USER MOD reduce.3.24.130724 H: found=0, std=0, add=1157, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1159 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 543 LYS NZ :NH3+ 178:sc= -0.403 (180deg=-0.312) USER MOD Set 1.2: A 674 GLN : amide:sc= -2.25 K(o=-2.7,f=-11!) USER MOD Set 2.1: A 657 HIS : no HE2:sc= -13.4! C(o=-22!,f=-21!) USER MOD Set 2.2: A 673 HIS : no HE2:sc= -8.56! C(o=-22!,f=-24!) USER MOD Set 3.1: A 628 SER OG : rot -118:sc= 0.0841 USER MOD Set 3.2: A 640 TYR OH : rot 130:sc= -0.968 USER MOD Set 4.1: A 570 MET CE :methyl -156:sc= -5.15! (180deg=-3.62!) USER MOD Set 4.2: A 576 SER OG : rot 145:sc= -2.08! USER MOD Single : A 547 SER OG : rot -10:sc= -0.284! USER MOD Single : A 549 MET CE :methyl -151:sc= -0.15 (180deg=-0.739) USER MOD Single : A 550 TYR OH : rot 143:sc= -1.31! USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 552 THR OG1 : rot 180:sc= -0.119 USER MOD Single : A 553 GLN : amide:sc= -2.4 K(o=-2.4,f=-0.21) USER MOD Single : A 554 GLN : amide:sc= -4.63 K(o=-4.6,f=-3.3!) USER MOD Single : A 564 CYS SG : rot -105:sc= -6.14! USER MOD Single : A 566 HIS : no HD1:sc= 0 X(o=0,f=-0.0074) USER MOD Single : A 573 ASN : amide:sc= -0.0847 X(o=-0.085,f=-0.39) USER MOD Single : A 575 TYR OH : rot 180:sc= 0 USER MOD Single : A 581 LYS NZ :NH3+ 162:sc= 0.0243 (180deg=0.00136) USER MOD Single : A 585 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 588 MET CE :methyl 174:sc= 0 (180deg=-0.0749) USER MOD Single : A 590 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 591 LYS NZ :NH3+ -160:sc= -0.241 (180deg=-0.853) USER MOD Single : A 593 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 594 HIS : no HD1:sc= -6.59! C(o=-6.6!,f=-7!) USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot 121:sc= 2.68 USER MOD Single : A 597 GLN : amide:sc= -0.0277 X(o=-0.028,f=-0.32) USER MOD Single : A 599 LYS NZ :NH3+ -130:sc= 0.795 (180deg=-2.76!) USER MOD Single : A 600 LYS NZ :NH3+ 172:sc= -0.728 (180deg=-0.93) USER MOD Single : A 601 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 602 THR OG1 : rot 180:sc= 0 USER MOD Single : A 604 ASN : amide:sc= 0.866 K(o=0.87,f=-4.8!) USER MOD Single : A 608 ASN : amide:sc= -0.0925 K(o=-0.092,f=-1.8!) USER MOD Single : A 613 TYR OH : rot -114:sc= 1.11 USER MOD Single : A 616 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 617 HIS : no HD1:sc= -3.83! C(o=-3.8!,f=-12!) USER