS A 539 -5.114 8.682 1.585 1.00 0.00 H new ATOM 0 HA HIS A 539 -5.228 10.302 -0.695 1.00 0.00 H new ATOM 0 HB2 HIS A 539 -3.291 10.139 0.888 1.00 0.00 H new ATOM 0 HB3 HIS A 539 -2.967 8.512 0.322 1.00 0.00 H new ATOM 0 HD1 HIS A 539 -3.309 12.055 -1.266 1.00 0.00 H new ATOM 0 HD2 HIS A 539 -1.456 8.304 -1.852 1.00 0.00 H new ATOM 0 HE1 HIS A 539 -2.090 12.171 -3.522 1.00 0.00 H new ATOM 475 N ALA A 540 -4.998 7.086 -1.364 1.00 0.00 N ATOM 476 CA ALA A 540 -5.247 6.097 -2.399 1.00 0.00 C ATOM 477 C ALA A 540 -6.543 6.460 -3.106 1.00 0.00 C ATOM 478 O ALA A 540 -6.453 6.717 -4.292 1.00 0.00 O ATOM 479 CB ALA A 540 -5.265 4.678 -1.823 1.00 0.00 C ATOM 0 H ALA A 540 -4.870 6.682 -0.436 1.00 0.00 H new ATOM 0 HA ALA A 540 -4.437 6.105 -3.128 1.00 0.00 H new ATOM 0 HB1 ALA A 540 -5.454 3.963 -2.624 1.00 0.00 H new ATOM 0 HB2 ALA A 540 -4.302 4.460 -1.362 1.00 0.00 H new ATOM 0 HB3 ALA A 540 -6.052 4.600 -1.073 1.00 0.00 H new ATOM 485 N GLU A 541 -7.693 6.569 -2.425 1.00 0.00 N ATOM 486 CA GLU A 541 -8.949 7.010 -3.031 1.00 0.00 C ATOM 487 C GLU A 541 -8.779 8.331 -3.775 1.00 0.00 C ATOM 488 O GLU A 541 -9.108 8.414 -4.950 1.00 0.00 O ATOM 489 CB GLU A 541 -10.051 7.172 -1.966 1.00 0.00 C ATOM 490 CG GLU A 541 -11.143 6.123 -2.149 1.00 0.00 C ATOM 491 CD GLU A 541 -12.456 6.541 -1.479 1.00 0.00 C ATOM 492 OE1 GLU A 541 -13.122 7.489 -1.943 1.00 0.00 O ATOM 493 OE2 GLU A 541 -12.767 5.978 -0.400 1.00 0.00 O ATOM 0 H GLU A 541 -7.774 6.351 -1.432 1.00 0.00 H new ATOM 0 HA GLU A 541 -9.243 6.239 -3.743 1.00 0.00 H new ATOM 0 HB2 GLU A 541 -9.617 7.081 -0.971 1.00 0.00 H new ATOM 0 HB3 GLU A 541 -10.484 8.170 -2.034 1.00 0.00 H new ATOM 0 HG2 GLU A 541 -11.315 5.960 -3.213 1.00 0.00 H new ATOM 0 HG3 GLU A 541 -10.808 5.174 -1.731 1.00 0.00 H new ATOM 500 N GLU A 542 -8.224 9.341 -3.110 1.00 0.00 N ATOM 501 CA GLU A 542 -8.024 10.693 -3.607 1.00 0.00 C ATOM 502 C GLU A 542 -7.394 10.646 -5.002 1.00 0.00 C ATOM 503 O GLU A 542 -7.929 11.233 -5.939 1.00 0.00 O ATOM 504 CB GLU A 542 -7.170 11.426 -2.566 1.00 0.00 C ATOM 505 CG GLU A 542 -6.814 12.878 -2.867 1.00 0.00 C ATOM 506 CD GLU A 542 -5.989 13.440 -1.710 1.00 0.00 C ATOM 507 OE1 GLU A 542 -4.809 13.045 -1.575 1.00 0.00 O ATOM 508 OE2 GLU A 542 -6.547 14.176 -0.868 1.00 0.00 O ATOM 0 H GLU A 542 -7.883 9.228 -2.155 1.00 0.00 H new ATOM 0 HA GLU A 542 -8.961 11.237 -3.731 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -7.697 11.396 -1.612 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -6.242 10.869 -2.435 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -6.250 12.942 -3.797 1.00 0.00 H new ATOM 0 HG3 GLU A 542 -7.721 13.467 -3.003 1.00 0.00 H new ATOM 515 N THR A 543 -6.335 9.857 -5.186 1.00 0.00 N ATOM 516 CA THR A 543 -5.627 9.750 -6.464 1.00 0.00 C ATOM 517 C THR A 543 -6.027 8.513 -7.300 1.00 0.00 C ATOM 518 O THR A 543 -5.480 8.287 -8.383 1.00 0.00 O ATOM 519 CB THR A 543 -4.110 9.841 -6.199 1.00 0.00 C ATOM 520 OG1 THR A 543 -3.648 8.993 -5.150 1.00 0.00 O ATOM 521 CG2 THR A 543 -3.700 11.261 -5.819 1.00 0.00 C ATOM 0 H THR A 543 -5.942 9.271 -4.450 1.00 0.00 H new ATOM 0 HA THR A 543 -5.929 10.587 -7.094 1.00 0.00 H new ATOM 0 HB THR A 543 -3.659 9.521 -7.138 1.00 0.00 H new ATOM 0 HG1 THR A 543 -4.145 9.189 -4.328 1.00 0.00 H new ATOM 0 HG21 THR A 543 -2.626 11.293 -5.638 1.00 0.00 H new ATOM 0 HG22 THR A 543 -3.952 11.942 -6.632 1.00 0.00 H new ATOM 0 HG23 THR A 543 -4.229 11.563 -4.915 1.00 0.00 H new ATOM 529 N ARG A 544 -6.949 7.685 -6.798 1.00 0.00 N ATOM 530 CA ARG A 544 -7.107 6.257 -7.107 1.00 0.00 C ATOM 531 C ARG A 544 -5.773 5.563 -7.443 1.00 0.00 C ATOM 532 O ARG A 544 -5.713 4.757 -8.378 1.00 0.00 O ATOM 533 CB ARG A 544 -8.290 6.003 -8.061 1.00 0.00 C ATOM 534 CG ARG A 544 -9.644 6.220 -7.354 1.00 0.00 C ATOM 535 CD ARG A 544 -10.237 7.622 -7.522 1.00 0.00 C ATOM 536 NE ARG A 544 -11.213 7.697 -8.617 1.00 0.00 N ATOM 537 CZ ARG A 544 -11.907 8.795 -8.944 1.00 0.00 C ATOM 538 NH1 ARG A 544 -11.687 9.954 -8.325 1.00 0.00 N ATOM 539 NH2 ARG A 544 -12.828 8.724 -9.901 1.00 0.00 N ATOM 0 H ARG A 544 -7.645 8.010 -6.127 1.00 0.00 H new ATOM 0 HA ARG A 544 -7.406 5.739 -6.196 1.00 0.00 H new ATOM 0 HB2 ARG A 544 -8.216 6.670 -8.920 1.00 0.00 H new ATOM 0 HB3 ARG A 544 -8.238 4.984 -8.444 1.00 0.00 H new ATOM 0 HG2 ARG A 544 -10.358 5.490 -7.735 1.00 0.00 H new ATOM 0 HG3 ARG A 544 -9.519 6.018 -6.290 1.00 0.00 H new ATOM 0 HD2 ARG A 544 -10.718 7.923 -6.591 1.00 0.00 H new ATOM 0 HD3 ARG A 544 -9.432 8.333 -7.709 1.00 0.00 H new ATOM 0 HE ARG A 544 -11.374 6.853 -9.167 1.00 0.00 H new ATOM 0 HH11 ARG A 544 -10.982 10.014 -7.591 1.00 0.00 H new ATOM 0 HH12 ARG A 544 -12.224 10.781 -8.586 1.00 0.00 H new ATOM 0 HH21 ARG A 544 -13.000 7.839 -10.378 1.00 0.00 H new ATOM 0 HH22 ARG A 544 -13.362 9.554 -10.158 1.00 0.00 H new ATOM 553 N LYS A 545 -4.704 5.869 -6.685 1.00 0.00 N ATOM 554 CA LYS A 545 -3.394 5.220 -6.829 1.00 0.00 C ATOM 555 C LYS A 545 -3.517 3.758 -6.403 1.00 0.00 C ATOM 556 O LYS A 545 -4.291 3.440 -5.500 1.00 0.00 O ATOM 557 CB LYS A 545 -2.288 5.942 -6.028 1.00 0.00 C ATOM 558 CG LYS A 545 -1.635 7.096 -6.812 1.00 0.00 C ATOM 559 CD LYS A 545 -0.557 7.839 -5.999 1.00 0.00 C ATOM 560 CE LYS A 545 -0.068 9.098 -6.747 1.00 0.00 C ATOM 561 NZ LYS A 545 1.232 9.627 -6.259 1.00 0.00 N ATOM 0 H LYS A 545 -4.728 6.578 -5.952 1.00 0.00 H new ATOM 0 HA LYS A 545 -3.094 5.276 -7.876 1.00 0.00 H new ATOM 0 HB2 LYS A 545 -2.713 6.333 -5.103 1.00 0.00 H new ATOM 0 HB3 LYS A 545 -1.521 5.221 -5.747 1.00 0.00 H new ATOM 0 HG2 LYS A 545 -1.187 6.701 -7.724 1.00 0.00 H new ATOM 0 HG3 LYS A 545 -2.406 7.804 -7.116 1.00 0.00 H new ATOM 0 HD2 LYS A 545 -0.961 8.123 -5.027 1.00 0.00 H new ATOM 0 HD3 LYS A 545 0.285 7.173 -5.812 1.00 0.00 H new ATOM 0 HE2 LYS A 545 0.022 8.865 -7.808 1.00 0.00 H new ATOM 0 HE3 LYS A 545 -0.823 9.879 -6.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 545 1.673 10.205 -7.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 545 1.074 10.212 -5.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 545 1.861 8.834 -6.019 1.00 0.00 H new ATOM 575 N LEU A 546 -2.726 2.881 -7.028 1.00 0.00 N ATOM 576 CA LEU A 546 -2.728 1.454 -6.722 1.00 0.00 C ATOM 577 C LEU A 546 -2.107 1.223 -5.344 1.00 0.00 C ATOM 578 O LEU A 546 -1.064 1.802 -5.022 1.00 0.00 O ATOM 579 CB LEU A 546 -1.931 0.693 -7.794 1.00 0.00 C ATOM 580 CG LEU A 546 -1.863 -0.834 -7.576 1.00 0.00 C ATOM 581 CD1 LEU A 546 -3.232 -1.525 -7.638 1.00 0.00 C ATOM 582 CD2 LEU A 546 -0.966 -1.460 -8.639 1.00 0.00 C ATOM 0 H LEU A 546 -2.067 3.144 -7.761 1.00 0.00 H new ATOM 0 HA LEU A 546 -3.754 1.086 -6.716 1.00 0.00 H new ATOM 0 HB2 LEU A 546 -2.378 0.889 -8.769 1.00 0.00 H new ATOM 0 HB3 LEU A 546 -0.916 1.089 -7.824 1.00 0.00 H new ATOM 0 HG LEU A 546 -1.465 -0.981 -6.572 1.00 0.00 H new ATOM 0 HD11 LEU A 546 -3.107 -2.596 -7.476 1.00 0.00 H new ATOM 0 HD12 LEU A 546 -3.882 -1.115 -6.865 1.00 0.00 H new ATOM 0 HD13 LEU A 546 -3.681 -1.356 -8.617 1.00 0.00 H new ATOM 0 HD21 LEU A 546 -0.918 -2.538 -8.485 1.00 0.00 H new ATOM 0 HD22 LEU A 546 -1.374 -1.252 -9.628 1.00 0.00 H new ATOM 0 HD23 LEU A 546 0.036 -1.038 -8.564 1.00 0.00 H new ATOM 594 N MET A 547 -2.684 0.308 -4.567 1.00 0.00 N ATOM 595 CA MET A 547 -2.240 0.001 -3.216 1.00 0.00 C ATOM 596 C MET A 547 -1.963 -1.505 -3.076 1.00 0.00 C ATOM 597 O MET A 547 -2.853 -2.256 -2.699 1.00 0.00 O ATOM 598 CB MET A 547 -3.305 0.547 -2.257 1.00 0.00 C ATOM 599 CG MET A 547 -2.886 0.500 -0.789 1.00 0.00 C ATOM 600 SD MET A 547 -3.846 1.666 0.215 1.00 0.00 S ATOM 601 CE MET A 547 -3.222 1.309 1.871 1.00 0.00 C ATOM 0 H MET A 547 -3.485 -0.247 -4.867 1.00 0.00 H new ATOM 0 HA MET A 547 -1.291 0.478 -2.970 1.00 0.00 H new ATOM 0 HB2 MET A 547 -3.533 1.578 -2.529 1.00 0.00 H new ATOM 0 HB3 MET A 547 -4.224 -0.026 -2.383 1.00 0.00 H new ATOM 0 HG2 MET A 547 -3.021 -0.511 -0.403 1.00 0.00 H new ATOM 0 HG3 MET A 547 -1.825 0.734 -0.705 1.00 0.00 H new ATOM 0 HE1 MET A 547 -3.542 2.093 2.557 1.00 0.00 H new ATOM 0 HE2 MET A 547 -3.614 0.350 2.208 1.00 0.00 H new ATOM 0 HE3 MET A 547 -2.133 1.268 1.849 1.00 0.00 H new ATOM 611 N PRO A 548 -0.769 -2.020 -3.404 1.00 0.00 N ATOM 612 CA PRO A 548 -0.474 -3.438 -3.210 1.00 0.00 C ATOM 613 C PRO A 548 -0.429 -3.758 -1.706 1.00 0.00 C ATOM 614 O PRO A 548 0.207 -3.016 -0.950 1.00 0.00 O ATOM 615 CB PRO A 548 0.850 -3.674 -3.947 1.00 0.00 C ATOM 616 CG PRO A 548 1.522 -2.313 -3.942 1.00 0.00 C ATOM 617 CD PRO A 548 0.380 -1.300 -3.913 1.00 0.00 C ATOM 0 HA PRO A 548 -1.235 -4.108 -3.611 1.00 0.00 H new ATOM 0 HB2 PRO A 548 1.460 -4.422 -3.441 1.00 0.00 H new ATOM 0 HB3 PRO A 548 0.683 -4.033 -4.963 1.00 0.00 H new ATOM 0 HG2 PRO A 548 2.172 -2.198 -3.074 1.00 0.00 H new ATOM 0 HG3 PRO A 548 2.145 -2.179 -4.826 1.00 0.00 H new ATOM 0 HD2 PRO A 548 0.625 -0.452 -3.274 1.00 0.00 H new ATOM 0 HD3 PRO A 548 0.184 -0.903 -4.909 1.00 0.00 H new ATOM 625 N ILE A 549 -1.076 -4.853 -1.284 1.00 0.00 N ATOM 626 CA ILE A 549 -1.211 -5.298 0.106 1.00 0.00 C ATOM 627 C ILE A 549 -0.802 -6.773 0.176 1.00 0.00 C ATOM 628 O ILE A 549 -1.171 -7.560 -0.699 1.00 0.00 O ATOM 629 CB ILE A 549 -2.674 -5.136 0.587 1.00 0.00 C ATOM 630 CG1 ILE A 549 -3.238 -3.704 0.518 1.00 0.00 C ATOM 631 CG2 ILE A 549 -2.907 -5.722 1.989 1.00 0.00 C ATOM 632 CD1 ILE A 549 -2.601 -2.660 1.437 1.00 0.00 C ATOM 0 H ILE A 549 -1.542 -5.483 -1.937 1.00 0.00 H new ATOM 0 HA ILE A 549 -0.573 -4.694 0.751 1.00 0.00 H new ATOM 0 HB ILE A 549 -3.235 -5.719 -0.144 1.00 0.00 H new ATOM 0 HG12 ILE A 549 -3.144 -3.353 -0.510 1.00 0.00 H new ATOM 0 HG13 ILE A 549 -4.303 -3.749 0.744 1.00 0.00 H new ATOM 0 HG21 ILE A 549 -3.949 -5.580 2.274 1.00 0.00 H new ATOM 0 HG22 ILE A 549 -2.675 -6.787 1.981 1.00 0.00 H new ATOM 0 HG23 ILE A 549 -2.262 -5.215 2.707 1.00 0.00 H new ATOM 0 HD11 ILE A 549 -3.090 -1.697 1.289 1.00 0.00 H new ATOM 0 HD12 ILE A 549 -2.717 -2.970 2.475 1.00 0.00 H new ATOM 0 HD13 ILE A 549 -1.540 -2.568 1.203 1.00 0.00 H new ATOM 644 N CYS A 550 -0.091 -7.163 1.236 1.00 0.00 N ATOM 645 CA CYS A 550 0.226 -8.560 1.501 1.00 0.00 C ATOM 646 C CYS A 550 -0.860 -9.143 2.405 1.00 0.00 C ATOM 647 O CYS A 550 -1.011 -8.695 3.537 1.00 0.00 O ATOM 648 CB CYS A 550 1.601 -8.668 2.172 1.00 0.00 C ATOM 649 SG CYS A 550 2.254 -10.335 1.886 1.00 0.00 S ATOM 0 H CYS A 550 0.279 -6.516 1.932 1.00 0.00 H new ATOM 0 HA CYS A 550 0.261 -9.120 0.566 1.00 0.00 H new ATOM 0 HB2 CYS A 550 2.281 -7.920 1.764 1.00 0.00 H new ATOM 0 HB3 CYS A 550 1.517 -8.473 3.241 1.00 0.00 H new ATOM 0 HG CYS A 550 2.718 -10.417 0.674 1.00 0.00 H new ATOM 655 N MET A 551 -1.602 -10.149 1.948 1.00 0.00 N ATOM 656 CA MET A 551 -2.733 -10.691 2.699 1.00 0.00 C ATOM 657 C MET A 551 -2.336 -11.363 4.016 1.00 0.00 C ATOM 658 O MET A 551 -3.203 -11.630 4.847 1.00 0.00 O ATOM 659 CB MET A 551 -3.596 -11.617 1.825 1.00 0.00 C ATOM 660 CG MET A 551 -2.825 -12.820 1.265 1.00 0.00 C ATOM 661 SD MET A 551 -3.830 -13.975 0.283 1.00 0.00 S ATOM 662 CE MET A 551 -4.278 -12.933 -1.136 1.00 0.00 C ATOM 0 H MET A 551 -1.438 -10.609 1.053 1.00 0.00 H new ATOM 0 HA MET A 551 -3.339 -9.831 2.984 1.00 0.00 H new ATOM 0 HB2 MET A 551 -4.440 -11.978 2.414 1.00 0.00 H new ATOM 0 HB3 MET A 551 -4.008 -11.042 0.996 1.00 0.00 H new ATOM 0 HG2 MET A 551 -2.007 -12.453 0.645 1.00 0.00 H new ATOM 0 HG3 MET A 551 -2.376 -13.365 2.095 1.00 0.00 H new ATOM 0 HE1 MET A 551 -4.758 -13.545 -1.900 1.00 0.00 H new ATOM 0 HE2 MET A 551 -4.966 -12.152 -0.811 1.00 0.00 H new ATOM 0 HE3 MET A 551 -3.379 -12.475 -1.550 1.00 0.00 H new ATOM 672 N ASP A 552 -1.043 -11.618 4.213 1.00 0.00 N ATOM 673 CA ASP A 552 -0.476 -12.120 5.456 1.00 0.00 C ATOM 674 C ASP A 552 -0.655 -11.147 6.623 1.00 0.00 C ATOM 675 O ASP A 552 -0.886 -11.603 7.749 1.00 0.00 O ATOM 676 CB ASP A 552 1.003 -12.422 5.213 1.00 0.00 C ATOM 677 CG ASP A 552 1.895 -12.357 6.447 1.00 0.00 C ATOM 678 OD1 ASP A 552 2.370 -11.253 6.781 1.00 0.00 O ATOM 679 OD2 ASP A 552 2.268 -13.438 6.950 1.00 0.00 O ATOM 0 H ASP A 552 -0.342 -11.475 3.486 1.00 0.00 H new ATOM 0 HA ASP A 552 -1.009 -13.026 5.745 1.00 0.00 H new ATOM 0 HB2 ASP A 552 1.086 -13.418 4.778 1.00 0.00 H new ATOM 0 HB3 ASP A 552 1.383 -11.718 4.473 1.00 0.00 H new ATOM 684 N VAL A 553 -0.592 -9.831 6.370 1.00 0.00 N ATOM 685 CA VAL A 553 -0.769 -8.832 7.414 1.00 0.00 C ATOM 686 C VAL A 553 -2.260 -8.657 7.689 1.00 0.00 C ATOM 687 O VAL A 553 -2.894 -7.666 7.312 1.00 0.00 O ATOM 688 CB VAL A 553 0.047 -7.553 7.166 1.00 0.00 C ATOM 689 CG1 VAL A 553 -0.176 -6.922 5.800 1.00 0.00 C ATOM 690 CG2 VAL A 553 0.017 -6.542 8.307 1.00 0.00 C ATOM 0 H VAL A 553 -0.418 -9.441 5.444 1.00 0.00 H new ATOM 0 HA VAL A 553 -0.334 -9.181 8.350 1.00 0.00 H new ATOM 0 HB VAL A 553 1.075 -7.916 7.149 1.00 0.00 H new ATOM 0 HG11 VAL A 553 0.437 -6.026 5.709 1.00 0.00 H new ATOM 0 HG12 VAL A 553 0.102 -7.632 5.021 1.00 0.00 H new ATOM 0 HG13 VAL A 553 -1.227 -6.655 5.690 1.00 0.00 H new ATOM 0 HG21 VAL A 553 0.620 -5.674 8.040 1.00 0.00 H new ATOM 0 HG22 VAL A 553 -1.011 -6.228 8.488 1.00 0.00 H new ATOM 0 HG23 VAL A 553 0.420 -7.000 9.210 1.00 0.00 H new ATOM 700 N ARG A 554 -2.833 -9.623 8.406 1.00 0.00 N ATOM 701 CA ARG A 554 -4.206 -9.563 8.898 1.00 0.00 C ATOM 702 C ARG A 554 -4.425 -8.298 9.744 1.00 0.00 C ATOM 703 O ARG A 554 -5.568 -7.869 9.889 1.00 0.00 O ATOM 704 CB ARG A 554 -4.540 -10.844 9.693 1.00 0.00 C ATOM 705 CG ARG A 554 -4.396 -12.177 8.926 1.00 0.00 C ATOM 706 CD ARG A 554 -5.431 -12.344 7.805 1.00 0.00 C ATOM 707 NE ARG A 554 -5.312 -13.650 7.132 1.00 0.00 N ATOM 708 CZ ARG A 554 -6.088 -14.121 6.148 1.00 0.00 C ATOM 709 NH1 ARG A 554 -7.024 -13.379 5.579 1.00 0.00 N ATOM 710 NH2 ARG A 554 -5.945 -15.377 5.751 1.00 0.00 N ATOM 0 H ARG A 554 -2.348 -10.482 8.665 1.00 0.00 H new ATOM 0 HA ARG A 554 -4.886 -9.507 8.048 1.00 0.00 H new ATOM 0 HB2 ARG A 554 -3.894 -10.881 10.570 1.00 0.00 H new ATOM 0 HB3 ARG A 554 -5.565 -10.766 10.055 1.00 0.00 H new ATOM 0 HG2 ARG A 554 -3.395 -12.237 8.499 1.00 0.00 H new ATOM 0 HG3 ARG A 554 -4.493 -13.005 9.628 1.00 0.00 H new ATOM 0 HD2 ARG A 554 -6.434 -12.240 8.219 1.00 0.00 H new ATOM 0 HD3 ARG A 554 -5.304 -11.546 7.073 1.00 0.00 H new ATOM 0 HE ARG A 554 -4.558 -14.260 7.450 1.00 0.00 H new ATOM 0 HH11 ARG A 554 -7.171 -12.418 5.888 1.00 0.00 H new ATOM 0 HH12 ARG A 554 -7.599 -13.768 4.831 1.00 0.00 H new ATOM 0 HH21 ARG A 554 -5.248 -15.976 6.194 1.00 0.00 H new ATOM 0 HH22 ARG A 554 -6.532 -15.745 5.002 1.00 0.00 H new ATOM 724 N ALA A 555 -3.366 -7.669 10.274 1.00 0.00 N ATOM 725 CA ALA A 555 -3.448 -6.385 10.963 1.00 0.00 C ATOM 726 C ALA A 555 -3.759 -5.205 10.030 1.00 0.00 C ATOM 727 O ALA A 555 -4.472 -4.280 10.436 1.00 0.00 O ATOM 728 CB ALA A 555 -2.150 -6.124 11.732 1.00 0.00 C ATOM 0 H ALA A 555 -2.420 -8.047 10.233 1.00 0.00 H new ATOM 0 HA ALA A 555 -4.288 -6.456 11.654 1.00 0.00 H new ATOM 0 HB1 ALA A 555 -2.217 -5.164 12.244 1.00 0.00 H new ATOM 0 HB2 ALA A 555 -1.996 -6.916 12.465 1.00 0.00 H new ATOM 0 HB3 ALA A 555 -1.312 -6.106 11.035 1.00 0.00 H new ATOM 734 N ILE A 556 -3.238 -5.178 8.800 1.00 0.00 N ATOM 735 CA ILE A 556 -3.652 -4.212 7.787 1.00 0.00 C ATOM 736 C ILE A 556 -5.048 -4.595 7.304 1.00 0.00 C ATOM 737 O ILE A 556 -5.932 -3.740 7.215 1.00 0.00 O ATOM 738 CB ILE A 556 -2.558 -4.206 6.695 1.00 0.00 C ATOM 739 CG1 ILE A 556 -1.453 -3.172 6.999 1.00 0.00 C ATOM 740 CG2 ILE A 556 -3.052 -3.946 5.263 1.00 0.00 C ATOM 741 CD1 ILE A 556 -1.001 -2.981 8.452 1.00 0.00 C ATOM 0 H ILE A 556 -2.518 -5.826 8.482 1.00 0.00 H new ATOM 0 HA ILE A 556 -3.738 -3.190 8.157 1.00 0.00 H new ATOM 0 HB ILE A 556 -2.175 -5.226 6.730 1.00 0.00 H new ATOM 0 HG12 ILE A 556 -0.575 -3.445 6.413 1.00 0.00 H new ATOM 0 HG13 ILE A 556 -1.795 -2.205 6.630 1.00 0.00 H new ATOM 0 HG21 ILE A 556 -2.205 -3.963 4.577 1.00 0.00 H new ATOM 0 HG22 ILE A 556 -3.765 -4.719 4.978 1.00 0.00 H new ATOM 0 HG23 ILE A 556 -3.537 -2.971 5.217 1.00 0.00 H new ATOM 0 HD11 ILE A 556 -0.221 -2.221 8.493 1.00 0.00 H new ATOM 0 HD12 ILE A 556 -1.849 -2.664 9.058 1.00 0.00 H new ATOM 0 HD13 ILE A 556 -0.611 -3.923 8.838 1.00 0.00 H new ATOM 753 N MET A 557 -5.260 -5.877 7.012 1.00 0.00 N ATOM 754 CA MET A 557 -6.432 -6.307 6.267 1.00 0.00 C ATOM 755 C MET A 557 -7.704 -6.115 7.092 1.00 0.00 C ATOM 756 O MET A 557 -8.696 -5.598 6.578 1.00 0.00 O ATOM 757 CB MET A 557 -6.250 -7.755 5.799 1.00 0.00 C ATOM 758 CG MET A 557 -5.005 -7.970 4.921 1.00 0.00 C ATOM 759 SD MET A 557 -5.364 -8.491 3.229 1.00 0.00 S ATOM 760 CE MET A 557 -6.326 -7.103 2.674 1.00 0.00 C ATOM 0 H MET A 557 -4.632 -6.634 7.282 1.00 0.00 H new ATOM 0 HA MET A 557 -6.542 -5.685 5.379 1.00 0.00 H new ATOM 0 HB2 MET A 557 -6.184 -8.404 6.672 1.00 0.00 H new ATOM 0 HB3 MET A 557 -7.135 -8.061 5.240 1.00 0.00 H new ATOM 0 HG2 MET A 557 -4.434 -7.042 4.889 1.00 0.00 H new ATOM 0 HG3 MET A 557 -4.369 -8.720 5.392 1.00 0.00 H new ATOM 0 HE1 MET A 557 -7.301 -7.450 2.332 1.00 0.00 H new ATOM 0 HE2 MET A 557 -6.459 -6.400 3.497 1.00 0.00 H new ATOM 0 HE3 MET A 557 -5.809 -6.607 1.853 1.00 0.00 H new ATOM 770 N ALA A 558 -7.666 -6.412 8.394 1.00 0.00 N ATOM 771 CA ALA A 558 -8.831 -6.232 9.257 1.00 0.00 C ATOM 772 C ALA A 558 -9.317 -4.774 9.293 1.00 0.00 C ATOM 773 O ALA A 558 -10.486 -4.540 9.606 1.00 0.00 O ATOM 774 CB ALA A 558 -8.510 -6.729 10.668 1.00 0.00 C ATOM 0 H ALA A 558 -6.841 -6.777 8.871 1.00 0.00 H new ATOM 0 HA ALA A 558 -9.646 -6.822 8.838 1.00 0.00 H new ATOM 0 HB1 ALA A 558 -9.381 -6.593 11.309 1.00 0.00 H new ATOM 0 HB2 ALA A 558 -8.249 -7.787 10.631 1.00 0.00 H new ATOM 0 HB3 ALA A 558 -7.671 -6.162 11.071 1.00 0.00 H new ATOM 780 N THR A 559 -8.468 -3.796 8.967 1.00 0.00 N ATOM 781 CA THR A 559 -8.866 -2.399 8.857 1.00 0.00 C ATOM 782 C THR A 559 -9.589 -2.164 7.528 1.00 0.00 C ATOM 783 O THR A 559 -10.643 -1.518 7.513 1.00 0.00 O ATOM 784 CB THR A 559 -7.616 -1.510 8.983 1.00 0.00 C ATOM 785 OG1 THR A 559 -6.913 -1.864 10.157 1.00 0.00 O ATOM 786 CG2 THR A 559 -8.002 -0.029 9.041 1.00 0.00 C ATOM 0 H THR A 559 -7.480 -3.957 8.772 1.00 0.00 H new ATOM 0 HA THR A 559 -9.558 -2.142 9.659 1.00 0.00 H new ATOM 0 HB THR A 559 -6.985 -1.665 8.108 1.00 0.00 H new ATOM 0 HG1 THR A 559 -6.114 -1.302 10.242 1.00 0.00 H new ATOM 0 HG21 THR A 559 -7.101 0.579 9.130 1.00 0.00 H new ATOM 0 HG22 THR A 559 -8.535 0.244 8.130 1.00 0.00 H new ATOM 0 HG23 THR A 559 -8.644 0.146 9.904 1.00 0.00 H new ATOM 794 N ILE A 560 -9.023 -2.663 6.422 1.00 0.00 N ATOM 795 CA ILE A 560 -9.561 -2.526 5.073 1.00 0.00 C ATOM 796 C ILE A 560 -10.937 -3.188 5.054 1.00 0.00 C ATOM 797 O ILE A 560 -11.941 -2.486 4.985 1.00 0.00 O ATOM 798 CB ILE A 560 -8.582 -3.092 4.015 1.00 0.00 C ATOM 799 CG1 ILE A 560 -7.201 -2.398 4.075 1.00 0.00 C ATOM 800 CG2 ILE A 560 -9.185 -2.942 2.604 1.00 0.00 C ATOM 801 CD1 ILE A 560 -6.152 -3.086 3.191 1.00 0.00 C ATOM 0 H ILE A 560 -8.150 -3.189 6.448 1.00 0.00 H new ATOM 0 HA ILE A 560 -9.678 -1.476 4.804 1.00 0.00 H new ATOM 0 HB ILE A 560 -8.431 -4.148 4.239 1.00 0.00 H new ATOM 0 HG12 ILE A 560 -7.308 -1.359 3.763 1.00 0.00 H new ATOM 0 HG13 ILE A 560 -6.849 -2.387 5.107 1.00 0.00 H new ATOM 0 HG21 ILE A 560 -8.489 -3.343 1.867 1.00 0.00 H new ATOM 0 HG22 ILE A 560 -10.126 -3.490 2.550 1.00 0.00 H new ATOM 0 HG23 ILE A 560 -9.366 -1.888 2.396 1.00 0.00 H new ATOM 0 HD11 ILE A 560 -5.203 -2.556 3.273 1.00 0.00 H new ATOM 0 HD12 ILE A 560 -6.021 -4.118 3.518 1.00 0.00 H new ATOM 0 HD13 ILE A 560 -6.486 -3.074 2.154 1.00 0.00 H new ATOM 813 N GLN A 561 -11.015 -4.515 5.135 1.00 0.00 N ATOM 814 CA GLN A 561 -12.238 -5.277 4.943 1.00 0.00 C ATOM 815 C GLN A 561 -13.372 -4.754 5.850 1.00 0.00 C ATOM 816 O GLN A 561 -14.531 -4.746 5.441 1.00 0.00 O ATOM 817 CB GLN A 561 -11.910 -6.737 5.279 1.00 0.00 C ATOM 818 CG GLN A 561 -11.193 -7.475 4.142 1.00 0.00 C ATOM 819 CD GLN A 561 -10.051 -6.707 3.485 1.00 0.00 C ATOM 820 OE1 GLN A 561 -8.959 -6.627 4.008 1.00 0.00 O ATOM 821 NE2 GLN A 561 -10.262 -6.081 2.340 1.00 0.00 N ATOM 0 H GLN A 561 -10.206 -5.101 5.342 1.00 0.00 H new ATOM 0 HA GLN A 561 -12.589 -5.180 3.916 1.00 0.00 H new ATOM 0 HB2 GLN A 561 -11.286 -6.766 6.172 1.00 0.00 H new ATOM 0 HB3 GLN A 561 -12.834 -7.264 5.519 1.00 0.00 H new ATOM 0 HG2 GLN A 561 -10.801 -8.414 4.531 1.00 0.00 H new ATOM 0 HG3 GLN A 561 -11.926 -7.729 3.376 1.00 0.00 H new ATOM 0 HE21 GLN A 561 -11.175 -6.139 1.888 1.00 0.00 H new ATOM 0 HE22 GLN A 561 -9.512 -5.540 1.909 1.00 0.00 H new ATOM 830 N ARG A 562 -13.064 -4.263 7.066 1.00 0.00 N ATOM 831 CA ARG A 562 -14.059 -3.685 7.961 1.00 0.00 C ATOM 832 C ARG A 562 -14.673 -2.415 7.389 1.00 0.00 C ATOM 833 O ARG A 562 -15.883 -2.225 7.546 1.00 0.00 O ATOM 834 CB ARG A 562 -13.396 -3.419 9.317 1.00 0.00 C ATOM 835 CG ARG A 562 -14.359 -2.709 10.265 1.00 0.00 C ATOM 836 CD ARG A 562 -13.792 -2.608 11.671 1.00 0.00 C ATOM 837 NE ARG A 562 -14.772 -1.973 12.574 1.00 0.00 N ATOM 838 CZ ARG A 562 -15.135 -0.683 12.562 1.00 0.00 C ATOM 839 NH1 ARG A 562 -14.338 0.234 12.025 1.00 0.00 N ATOM 840 NH2 ARG A 562 -16.309 -0.344 13.076 1.00 0.00 N ATOM 0 H ARG A 562 -12.117 -4.260 7.446 1.00 0.00 H new ATOM 0 HA ARG A 562 -14.881 -4.391 8.082 1.00 0.00 H new ATOM 0 HB2 ARG A 562 -13.073 -4.361 9.759 1.00 0.00 H new ATOM 0 HB3 ARG A 562 -12.503 -2.810 9.176 1.00 0.00 H new ATOM 0 HG2 ARG A 562 -14.572 -1.709 9.886 1.00 0.00 H new ATOM 0 HG3 ARG A 562 -15.306 -3.248 10.292 1.00 0.00 H new ATOM 0 HD2 ARG A 562 -13.538 -3.602 12.040 1.00 0.00 H new ATOM 0 HD3 ARG A 562 -12.870 -2.027 11.658 1.00 0.00 H new ATOM 0 HE ARG A 562 -15.214 -2.572 13.272 1.00 0.00 H new ATOM 0 HH11 ARG A 562 -13.444 -0.042 11.619 1.00 0.00 H new ATOM 0 HH12 ARG A 562 -14.620 1.214 12.019 1.00 0.00 H new ATOM 0 HH21 ARG A 562 -16.918 -1.060 13.471 1.00 0.00 H new ATOM 0 HH22 ARG A 562 -16.603 0.633 13.076 1.00 0.00 H new ATOM 854 N LYS A 563 -13.840 -1.531 6.826 1.00 0.00 N ATOM 855 CA LYS A 563 -14.258 -0.267 6.233 1.00 0.00 C ATOM 856 C LYS A 563 -15.251 -0.569 5.120 1.00 0.00 C ATOM 857 O LYS A 563 -16.405 -0.156 5.174 1.00 0.00 O ATOM 858 CB LYS A 563 -13.029 0.492 5.681 1.00 0.00 C ATOM 859 CG LYS A 563 -13.359 1.941 5.266 1.00 0.00 C ATOM 860 CD LYS A 563 -12.440 3.020 5.867 1.00 0.00 C ATOM 861 CE LYS A 563 -11.529 3.696 4.838 1.00 0.00 C ATOM 862 NZ LYS A 563 -10.959 4.948 5.374 1.00 0.00 N ATOM 0 H LYS A 563 -12.833 -1.684 6.772 1.00 0.00 H new ATOM 0 HA LYS A 563 -14.731 0.366 6.984 1.00 0.00 H new ATOM 0 HB2 LYS A 563 -12.245 0.505 6.438 1.00 0.00 H new ATOM 0 HB3 LYS A 563 -12.632 -0.046 4.820 1.00 0.00 H new ATOM 0 HG2 LYS A 563 -13.312 2.010 4.179 1.00 0.00 H new ATOM 0 HG3 LYS A 563 -14.387 2.160 5.555 1.00 0.00 H new ATOM 0 HD2 LYS A 563 -13.054 3.780 6.350 1.00 0.00 H new ATOM 0 HD3 LYS A 563 -11.823 2.568 6.644 1.00 0.00 H new ATOM 0 HE2 LYS A 563 -10.724 3.017 4.559 1.00 0.00 H new ATOM 0 HE3 LYS A 563 -12.095 3.909 3.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 563 -10.346 5.385 4.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 563 -11.729 5.603 5.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 563 -10.400 4.738 6.226 1.00 0.00 H new ATOM 876 N TYR A 564 -14.773 -1.296 4.117 1.00 0.00 N ATOM 877 CA TYR A 564 -15.447 -1.483 2.846 1.00 0.00 C ATOM 878 C TYR A 564 -16.350 -2.714 2.983 1.00 0.00 C ATOM 879 O TYR A 564 -16.030 -3.790 2.474 1.00 0.00 O ATOM 880 CB TYR A 564 -14.390 -1.561 1.736 1.00 0.00 C ATOM 881 CG TYR A 564 -13.371 -0.422 1.714 1.00 0.00 C ATOM 882 CD1 TYR A 564 -13.629 0.768 1.004 1.00 0.00 C ATOM 883 CD2 TYR A 564 -12.138 -0.560 2.382 1.00 0.00 C ATOM 884 CE1 TYR A 564 -12.668 1.800 0.947 1.00 0.00 C ATOM 885 CE2 TYR A 564 -11.185 0.464 2.350 1.00 0.00 C ATOM 886 CZ TYR A 564 -11.445 1.650 1.640 1.00 0.00 C ATOM 887 OH TYR A 564 -10.498 2.621 1.695 1.00 0.00 O ATOM 0 H TYR A 564 -13.879 -1.784 4.171 1.00 0.00 H new ATOM 0 HA TYR A 564 -16.094 -0.651 2.568 1.00 0.00 H new ATOM 0 HB2 TYR A 564 -13.852 -2.504 1.836 1.00 0.00 H new ATOM 0 HB3 TYR A 564 -14.901 -1.586 0.773 1.00 0.00 H new ATOM 0 HD1 TYR A 564 -14.575 0.892 0.497 1.00 0.00 H new ATOM 0 HD2 TYR A 564 -11.926 -1.468 2.926 1.00 0.00 H new ATOM 0 HE1 TYR A 564 -12.865 2.697 0.379 1.00 0.00 H new ATOM 0 HE2 TYR A 564 -10.247 0.343 2.872 1.00 0.00 H new ATOM 0 HH TYR A 564 -10.928 3.500 1.642 1.00 0.00 H new ATOM 897 N LYS A 565 -17.418 -2.591 3.786 1.00 0.00 N ATOM 898 CA LYS A 565 -18.165 -3.726 4.300 1.00 0.00 C ATOM 899 C LYS A 565 -18.623 -4.627 3.164 1.00 0.00 C ATOM 900 O LYS A 565 -19.039 -4.155 2.106 1.00 0.00 O ATOM 901 CB LYS A 565 -19.292 -3.259 5.237 1.00 0.00 C ATOM 902 CG LYS A 565 -20.615 -3.007 4.505 1.00 0.00 C ATOM 903 CD LYS A 565 -21.779 -2.608 5.426 1.00 0.00 C ATOM 904 CE LYS A 565 -22.231 -3.739 6.364 1.00 0.00 C ATOM 905 NZ LYS A 565 -23.073 -4.756 5.694 1.00 0.00 N ATOM 0 H LYS A 565 -17.782 -1.689 4.093 1.00 0.00 H new ATOM 0 HA LYS A 565 -17.513 -4.344 4.917 1.00 0.00 H new ATOM 0 HB2 LYS A 565 -19.449 -4.011 6.010 1.00 0.00 H new ATOM 0 HB3 LYS A 565 -18.982 -2.343 5.741 1.00 0.00 H new ATOM 0 HG2 LYS A 565 -20.464 -2.219 3.767 1.00 0.00 H new ATOM 0 HG3 LYS A 565 -20.892 -3.908 3.958 1.00 0.00 H new ATOM 0 HD2 LYS A 565 -21.480 -1.747 6.024 1.00 0.00 H new ATOM 0 HD3 LYS A 565 -22.625 -2.293 4.815 1.00 0.00 H new ATOM 0 HE2 LYS A 565 -21.351 -4.226 6.784 1.00 0.00 H new ATOM 0 HE3 LYS A 565 -22.787 -3.310 7.