MOD Single : A 618 SER OG : rot 180:sc= 0 USER MOD Single : A 622 LYS NZ :NH3+ -102:sc= 0.144 (180deg=-1.92!) USER MOD Single : A 623 LYS NZ :NH3+ 173:sc= -3.82! (180deg=-4.14!) USER MOD Single : A 624 SER OG : rot 180:sc= -1.37 USER MOD Single : A 632 TYR OH : rot 180:sc= 0 USER MOD Single : A 636 LYS NZ :NH3+ 180:sc= -0.129 (180deg=-0.129) USER MOD Single : A 637 SER OG : rot 180:sc= 0.0908 USER MOD Single : A 638 ASN : amide:sc= 0.309! C(o=0.31!,f=-5.1!) USER MOD Single : A 644 CYS SG : rot 45:sc= 0.255 USER MOD Single : A 645 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 649 SER OG : rot -47:sc= 0.0213 USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 656 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 659 TYR OH : rot 180:sc= 0 USER MOD Single : A 661 CYS SG : rot -27:sc= -2.83! USER MOD Single : A 663 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 664 ASN : amide:sc= -2.38! C(o=-2.4!,f=-6.9!) USER MOD Single : A 665 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 668 LYS NZ :NH3+ -154:sc= -0.839 (180deg=-2.21!) USER MOD Single : A 676 GLN : amide:sc= -0.331 K(o=-0.33,f=-2.6!) USER MOD Single : A 677 ASN : amide:sc= -1.38 K(o=-1.4,f=-2!) USER MOD Single : A 679 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 680 HIS : no HD1:sc= -0.636 K(o=-0.64,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 541 -2.128 -11.584 11.315 1.00 0.00 N ATOM 2 CA ARG A 541 -1.727 -10.181 11.027 1.00 0.00 C ATOM 3 C ARG A 541 -2.781 -9.466 10.190 1.00 0.00 C ATOM 4 O ARG A 541 -3.061 -8.286 10.403 1.00 0.00 O ATOM 5 CB ARG A 541 -0.388 -10.200 10.287 1.00 0.00 C ATOM 6 CG ARG A 541 0.758 -9.601 11.087 1.00 0.00 C ATOM 7 CD ARG A 541 1.049 -10.414 12.338 1.00 0.00 C ATOM 8 NE ARG A 541 2.316 -11.133 12.240 1.00 0.00 N ATOM 9 CZ ARG A 541 2.436 -12.344 11.708 1.00 0.00 C ATOM 10 NH1 ARG A 541 1.370 -12.969 11.227 1.00 0.00 N ATOM 11 NH2 ARG A 541 3.624 -12.933 11.656 1.00 0.00 N ATOM 0 HA ARG A 541 -1.631 -9.636 11.966 1.00 0.00 H new ATOM 0 HB2 ARG A 541 -0.140 -11.229 10.028 1.00 0.00 H new ATOM 0 HB3 ARG A 541 -0.492 -9.652 9.351 1.00 0.00 H new ATOM 0 HG2 ARG A 541 1.652 -9.555 10.465 1.00 0.00 H new ATOM 0 HG3 ARG A 541 0.512 -8.577 11.367 1.00 0.00 H new ATOM 0 HD2 ARG A 541 1.074 -9.752 13.203 1.00 0.00 H new ATOM 0 HD3 ARG A 541 0.240 -11.125 12.504 1.00 0.00 H new ATOM 0 HE ARG A 541 3.156 -10.680 