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 565 -23.344 -5.489 6.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 565 -23.929 -4.303 5.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 565 -22.538 -5.191 4.915 1.00 0.00 H new ATOM 919 N GLY A 566 -18.636 -5.928 3.418 1.00 0.00 N ATOM 920 CA GLY A 566 -19.105 -6.915 2.467 1.00 0.00 C ATOM 921 C GLY A 566 -17.943 -7.680 1.859 1.00 0.00 C ATOM 922 O GLY A 566 -18.036 -8.895 1.681 1.00 0.00 O ATOM 0 H GLY A 566 -18.317 -6.328 4.300 1.00 0.00 H new ATOM 0 HA2 GLY A 566 -19.783 -7.610 2.963 1.00 0.00 H new ATOM 0 HA3 GLY A 566 -19.674 -6.423 1.678 1.00 0.00 H new ATOM 926 N ILE A 567 -16.840 -6.985 1.579 1.00 0.00 N ATOM 927 CA ILE A 567 -15.645 -7.570 0.998 1.00 0.00 C ATOM 928 C ILE A 567 -15.055 -8.621 1.965 1.00 0.00 C ATOM 929 O ILE A 567 -15.124 -8.435 3.186 1.00 0.00 O ATOM 930 CB ILE A 567 -14.685 -6.408 0.672 1.00 0.00 C ATOM 931 CG1 ILE A 567 -13.709 -6.799 -0.435 1.00 0.00 C ATOM 932 CG2 ILE A 567 -13.885 -5.936 1.885 1.00 0.00 C ATOM 933 CD1 ILE A 567 -12.480 -5.875 -0.509 1.00 0.00 C ATOM 0 H ILE A 567 -16.757 -5.984 1.755 1.00 0.00 H new ATOM 0 HA ILE A 567 -15.851 -8.110 0.074 1.00 0.00 H new ATOM 0 HB ILE A 567 -15.320 -5.585 0.343 1.00 0.00 H new ATOM 0 HG12 ILE A 567 -13.376 -7.824 -0.273 1.00 0.00 H new ATOM 0 HG13 ILE A 567 -14.229 -6.780 -1.393 1.00 0.00 H new ATOM 0 HG21 ILE A 567 -13.228 -5.117 1.591 1.00 0.00 H new ATOM 0 HG22 ILE A 567 -14.569 -5.592 2.661 1.00 0.00 H new ATOM 0 HG23 ILE A 567 -13.286 -6.762 2.270 1.00 0.00 H new ATOM 0 HD11 ILE A 567 -11.825 -6.205 -1.315 1.00 0.00 H new ATOM 0 HD12 ILE A 567 -12.805 -4.852 -0.701 1.00 0.00 H new ATOM 0 HD13 ILE A 567 -11.939 -5.912 0.437 1.00 0.00 H new ATOM 945 N LYS A 568 -14.444 -9.700 1.459 1.00 0.00 N ATOM 946 CA LYS A 568 -13.899 -10.783 2.293 1.00 0.00 C ATOM 947 C LYS A 568 -12.669 -11.455 1.657 1.00 0.00 C ATOM 948 O LYS A 568 -12.621 -12.676 1.534 1.00 0.00 O ATOM 949 CB LYS A 568 -15.020 -11.794 2.603 1.00 0.00 C ATOM 950 CG LYS A 568 -14.731 -12.592 3.886 1.00 0.00 C ATOM 951 CD LYS A 568 -15.562 -13.878 3.957 1.00 0.00 C ATOM 952 CE LYS A 568 -14.897 -15.004 3.156 1.00 0.00 C ATOM 953 NZ LYS A 568 -15.750 -16.209 3.063 1.00 0.00 N ATOM 0 H LYS A 568 -14.313 -9.848 0.458 1.00 0.00 H new ATOM 0 HA LYS A 568 -13.540 -10.354 3.229 1.00 0.00 H new ATOM 0 HB2 LYS A 568 -15.967 -11.265 2.710 1.00 0.00 H new ATOM 0 HB3 LYS A 568 -15.131 -12.482 1.765 1.00 0.00 H new ATOM 0 HG2 LYS A 568 -13.671 -12.842 3.927 1.00 0.00 H new ATOM 0 HG3 LYS A 568 -14.947 -11.972 4.756 1.00 0.00 H new ATOM 0 HD2 LYS A 568 -15.677 -14.185 4.997 1.00 0.00 H new ATOM 0 HD3 LYS A 568 -16.563 -13.691 3.567 1.00 0.00 H new ATOM 0 HE2 LYS A 568 -14.668 -14.646 2.152 1.00 0.00 H new ATOM 0 HE3 LYS A 568 -13.949 -15.268 3.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 568 -15.258 -16.941 2.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 568 -15.948 -16.569 4.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 568 -16.645 -15.965 2.592 1.00 0.00 H new ATOM 967 N ILE A 569 -11.666 -10.645 1.312 1.00 0.00 N ATOM 968 CA ILE A 569 -10.397 -10.966 0.652 1.00 0.00 C ATOM 969 C ILE A 569 -10.563 -11.650 -0.721 1.00 0.00 C ATOM 970 O ILE A 569 -11.413 -12.512 -0.927 1.00 0.00 O ATOM 971 CB ILE A 569 -9.450 -11.722 1.602 1.00 0.00 C ATOM 972 CG1 ILE A 569 -9.356 -11.143 3.032 1.00 0.00 C ATOM 973 CG2 ILE A 569 -8.045 -11.741 0.975 1.00 0.00 C ATOM 974 CD1 ILE A 569 -8.788 -9.722 3.081 1.00 0.00 C ATOM 0 H ILE A 569 -11.728 -9.646 1.508 1.00 0.00 H new ATOM 0 HA ILE A 569 -9.921 -10.014 0.416 1.00 0.00 H new ATOM 0 HB ILE A 569 -9.870 -12.721 1.718 1.00 0.00 H new ATOM 0 HG12 ILE A 569 -10.349 -11.144 3.482 1.00 0.00 H new ATOM 0 HG13 ILE A 569 -8.730 -11.797 3.639 1.00 0.00 H new ATOM 0 HG21 ILE A 569 -7.359 -12.273 1.635 1.00 0.00 H new ATOM 0 HG22 ILE A 569 -8.084 -12.245 0.009 1.00 0.00 H new ATOM 0 HG23 ILE A 569 -7.695 -10.718 0.836 1.00 0.00 H new ATOM 0 HD11 ILE A 569 -8.751 -9.380 4.115 1.00 0.00 H new ATOM 0 HD12 ILE A 569 -7.782 -9.718 2.661 1.00 0.00 H new ATOM 0 HD13 ILE A 569 -9.426 -9.055 2.501 1.00 0.00 H new ATOM 986 N GLN A 570 -9.778 -11.204 -1.707 1.00 0.00 N ATOM 987 CA GLN A 570 -9.877 -11.605 -3.101 1.00 0.00 C ATOM 988 C GLN A 570 -8.513 -11.312 -3.713 1.00 0.00 C ATOM 989 O GLN A 570 -8.044 -10.179 -3.674 1.00 0.00 O ATOM 990 CB GLN A 570 -11.019 -10.862 -3.828 1.00 0.00 C ATOM 991 CG GLN A 570 -11.216 -9.381 -3.456 1.00 0.00 C ATOM 992 CD GLN A 570 -11.863 -9.207 -2.083 1.00 0.00 C ATOM 993 OE1 GLN A 570 -11.233 -8.515 -1.136 1.00 0.00 O flip ATOM 994 NE2 GLN A 570 -12.929 -9.745 -1.802 1.00 0.00 N flip ATOM 0 H GLN A 570 -9.031 -10.529 -1.543 1.00 0.00 H new ATOM 0 HA GLN A 570 -10.126 -12.662 -3.197 1.00 0.00 H new ATOM 0 HB2 GLN A 570 -10.838 -10.924 -4.901 1.00 0.00 H new ATOM 0 HB3 GLN A 570 -11.951 -11.391 -3.631 1.00 0.00 H new ATOM 0 HG2 GLN A 570 -10.251 -8.875 -3.467 1.00 0.00 H new ATOM 0 HG3 GLN A 570 -11.837 -8.899 -4.211 1.00 0.00 H new ATOM 0 HE21 GLN A 570 -13.432 -10.281 -2.509 1.00 0.00 H new ATOM 0 HE22 GLN A 570 -13.313 -9.656 -0.861 1.00 0.00 H new ATOM 1003 N GLU A 571 -7.838 -12.358 -4.159 1.00 0.00 N ATOM 1004 CA GLU A 571 -6.532 -12.309 -4.786 1.00 0.00 C ATOM 1005 C GLU A 571 -6.677 -11.683 -6.177 1.00 0.00 C ATOM 1006 O GLU A 571 -7.768 -11.688 -6.763 1.00 0.00 O ATOM 1007 CB GLU A 571 -6.042 -13.758 -4.884 1.00 0.00 C ATOM 1008 CG GLU A 571 -4.539 -13.939 -5.107 1.00 0.00 C ATOM 1009 CD GLU A 571 -4.226 -15.344 -5.624 1.00 0.00 C ATOM 1010 OE1 GLU A 571 -4.904 -16.315 -5.210 1.00 0.00 O ATOM 1011 OE2 GLU A 571 -3.326 -15.453 -6.487 1.00 0.00 O ATOM 0 H GLU A 571 -8.204 -13.307 -4.090 1.00 0.00 H new ATOM 0 HA GLU A 571 -5.821 -11.709 -4.219 1.00 0.00 H new ATOM 0 HB2 GLU A 571 -6.319 -14.278 -3.967 1.00 0.00 H new ATOM 0 HB3 GLU A 571 -6.573 -14.247 -5.701 1.00 0.00 H new ATOM 0 HG2 GLU A 571 -4.182 -13.197 -5.821 1.00 0.00 H new ATOM 0 HG3 GLU A 571 -4.006 -13.764 -4.173 1.00 0.00 H new ATOM 1018 N GLY A 572 -5.568 -11.228 -6.753 1.00 0.00 N ATOM 1019 CA GLY A 572 -5.584 -10.446 -7.979 1.00 0.00 C ATOM 1020 C GLY A 572 -5.636 -8.979 -7.634 1.00 0.00 C ATOM 1021 O GLY A 572 -5.211 -8.545 -6.556 1.00 0.00 O ATOM 0 H GLY A 572 -4.633 -11.393 -6.380 1.00 0.00 H new ATOM 0 HA2 GLY A 572 -4.695 -10.660 -8.572 1.00 0.00 H new ATOM 0 HA3 GLY A 572 -6.447 -10.719 -8.587 1.00 0.00 H new ATOM 1025 N ILE A 573 -6.041 -8.195 -8.618 1.00 0.00 N ATOM 1026 CA ILE A 573 -6.374 -6.803 -8.440 1.00 0.00 C ATOM 1027 C ILE A 573 -7.725 -6.769 -7.736 1.00 0.00 C ATOM 1028 O ILE A 573 -8.673 -7.404 -8.196 1.00 0.00 O ATOM 1029 CB ILE A 573 -6.387 -6.163 -9.836 1.00 0.00 C ATOM 1030 CG1 ILE A 573 -4.969 -6.281 -10.438 1.00 0.00 C ATOM 1031 CG2 ILE A 573 -6.895 -4.711 -9.786 1.00 0.00 C ATOM 1032 CD1 ILE A 573 -4.750 -5.498 -11.732 1.00 0.00 C ATOM 0 H ILE A 573 -6.148 -8.520 -9.579 1.00 0.00 H new ATOM 0 HA ILE A 573 -5.665 -6.242 -7.831 1.00 0.00 H new ATOM 0 HB ILE A 573 -7.087 -6.691 -10.484 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -4.246 -5.939 -9.697 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -4.757 -7.333 -10.627 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -6.891 -4.289 -10.791 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -7.910 -4.694 -9.390 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -6.244 -4.120 -9.142 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -3.726 -5.643 -12.076 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -5.443 -5.854 -12.494 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -4.924 -4.438 -11.550 1.00 0.00 H new ATOM 1044 N VAL A 574 -7.834 -6.003 -6.658 1.00 0.00 N ATOM 1045 CA VAL A 574 -9.076 -5.814 -5.929 1.00 0.00 C ATOM 1046 C VAL A 574 -9.425 -4.353 -5.956 1.00 0.00 C ATOM 1047 O VAL A 574 -9.004 -3.554 -5.134 1.00 0.00 O ATOM 1048 CB VAL A 574 -9.083 -6.502 -4.570 1.00 0.00 C ATOM 1049 CG1 VAL A 574 -7.853 -6.406 -3.714 1.00 0.00 C ATOM 1050 CG2 VAL A 574 -10.321 -6.178 -3.724 1.00 0.00 C ATOM 0 H VAL A 574 -7.048 -5.488 -6.261 1.00 0.00 H new ATOM 0 HA VAL A 574 -9.897 -6.333 -6.424 1.00 0.00 H new ATOM 0 HB VAL A 574 -9.107 -7.541 -4.898 1.00 0.00 H new ATOM 0 HG11 VAL A 574 -8.016 -6.946 -2.781 1.00 0.00 H new ATOM 0 HG12 VAL A 574 -7.006 -6.843 -4.243 1.00 0.00 H new ATOM 0 HG13 VAL A 574 -7.643 -5.359 -3.495 1.00 0.00 H new ATOM 0 HG21 VAL A 574 -10.258 -6.702 -2.771 1.00 0.00 H new ATOM 0 HG22 VAL A 574 -10.368 -5.104 -3.545 1.00 0.00 H new ATOM 0 HG23 VAL A 574 -11.218 -6.497 -4.255 1.00 0.00 H new ATOM 1060 N ASP A 575 -10.172 -4.053 -6.995 1.00 0.00 N ATOM 1061 CA ASP A 575 -10.964 -2.863 -7.228 1.00 0.00 C ATOM 1062 C ASP A 575 -12.185 -2.936 -6.310 1.00 0.00 C ATOM 1063 O ASP A 575 -13.222 -3.488 -6.690 1.00 0.00 O ATOM 1064 CB ASP A 575 -11.321 -2.866 -8.719 1.00 0.00 C ATOM 1065 CG ASP A 575 -12.058 -1.630 -9.225 1.00 0.00 C ATOM 1066 OD1 ASP A 575 -12.214 -0.644 -8.467 1.00 0.00 O ATOM 1067 OD2 ASP A 575 -12.400 -1.623 -10.434 1.00 0.00 O ATOM 0 H ASP A 575 -10.248 -4.702 -7.778 1.00 0.00 H new ATOM 0 HA ASP A 575 -10.446 -1.931 -7.002 1.00 0.00 H new ATOM 0 HB2 ASP A 575 -10.402 -2.979 -9.294 1.00 0.00 H new ATOM 0 HB3 ASP A 575 -11.935 -3.742 -8.925 1.00 0.00 H new ATOM 1072 N TYR A 576 -12.019 -2.500 -5.060 1.00 0.00 N ATOM 1073 CA TYR A 576 -13.082 -2.461 -4.057 1.00 0.00 C ATOM 1074 C TYR A 576 -12.827 -1.289 -3.108 1.00 0.00 C ATOM 1075 O TYR A 576 -12.103 -1.430 -2.118 1.00 0.00 O ATOM 1076 CB TYR A 576 -13.206 -3.801 -3.302 1.00 0.00 C ATOM 1077 CG TYR A 576 -14.569 -4.019 -2.663 1.00 0.00 C ATOM 1078 CD1 TYR A 576 -14.996 -3.213 -1.588 1.00 0.00 C ATOM 1079 CD2 TYR A 576 -15.396 -5.068 -3.112 1.00 0.00 C ATOM 1080 CE1 TYR A 576 -16.246 -3.435 -0.990 1.00 0.00 C ATOM 1081 CE2 TYR A 576 -16.637 -5.313 -2.499 1.00 0.00 C ATOM 1082 CZ TYR A 576 -17.074 -4.484 -1.443 1.00 0.00 C ATOM 1083 OH TYR A 576 -18.279 -4.699 -0.852 1.00 0.00 O ATOM 0 H TYR A 576 -11.124 -2.158 -4.711 1.00 0.00 H new ATOM 0 HA TYR A 576 -14.039 -2.309 -4.556 1.00 0.00 H new ATOM 0 HB2 TYR A 576 -13.004 -4.618 -3.995 1.00 0.00 H new ATOM 0 HB3 TYR A 576 -12.440 -3.844 -2.527 1.00 0.00 H new ATOM 0 HD1 TYR A 576 -14.358 -2.421 -1.223 1.00 0.00 H new ATOM 0 HD2 TYR A 576 -15.073 -5.689 -3.934 1.00 0.00 H new ATOM 0 HE1 TYR A 576 -16.575 -2.801 -0.180 1.00 0.00 H new ATOM 0 HE2 TYR A 576 -17.254 -6.133 -2.835 1.00 0.00 H new ATOM 0 HH TYR A 576 -18.236 -4.426 0.088 1.00 0.00 H new ATOM 1093 N GLY A 577 -13.408 -0.123 -3.396 1.00 0.00 N ATOM 1094 CA GLY A 577 -13.264 1.094 -2.596 1.00 0.00 C ATOM 1095 C GLY A 577 -11.933 1.800 -2.846 1.00 0.00 C ATOM 1096 O GLY A 577 -11.893 3.013 -3.028 1.00 0.00 O ATOM 0 H GLY A 577 -14.006 0.004 -4.212 1.00 0.00 H new ATOM 0 HA2 GLY A 577 -14.083 1.776 -2.826 1.00 0.00 H new ATOM 0 HA3 GLY A 577 -13.346 0.842 -1.539 1.00 0.00 H new ATOM 1100 N VAL A 578 -10.843 1.041 -2.895 1.00 0.00 N ATOM 1101 CA VAL A 578 -9.550 1.425 -3.431 1.00 0.00 C ATOM 1102 C VAL A 578 -9.167 0.266 -4.353 1.00 0.00 C ATOM 1103 O VAL A 578 -9.672 -0.850 -4.189 1.00 0.00 O ATOM 1104 CB VAL A 578 -8.579 1.676 -2.251 1.00 0.00 C ATOM 1105 CG1 VAL A 578 -7.100 1.727 -2.653 1.00 0.00 C ATOM 1106 CG2 VAL A 578 -8.926 2.978 -1.510 1.00 0.00 C ATOM 0 H VAL A 578 -10.843 0.085 -2.539 1.00 0.00 H new ATOM 0 HA VAL A 578 -9.535 2.354 -4.002 1.00 0.00 H new ATOM 0 HB VAL A 578 -8.713 0.813 -1.599 1.00 0.00 H new ATOM 0 HG11 VAL A 578 -6.489 1.906 -1.769 1.00 0.00 H new ATOM 0 HG12 VAL A 578 -6.813 0.778 -3.106 1.00 0.00 H new ATOM 0 HG13 VAL A 578 -6.946 2.533 -3.370 1.00 0.00 H new ATOM 0 HG21 VAL A 578 -8.226 3.126 -0.687 1.00 0.00 H new ATOM 0 HG22 VAL A 578 -8.857 3.819 -2.200 1.00 0.00 H new ATOM 0 HG23 VAL A 578 -9.940 2.913 -1.116 1.00 0.00 H new ATOM 1116 N ARG A 579 -8.299 0.516 -5.337 1.00 0.00 N ATOM 1117 CA ARG A 579 -7.731 -0.545 -6.151 1.00 0.00 C ATOM 1118 C ARG A 579 -6.504 -1.055 -5.417 1.00 0.00 C ATOM 1119 O ARG A 579 -5.532 -0.305 -5.278 1.00 0.00 O ATOM 1120 CB ARG A 579 -7.402 -0.040 -7.565 1.00 0.00 C ATOM 1121 CG ARG A 579 -7.613 -1.161 -8.593 1.00 0.00 C ATOM 1122 CD ARG A 579 -7.099 -0.740 -9.975 1.00 0.00 C ATOM 1123 NE ARG A 579 -7.528 -1.637 -11.057 1.00 0.00 N ATOM 1124 CZ ARG A 579 -8.761 -1.772 -11.554 1.00 0.00 C ATOM 1125 NH1 ARG A 579 -9.741 -0.960 -11.169 1.00 0.00 N ATOM 1126 NH2 ARG A 579 -8.990 -2.733 -12.439 1.00 0.00 N ATOM 0 H ARG A 579 -7.977 1.452 -5.585 1.00 0.00 H new ATOM 0 HA ARG A 579 -8.442 -1.359 -6.291 1.00 0.00 H new ATOM 0 HB2 ARG A 579 -8.035 0.812 -7.811 1.00 0.00 H new ATOM 0 HB3 ARG A 579 -6.370 0.308 -7.603 1.00 0.00 H new ATOM 0 HG2 ARG A 579 -7.094 -2.062 -8.266 1.00 0.00 H new ATOM 0 HG3 ARG A 579 -8.673 -1.409 -8.655 1.00 0.00 H new ATOM 0 HD2 ARG A 579 -7.447 0.270 -10.191 1.00 0.00 H new ATOM 0 HD3 ARG A 579 -6.010 -0.704 -9.954 1.00 0.00 H new ATOM 0 HE ARG A 579 -6.804 -2.222 -11.475 1.00 0.00 H new ATOM 0 HH11 ARG A 579 -9.556 -0.224 -10.487 1.00 0.00 H new ATOM 0 HH12 ARG A 579 -10.678 -1.073 -11.555 1.00 0.00 H new ATOM 0 HH21 ARG A 579 -8.232 -3.352 -12.728 1.00 0.00 H new ATOM 0 HH22 ARG A 579 -9.924 -2.853 -12.831 1.00 0.00 H new ATOM 1140 N PHE A 580 -6.526 -2.295 -4.939 1.00 0.00 N ATOM 1141 CA PHE A 580 -5.363 -2.913 -4.352 1.00 0.00 C ATOM 1142 C PHE A 580 -4.828 -3.983 -5.295 1.00 0.00 C ATOM 1143 O PHE A 580 -5.492 -4.363 -6.260 1.00 0.00 O ATOM 1144 CB PHE A 580 -5.731 -3.531 -3.009 1.00 0.00 C ATOM 1145 CG PHE A 580 -6.462 -2.653 -2.016 1.00 0.00 C ATOM 1146 CD1 PHE A 580 -5.724 -1.847 -1.132 1.00 0.00 C ATOM 1147 CD2 PHE A 580 -7.868 -2.681 -1.934 1.00 0.00 C ATOM 1148 CE1 PHE A 580 -6.363 -1.112 -0.124 1.00 0.00 C ATOM 1149 CE2 PHE A 580 -8.514 -1.898 -0.958 1.00 0.00 C ATOM 1150 CZ PHE A 580 -7.765 -1.133 -0.039 1.00 0.00 C ATOM 0 H PHE A 580 -7.354 -2.891 -4.952 1.00 0.00 H new ATOM 0 HA PHE A 580 -4.591 -2.160 -4.192 1.00 0.00 H new ATOM 0 HB2 PHE A 580 -6.348 -4.409 -3.200 1.00 0.00 H new ATOM 0 HB3 PHE A 580 -4.813 -3.882 -2.537 1.00 0.00 H new ATOM 0 HD1 PHE A 580 -4.650 -1.793 -1.231 1.00 0.00 H new ATOM 0 HD2 PHE A 580 -8.443 -3.295 -2.611 1.00 0.00 H new ATOM 0 HE1 PHE A 580 -5.783 -0.535 0.581 1.00 0.00 H new ATOM 0 HE2 PHE A 580 -9.593 -1.883 -0.912 1.00 0.00 H new ATOM 0 HZ PHE A 580 -8.269 -0.564 0.729 1.00 0.00 H new ATOM 1160 N PHE A 581 -3.669 -4.539 -4.954 1.00 0.00 N ATOM 1161 CA PHE A 581 -3.093 -5.719 -5.580 1.00 0.00 C ATOM 1162 C PHE A 581 -2.786 -6.694 -4.445 1.00 0.00 C ATOM 1163 O PHE A 581 -1.878 -6.434 -3.652 1.00 0.00 O ATOM 1164 CB PHE A 581 -1.867 -5.304 -6.413 1.00 0.00 C ATOM 1165 CG PHE A 581 -1.090 -6.425 -7.077 1.00 0.00 C ATOM 1166 CD1 PHE A 581 -1.616 -7.043 -8.223 1.00 0.00 C ATOM 1167 CD2 PHE A 581 0.178 -6.819 -6.603 1.00 0.00 C ATOM 1168 CE1 PHE A 581 -0.895 -8.046 -8.890 1.00 0.00 C ATOM 1169 CE2 PHE A 581 0.895 -7.837 -7.260 1.00 0.00 C ATOM 1170 CZ PHE A 581 0.359 -8.441 -8.407 1.00 0.00 C ATOM 0 H PHE A 581 -3.086 -4.164 -4.206 1.00 0.00 H new ATOM 0 HA PHE A 581 -3.763 -6.212 -6.284 1.00 0.00 H new ATOM 0 HB2 PHE A 581 -2.199 -4.613 -7.188 1.00 0.00 H new ATOM 0 HB3 PHE A 581 -1.185 -4.753 -5.765 1.00 0.00 H new ATOM 0 HD1 PHE A 581 -2.585 -6.744 -8.595 1.00 0.00 H new ATOM 0 HD2 PHE A 581 0.601 -6.338 -5.733 1.00 0.00 H new ATOM 0 HE1 PHE A 581 -1.306 -8.512 -9.773 1.00 0.00 H new ATOM 0 HE2 PHE A 581 1.856 -8.152 -6.882 1.00 0.00 H new ATOM 0 HZ PHE A 581 0.915 -9.213 -8.919 1.00 0.00 H new ATOM 1180 N PHE A 582 -3.604 -7.737 -4.286 1.00 0.00 N ATOM 1181 CA PHE A 582 -3.476 -8.737 -3.231 1.00 0.00 C ATOM 1182 C PHE A 582 -2.670 -9.924 -3.768 1.00 0.00 C ATOM 1183 O PHE A 582 -3.203 -10.771 -4.492 1.00 0.00 O ATOM 1184 CB PHE A 582 -4.859 -9.174 -2.712 1.00 0.00 C ATOM 1185 CG PHE A 582 -5.636 -8.216 -1.812 1.00 0.00 C ATOM 1186 CD1 PHE A 582 -5.224 -6.892 -1.565 1.00 0.00 C ATOM 1187 CD2 PHE A 582 -6.841 -8.667 -1.241 1.00 0.00 C ATOM 1188 CE1 PHE A 582 -6.020 -6.040 -0.773 1.00 0.00 C ATOM 1189 CE2 PHE A 582 -7.649 -7.812 -0.472 1.00 0.00 C ATOM 1190 CZ PHE A 582 -7.237 -6.492 -0.238 1.00 0.00 C ATOM 0 H PHE A 582 -4.395 -7.911 -4.906 1.00 0.00 H new ATOM 0 HA PHE A 582 -2.946 -8.306 -2.381 1.00 0.00 H new ATOM 0 HB2 PHE A 582 -5.483 -9.395 -3.578 1.00 0.00 H new ATOM 0 HB3 PHE A 582 -4.728 -10.109 -2.166 1.00 0.00 H new ATOM 0 HD1 PHE A 582 -4.297 -6.529 -1.983 1.00 0.00 H new ATOM 0 HD2 PHE A 582 -7.151 -9.690 -1.397 1.00 0.00 H new ATOM 0 HE1 PHE A 582 -5.691 -5.030 -0.576 1.00 0.00 H new ATOM 0 HE2 PHE A 582 -8.583 -8.170 -0.063 1.00 0.00 H new ATOM 0 HZ PHE A 582 -7.852 -5.827 0.350 1.00 0.00 H new ATOM 1200 N TYR A 583 -1.368 -9.946 -3.476 1.00 0.00 N ATOM 1201 CA TYR A 583 -0.391 -10.959 -3.888 1.00 0.00 C ATOM 1202 C TYR A 583 -0.194 -12.002 -2.783 1.00 0.00 C ATOM 1203 O TYR A 583 -0.511 -11.733 -1.620 1.00 0.00 O ATOM 1204 CB TYR A 583 0.941 -10.269 -4.238 1.00 0.00 C ATOM 1205 CG TYR A 583 1.467 -9.295 -3.194 1.00 0.00 C ATOM 1206 CD1 TYR A 583 1.015 -7.965 -3.186 1.00 0.00 C ATOM 1207 CD2 TYR A 583 2.409 -9.702 -2.234 1.00 0.00 C ATOM 1208 CE1 TYR A 583 1.476 -7.059 -2.220 1.00 0.00 C ATOM 1209 CE2 TYR A 583 2.889 -8.795 -1.267 1.00 0.00 C ATOM 1210 CZ TYR A 583 2.410 -7.466 -1.248 1.00 0.00 C ATOM 1211 OH TYR A 583 2.812 -6.582 -0.291 1.00 0.00 O ATOM 0 H TYR A 583 -0.940 -9.212 -2.911 1.00 0.00 H new ATOM 0 HA TYR A 583 -0.763 -11.480 -4.770 1.00 0.00 H new ATOM 0 HB2 TYR A 583 1.695 -11.038 -4.406 1.00 0.00 H new ATOM 0 HB3 TYR A 583 0.817 -9.734 -5.179 1.00 0.00 H new ATOM 0 HD1 TYR A 583 0.305 -7.637 -3.931 1.00 0.00 H new ATOM 0 HD2 TYR A 583 2.769 -10.720 -2.237 1.00 0.00 H new ATOM 0 HE1 TYR A 583 1.112 -6.042 -2.222 1.00 0.00 H new ATOM 0 HE2 TYR A 583 3.622 -9.116 -0.542 1.00 0.00 H new ATOM 0 HH TYR A 583 2.026 -6.167 0.122 1.00 0.00 H new ATOM 1221 N THR A 584 0.334 -13.181 -3.121 1.00 0.00 N ATOM 1222 CA THR A 584 0.584 -14.253 -2.164 1.00 0.00 C ATOM 1223 C THR A 584 1.724 -13.850 -1.227 1.00 0.00 C ATOM 1224 O THR A 584 2.734 -13.300 -1.674 1.00 0.00 O ATOM 1225 CB THR A 584 0.868 -15.571 -2.912 1.00 0.00 C ATOM 1226 OG1 THR A 584 1.813 -15.385 -3.950 1.00 0.00 O ATOM 1227 CG2 THR A 584 -0.421 -16.153 -3.498 1.00 0.00 C ATOM 0 H THR A 584 0.601 -13.417 -4.077 1.00 0.00 H new ATOM 0 HA THR A 584 -0.299 -14.420 -1.548 1.00 0.00 H new ATOM 0 HB THR A 584 1.282 -16.270 -2.185 1.00 0.00 H new ATOM 0 HG1 THR A 584 1.973 -16.239 -4.404 1.00 0.00 H new ATOM 0 HG21 THR A 584 -0.196 -17.082 -4.021 1.00 0.00 H new ATOM 0 HG22 THR A 584 -1.129 -16.352 -2.694 1.00 0.00 H new ATOM 0 HG23 THR A 584 -0.857 -15.440 -4.197 1.00 0.00 H new ATOM 1235 N SER A 585 1.602 -14.114 0.079 1.00 0.00 N ATOM 1236 CA SER A 585 2.666 -13.785 1.023 1.00 0.00 C ATOM 1237 C SER A 585 3.899 -14.678 0.863 1.00 0.00 C ATOM 1238 O SER A 585 4.963 -14.367 1.403 1.00 0.00 O ATOM 1239 CB SER A 585 2.129 -13.804 2.453 1.00 0.00 C ATOM 1240 OG SER A 585 1.491 -15.017 2.810 1.00 0.00 O ATOM 0 H SER A 585 0.782 -14.551 0.500 1.00 0.00 H new ATOM 0 HA SER A 585 3.004 -12.774 0.795 1.00 0.00 H new ATOM 0 HB2 SER A 585 2.953 -13.622 3.143 1.00 0.00 H new ATOM 0 HB3 SER A 585 1.423 -12.983 2.576 1.00 0.00 H new ATOM 0 HG SER A 585 1.733 -15.256 3.729 1.00 0.00 H new ATOM 1246 N LYS A 586 3.782 -15.782 0.124 1.00 0.00 N ATOM 1247 CA LYS A 586 4.901 -16.623 -0.248 1.00 0.00 C ATOM 1248 C LYS A 586 5.776 -15.939 -1.300 1.00 0.00 C ATOM 1249 O LYS A 586 6.987 -16.163 -1.274 1.00 0.00 O ATOM 1250 CB LYS A 586 4.331 -17.964 -0.722 1.00 0.00 C ATOM 1251 CG LYS A 586 5.401 -19.003 -1.055 1.00 0.00 C ATOM 1252 CD LYS A 586 4.705 -20.305 -1.457 1.00 0.00 C ATOM 1253 CE LYS A 586 5.717 -21.435 -1.629 1.00 0.00 C ATOM 1254 NZ LYS A 586 5.035 -22.669 -2.055 1.00 0.00 N ATOM 0 H LYS A 586 2.887 -16.116 -0.235 1.00 0.00 H new ATOM 0 HA LYS A 586 5.559 -16.798 0.603 1.00 0.00 H new ATOM 0 HB2 LYS A 586 3.677 -18.365 0.052 1.00 0.00 H new ATOM 0 HB3 LYS A 586 3.714 -17.795 -1.605 1.00 0.00 H new ATOM 0 HG2 LYS A 586 6.036 -18.647 -1.866 1.00 0.00 H new ATOM 0 HG3 LYS A 586 6.048 -19.170 -0.194 1.00 0.00 H new ATOM 0 HD2 LYS A 586 3.973 -20.580 -0.698 1.00 0.00 H new ATOM 0 HD3 LYS A 586 4.158 -20.157 -2.388 1.00 0.00 H new ATOM 0 HE2 LYS A 586 6.467 -21.152 -2.368 1.00 0.00 H new ATOM 0 HE3 LYS A 586 6.243 -21.607 -0.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 586 5.734 -23.431 -2.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 586 4.336 -22.945 -1.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 586 4.553 -22.504 -2.961 1.00 0.00 H new ATOM 1268 N GLU A 587 5.219 -15.108 -2.190 1.00 0.00 N ATOM 1269 CA GLU A 587 6.007 -14.547 -3.287 1.00 0.00 C ATOM 1270 C GLU A 587 7.117 -13.632 -2.727 1.00 0.00 C ATOM 1271 O GLU A 587 6.839 -12.829 -1.823 1.00 0.00 O ATOM 1272 CB GLU A 587 5.080 -13.855 -4.302 1.00 0.00 C ATOM 1273 CG GLU A 587 5.833 -13.461 -5.584 1.00 0.00 C ATOM 1274 CD GLU A 587 4.926 -13.163 -6.787 1.00 0.00 C ATOM 1275 OE1 GLU A 587 3.796 -12.658 -6.605 1.00 0.00 O ATOM 1276 OE2 GLU A 587 5.374 -13.388 -7.935 1.00 0.00 O ATOM 0 H GLU A 587 4.242 -14.815 -2.171 1.00 0.00 H new ATOM 0 HA GLU A 587 6.516 -15.341 -3.833 1.00 0.00 H new ATOM 0 HB2 GLU A 587 4.255 -14.521 -4.555 1.00 0.00 H new ATOM 0 HB3 GLU A 587 4.643 -12.965 -3.848 1.00 0.00 H new ATOM 0 HG2 GLU A 587 6.442 -12.581 -5.377 1.00 0.00 H new ATOM 0 HG3 GLU A 587 6.517 -14.267 -5.851 1.00 0.00 H new ATOM 1283 N PRO A 588 8.381 -13.743 -3.184 1.00 0.00 N ATOM 1284 CA PRO A 588 9.451 -12.891 -2.688 1.00 0.00 C ATOM 1285 C PRO A 588 9.246 -11.437 -3.089 1.00 0.00 C ATOM 1286 O PRO A 588 8.612 -11.113 -4.092 1.00 0.00 O ATOM 1287 CB PRO A 588 10.769 -13.447 -3.226 1.00 0.00 C ATOM 1288 CG PRO A 588 10.392 -14.536 -4.223 1.00 0.00 C ATOM 1289 CD PRO A 588 8.871 -14.645 -4.215 1.00 0.00 C ATOM 0 HA PRO A 588 9.460 -12.898 -1.598 1.00 0.00 H new ATOM 0 HB2 PRO A 588 11.355 -12.664 -3.707 1.00 0.00 H new ATOM 0 HB3 PRO A 588 11.380 -13.852 -2.419 1.00 0.00 H new ATOM 0 HG2 PRO A 588 10.755 -14.287 -5.220 1.00 0.00 H new ATOM 0 HG3 PRO A 588 10.848 -15.487 -3.946 1.00 0.00 H new ATOM 0 HD2 PRO A 588 8.461 -14.376 -5.188 1.00 0.00 H new ATOM 0 HD3 PRO A 588 8.560 -15.669 -4.010 1.00 0.00 H new ATOM 1297 N VAL A 589 9.849 -10.552 -2.303 1.00 0.00 N ATOM 1298 CA VAL A 589 9.673 -9.110 -2.437 1.00 0.00 C ATOM 1299 C VAL A 589 10.281 -8.688 -3.769 1.00 0.00 C ATOM 1300 O VAL A 589 9.666 -7.927 -4.511 1.00 0.00 O ATOM 1301 CB VAL A 589 10.333 -8.364 -1.254 1.00 0.00 C ATOM 1302 CG1 VAL A 589 10.033 -6.860 -1.272 1.00 0.00 C ATOM 1303 CG2 VAL A 589 9.879 -8.898 0.107 1.00 0.00 C ATOM 0 H VAL A 589 10.480 -10.818 -1.547 1.00 0.00 H new ATOM 0 HA VAL A 589 8.614 -8.854 -2.418 1.00 0.00 H new ATOM 0 HB VAL A 589 11.401 -8.538 -1.385 1.00 0.00 H new ATOM 0 HG11 VAL A 589 10.519 -6.382 -0.421 1.00 0.00 H new ATOM 0 HG12 VAL A 589 10.411 -6.425 -2.197 1.00 0.00 H new ATOM 0 HG13 VAL A 589 8.956 -6.703 -1.210 1.00 0.00 H new ATOM 0 HG21 VAL A 589 10.374 -8.338 0.901 1.00 0.00 H new ATOM 0 HG22 VAL A 589 8.799 -8.784 0.201 1.00 0.00 H new ATOM 0 HG23 VAL A 589 10.141 -9.953 0.190 1.00 0.00 H new ATOM 1313 N ALA A 590 11.454 -9.236 -4.102 1.00 0.00 N ATOM 1314 CA ALA A 590 12.130 -8.984 -5.365 1.00 0.00 C ATOM 1315 C ALA A 590 11.189 -9.278 -6.541 1.00 0.00 C ATOM 1316 O ALA A 590 11.081 -8.470 -7.467 1.00 0.00 O ATOM 1317 CB ALA A 590 13.407 -9.831 -5.414 1.00 0.00 C ATOM 0 H ALA A 590 11.962 -9.874 -3.490 1.00 0.00 H new ATOM 0 HA ALA A 590 12.411 -7.934 -5.445 1.00 0.00 H new ATOM 0 HB1 ALA A 590 13.926 -9.653 -6.356 1.00 0.00 H new ATOM 0 HB2 ALA A 590 14.058 -9.556 -4.584 1.00 0.00 H new ATOM 0 HB3 ALA A 590 13.147 -10.887 -5.337 1.00 0.00 H new ATOM 1323 N SER A 591 10.475 -10.404 -6.474 1.00 0.00 N ATOM 1324 CA SER A 591 9.587 -10.851 -7.517 1.00 0.00 C ATOM 1325 C SER A 591 8.364 -9.945 -7.640 1.00 0.00 C ATOM 1326 O SER A 591 8.012 -9.579 -8.765 1.00 0.00 O ATOM 1327 CB SER A 591 9.254 -12.308 -7.204 1.00 0.00 C ATOM 1328 OG SER A 591 10.438 -13.047 -7.432 1.00 0.00 O ATOM 0 H SER A 591 10.508 -11.034 -5.672 1.00 0.00 H new ATOM 0 HA SER A 591 10.054 -10.792 -8.500 1.00 0.00 H new ATOM 0 HB2 SER A 591 8.921 -12.417 -6.172 1.00 0.00 H new ATOM 0 HB3 SER A 591 8.444 -12.666 -7.840 1.00 0.00 H new ATOM 0 HG SER A 591 10.237 -14.006 -7.398 1.00 0.00 H new ATOM 1334 N ILE A 592 7.727 -9.526 -6.536 1.00 0.00 N ATOM 1335 CA ILE A 592 6.574 -8.652 -6.676 1.00 0.00 C ATOM 1336 C ILE A 592 7.001 -7.244 -7.117 1.00 0.00 C ATOM 1337 O ILE A 592 6.302 -6.636 -7.927 1.00 0.00 O ATOM 1338 CB ILE A 592 5.672 -8.673 -5.430 1.00 0.00 C ATOM 1339 CG1 ILE A 592 6.134 -7.795 -4.266 1.00 0.00 C ATOM 1340 CG2 ILE A 592 5.364 -10.077 -4.910 1.00 0.00 C ATOM 1341 CD1 ILE A 592 5.201 -6.587 -4.193 1.00 0.00 C ATOM 0 H ILE A 592 7.983 -9.770 -5.579 1.00 0.00 H new ATOM 0 HA ILE A 592 5.947 -9.042 -7.477 1.00 0.00 H new ATOM 0 HB ILE A 592 4.755 -8.231 -5.819 1.00 0.00 H new ATOM 0 HG12 