12.600 1.00 0.00 H new ATOM 0 HH11 ARG A 541 0.455 -12.520 11.265 1.00 0.00 H new ATOM 0 HH12 ARG A 541 1.465 -13.899 10.819 1.00 0.00 H new ATOM 0 HH21 ARG A 541 4.446 -12.456 12.025 1.00 0.00 H new ATOM 0 HH22 ARG A 541 3.715 -13.863 11.247 1.00 0.00 H new ATOM 27 N GLY A 542 -3.365 -10.187 9.239 1.00 0.00 N ATOM 28 CA GLY A 542 -4.384 -9.601 8.387 1.00 0.00 C ATOM 29 C GLY A 542 -3.911 -9.408 6.960 1.00 0.00 C ATOM 30 O GLY A 542 -2.739 -9.628 6.650 1.00 0.00 O ATOM 0 H GLY A 542 -3.152 -11.165 9.043 1.00 0.00 H new ATOM 0 HA2 GLY A 542 -5.267 -10.241 8.390 1.00 0.00 H new ATOM 0 HA3 GLY A 542 -4.687 -8.638 8.799 1.00 0.00 H new ATOM 34 N LYS A 543 -4.825 -8.995 6.087 1.00 0.00 N ATOM 35 CA LYS A 543 -4.500 -8.769 4.683 1.00 0.00 C ATOM 36 C LYS A 543 -5.112 -7.458 4.199 1.00 0.00 C ATOM 37 O LYS A 543 -6.269 -7.160 4.493 1.00 0.00 O ATOM 38 CB LYS A 543 -5.009 -9.931 3.826 1.00 0.00 C ATOM 39 CG LYS A 543 -4.942 -11.279 4.526 1.00 0.00 C ATOM 40 CD LYS A 543 -6.284 -11.993 4.490 1.00 0.00 C ATOM 41 CE LYS A 543 -6.292 -13.212 5.398 1.00 0.00 C ATOM 42 NZ LYS A 543 -5.048 -14.018 5.257 1.00 0.00 N ATOM 0 H LYS A 543 -5.799 -8.810 6.328 1.00 0.00 H new ATOM 0 HA LYS A 543 -3.416 -8.707 4.586 1.00 0.00 H new ATOM 0 HB2 LYS A 543 -6.041 -9.733 3.536 1.00 0.00 H new ATOM 0 HB3 LYS A 543 -4.423 -9.978 2.908 1.00 0.00 H new ATOM 0 HG2 LYS A 543 -4.185 -11.901 4.048 1.00 0.00 H new ATOM 0 HG3 LYS A 543 -4.632 -11.138 5.561 1.00 0.00 H new ATOM 0 HD2 LYS A 543 -7.072 -11.305 4.797 1.00 0.00 H new ATOM 0 HD3 LYS A 543 -6.507 -12.298 3.468 1.00 0.00 H new ATOM 0 HE2 LYS A 543 -6.402 -12.892 6.434 1.00 0.00 H new ATOM 0 HE3 LYS A 543 -7.156 -13.834 5.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 -5.078 -14.821 5.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 -4.973 -14.373 4.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 -4.223 -13.423 5.473 1.00 0.00 H new ATOM 56 N ILE A 544 -4.331 -6.676 3.460 1.00 0.00 N ATOM 57 CA ILE A 544 -4.810 -5.398 2.947 1.00 0.00 C ATOM 58 C ILE A 544 -4.961 -5.429 1.429 1.00 0.00 C ATOM 59 O ILE A 544 -4.040 -5.813 0.708 1.00 0.00 O ATOM 60 CB ILE A 544 -3.872 -4.239 3.346 1.00 0.00 C ATOM 61 CG1 ILE A 544 -4.636 -2.914 3.346 1.00 0.00 C ATOM 62 CG2 ILE A 544 -2.674 -4.162 2.410 1.00 0.00 C ATOM 63 CD1 ILE A 544 -4.686 -2.245 1.989 1.00 0.00 C ATOM 0 H ILE A 544 -3.370 -6.903 3.205 1.00 0.00 H