ILE A 592 6.108 -8.355 -3.331 1.00 0.00 H new ATOM 0 HG13 ILE A 592 7.165 -7.473 -4.416 1.00 0.00 H new ATOM 0 HG21 ILE A 592 4.723 -10.007 -4.031 1.00 0.00 H new ATOM 0 HG22 ILE A 592 4.854 -10.649 -5.686 1.00 0.00 H new ATOM 0 HG23 ILE A 592 6.294 -10.578 -4.642 1.00 0.00 H new ATOM 0 HD11 ILE A 592 5.506 -5.941 -3.370 1.00 0.00 H new ATOM 0 HD12 ILE A 592 5.252 -6.031 -5.129 1.00 0.00 H new ATOM 0 HD13 ILE A 592 4.178 -6.926 -4.028 1.00 0.00 H new ATOM 1353 N ILE A 593 8.160 -6.740 -6.673 1.00 0.00 N ATOM 1354 CA ILE A 593 8.679 -5.440 -7.099 1.00 0.00 C ATOM 1355 C ILE A 593 8.698 -5.387 -8.623 1.00 0.00 C ATOM 1356 O ILE A 593 8.169 -4.459 -9.245 1.00 0.00 O ATOM 1357 CB ILE A 593 10.094 -5.177 -6.521 1.00 0.00 C ATOM 1358 CG1 ILE A 593 10.031 -4.775 -5.037 1.00 0.00 C ATOM 1359 CG2 ILE A 593 10.819 -4.077 -7.321 1.00 0.00 C ATOM 1360 CD1 ILE A 593 11.368 -4.994 -4.335 1.00 0.00 C ATOM 0 H ILE A 593 8.762 -7.225 -6.008 1.00 0.00 H new ATOM 0 HA ILE A 593 8.026 -4.656 -6.715 1.00 0.00 H new ATOM 0 HB ILE A 593 10.653 -6.109 -6.605 1.00 0.00 H new ATOM 0 HG12 ILE A 593 9.745 -3.726 -4.956 1.00 0.00 H new ATOM 0 HG13 ILE A 593 9.257 -5.356 -4.535 1.00 0.00 H new ATOM 0 HG21 ILE A 593 11.809 -3.911 -6.896 1.00 0.00 H new ATOM 0 HG22 ILE A 593 10.918 -4.389 -8.361 1.00 0.00 H new ATOM 0 HG23 ILE A 593 10.244 -3.153 -7.272 1.00 0.00 H new ATOM 0 HD11 ILE A 593 11.283 -4.698 -3.289 1.00 0.00 H new ATOM 0 HD12 ILE A 593 11.641 -6.048 -4.393 1.00 0.00 H new ATOM 0 HD13 ILE A 593 12.137 -4.393 -4.820 1.00 0.00 H new ATOM 1372 N THR A 594 9.301 -6.409 -9.221 1.00 0.00 N ATOM 1373 CA THR A 594 9.457 -6.515 -10.649 1.00 0.00 C ATOM 1374 C THR A 594 8.095 -6.431 -11.365 1.00 0.00 C ATOM 1375 O THR A 594 7.969 -5.882 -12.463 1.00 0.00 O ATOM 1376 CB THR A 594 10.194 -7.826 -10.908 1.00 0.00 C ATOM 1377 OG1 THR A 594 11.570 -7.640 -10.639 1.00 0.00 O ATOM 1378 CG2 THR A 594 9.932 -8.294 -12.328 1.00 0.00 C ATOM 0 H THR A 594 9.699 -7.196 -8.709 1.00 0.00 H new ATOM 0 HA THR A 594 10.035 -5.685 -11.055 1.00 0.00 H new ATOM 0 HB THR A 594 9.829 -8.611 -10.246 1.00 0.00 H new ATOM 0 HG1 THR A 594 12.051 -8.478 -10.801 1.00 0.00 H new ATOM 0 HG21 THR A 594 10.461 -9.230 -12.506 1.00 0.00 H new ATOM 0 HG22 THR A 594 8.862 -8.449 -12.468 1.00 0.00 H new ATOM 0 HG23 THR A 594 10.284 -7.539 -13.031 1.00 0.00 H new ATOM 1386 N LYS A 595 7.068 -7.017 -10.767 1.00 0.00 N ATOM 1387 CA LYS A 595 5.738 -7.024 -11.359 1.00 0.00 C ATOM 1388 C LYS A 595 5.096 -5.658 -11.179 1.00 0.00 C ATOM 1389 O LYS A 595 4.491 -5.181 -12.125 1.00 0.00 O ATOM 1390 CB LYS A 595 4.844 -8.117 -10.768 1.00 0.00 C ATOM 1391 CG LYS A 595 3.959 -8.734 -11.861 1.00 0.00 C ATOM 1392 CD LYS A 595 2.706 -9.389 -11.270 1.00 0.00 C ATOM 1393 CE LYS A 595 1.905 -10.078 -12.381 1.00 0.00 C ATOM 1394 NZ LYS A 595 0.604 -10.602 -11.914 1.00 0.00 N ATOM 0 H LYS A 595 7.131 -7.496 -9.868 1.00 0.00 H new ATOM 0 HA LYS A 595 5.846 -7.245 -12.421 1.00 0.00 H new ATOM 0 HB2 LYS A 595 5.460 -8.891 -10.310 1.00 0.00 H new ATOM 0 HB3 LYS A 595 4.219 -7.698 -9.979 1.00 0.00 H new ATOM 0 HG2 LYS A 595 3.665 -7.961 -12.571 1.00 0.00 H new ATOM 0 HG3 LYS A 595 4.531 -9.477 -12.417 1.00 0.00 H new ATOM 0 HD2 LYS A 595 2.989 -10.116 -10.509 1.00 0.00 H new ATOM 0 HD3 LYS A 595 2.089 -8.637 -10.778 1.00 0.00 H new ATOM 0 HE2 LYS A 595 1.735 -9.370 -13.192 1.00 0.00 H new ATOM 0 HE3 LYS A 595 2.495 -10.898 -12.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 0.108 -11.056 -12.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 0.762 -11.300 -11.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 0.026 -9.819 -11.547 1.00 0.00 H new ATOM 1408 N LEU A 596 5.249 -5.001 -10.019 1.00 0.00 N ATOM 1409 CA LEU A 596 4.685 -3.670 -9.779 1.00 0.00 C ATOM 1410 C LEU A 596 5.194 -2.675 -10.817 1.00 0.00 C ATOM 1411 O LEU A 596 4.428 -1.848 -11.307 1.00 0.00 O ATOM 1412 CB LEU A 596 4.996 -3.142 -8.362 1.00 0.00 C ATOM 1413 CG LEU A 596 4.267 -3.872 -7.220 1.00 0.00 C ATOM 1414 CD1 LEU A 596 4.707 -3.367 -5.849 1.00 0.00 C ATOM 1415 CD2 LEU A 596 2.742 -3.790 -7.321 1.00 0.00 C ATOM 0 H LEU A 596 5.766 -5.379 -9.225 1.00 0.00 H new ATOM 0 HA LEU A 596 3.603 -3.771 -9.865 1.00 0.00 H new ATOM 0 HB2 LEU A 596 6.070 -3.214 -8.192 1.00 0.00 H new ATOM 0 HB3 LEU A 596 4.737 -2.084 -8.320 1.00 0.00 H new ATOM 0 HG LEU A 596 4.552 -4.918 -7.330 1.00 0.00 H new ATOM 0 HD11 LEU A 596 4.168 -3.909 -5.072 1.00 0.00 H new ATOM 0 HD12 LEU A 596 5.778 -3.529 -5.728 1.00 0.00 H new ATOM 0 HD13 LEU A 596 4.489 -2.302 -5.766 1.00 0.00 H new ATOM 0 HD21 LEU A 596 2.293 -4.326 -6.485 1.00 0.00 H new ATOM 0 HD22 LEU A 596 2.431 -2.746 -7.292 1.00 0.00 H new ATOM 0 HD23 LEU A 596 2.415 -4.240 -8.258 1.00 0.00 H new ATOM 1427 N ASN A 597 6.474 -2.762 -11.183 1.00 0.00 N ATOM 1428 CA ASN A 597 7.018 -1.939 -12.256 1.00 0.00 C ATOM 1429 C ASN A 597 6.342 -2.213 -13.593 1.00 0.00 C ATOM 1430 O ASN A 597 6.061 -1.296 -14.356 1.00 0.00 O ATOM 1431 CB ASN A 597 8.531 -2.105 -12.343 1.00 0.00 C ATOM 1432 CG ASN A 597 9.098 -3.223 -13.160 1.00 0.00 C ATOM 1433 OD1 ASN A 597 8.864 -3.377 -14.353 1.00 0.00 O ATOM 1434 ND2 ASN A 597 9.954 -3.986 -12.533 1.00 0.00 N ATOM 0 H ASN A 597 7.149 -3.393 -10.751 1.00 0.00 H new ATOM 0 HA ASN A 597 6.804 -0.898 -12.014 1.00 0.00 H new ATOM 0 HB2 ASN A 597 8.941 -1.173 -12.733 1.00 0.00 H new ATOM 0 HB3 ASN A 597 8.907 -2.218 -11.326 1.00 0.00 H new ATOM 0 HD21 ASN A 597 10.442 -4.727 -13.037 1.00 0.00 H new ATOM 0 HD22 ASN A 597 10.134 -3.841 -11.540 1.00 0.00 H new ATOM 1441 N SER A 598 6.026 -3.475 -13.840 1.00 0.00 N ATOM 1442 CA SER A 598 5.367 -3.945 -15.039 1.00 0.00 C ATOM 1443 C SER A 598 3.886 -3.540 -15.100 1.00 0.00 C ATOM 1444 O SER A 598 3.255 -3.720 -16.138 1.00 0.00 O ATOM 1445 CB SER A 598 5.482 -5.468 -15.050 1.00 0.00 C ATOM 1446 OG SER A 598 6.289 -5.955 -16.099 1.00 0.00 O ATOM 0 H SER A 598 6.232 -4.226 -13.181 1.00 0.00 H new ATOM 0 HA SER A 598 5.847 -3.492 -15.906 1.00 0.00 H new ATOM 0 HB2 SER A 598 5.894 -5.802 -14.098 1.00 0.00 H new ATOM 0 HB3 SER A 598 4.485 -5.901 -15.135 1.00 0.00 H new ATOM 0 HG SER A 598 6.327 -6.933 -16.055 1.00 0.00 H new ATOM 1452 N LEU A 599 3.330 -2.985 -14.022 1.00 0.00 N ATOM 1453 CA LEU A 599 2.027 -2.332 -13.980 1.00 0.00 C ATOM 1454 C LEU A 599 2.171 -0.868 -14.379 1.00 0.00 C ATOM 1455 O LEU A 599 1.204 -0.308 -14.886 1.00 0.00 O ATOM 1456 CB LEU A 599 1.389 -2.427 -12.584 1.00 0.00 C ATOM 1457 CG LEU A 599 1.301 -3.827 -11.955 1.00 0.00 C ATOM 1458 CD1 LEU A 599 0.784 -3.680 -10.528 1.00 0.00 C ATOM 1459 CD2 LEU A 599 0.378 -4.779 -12.717 1.00 0.00 C ATOM 0 H LEU A 599 3.799 -2.980 -13.116 1.00 0.00 H new ATOM 0 HA LEU A 599 1.373 -2.846 -14.684 1.00 0.00 H new ATOM 0 HB2 LEU A 599 1.955 -1.786 -11.908 1.00 0.00 H new ATOM 0 HB3 LEU A 599 0.381 -2.017 -12.643 1.00 0.00 H new ATOM 0 HG LEU A 599 2.300 -4.261 -11.987 1.00 0.00 H new ATOM 0 HD11 LEU A 599 0.714 -4.663 -10.063 1.00 0.00 H new ATOM 0 HD12 LEU A 599 1.470 -3.056 -9.955 1.00 0.00 H new ATOM 0 HD13 LEU A 599 -0.202 -3.215 -10.544 1.00 0.00 H new ATOM 0 HD21 LEU A 599 0.363 -5.748 -12.218 1.00 0.00 H new ATOM 0 HD22 LEU A 599 -0.631 -4.367 -12.740 1.00 0.00 H new ATOM 0 HD23 LEU A 599 0.743 -4.901 -13.737 1.00 0.00 H new ATOM 1471 N ASN A 600 3.360 -0.265 -14.200 1.00 0.00 N ATOM 1472 CA ASN A 600 3.698 1.107 -14.606 1.00 0.00 C ATOM 1473 C ASN A 600 2.612 2.101 -14.180 1.00 0.00 C ATOM 1474 O ASN A 600 2.288 3.063 -14.878 1.00 0.00 O ATOM 1475 CB ASN A 600 4.137 1.208 -16.085 1.00 0.00 C ATOM 1476 CG ASN A 600 3.383 0.263 -17.007 1.00 0.00 C ATOM 1477 OD1 ASN A 600 2.386 0.622 -17.626 1.00 0.00 O ATOM 1478 ND2 ASN A 600 3.849 -0.976 -17.055 1.00 0.00 N ATOM 0 H ASN A 600 4.142 -0.741 -13.750 1.00 0.00 H new ATOM 0 HA ASN A 600 4.591 1.406 -14.057 1.00 0.00 H new ATOM 0 HB2 ASN A 600 3.992 2.232 -16.430 1.00 0.00 H new ATOM 0 HB3 ASN A 600 5.204 0.996 -16.154 1.00 0.00 H new ATOM 0 HD21 ASN A 600 3.375 -1.677 -17.624 1.00 0.00 H new ATOM 0 HD22 ASN A 600 4.682 -1.229 -16.523 1.00 0.00 H new ATOM 1485 N GLU A 601 2.075 1.862 -12.987 1.00 0.00 N ATOM 1486 CA GLU A 601 1.130 2.702 -12.285 1.00 0.00 C ATOM 1487 C GLU A 601 1.857 3.492 -11.189 1.00 0.00 C ATOM 1488 O GLU A 601 2.953 3.096 -10.776 1.00 0.00 O ATOM 1489 CB GLU A 601 0.071 1.810 -11.630 1.00 0.00 C ATOM 1490 CG GLU A 601 -0.681 0.948 -12.649 1.00 0.00 C ATOM 1491 CD GLU A 601 -2.115 0.722 -12.207 1.00 0.00 C ATOM 1492 OE1 GLU A 601 -2.866 1.717 -12.111 1.00 0.00 O ATOM 1493 OE2 GLU A 601 -2.506 -0.429 -11.900 1.00 0.00 O ATOM 0 H GLU A 601 2.308 1.022 -12.458 1.00 0.00 H new ATOM 0 HA GLU A 601 0.664 3.394 -12.986 1.00 0.00 H new ATOM 0 HB2 GLU A 601 0.550 1.163 -10.895 1.00 0.00 H new ATOM 0 HB3 GLU A 601 -0.642 2.434 -11.090 1.00 0.00 H new ATOM 0 HG2 GLU A 601 -0.668 1.435 -13.624 1.00 0.00 H new ATOM 0 HG3 GLU A 601 -0.176 -0.011 -12.765 1.00 0.00 H new ATOM 1500 N PRO A 602 1.263 4.581 -10.684 1.00 0.00 N ATOM 1501 CA PRO A 602 1.682 5.249 -9.464 1.00 0.00 C ATOM 1502 C PRO A 602 1.113 4.513 -8.246 1.00 0.00 C ATOM 1503 O PRO A 602 -0.088 4.228 -8.183 1.00 0.00 O ATOM 1504 CB PRO A 602 1.106 6.657 -9.583 1.00 0.00 C ATOM 1505 CG PRO A 602 -0.127 6.519 -10.482 1.00 0.00 C ATOM 1506 CD PRO A 602 0.138 5.259 -11.303 1.00 0.00 C ATOM 0 HA PRO A 602 2.764 5.267 -9.336 1.00 0.00 H new ATOM 0 HB2 PRO A 602 0.836 7.055 -8.605 1.00 0.00 H new ATOM 0 HB3 PRO A 602 1.833 7.343 -10.017 1.00 0.00 H new ATOM 0 HG2 PRO A 602 -1.039 6.424 -9.893 1.00 0.00 H new ATOM 0 HG3 PRO A 602 -0.251 7.392 -11.123 1.00 0.00 H new ATOM 0 HD2 PRO A 602 -0.741 4.615 -11.316 1.00 0.00 H new ATOM 0 HD3 PRO A 602 0.363 5.513 -12.339 1.00 0.00 H new ATOM 1514 N LEU A 603 1.963 4.225 -7.256 1.00 0.00 N ATOM 1515 CA LEU A 603 1.568 3.431 -6.092 1.00 0.00 C ATOM 1516 C LEU A 603 1.461 4.296 -4.838 1.00 0.00 C ATOM 1517 O LEU A 603 2.097 5.350 -4.734 1.00 0.00 O ATOM 1518 CB LEU A 603 2.549 2.274 -5.819 1.00 0.00 C ATOM 1519 CG LEU A 603 3.070 1.502 -7.047 1.00 0.00 C ATOM 1520 CD1 LEU A 603 4.072 0.453 -6.567 1.00 0.00 C ATOM 1521 CD2 LEU A 603 1.944 0.806 -7.813 1.00 0.00 C ATOM 0 H LEU A 603 2.935 4.533 -7.239 1.00 0.00 H new ATOM 0 HA LEU A 603 0.590 3.012 -6.329 1.00 0.00 H new ATOM 0 HB2 LEU A 603 3.407 2.676 -5.281 1.00 0.00 H new ATOM 0 HB3 LEU A 603 2.060 1.563 -5.153 1.00 0.00 H new ATOM 0 HG LEU A 603 3.536 2.216 -7.726 1.00 0.00 H new ATOM 0 HD11 LEU A 603 4.453 -0.105 -7.423 1.00 0.00 H new ATOM 0 HD12 LEU A 603 4.900 0.947 -6.058 1.00 0.00 H new ATOM 0 HD13 LEU A 603 3.579 -0.232 -5.877 1.00 0.00 H new ATOM 0 HD21 LEU A 603 2.360 0.275 -8.669 1.00 0.00 H new ATOM 0 HD22 LEU A 603 1.441 0.096 -7.156 1.00 0.00 H new ATOM 0 HD23 LEU A 603 1.227 1.549 -8.161 1.00 0.00 H new ATOM 1533 N VAL A 604 0.755 3.795 -3.831 1.00 0.00 N ATOM 1534 CA VAL A 604 0.792 4.255 -2.449 1.00 0.00 C ATOM 1535 C VAL A 604 0.715 2.987 -1.603 1.00 0.00 C ATOM 1536 O VAL A 604 -0.285 2.277 -1.620 1.00 0.00 O ATOM 1537 CB VAL A 604 -0.321 5.301 -2.188 1.00 0.00 C ATOM 1538 CG1 VAL A 604 -1.717 4.789 -2.535 1.00 0.00 C ATOM 1539 CG2 VAL A 604 -0.402 5.791 -0.732 1.00 0.00 C ATOM 0 H VAL A 604 0.109 3.017 -3.964 1.00 0.00 H new ATOM 0 HA VAL A 604 1.702 4.796 -2.190 1.00 0.00 H new ATOM 0 HB VAL A 604 -0.026 6.122 -2.842 1.00 0.00 H new ATOM 0 HG11 VAL A 604 -2.452 5.568 -2.330 1.00 0.00 H new ATOM 0 HG12 VAL A 604 -1.755 4.523 -3.591 1.00 0.00 H new ATOM 0 HG13 VAL A 604 -1.942 3.910 -1.932 1.00 0.00 H new ATOM 0 HG21 VAL A 604 -1.207 6.520 -0.638 1.00 0.00 H new ATOM 0 HG22 VAL A 604 -0.600 4.945 -0.074 1.00 0.00 H new ATOM 0 HG23 VAL A 604 0.543 6.256 -0.451 1.00 0.00 H new ATOM 1549 N THR A 605 1.802 2.623 -0.935 1.00 0.00 N ATOM 1550 CA THR A 605 1.821 1.499 -0.003 1.00 0.00 C ATOM 1551 C THR A 605 3.020 1.665 0.934 1.00 0.00 C ATOM 1552 O THR A 605 3.620 2.737 1.016 1.00 0.00 O ATOM 1553 CB THR A 605 1.796 0.162 -0.771 1.00 0.00 C ATOM 1554 OG1 THR A 605 1.597 -0.919 0.119 1.00 0.00 O ATOM 1555 CG2 THR A 605 3.075 -0.027 -1.589 1.00 0.00 C ATOM 0 H THR A 605 2.699 3.100 -1.023 1.00 0.00 H new ATOM 0 HA THR A 605 0.926 1.486 0.619 1.00 0.00 H new ATOM 0 HB THR A 605 0.959 0.187 -1.468 1.00 0.00 H new ATOM 0 HG1 THR A 605 1.107 -1.634 -0.339 1.00 0.00 H new ATOM 0 HG21 THR A 605 3.030 -0.978 -2.120 1.00 0.00 H new ATOM 0 HG22 THR A 605 3.170 0.786 -2.308 1.00 0.00 H new ATOM 0 HG23 THR A 605 3.937 -0.024 -0.922 1.00 0.00 H new ATOM 1563 N MET A 606 3.352 0.637 1.695 1.00 0.00 N ATOM 1564 CA MET A 606 4.477 0.611 2.620 1.00 0.00 C ATOM 1565 C MET A 606 5.660 -0.100 1.967 1.00 0.00 C ATOM 1566 O MET A 606 5.556 -0.478 0.804 1.00 0.00 O ATOM 1567 CB MET A 606 4.031 -0.020 3.946 1.00 0.00 C ATOM 1568 CG MET A 606 2.559 0.198 4.279 1.00 0.00 C ATOM 1569 SD MET A 606 1.478 -1.159 3.732 1.00 0.00 S ATOM 1570 CE MET A 606 -0.054 -0.243 3.456 1.00 0.00 C ATOM 0 H MET A 606 2.827 -0.237 1.687 1.00 0.00 H new ATOM 0 HA MET A 606 4.816 1.620 2.853 1.00 0.00 H new ATOM 0 HB2 MET A 606 4.229 -1.091 3.910 1.00 0.00 H new ATOM 0 HB3 MET A 606 4.639 0.390 4.753 1.00 0.00 H new ATOM 0 HG2 MET A 606 2.454 0.323 5.357 1.00 0.00 H new ATOM 0 HG3 MET A 606 2.224 1.127 3.816 1.00 0.00 H new ATOM 0 HE1 MET A 606 -0.872 -0.944 3.288 1.00 0.00 H new ATOM 0 HE2 MET A 606 -0.275 0.369 4.331 1.00 0.00 H new ATOM 0 HE3 MET A 606 0.059 0.400 2.583 1.00 0.00 H new ATOM 1580 N PRO A 607 6.812 -0.230 2.654 1.00 0.00 N ATOM 1581 CA PRO A 607 8.011 -0.829 2.096 1.00 0.00 C ATOM 1582 C PRO A 607 7.931 -2.354 1.898 1.00 0.00 C ATOM 1583 O PRO A 607 8.871 -3.061 2.227 1.00 0.00 O ATOM 1584 CB PRO A 607 9.148 -0.384 3.034 1.00 0.00 C ATOM 1585 CG PRO A 607 8.588 0.685 3.953 1.00 0.00 C ATOM 1586 CD PRO A 607 7.101 0.398 3.925 1.00 0.00 C ATOM 0 HA PRO A 607 8.176 -0.488 1.074 1.00 0.00 H new ATOM 0 HB2 PRO A 607 9.521 -1.229 3.612 1.00 0.00 H new ATOM 0 HB3 PRO A 607 9.989 0.006 2.460 1.00 0.00 H new ATOM 0 HG2 PRO A 607 8.997 0.608 4.961 1.00 0.00 H new ATOM 0 HG3 PRO A 607 8.814 1.689 3.593 1.00 0.00 H new ATOM 0 HD2 PRO A 607 6.819 -0.256 4.750 1.00 0.00 H new ATOM 0 HD3 PRO A 607 6.529 1.319 4.038 1.00 0.00 H new ATOM 1594 N ILE A 608 6.816 -2.862 1.347 1.00 0.00 N ATOM 1595 CA ILE A 608 6.431 -4.256 1.138 1.00 0.00 C ATOM 1596 C ILE A 608 7.033 -5.162 2.226 1.00 0.00 C ATOM 1597 O ILE A 608 6.514 -5.215 3.346 1.00 0.00 O ATOM 1598 CB ILE A 608 6.732 -4.663 -0.327 1.00 0.00 C ATOM 1599 CG1 ILE A 608 6.067 -3.709 -1.354 1.00 0.00 C ATOM 1600 CG2 ILE A 608 6.354 -6.125 -0.646 1.00 0.00 C ATOM 1601 CD1 ILE A 608 4.535 -3.753 -1.485 1.00 0.00 C ATOM 0 H ILE A 608 6.090 -2.234 1.003 1.00 0.00 H new ATOM 0 HA ILE A 608 5.355 -4.386 1.258 1.00 0.00 H new ATOM 0 HB ILE A 608 7.814 -4.576 -0.422 1.00 0.00 H new ATOM 0 HG12 ILE A 608 6.352 -2.689 -1.097 1.00 0.00 H new ATOM 0 HG13 ILE A 608 6.493 -3.922 -2.334 1.00 0.00 H new ATOM 0 HG21 ILE A 608 6.591 -6.343 -1.687 1.00 0.00 H new ATOM 0 HG22 ILE A 608 6.917 -6.796 0.003 1.00 0.00 H new ATOM 0 HG23 ILE A 608 5.287 -6.270 -0.479 1.00 0.00 H new ATOM 0 HD11 ILE A 608 4.213 -3.034 -2.238 1.00 0.00 H new ATOM 0 HD12 ILE A 608 4.224 -4.754 -1.783 1.00 0.00 H new ATOM 0 HD13 ILE A 608 4.081 -3.502 -0.527 1.00 0.00 H new ATOM 1613 N GLY A 609 8.150 -5.831 1.937 1.00 0.00 N ATOM 1614 CA GLY A 609 8.917 -6.581 2.899 1.00 0.00 C ATOM 1615 C GLY A 609 9.610 -5.606 3.830 1.00 0.00 C ATOM 1616 O GLY A 609 10.742 -5.236 3.579 1.00 0.00 O ATOM 0 H GLY A 609 8.547 -5.859 0.998 1.00 0.00 H new ATOM 0 HA2 GLY A 609 8.266 -7.247 3.465 1.00 0.00 H new ATOM 0 HA3 GLY A 609 9.651 -7.207 2.392 1.00 0.00 H new ATOM 1620 N TYR A 610 8.935 -5.227 4.906 1.00 0.00 N ATOM 1621 CA TYR A 610 9.450 -4.569 6.103 1.00 0.00 C ATOM 1622 C TYR A 610 8.880 -5.190 7.394 1.00 0.00 C ATOM 1623 O TYR A 610 9.412 -4.996 8.482 1.00 0.00 O ATOM 1624 CB TYR A 610 9.100 -3.077 6.007 1.00 0.00 C ATOM 1625 CG TYR A 610 9.390 -2.299 7.268 1.00 0.00 C ATOM 1626 CD1 TYR A 610 10.661 -2.407 7.860 1.00 0.00 C ATOM 1627 CD2 TYR A 610 8.349 -1.625 7.927 1.00 0.00 C ATOM 1628 CE1 TYR A 610 10.869 -1.936 9.164 1.00 0.00 C ATOM 1629 CE2 TYR A 610 8.548 -1.149 9.234 1.00 0.00 C ATOM 1630 CZ TYR A 610 9.798 -1.336 9.870 1.00 0.00 C ATOM 1631 OH TYR A 610 9.962 -1.003 11.179 1.00 0.00 O ATOM 0 H TYR A 610 7.929 -5.384 4.971 1.00 0.00 H new ATOM 0 HA TYR A 610 10.530 -4.703 6.154 1.00 0.00 H new ATOM 0 HB2 TYR A 610 9.659 -2.635 5.182 1.00 0.00 H new ATOM 0 HB3 TYR A 610 8.042 -2.977 5.765 1.00 0.00 H new ATOM 0 HD1 TYR A 610 11.477 -2.853 7.310 1.00 0.00 H new ATOM 0 HD2 TYR A 610 7.401 -1.473 7.432 1.00 0.00 H new ATOM 0 HE1 TYR A 610 11.840 -2.030 9.627 1.00 0.00 H new ATOM 0 HE2 TYR A 610 7.748 -0.641 9.752 1.00 0.00 H new ATOM 0 HH TYR A 610 9.136 -0.600 11.520 1.00 0.00 H new ATOM 1641 N VAL A 611 7.789 -5.951 7.296 1.00 0.00 N ATOM 1642 CA VAL A 611 7.135 -6.566 8.454 1.00 0.00 C ATOM 1643 C VAL A 611 6.656 -7.969 8.087 1.00 0.00 C ATOM 1644 O VAL A 611 7.169 -8.971 8.574 1.00 0.00 O ATOM 1645 CB VAL A 611 6.044 -5.661 9.062 1.00 0.00 C ATOM 1646 CG1 VAL A 611 6.627 -4.624 10.036 1.00 0.00 C ATOM 1647 CG2 VAL A 611 5.252 -4.906 8.005 1.00 0.00 C ATOM 0 H VAL A 611 7.332 -6.159 6.408 1.00 0.00 H new ATOM 0 HA VAL A 611 7.862 -6.677 9.259 1.00 0.00 H new ATOM 0 HB VAL A 611 5.382 -6.344 9.595 1.00 0.00 H new ATOM 0 HG11 VAL A 611 5.821 -4.010 10.439 1.00 0.00 H new ATOM 0 HG12 VAL A 611 7.135 -5.137 10.853 1.00 0.00 H new ATOM 0 HG13 VAL A 611 7.338 -3.989 9.508 1.00 0.00 H new ATOM 0 HG21 VAL A 611 4.498 -4.285 8.489 1.00 0.00 H new ATOM 0 HG22 VAL A 611 5.926 -4.274 7.428 1.00 0.00 H new ATOM 0 HG23 VAL A 611 4.763 -5.617 7.340 1.00 0.00 H new ATOM 1657 N THR A 612 5.736 -8.044 7.135 1.00 0.00 N ATOM 1658 CA THR A 612 5.069 -9.223 6.594 1.00 0.00 C ATOM 1659 C THR A 612 6.030 -10.266 5.971 1.00 0.00 C ATOM 1660 O THR A 612 5.592 -11.325 5.527 1.00 0.00 O ATOM 1661 CB THR A 612 3.998 -8.671 5.624 1.00 0.00 C ATOM 1662 OG1 THR A 612 3.273 -9.675 4.970 1.00 0.00 O ATOM 1663 CG2 THR A 612 4.582 -7.737 4.555 1.00 0.00 C ATOM 0 H THR A 612 5.404 -7.196 6.676 1.00 0.00 H new ATOM 0 HA THR A 612 4.606 -9.814 7.385 1.00 0.00 H new ATOM 0 HB THR A 612 3.327 -8.108 6.273 1.00 0.00 H new ATOM 0 HG1 THR A 612 3.240 -10.475 5.535 1.00 0.00 H new ATOM 0 HG21 THR A 612 3.782 -7.382 3.905 1.00 0.00 H new ATOM 0 HG22 THR A 612 5.061 -6.886 5.038 1.00 0.00 H new ATOM 0 HG23 THR A 612 5.318 -8.279 3.961 1.00 0.00 H new ATOM 1671 N HIS A 613 7.338 -10.006 5.875 1.00 0.00 N ATOM 1672 CA HIS A 613 8.361 -10.967 5.429 1.00 0.00 C ATOM 1673 C HIS A 613 9.560 -10.996 6.392 1.00 0.00 C ATOM 1674 O HIS A 613 10.581 -11.586 6.060 1.00 0.00 O ATOM 1675 CB HIS A 613 8.816 -10.652 3.986 1.00 0.00 C ATOM 1676 CG HIS A 613 7.894 -11.114 2.873 1.00 0.00 C ATOM 1677 ND1 HIS A 613 6.514 -11.205 2.921 1.00 0.00 N ATOM 1678 CD2 HIS A 613 8.297 -11.558 1.638 1.00 0.00 C ATOM 1679 CE1 HIS A 613 6.095 -11.651 1.725 1.00 0.00 C ATOM 1680 NE2 HIS A 613 7.157 -11.885 0.930 1.00 0.00 N ATOM 0 H HIS A 613 7.729 -9.094 6.112 1.00 0.00 H new ATOM 0 HA HIS A 613 7.911 -11.960 5.435 1.00 0.00 H new ATOM 0 HB2 HIS A 613 8.946 -9.574 3.896 1.00 0.00 H new ATOM 0 HB3 HIS A 613 9.795 -11.105 3.829 1.00 0.00 H new ATOM 0 HD1 HIS A 613 5.922 -10.975 3.719 1.00 0.00 H new ATOM 0 HD2 HIS A 613 9.315 -11.637 1.286 1.00 0.00 H new ATOM 0 HE1 HIS A 613 5.063 -11.799 1.444 1.00 0.00 H new ATOM 0 HE2 HIS A 613 7.125 -12.241 -0.025 1.00 0.00 H new ATOM 1689 N GLY A 614 9.488 -10.331 7.551 1.00 0.00 N ATOM 1690 CA GLY A 614 10.594 -10.289 8.501 1.00 0.00 C ATOM 1691 C GLY A 614 11.805 -9.511 7.989 1.00 0.00 C ATOM 1692 O GLY A 614 12.903 -9.680 8.517 1.00 0.00 O ATOM 0 H GLY A 614 8.664 -9.811 7.851 1.00 0.00 H new ATOM 0 HA2 GLY A 614 10.248 -9.837 9.430 1.00 0.00 H new ATOM 0 HA3 GLY A 614 10.900 -11.308 8.737 1.00 0.00 H new ATOM 1696 N PHE A 615 11.634 -8.678 6.962 1.00 0.00 N ATOM 1697 CA PHE A 615 12.716 -7.842 6.462 1.00 0.00 C ATOM 1698 C PHE A 615 12.988 -6.733 7.479 1.00 0.00 C ATOM 1699 O PHE A 615 12.050 -6.222 8.087 1.00 0.00 O ATOM 1700 CB PHE A 615 12.302 -7.191 5.147 1.00 0.00 C ATOM 1701 CG PHE A 615 12.472 -7.980 3.859 1.00 0.00 C ATOM 1702 CD1 PHE A 615 12.315 -9.376 3.812 1.00 0.00 C ATOM 1703 CD2 PHE A 615 12.748 -7.282 2.668 1.00 0.00 C ATOM 1704 CE1 PHE A 615 12.435 -10.060 2.588 1.00 0.00 C ATOM 1705 CE2 PHE A 615 12.924 -7.964 1.457 1.00 0.00 C ATOM 1706 CZ PHE A 615 12.767 -9.357 1.417 1.00 0.00 C ATOM 0 H PHE A 615 10.752 -8.567 6.462 1.00 0.00 H new ATOM 0 HA PHE A 615 13.604 -8.455 6.307 1.00 0.00 H new ATOM 0 HB2 PHE A 615 11.251 -6.916 5.230 1.00 0.00 H new ATOM 0 HB3 PHE A 615 12.867 -6.264 5.044 1.00 0.00 H new ATOM 0 HD1 PHE A 615 12.102 -9.925 4.717 1.00 0.00 H new ATOM 0 HD2 PHE A 615 12.825 -6.205 2.688 1.00 0.00 H new ATOM 0 HE1 PHE A 615 12.272 -11.127 2.548 1.00 0.00 H new ATOM 0 HE2 PHE A 615 13.179 -7.420 0.559 1.00 0.00 H new ATOM 0 HZ PHE A 615 12.901 -9.889 0.487 1.00 0.00 H new ATOM 1716 N ASN A 616 14.241 -6.304 7.612 1.00 0.00 N ATOM 1717 CA ASN A 616 14.574 -5.073 8.339 1.00 0.00 C ATOM 1718 C ASN A 616 14.223 -3.849 7.495 1.00 0.00 C ATOM 1719 O ASN A 616 13.975 -3.974 6.298 1.00 0.00 O ATOM 1720 CB ASN A 616 16.071 -5.007 8.648 1.00 0.00 C ATOM 1721 CG ASN A 616 16.584 -6.239 9.394 1.00 0.00 C ATOM 1722 OD1 ASN A 616 15.925 -6.737 10.302 1.00 0.00 O ATOM 1723 ND2 ASN A 616 17.751 -6.752 9.058 1.00 0.00 N ATOM 0 H ASN A 616 15.049 -6.791 7.225 1.00 0.00 H new ATOM 0 HA ASN A 616 14.002 -5.079 9.267 1.00 0.00 H new ATOM 0 HB2 ASN A 616 16.624 -4.898 7.715 1.00 0.00 H new ATOM 0 HB3 ASN A 616 16.274 -4.118 9.245 1.00 0.00 H new ATOM 0 HD21 ASN A 616 18.111 -7.568 9.553 1.00 0.00 H new ATOM 0 HD22 ASN A 616 18.294 -6.333 8.303 1.00 0.00 H new ATOM 1730 N LEU A 617 14.292 -2.644 8.075 1.00 0.00 N ATOM 1731 CA LEU A 617 14.044 -1.396 7.350 1.00 0.00 C ATOM 1732 C LEU A 617 15.081 -1.159 6.251 1.00 0.00 C ATOM 1733 O LEU A 617 14.720 -0.683 5.177 1.00 0.00 O ATOM 1734 CB LEU A 617 13.994 -0.209 8.327 1.00 0.00 C ATOM 1735 CG LEU A 617 13.375 1.082 7.737 1.00 0.00 C ATOM 1736 CD1 LEU A 617 11.904 0.911 7.328 1.00 0.00 C ATOM 1737 CD2 LEU A 617 13.459 2.219 8.765 1.00 0.00 C ATOM 0 H LEU A 617 14.521 -2.509 9.060 1.00 0.00 H new ATOM 0 HA LEU A 617 13.074 -1.485 6.860 1.00 0.00 H new ATOM 0 HB2 LEU A 617 13.421 -0.503 9.207 1.00 0.00 H new ATOM 0 HB3 LEU A 617 15.007 0.010 8.665 1.00 0.00 H new ATOM 0 HG LEU A 617 13.950 1.315 6.841 1.00 0.00 H new ATOM 0 HD11 LEU A 617 11.528 1.850 6.922 1.00 0.00 H new ATOM 0 HD12 LEU A 617 11.825 0.131 6.571 1.00 0.00 H new ATOM 0 HD13 LEU A 617 11.314 0.631 8.201 1.00 0.00 H new ATOM 0 HD21 LEU A 617 13.022 3.124 8.343 1.00 0.00 H new ATOM 0 HD22 LEU A 617 12.912 1.937 9.665 1.00 0.00 H new ATOM 0 HD23 LEU A 617 14.503 2.404 9.018 1.00 0.00 H new ATOM 1749 N GLU A 618 16.353 -1.512 6.483 1.00 0.00 N ATOM 1750 CA GLU A 618 17.362 -1.418 5.427 1.00 0.00 C ATOM 1751 C GLU A 618 17.043 -2.398 4.312 1.00 0.00 C ATOM 1752 O GLU A 618 17.103 -2.055 3.140 1.00 0.00 O ATOM 1753 CB GLU A 618 18.771 -1.809 5.871 1.00 0.00 C ATOM 1754 CG GLU A 618 19.334 -0.924 6.956 1.00 0.00 C ATOM 1755 CD GLU A 618 20.849 -0.733 6.790 1.00 0.00 C ATOM 1756 OE1 GLU A 618 21.624 -1.627 7.202 1.00 0.00 O ATOM 1757 OE2 GLU A 618 21.293 0.272 6.186 1.00 0.00 O ATOM 0 H GLU A 618 16.700 -1.859 7.377 1.00 0.00 H new ATOM 0 HA GLU A 618 17.338 -0.371 5.126 1.00 0.00 H new ATOM 0 HB2 GLU A 618 18.757 -2.840 6.226 1.00 0.00 H new ATOM 0 HB3 GLU A 618 19.436 -1.778 5.008 1.00 0.00 H new ATOM 0 HG2 GLU A 618 18.838 0.046 6.931 1.00 0.00 H new ATOM 0 HG3 GLU A 618 19.125 -1.363 7.931 1.00 0.00 H new ATOM 1764 N GLU A 619 16.791 -3.651 4.684 1.00 0.00 N ATOM 1765 CA GLU A 619 16.502 -4.701 3.699 1.00 0.00 C ATOM 1766 C GLU A 619 15.311 -4.305 2.829 1.00 0.00 C ATOM 1767 O GLU A 619 15.341 -4.497 1.611 1.00 0.00 O ATOM 1768 CB GLU A 619 16.173 -6.042 4.351 1.00 0.00 C ATOM 1769 CG GLU A 619 17.324 -6.610 5.172 1.00 0.00 C ATOM 1770 CD GLU A 619 16.989 -8.050 5.543 1.00 0.00 C ATOM 1771 OE1 GLU A 619 16.015 -8.255 6.301 1.00 0.00 O ATOM 1772 OE2 GLU A 619 17.625 -8.972 4.980 1.00 0.00 O ATOM 0 H GLU A 619 16.780 -3.967 5.654 1.00 0.00 H new ATOM 0 HA GLU A 619 17.407 -4.810 3.101 1.00 0.00 H new ATOM 0 HB2 GLU A 619 15.301 -5.921 4.994 1.00 0.00 H new ATOM 0 HB3 GLU A 619 15.900 -6.758 3.576 1.00 0.00 H new ATOM 0 HG2 GLU A 619 18.252 -6.572 4.601 1.00 0.00 H new ATOM 0 HG3 GLU A 619 17.479 -6.013 6.071 1.00 0.00 H new ATOM 1779 N ALA A 620 14.276 -3.759 3.462 1.00 0.00 N ATOM 1780 CA ALA A 620 13.094 -3.216 2.834 1.00 0.00 C ATOM 1781 C ALA A 620 13.490 -2.119 1.849 1.00 0.00 C ATOM 1782 O ALA A 620 13.214 -2.235 0.657 1.00 0.00 O ATOM 1783 CB ALA A 620 12.154 -2.724 3.940 1.00 0.00 C ATOM 0 H ALA A 620 14.246 -3.684 4.479 1.00 0.00 H new ATOM 0 HA ALA A 620 12.566 -3.971 2.252 1.00 0.00 H new ATOM 0 HB1 ALA A 620 11.251 -2.308 3.492 1.00 0.00 H new ATOM 0 HB2 ALA A 620 11.886 -3.559 4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 620 12.655 -1.955 4.528 1.00 0.00 H new ATOM 1789 N ALA A 621 14.200 -1.093 2.321 1.00 0.00 N ATOM 1790 CA ALA A 621 14.707 0.020 