new ATOM 0 HA ILE A 544 -5.788 -5.227 3.396 1.00 0.00 H new ATOM 0 HB ILE A 544 -3.503 -4.430 4.353 1.00 0.00 H new ATOM 0 HG12 ILE A 544 -5.654 -3.091 3.693 1.00 0.00 H new ATOM 0 HG13 ILE A 544 -4.170 -2.235 4.060 1.00 0.00 H new ATOM 0 HG21 ILE A 544 -2.028 -3.337 2.712 1.00 0.00 H new ATOM 0 HG22 ILE A 544 -2.115 -5.097 2.457 1.00 0.00 H new ATOM 0 HG23 ILE A 544 -3.020 -3.997 1.390 1.00 0.00 H new ATOM 0 HD11 ILE A 544 -5.243 -1.311 2.064 1.00 0.00 H new ATOM 0 HD12 ILE A 544 -3.672 -2.036 1.649 1.00 0.00 H new ATOM 0 HD13 ILE A 544 -5.179 -2.905 1.276 1.00 0.00 H new ATOM 75 N LEU A 545 -6.132 -5.017 0.953 1.00 0.00 N ATOM 76 CA LEU A 545 -6.413 -4.990 -0.476 1.00 0.00 C ATOM 77 C LEU A 545 -5.819 -3.742 -1.116 1.00 0.00 C ATOM 78 O LEU A 545 -6.213 -2.621 -0.796 1.00 0.00 O ATOM 79 CB LEU A 545 -7.923 -5.032 -0.720 1.00 0.00 C ATOM 80 CG LEU A 545 -8.341 -5.359 -2.153 1.00 0.00 C ATOM 81 CD1 LEU A 545 -8.092 -6.825 -2.460 1.00 0.00 C ATOM 82 CD2 LEU A 545 -9.805 -5.012 -2.374 1.00 0.00 C ATOM 0 H LEU A 545 -6.903 -4.697 1.539 1.00 0.00 H new ATOM 0 HA LEU A 545 -5.955 -5.868 -0.932 1.00 0.00 H new ATOM 0 HB2 LEU A 545 -8.362 -5.773 -0.052 1.00 0.00 H new ATOM 0 HB3 LEU A 545 -8.346 -4.065 -0.446 1.00 0.00 H new ATOM 0 HG LEU A 545 -7.737 -4.757 -2.832 1.00 0.00 H new ATOM 0 HD11 LEU A 545 -8.396 -7.039 -3.485 1.00 0.00 H new ATOM 0 HD12 LEU A 545 -7.031 -7.046 -2.342 1.00 0.00 H new ATOM 0 HD13 LEU A 545 -8.670 -7.444 -1.774 1.00 0.00 H new ATOM 0 HD21 LEU A 545 -10.085 -5.252 -3.400 1.00 0.00 H new ATOM 0 HD22 LEU A 545 -10.423 -5.588 -1.685 1.00 0.00 H new ATOM 0 HD23 LEU A 545 -9.958 -3.948 -2.195 1.00 0.00 H new ATOM 94 N VAL A 546 -4.865 -3.942 -2.017 1.00 0.00 N ATOM 95 CA VAL A 546 -4.215 -2.829 -2.695 1.00 0.00 C ATOM 96 C VAL A 546 -4.495 -2.854 -4.193 1.00 0.00 C ATOM 97 O VAL A 546 -4.333 -3.883 -4.849 1.00 0.00 O ATOM 98 CB VAL A 546 -2.691 -2.848 -2.473 1.00 0.00 C ATOM 99 CG1 VAL A 546 -2.005 -1.836 -3.377 1.00 0.00 C ATOM 100 CG2 VAL A 546 -2.361 -2.580 -1.013 1.00 0.00 C ATOM 0 H VAL A 546 -4.525 -4.863 -2.294 1.00 0.00 H new ATOM 0 HA VAL A 546 -4.629 -1.917 -2.266 1.00 0.00 H new ATOM 0 HB VAL A 546 -2.318 -3.839 -2.730 1.00 0.00 H new ATOM 0 HG11 VAL A 546 -0.929 -1.865 -3.205 1.00 0.00 H new ATOM 0 HG12 VAL A 546 -2.213 -2.079 -4.419 1.00 0.00 H new ATOM 0 HG13 VAL A 546 -2.381 -0.837 -3.156 1.00 0.00 H new ATOM 