1.528 1.00 0.00 C ATOM 1791 C ALA A 621 15.531 -0.438 0.314 1.00 0.00 C ATOM 1792 O ALA A 621 15.309 0.025 -0.804 1.00 0.00 O ATOM 1793 CB ALA A 621 15.610 0.865 2.434 1.00 0.00 C ATOM 0 H ALA A 621 14.446 -1.015 3.308 1.00 0.00 H new ATOM 0 HA ALA A 621 13.853 0.581 1.149 1.00 0.00 H new ATOM 0 HB1 ALA A 621 16.006 1.708 1.868 1.00 0.00 H new ATOM 0 HB2 ALA A 621 15.032 1.235 3.280 1.00 0.00 H new ATOM 0 HB3 ALA A 621 16.435 0.253 2.798 1.00 0.00 H new ATOM 1799 N ARG A 622 16.501 -1.330 0.526 1.00 0.00 N ATOM 1800 CA ARG A 622 17.366 -1.878 -0.515 1.00 0.00 C ATOM 1801 C ARG A 622 16.533 -2.570 -1.585 1.00 0.00 C ATOM 1802 O ARG A 622 16.802 -2.372 -2.771 1.00 0.00 O ATOM 1803 CB ARG A 622 18.387 -2.841 0.087 1.00 0.00 C ATOM 1804 CG ARG A 622 19.494 -2.090 0.842 1.00 0.00 C ATOM 1805 CD ARG A 622 20.280 -3.126 1.635 1.00 0.00 C ATOM 1806 NE ARG A 622 21.377 -2.534 2.416 1.00 0.00 N ATOM 1807 CZ ARG A 622 21.755 -2.889 3.649 1.00 0.00 C ATOM 1808 NH1 ARG A 622 21.112 -3.838 4.327 1.00 0.00 N ATOM 1809 NH2 ARG A 622 22.791 -2.284 4.209 1.00 0.00 N ATOM 0 H ARG A 622 16.710 -1.700 1.453 1.00 0.00 H new ATOM 0 HA ARG A 622 17.910 -1.057 -0.982 1.00 0.00 H new ATOM 0 HB2 ARG A 622 17.883 -3.528 0.767 1.00 0.00 H new ATOM 0 HB3 ARG A 622 18.831 -3.444 -0.705 1.00 0.00 H new ATOM 0 HG2 ARG A 622 20.146 -1.563 0.145 1.00 0.00 H new ATOM 0 HG3 ARG A 622 19.066 -1.340 1.507 1.00 0.00 H new ATOM 0 HD2 ARG A 622 19.603 -3.652 2.309 1.00 0.00 H new ATOM 0 HD3 ARG A 622 20.688 -3.869 0.949 1.00 0.00 H new ATOM 0 HE ARG A 622 21.901 -1.779 1.974 1.00 0.00 H new ATOM 0 HH11 ARG A 622 20.312 -4.312 3.907 1.00 0.00 H new ATOM 0 HH12 ARG A 622 21.419 -4.091 5.266 1.00 0.00 H new ATOM 0 HH21 ARG A 622 23.292 -1.555 3.701 1.00 0.00 H new ATOM 0 HH22 ARG A 622 23.088 -2.547 5.149 1.00 0.00 H new ATOM 1823 N CYS A 623 15.527 -3.351 -1.179 1.00 0.00 N ATOM 1824 CA CYS A 623 14.564 -3.911 -2.110 1.00 0.00 C ATOM 1825 C CYS A 623 13.846 -2.780 -2.853 1.00 0.00 C ATOM 1826 O CYS A 623 13.778 -2.811 -4.073 1.00 0.00 O ATOM 1827 CB CYS A 623 13.570 -4.845 -1.389 1.00 0.00 C ATOM 1828 SG CYS A 623 13.702 -6.517 -2.086 1.00 0.00 S ATOM 0 H CYS A 623 15.365 -3.606 -0.205 1.00 0.00 H new ATOM 0 HA CYS A 623 15.093 -4.521 -2.843 1.00 0.00 H new ATOM 0 HB2 CYS A 623 13.783 -4.866 -0.320 1.00 0.00 H new ATOM 0 HB3 CYS A 623 12.553 -4.470 -1.504 1.00 0.00 H new ATOM 0 HG CYS A 623 12.516 -6.956 -2.388 1.00 0.00 H new ATOM 1834 N MET A 624 13.328 -1.773 -2.152 1.00 0.00 N ATOM 1835 CA MET A 624 12.534 -0.690 -2.733 1.00 0.00 C ATOM 1836 C MET A 624 13.298 0.084 -3.817 1.00 0.00 C ATOM 1837 O MET A 624 12.704 0.438 -4.835 1.00 0.00 O ATOM 1838 CB MET A 624 12.037 0.233 -1.615 1.00 0.00 C ATOM 1839 CG MET A 624 11.011 -0.480 -0.722 1.00 0.00 C ATOM 1840 SD MET A 624 9.298 -0.369 -1.287 1.00 0.00 S ATOM 1841 CE MET A 624 8.980 1.336 -0.824 1.00 0.00 C ATOM 0 H MET A 624 13.451 -1.685 -1.143 1.00 0.00 H new ATOM 0 HA MET A 624 11.674 -1.130 -3.238 1.00 0.00 H new ATOM 0 HB2 MET A 624 12.882 0.564 -1.011 1.00 0.00 H new ATOM 0 HB3 MET A 624 11.587 1.126 -2.050 1.00 0.00 H new ATOM 0 HG2 MET A 624 11.286 -1.532 -0.648 1.00 0.00 H new ATOM 0 HG3 MET A 624 11.074 -0.062 0.283 1.00 0.00 H new ATOM 0 HE1 MET A 624 7.925 1.564 -0.978 1.00 0.00 H new ATOM 0 HE2 MET A 624 9.233 1.481 0.226 1.00 0.00 H new ATOM 0 HE3 MET A 624 9.589 1.999 -1.438 1.00 0.00 H new ATOM 1851 N ARG A 625 14.609 0.302 -3.672 1.00 0.00 N ATOM 1852 CA ARG A 625 15.467 0.815 -4.750 1.00 0.00 C ATOM 1853 C ARG A 625 15.363 0.041 -6.076 1.00 0.00 C ATOM 1854 O ARG A 625 15.570 0.638 -7.133 1.00 0.00 O ATOM 1855 CB ARG A 625 16.925 0.912 -4.273 1.00 0.00 C ATOM 1856 CG ARG A 625 17.096 1.978 -3.182 1.00 0.00 C ATOM 1857 CD ARG A 625 18.548 2.387 -2.915 1.00 0.00 C ATOM 1858 NE ARG A 625 19.201 3.107 -4.024 1.00 0.00 N ATOM 1859 CZ ARG A 625 18.995 4.370 -4.428 1.00 0.00 C ATOM 1860 NH1 ARG A 625 17.909 5.051 -4.079 1.00 0.00 N ATOM 1861 NH2 ARG A 625 19.899 4.954 -5.202 1.00 0.00 N ATOM 0 H ARG A 625 15.109 0.127 -2.800 1.00 0.00 H new ATOM 0 HA ARG A 625 15.091 1.812 -4.980 1.00 0.00 H new ATOM 0 HB2 ARG A 625 17.248 -0.056 -3.890 1.00 0.00 H new ATOM 0 HB3 ARG A 625 17.570 1.151 -5.119 1.00 0.00 H new ATOM 0 HG2 ARG A 625 16.529 2.864 -3.466 1.00 0.00 H new ATOM 0 HG3 ARG A 625 16.661 1.604 -2.255 1.00 0.00 H new ATOM 0 HD2 ARG A 625 18.576 3.016 -2.025 1.00 0.00 H new ATOM 0 HD3 ARG A 625 19.128 1.492 -2.690 1.00 0.00 H new ATOM 0 HE ARG A 625 19.897 2.578 -4.550 1.00 0.00 H new ATOM 0 HH11 ARG A 625 17.202 4.615 -3.487 1.00 0.00 H new ATOM 0 HH12 ARG A 625 17.782 6.010 -4.403 1.00 0.00 H new ATOM 0 HH21 ARG A 625 20.737 4.444 -5.482 1.00 0.00 H new ATOM 0 HH22 ARG A 625 19.757 5.914 -5.517 1.00 0.00 H new ATOM 1875 N SER A 626 15.012 -1.247 -6.068 1.00 0.00 N ATOM 1876 CA SER A 626 14.820 -2.040 -7.282 1.00 0.00 C ATOM 1877 C SER A 626 13.571 -1.608 -8.069 1.00 0.00 C ATOM 1878 O SER A 626 13.510 -1.842 -9.276 1.00 0.00 O ATOM 1879 CB SER A 626 14.747 -3.529 -6.896 1.00 0.00 C ATOM 1880 OG SER A 626 14.646 -4.397 -8.009 1.00 0.00 O ATOM 0 H SER A 626 14.852 -1.773 -5.209 1.00 0.00 H new ATOM 0 HA SER A 626 15.669 -1.872 -7.945 1.00 0.00 H new ATOM 0 HB2 SER A 626 15.635 -3.791 -6.321 1.00 0.00 H new ATOM 0 HB3 SER A 626 13.887 -3.685 -6.244 1.00 0.00 H new ATOM 0 HG SER A 626 14.605 -5.325 -7.697 1.00 0.00 H new ATOM 1886 N LEU A 627 12.552 -1.024 -7.430 1.00 0.00 N ATOM 1887 CA LEU A 627 11.250 -0.732 -8.041 1.00 0.00 C ATOM 1888 C LEU A 627 11.375 0.328 -9.120 1.00 0.00 C ATOM 1889 O LEU A 627 12.004 1.361 -8.900 1.00 0.00 O ATOM 1890 CB LEU A 627 10.279 -0.280 -6.936 1.00 0.00 C ATOM 1891 CG LEU A 627 8.969 0.372 -7.409 1.00 0.00 C ATOM 1892 CD1 LEU A 627 8.099 -0.576 -8.257 1.00 0.00 C ATOM 1893 CD2 LEU A 627 8.212 0.910 -6.184 1.00 0.00 C ATOM 0 H LEU A 627 12.610 -0.735 -6.454 1.00 0.00 H new ATOM 0 HA LEU A 627 10.866 -1.632 -8.521 1.00 0.00 H new ATOM 0 HB2 LEU A 627 10.029 -1.147 -6.324 1.00 0.00 H new ATOM 0 HB3 LEU A 627 10.800 0.427 -6.290 1.00 0.00 H new ATOM 0 HG LEU A 627 9.215 1.199 -8.074 1.00 0.00 H new ATOM 0 HD11 LEU A 627 7.189 -0.060 -8.561 1.00 0.00 H new ATOM 0 HD12 LEU A 627 8.654 -0.885 -9.143 1.00 0.00 H new ATOM 0 HD13 LEU A 627 7.838 -1.455 -7.668 1.00 0.00 H new ATOM 0 HD21 LEU A 627 7.281 1.375 -6.507 1.00 0.00 H new ATOM 0 HD22 LEU A 627 7.990 0.088 -5.503 1.00 0.00 H new ATOM 0 HD23 LEU A 627 8.828 1.649 -5.672 1.00 0.00 H new ATOM 1905 N LYS A 628 10.702 0.116 -10.258 1.00 0.00 N ATOM 1906 CA LYS A 628 10.768 0.992 -11.429 1.00 0.00 C ATOM 1907 C LYS A 628 9.384 1.623 -11.657 1.00 0.00 C ATOM 1908 O LYS A 628 8.811 1.530 -12.739 1.00 0.00 O ATOM 1909 CB LYS A 628 11.369 0.240 -12.651 1.00 0.00 C ATOM 1910 CG LYS A 628 12.427 -0.857 -12.347 1.00 0.00 C ATOM 1911 CD LYS A 628 13.846 -0.410 -12.693 1.00 0.00 C ATOM 1912 CE LYS A 628 14.233 0.736 -11.756 1.00 0.00 C ATOM 1913 NZ LYS A 628 15.264 1.594 -12.354 1.00 0.00 N ATOM 0 H LYS A 628 10.085 -0.685 -10.391 1.00 0.00 H new ATOM 0 HA LYS A 628 11.457 1.820 -11.264 1.00 0.00 H new ATOM 0 HB2 LYS A 628 10.550 -0.221 -13.202 1.00 0.00 H new ATOM 0 HB3 LYS A 628 11.824 0.977 -13.313 1.00 0.00 H new ATOM 0 HG2 LYS A 628 12.380 -1.121 -11.290 1.00 0.00 H new ATOM 0 HG3 LYS A 628 12.185 -1.758 -12.911 1.00 0.00 H new ATOM 0 HD2 LYS A 628 14.543 -1.241 -12.584 1.00 0.00 H new ATOM 0 HD3 LYS A 628 13.898 -0.085 -13.732 1.00 0.00 H new ATOM 0 HE2 LYS A 628 13.350 1.333 -11.525 1.00 0.00 H new ATOM 0 HE3 LYS A 628 14.598 0.329 -10.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 628 15.504 2.361 -11.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 628 16.114 1.029 -12.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 628 14.905 2.001 -13.241 1.00 0.00 H new ATOM 1927 N ALA A 629 8.800 2.168 -10.587 1.00 0.00 N ATOM 1928 CA ALA A 629 7.535 2.908 -10.584 1.00 0.00 C ATOM 1929 C ALA A 629 7.545 3.936 -9.437 1.00 0.00 C ATOM 1930 O ALA A 629 8.245 3.704 -8.441 1.00 0.00 O ATOM 1931 CB ALA A 629 6.363 1.934 -10.389 1.00 0.00 C ATOM 0 H ALA A 629 9.214 2.103 -9.657 1.00 0.00 H new ATOM 0 HA ALA A 629 7.418 3.425 -11.537 1.00 0.00 H new ATOM 0 HB1 ALA A 629 5.425 2.489 -10.387 1.00 0.00 H new ATOM 0 HB2 ALA A 629 6.354 1.208 -11.202 1.00 0.00 H new ATOM 0 HB3 ALA A 629 6.478 1.413 -9.439 1.00 0.00 H new ATOM 1937 N PRO A 630 6.775 5.040 -9.505 1.00 0.00 N ATOM 1938 CA PRO A 630 6.568 5.922 -8.366 1.00 0.00 C ATOM 1939 C PRO A 630 5.769 5.211 -7.281 1.00 0.00 C ATOM 1940 O PRO A 630 4.846 4.447 -7.557 1.00 0.00 O ATOM 1941 CB PRO A 630 5.781 7.136 -8.872 1.00 0.00 C ATOM 1942 CG PRO A 630 5.536 6.894 -10.357 1.00 0.00 C ATOM 1943 CD PRO A 630 5.914 5.438 -10.605 1.00 0.00 C ATOM 0 HA PRO A 630 7.525 6.222 -7.938 1.00 0.00 H new ATOM 0 HB2 PRO A 630 4.839 7.241 -8.334 1.00 0.00 H new ATOM 0 HB3 PRO A 630 6.342 8.057 -8.715 1.00 0.00 H new ATOM 0 HG2 PRO A 630 4.494 7.078 -10.617 1.00 0.00 H new ATOM 0 HG3 PRO A 630 6.140 7.565 -10.968 1.00 0.00 H new ATOM 0 HD2 PRO A 630 5.025 4.809 -10.648 1.00 0.00 H new ATOM 0 HD3 PRO A 630 6.429 5.328 -11.559 1.00 0.00 H new ATOM 1951 N ALA A 631 6.080 5.514 -6.028 1.00 0.00 N ATOM 1952 CA ALA A 631 5.471 4.909 -4.869 1.00 0.00 C ATOM 1953 C ALA A 631 5.611 5.855 -3.686 1.00 0.00 C ATOM 1954 O ALA A 631 6.724 6.137 -3.237 1.00 0.00 O ATOM 1955 CB ALA A 631 6.148 3.574 -4.583 1.00 0.00 C ATOM 0 H ALA A 631 6.786 6.211 -5.791 1.00 0.00 H new ATOM 0 HA ALA A 631 4.411 4.726 -5.048 1.00 0.00 H new ATOM 0 HB1 ALA A 631 5.690 3.114 -3.707 1.00 0.00 H new ATOM 0 HB2 ALA A 631 6.030 2.915 -5.443 1.00 0.00 H new ATOM 0 HB3 ALA A 631 7.209 3.737 -4.394 1.00 0.00 H new ATOM 1961 N VAL A 632 4.477 6.322 -3.172 1.00 0.00 N ATOM 1962 CA VAL A 632 4.421 6.898 -1.835 1.00 0.00 C ATOM 1963 C VAL A 632 4.769 5.769 -0.853 1.00 0.00 C ATOM 1964 O VAL A 632 4.444 4.602 -1.120 1.00 0.00 O ATOM 1965 CB VAL A 632 3.026 7.516 -1.605 1.00 0.00 C ATOM 1966 CG1 VAL A 632 2.832 8.144 -0.221 1.00 0.00 C ATOM 1967 CG2 VAL A 632 2.745 8.641 -2.606 1.00 0.00 C ATOM 0 H VAL A 632 3.583 6.312 -3.663 1.00 0.00 H new ATOM 0 HA VAL A 632 5.133 7.711 -1.691 1.00 0.00 H new ATOM 0 HB VAL A 632 2.350 6.669 -1.720 1.00 0.00 H new ATOM 0 HG11 VAL A 632 1.825 8.554 -0.145 1.00 0.00 H new ATOM 0 HG12 VAL A 632 2.973 7.383 0.547 1.00 0.00 H new ATOM 0 HG13 VAL A 632 3.560 8.942 -0.078 1.00 0.00 H new ATOM 0 HG21 VAL A 632 1.755 9.056 -2.418 1.00 0.00 H new ATOM 0 HG22 VAL A 632 3.494 9.424 -2.493 1.00 0.00 H new ATOM 0 HG23 VAL A 632 2.786 8.244 -3.620 1.00 0.00 H new ATOM 1977 N VAL A 633 5.443 6.079 0.258 1.00 0.00 N ATOM 1978 CA VAL A 633 5.913 5.094 1.237 1.00 0.00 C ATOM 1979 C VAL A 633 5.479 5.526 2.634 1.00 0.00 C ATOM 1980 O VAL A 633 5.326 6.716 2.894 1.00 0.00 O ATOM 1981 CB VAL A 633 7.438 4.875 1.117 1.00 0.00 C ATOM 1982 CG1 VAL A 633 7.909 3.679 1.955 1.00 0.00 C ATOM 1983 CG2 VAL A 633 7.867 4.612 -0.328 1.00 0.00 C ATOM 0 H VAL A 633 5.682 7.039 0.507 1.00 0.00 H new ATOM 0 HA VAL A 633 5.458 4.125 1.034 1.00 0.00 H new ATOM 0 HB VAL A 633 7.893 5.796 1.482 1.00 0.00 H new ATOM 0 HG11 VAL A 633 8.987 3.559 1.844 1.00 0.00 H new ATOM 0 HG12 VAL A 633 7.670 3.853 3.004 1.00 0.00 H new ATOM 0 HG13 VAL A 633 7.406 2.775 1.613 1.00 0.00 H new ATOM 0 HG21 VAL A 633 8.946 4.464 -0.366 1.00 0.00 H new ATOM 0 HG22 VAL A 633 7.365 3.719 -0.700 1.00 0.00 H new ATOM 0 HG23 VAL A 633 7.596 5.466 -0.949 1.00 0.00 H new ATOM 1993 N SER A 634 5.288 4.572 3.543 1.00 0.00 N ATOM 1994 CA SER A 634 4.830 4.839 4.894 1.00 0.00 C ATOM 1995 C SER A 634 5.665 4.039 5.882 1.00 0.00 C ATOM 1996 O SER A 634 6.157 2.953 5.573 1.00 0.00 O ATOM 1997 CB SER A 634 3.334 4.512 4.927 1.00 0.00 C ATOM 1998 OG SER A 634 2.862 3.837 6.076 1.00 0.00 O ATOM 0 H SER A 634 5.450 3.583 3.355 1.00 0.00 H new ATOM 0 HA SER A 634 4.957 5.881 5.187 1.00 0.00 H new ATOM 0 HB2 SER A 634 2.778 5.444 4.827 1.00 0.00 H new ATOM 0 HB3 SER A 634 3.098 3.905 4.053 1.00 0.00 H new ATOM 0 HG SER A 634 2.407 4.474 6.666 1.00 0.00 H new ATOM 2004 N VAL A 635 5.762 4.556 7.096 1.00 0.00 N ATOM 2005 CA VAL A 635 6.340 3.922 8.261 1.00 0.00 C ATOM 2006 C VAL A 635 5.534 4.429 9.451 1.00 0.00 C ATOM 2007 O VAL A 635 4.985 5.533 9.413 1.00 0.00 O ATOM 2008 CB VAL A 635 7.842 4.253 8.395 1.00 0.00 C ATOM 2009 CG1 VAL A 635 8.735 3.184 7.756 1.00 0.00 C ATOM 2010 CG2 VAL A 635 8.232 5.628 7.839 1.00 0.00 C ATOM 0 H VAL A 635 5.415 5.492 7.303 1.00 0.00 H new ATOM 0 HA VAL A 635 6.291 2.835 8.192 1.00 0.00 H new ATOM 0 HB VAL A 635 8.011 4.272 9.472 1.00 0.00 H new ATOM 0 HG11 VAL A 635 9.781 3.464 7.877 1.00 0.00 H new ATOM 0 HG12 VAL A 635 8.558 2.224 8.241 1.00 0.00 H new ATOM 0 HG13 VAL A 635 8.502 3.102 6.694 1.00 0.00 H new ATOM 0 HG21 VAL A 635 9.303 5.784 7.971 1.00 0.00 H new ATOM 0 HG22 VAL A 635 7.987 5.674 6.778 1.00 0.00 H new ATOM 0 HG23 VAL A 635 7.684 6.405 8.372 1.00 0.00 H new ATOM 2020 N SER A 636 5.481 3.628 10.513 1.00 0.00 N ATOM 2021 CA SER A 636 4.722 3.936 11.712 1.00 0.00 C ATOM 2022 C SER A 636 5.156 5.261 12.347 1.00 0.00 C ATOM 2023 O SER A 636 4.314 5.972 12.900 1.00 0.00 O ATOM 2024 CB SER A 636 4.842 2.755 12.691 1.00 0.00 C ATOM 2025 OG SER A 636 6.117 2.116 12.631 1.00 0.00 O ATOM 0 H SER A 636 5.973 2.736 10.561 1.00 0.00 H new ATOM 0 HA SER A 636 3.674 4.072 11.445 1.00 0.00 H new ATOM 0 HB2 SER A 636 4.666 3.111 13.706 1.00 0.00 H new ATOM 0 HB3 SER A 636 4.064 2.025 12.470 1.00 0.00 H new ATOM 0 HG SER A 636 6.142 1.375 13.272 1.00 0.00 H new ATOM 2031 N SER A 637 6.447 5.600 12.271 1.00 0.00 N ATOM 2032 CA SER A 637 7.019 6.692 13.049 1.00 0.00 C ATOM 2033 C SER A 637 7.557 7.802 12.137 1.00 0.00 C ATOM 2034 O SER A 637 8.075 7.525 11.054 1.00 0.00 O ATOM 2035 CB SER A 637 8.091 6.156 14.013 1.00 0.00 C ATOM 2036 OG SER A 637 8.711 4.970 13.542 1.00 0.00 O ATOM 0 H SER A 637 7.119 5.124 11.669 1.00 0.00 H new ATOM 0 HA SER A 637 6.231 7.142 13.652 1.00 0.00 H new ATOM 0 HB2 SER A 637 8.851 6.922 14.166 1.00 0.00 H new ATOM 0 HB3 SER A 637 7.635 5.961 14.984 1.00 0.00 H new ATOM 0 HG SER A 637 9.384 4.673 14.190 1.00 0.00 H new ATOM 2042 N PRO A 638 7.509 9.068 12.584 1.00 0.00 N ATOM 2043 CA PRO A 638 7.972 10.212 11.810 1.00 0.00 C ATOM 2044 C PRO A 638 9.485 10.155 11.622 1.00 0.00 C ATOM 2045 O PRO A 638 9.992 10.478 10.551 1.00 0.00 O ATOM 2046 CB PRO A 638 7.547 11.444 12.612 1.00 0.00 C ATOM 2047 CG PRO A 638 7.494 10.937 14.051 1.00 0.00 C ATOM 2048 CD PRO A 638 7.036 9.493 13.887 1.00 0.00 C ATOM 0 HA PRO A 638 7.546 10.231 10.807 1.00 0.00 H new ATOM 0 HB2 PRO A 638 8.261 12.260 12.501 1.00 0.00 H new ATOM 0 HB3 PRO A 638 6.578 11.821 12.284 1.00 0.00 H new ATOM 0 HG2 PRO A 638 8.468 10.999 14.537 1.00 0.00 H new ATOM 0 HG3 PRO A 638 6.797 11.515 14.658 1.00 0.00 H new ATOM 0 HD2 PRO A 638 7.446 8.862 14.676 1.00 0.00 H new ATOM 0 HD3 PRO A 638 5.950 9.419 13.951 1.00 0.00 H new ATOM 2056 N ASP A 639 10.203 9.697 12.642 1.00 0.00 N ATOM 2057 CA ASP A 639 11.648 9.526 12.614 1.00 0.00 C ATOM 2058 C ASP A 639 12.072 8.450 11.624 1.00 0.00 C ATOM 2059 O ASP A 639 13.130 8.511 11.011 1.00 0.00 O ATOM 2060 CB ASP A 639 12.066 9.078 14.003 1.00 0.00 C ATOM 2061 CG ASP A 639 13.578 8.973 14.110 1.00 0.00 C ATOM 2062 OD1 ASP A 639 14.279 9.926 13.718 1.00 0.00 O ATOM 2063 OD2 ASP A 639 14.060 7.953 14.661 1.00 0.00 O ATOM 0 H ASP A 639 9.784 9.428 13.532 1.00 0.00 H new ATOM 0 HA ASP A 639 12.114 10.464 12.313 1.00 0.00 H new ATOM 0 HB2 ASP A 639 11.694 9.785 14.744 1.00 0.00 H new ATOM 0 HB3 ASP A 639 11.614 8.112 14.229 1.00 0.00 H new ATOM 2068 N ALA A 640 11.206 7.463 11.437 1.00 0.00 N ATOM 2069 CA ALA A 640 11.477 6.337 10.563 1.00 0.00 C ATOM 2070 C ALA A 640 11.382 6.778 9.112 1.00 0.00 C ATOM 2071 O ALA A 640 12.041 6.175 8.277 1.00 0.00 O ATOM 2072 CB ALA A 640 10.544 5.158 10.846 1.00 0.00 C ATOM 0 H ALA A 640 10.293 7.424 11.890 1.00 0.00 H new ATOM 0 HA ALA A 640 12.491 5.988 10.761 1.00 0.00 H new ATOM 0 HB1 ALA A 640 10.781 4.336 10.170 1.00 0.00 H new ATOM 0 HB2 ALA A 640 10.676 4.829 11.877 1.00 0.00 H new ATOM 0 HB3 ALA A 640 9.510 5.467 10.693 1.00 0.00 H new ATOM 2078 N VAL A 641 10.610 7.826 8.796 1.00 0.00 N ATOM 2079 CA VAL A 641 10.583 8.415 7.459 1.00 0.00 C ATOM 2080 C VAL A 641 12.003 8.869 7.123 1.00 0.00 C ATOM 2081 O VAL A 641 12.499 8.600 6.031 1.00 0.00 O ATOM 2082 CB VAL A 641 9.593 9.596 7.421 1.00 0.00 C ATOM 2083 CG1 VAL A 641 9.535 10.296 6.059 1.00 0.00 C ATOM 2084 CG2 VAL A 641 8.162 9.197 7.805 1.00 0.00 C ATOM 0 H VAL A 641 9.989 8.286 9.462 1.00 0.00 H new ATOM 0 HA VAL A 641 10.246 7.688 6.720 1.00 0.00 H new ATOM 0 HB VAL A 641 9.991 10.286 8.165 1.00 0.00 H new ATOM 0 HG11 VAL A 641 8.819 11.117 6.102 1.00 0.00 H new ATOM 0 HG12 VAL A 641 10.521 10.687 5.809 1.00 0.00 H new ATOM 0 HG13 VAL A 641 9.223 9.583 5.296 1.00 0.00 H new ATOM 0 HG21 VAL A 641 7.515 10.073 7.758 1.00 0.00 H new ATOM 0 HG22 VAL A 641 7.797 8.439 7.112 1.00 0.00 H new ATOM 0 HG23 VAL A 641 8.156 8.795 8.818 1.00 0.00 H new ATOM 2094 N THR A 642 12.653 9.536 8.072 1.00 0.00 N ATOM 2095 CA THR A 642 13.980 10.095 7.969 1.00 0.00 C ATOM 2096 C THR A 642 14.982 8.946 7.868 1.00 0.00 C ATOM 2097 O THR A 642 15.747 8.897 6.906 1.00 0.00 O ATOM 2098 CB THR A 642 14.131 11.024 9.185 1.00 0.00 C ATOM 2099 OG1 THR A 642 13.260 12.123 8.959 1.00 0.00 O ATOM 2100 CG2 THR A 642 15.561 11.518 9.410 1.00 0.00 C ATOM 0 H THR A 642 12.234 9.706 8.986 1.00 0.00 H new ATOM 0 HA THR A 642 14.165 10.694 7.078 1.00 0.00 H new ATOM 0 HB THR A 642 13.879 10.469 10.089 1.00 0.00 H new ATOM 0 HG1 THR A 642 13.319 12.747 9.712 1.00 0.00 H new ATOM 0 HG21 THR A 642 15.588 12.168 10.285 1.00 0.00 H new ATOM 0 HG22 THR A 642 16.220 10.665 9.571 1.00 0.00 H new ATOM 0 HG23 THR A 642 15.896 12.074 8.534 1.00 0.00 H new ATOM 2108 N THR A 643 14.918 7.977 8.781 1.00 0.00 N ATOM 2109 CA THR A 643 15.785 6.813 8.760 1.00 0.00 C ATOM 2110 C THR A 643 15.723 6.086 7.411 1.00 0.00 C ATOM 2111 O THR A 643 16.753 5.834 6.781 1.00 0.00 O ATOM 2112 CB THR A 643 15.397 5.915 9.942 1.00 0.00 C ATOM 2113 OG1 THR A 643 15.531 6.619 11.161 1.00 0.00 O ATOM 2114 CG2 THR A 643 16.174 4.612 10.074 1.00 0.00 C ATOM 0 H THR A 643 14.257 7.983 9.558 1.00 0.00 H new ATOM 0 HA THR A 643 16.827 7.114 8.871 1.00 0.00 H new ATOM 0 HB THR A 643 14.364 5.641 9.727 1.00 0.00 H new ATOM 0 HG1 THR A 643 14.757 7.207 11.286 1.00 0.00 H new ATOM 0 HG21 THR A 643 15.815 4.061 10.943 1.00 0.00 H new ATOM 0 HG22 THR A 643 16.030 4.010 9.177 1.00 0.00 H new ATOM 0 HG23 THR A 643 17.235 4.832 10.197 1.00 0.00 H new ATOM 2122 N TYR A 644 14.507 5.787 6.947 1.00 0.00 N ATOM 2123 CA TYR A 644 14.235 5.152 5.678 1.00 0.00 C ATOM 2124 C TYR A 644 14.894 5.968 4.558 1.00 0.00 C ATOM 2125 O TYR A 644 15.675 5.438 3.769 1.00 0.00 O ATOM 2126 CB TYR A 644 12.704 5.050 5.534 1.00 0.00 C ATOM 2127 CG TYR A 644 12.237 4.394 4.263 1.00 0.00 C ATOM 2128 CD1 TYR A 644 12.059 3.004 4.236 1.00 0.00 C ATOM 2129 CD2 TYR A 644 12.064 5.153 3.094 1.00 0.00 C ATOM 2130 CE1 TYR A 644 11.790 2.348 3.025 1.00 0.00 C ATOM 2131 CE2 TYR A 644 11.797 4.508 1.875 1.00 0.00 C ATOM 2132 CZ TYR A 644 11.681 3.101 1.833 1.00 0.00 C ATOM 2133 OH TYR A 644 11.524 2.477 0.640 1.00 0.00 O ATOM 0 H TYR A 644 13.659 5.993 7.475 1.00 0.00 H new ATOM 0 HA TYR A 644 14.652 4.147 5.617 1.00 0.00 H new ATOM 0 HB2 TYR A 644 12.309 4.491 6.382 1.00 0.00 H new ATOM 0 HB3 TYR A 644 12.280 6.053 5.587 1.00 0.00 H new ATOM 0 HD1 TYR A 644 12.129 2.435 5.151 1.00 0.00 H new ATOM 0 HD2 TYR A 644 12.136 6.230 3.132 1.00 0.00 H new ATOM 0 HE1 TYR A 644 11.667 1.275 3.003 1.00 0.00 H new ATOM 0 HE2 TYR A 644 11.681 5.087 0.971 1.00 0.00 H new ATOM 0 HH TYR A 644 11.465 3.146 -0.074 1.00 0.00 H new ATOM 2143 N ASN A 645 14.607 7.267 4.485 1.00 0.00 N ATOM 2144 CA ASN A 645 15.124 8.172 3.452 1.00 0.00 C ATOM 2145 C ASN A 645 16.649 8.152 3.410 1.00 0.00 C ATOM 2146 O ASN A 645 17.238 8.206 2.326 1.00 0.00 O ATOM 2147 CB ASN A 645 14.684 9.611 3.771 1.00 0.00 C ATOM 2148 CG ASN A 645 13.456 10.065 3.018 1.00 0.00 C ATOM 2149 OD1 ASN A 645 13.546 10.831 2.066 1.00 0.00 O ATOM 2150 ND2 ASN A 645 12.286 9.658 3.446 1.00 0.00 N ATOM 0 H ASN A 645 13.995 7.732 5.156 1.00 0.00 H new ATOM 0 HA ASN A 645 14.731 7.840 2.491 1.00 0.00 H new ATOM 0 HB2 ASN A 645 14.491 9.691 4.841 1.00 0.00 H new ATOM 0 HB3 ASN A 645 15.507 10.289 3.544 1.00 0.00 H new ATOM 0 HD21 ASN A 645 11.434 9.979 2.985 1.00 0.00 H new ATOM 0 HD22 ASN A 645 12.227 9.020 4.240 1.00 0.00 H new ATOM 2157 N GLY A 646 17.279 8.064 4.577 1.00 0.00 N ATOM 2158 CA GLY A 646 18.710 7.989 4.759 1.00 0.00 C ATOM 2159 C GLY A 646 19.283 6.796 4.012 1.00 0.00 C ATOM 2160 O GLY A 646 20.291 6.940 3.325 1.00 0.00 O ATOM 0 H GLY A 646 16.772 8.043 5.462 1.00 0.00 H new ATOM 0 HA2 GLY A 646 19.176 8.907 4.401 1.00 0.00 H new ATOM 0 HA3 GLY A 646 18.943 7.906 5.821 1.00 0.00 H new ATOM 2164 N TYR A 647 18.620 5.638 4.067 1.00 0.00 N ATOM 2165 CA TYR A 647 19.063 4.448 3.357 1.00 0.00 C ATOM 2166 C TYR A 647 18.969 4.630 1.846 1.00 0.00 C ATOM 2167 O TYR A 647 19.815 4.094 1.130 1.00 0.00 O ATOM 2168 CB TYR A 647 18.263 3.211 3.780 1.00 0.00 C ATOM 2169 CG TYR A 647 18.214 2.925 5.270 1.00 0.00 C ATOM 2170 CD1 TYR A 647 19.328 3.142 6.108 1.00 0.00 C ATOM 2171 CD2 TYR A 647 17.040 2.386 5.815 1.00 0.00 C ATOM 2172 CE1 TYR A 647 19.268 2.831 7.479 1.00 0.00 C ATOM 2173 CE2 TYR A 647 16.972 2.073 7.178 1.00 0.00 C ATOM 2174 CZ TYR A 647 18.082 2.292 8.026 1.00 0.00 C ATOM 2175 OH TYR A 647 18.014 1.952 9.344 1.00 0.00 O ATOM 0 H TYR A 647 17.764 5.505 4.605 1.00 0.00 H new ATOM 0 HA TYR A 647 20.109 4.295 3.624 1.00 0.00 H new ATOM 0 HB2 TYR A 647 17.241 3.323 3.418 1.00 0.00 H new ATOM 0 HB3 TYR A 647 18.685 2.341 3.277 1.00 0.00 H new ATOM 0 HD1 TYR A 647 20.237 3.551 5.693 1.00 0.00 H new ATOM 0 HD2 TYR A 647 16.184 2.211 5.180 1.00 0.00 H new ATOM 0 HE1 TYR A 647 20.126 3.004 8.111 1.00 0.00 H new ATOM 0 HE2 TYR A 647 16.062 1.660 7.586 1.00 0.00 H new ATOM 0 HH TYR A 647 17.122 1.598 9.545 1.00 0.00 H new ATOM 2185 N LEU A 648 17.989 5.399 1.351 1.00 0.00 N ATOM 2186 CA LEU A 648 17.885 5.656 -0.088 1.00 0.00 C ATOM 2187 C LEU A 648 19.054 6.510 -0.577 1.00 0.00 C ATOM 2188 O LEU A 648 19.378 6.472 -1.762 1.00 0.00 O ATOM 2189 CB LEU A 648 16.552 6.306 -0.491 1.00 0.00 C ATOM 2190 CG LEU A 648 15.290 5.469 -0.212 1.00 0.00 C ATOM 2191 CD1 LEU A 648 14.142 5.871 -1.145 1.00 0.00 C ATOM 2192 CD2 LEU A 648 15.447 3.960 -0.433 1.00 0.00 C ATOM 0 H LEU A 648 17.268 5.847 1.917 1.00 0.00 H new ATOM 0 HA LEU A 648 17.923 4.680 -0.572 1.00 0.00 H new ATOM 0 HB2 LEU A 648 16.459 7.256 0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 648 16.587 6.533 -1.557 1.00 0.00 H new ATOM 0 HG LEU A 648 15.095 5.670 0.841 1.00 0.00 H new ATOM 0 HD11 LEU A 648 13.264 5.263 -0.925 1.00 0.00 H new ATOM 0 HD12 LEU A 648 13.902 6.923 -0.994 1.00 0.00 H new ATOM 0 HD13 LEU A 648 14.442 5.713 -2.181 1.00 0.00 H new ATOM 0 HD21 LEU A 648 14.505 3.460 -0.210 1.00 0.00 H new ATOM 0 HD22 LEU A 648 15.722 3.771 -1.471 1.00 0.00 H new ATOM 0 HD23 LEU A 648 16.226 3.575 0.225 1.00 0.00 H new ATOM 2204 N THR A 649 19.714 7.243 0.320 1.00 0.00 N ATOM 2205 CA THR A 649 20.900 8.037 -0.013 1.00 0.00 C ATOM 2206 C THR A 649 22.167 7.476 0.676 1.00 0.00 C ATOM 2207 O THR A 649 23.211 8.127 0.711 1.00 0.00 O ATOM 2208 CB THR A 649 20.602 9.535 0.236 1.00 0.00 C ATOM 2209 OG1 THR A 649 19.257 9.863 -0.096 1.00 0.00 O ATOM 2210 CG2 THR A 649 21.454 10.430 -0.661 1.00 0.00 C ATOM 0 H THR A 649 19.442 7.304 1.301 1.00 0.00 H new ATOM 0 HA THR A 649 21.133 7.956 -1.075 1.00 0.00 H new ATOM 0 HB THR A 649 20.811 9.698 1.293 1.00 0.00 H new ATOM 0 HG1 THR A 649 19.101 10.815 0.074 1.00 0.00 H new ATOM 0 HG21 THR A 649 21.219 11.475 -0.460 1.00 0.00 H new ATOM 0 HG22 THR A 649 22.510 10.250 -0.458 1.00 0.00 H new ATOM 0 HG23 THR A 649 21.242 10.205 -1.706 1.00 0.00 H new ATOM 2218 N SER A 650 22.105 6.253 1.218 1.00 0.00 N ATOM 2219 CA SER A 650 23.269 5.504 1.671 1.00 0.00 C ATOM 2220 C SER A 650 24.038 5.093 0.414 1.00 0.00 C ATOM 2221 O SER A 650 25.031 5.725 0.052 1.00 0.00 O ATOM 2222 CB SER A 650 22.799 4.333 2.561 1.00 0.00 C ATOM 2223 OG SER A 650 23.833 3.514 3.088 1.00 0.00 O ATOM 0 H SER A 650 21.226 5.753 1.353 1.00 0.00 H new ATOM 0 HA SER A 650 23.947 6.082 2.299 1.00 0.00 H new ATOM 0 HB2 SER A 650 22.222 4.739 3.392 1.00 0.00 H new ATOM 0 HB3 SER A 650 22.123 3.706 1.980 1.00 0.00 H new ATOM 0 HG SER A 650 23.440 2.804 3.637 1.00 0.00 H new ATOM 2229 N SER A 651 23.541 4.067 -0.270 1.00 0.00 N ATOM 2230 CA SER A 651 24.101 3.487 -1.472 1.00 0.00 C ATOM 2231 C SER A 651 23.955 4.478 -2.614 1.00 0.00 C ATOM 2232 O SER A 651 24.966 5.065 -3.053 1.00 0.00 O ATOM 2233 CB SER A 651 23.356 2.168 -1.723 1.00 0.00 C ATOM 2234 OG SER A 651 23.346 1.370 -0.545 1.00 0.00 O ATOM 0 H SER A 651 22.686 3.595 0.023 1.00 0.00 H new ATOM 0 HA SER A 651 25.166 3.274 -1.379 1.00 0.00 H new ATOM 0 HB2 SER A 651 22.333 2.375 -2.038 1.00 0.00 H new ATOM 0 HB3 SER A 651 23.835 1.622 -2.536 1.00 0.00 H new ATOM 0 HG SER A 651 22.866 0.534 -0.720 1.00 0.00 H new TER 2240 SER A 651