0 HG21 VAL A 546 -1.280 -2.597 -0.875 1.00 0.00 H new ATOM 0 HG22 VAL A 546 -2.748 -1.602 -0.726 1.00 0.00 H new ATOM 0 HG23 VAL A 546 -2.819 -3.348 -0.390 1.00 0.00 H new ATOM 110 N SER A 547 -4.912 -1.713 -4.731 1.00 0.00 N ATOM 111 CA SER A 547 -5.209 -1.603 -6.153 1.00 0.00 C ATOM 112 C SER A 547 -4.238 -0.641 -6.832 1.00 0.00 C ATOM 113 O SER A 547 -4.195 0.544 -6.507 1.00 0.00 O ATOM 114 CB SER A 547 -6.648 -1.129 -6.363 1.00 0.00 C ATOM 115 OG SER A 547 -6.703 0.277 -6.535 1.00 0.00 O ATOM 0 H SER A 547 -5.052 -0.852 -4.203 1.00 0.00 H new ATOM 0 HA SER A 547 -5.094 -2.589 -6.602 1.00 0.00 H new ATOM 0 HB2 SER A 547 -7.072 -1.622 -7.237 1.00 0.00 H new ATOM 0 HB3 SER A 547 -7.258 -1.418 -5.507 1.00 0.00 H new ATOM 0 HG SER A 547 -5.830 0.667 -6.319 1.00 0.00 H new ATOM 121 N LEU A 548 -3.456 -1.161 -7.772 1.00 0.00 N ATOM 122 CA LEU A 548 -2.481 -0.350 -8.491 1.00 0.00 C ATOM 123 C LEU A 548 -3.002 0.059 -9.865 1.00 0.00 C ATOM 124 O LEU A 548 -3.969 -0.509 -10.371 1.00 0.00 O ATOM 125 CB LEU A 548 -1.170 -1.117 -8.651 1.00 0.00 C ATOM 126 CG LEU A 548 -0.355 -1.287 -7.370 1.00 0.00 C ATOM 127 CD1 LEU A 548 1.052 -1.749 -7.701 1.00 0.00 C ATOM 128 CD2 LEU A 548 -0.319 0.015 -6.585 1.00 0.00 C ATOM 0 H LEU A 548 -3.479 -2.141 -8.054 1.00 0.00 H new ATOM 0 HA LEU A 548 -2.307 0.553 -7.906 1.00 0.00 H new ATOM 0 HB2 LEU A 548 -1.393 -2.105 -9.055 1.00 0.00 H new ATOM 0 HB3 LEU A 548 -0.554 -0.602 -9.389 1.00 0.00 H new ATOM 0 HG LEU A 548 -0.833 -2.046 -6.751 1.00 0.00 H new ATOM 0 HD11 LEU A 548 1.623 -1.866 -6.780 1.00 0.00 H new ATOM 0 HD12 LEU A 548 1.008 -2.704 -8.225 1.00 0.00 H new ATOM 0 HD13 LEU A 548 1.538 -1.009 -8.337 1.00 0.00 H new ATOM 0 HD21 LEU A 548 0.266 -0.124 -5.676 1.00 0.00 H new ATOM 0 HD22 LEU A 548 0.138 0.795 -7.194 1.00 0.00 H new ATOM 0 HD23 LEU A 548 -1.335 0.309 -6.322 1.00 0.00 H new ATOM 140 N MET A 549 -2.340 1.047 -10.461 1.00 0.00 N ATOM 141 CA MET A 549 -2.712 1.546 -11.780 1.00 0.00 C ATOM 142 C MET A 549 -1.871 2.763 -12.146 1.00 0.00 C ATOM 143 O MET A 549 -1.792 3.722 -11.380 1.00 0.00 O ATOM 144 CB MET A 549 -4.195 1.921 -11.820 1.00 0.00 C ATOM 145 CG MET A 549 -4.795 1.881 -13.217 1.00 0.00 C ATOM 146 SD MET A 549 -5.251 3.518 -13.822 1.00 0.00 S ATOM 147 CE MET A 549 -6.484 3.993 -12.613 1.00 0.00 C ATOM 0 H MET A 549 -1.537 1.520 -10.047 1.00 0.00 H new ATOM 0 HA MET A 549 -2.528 0.751 -12.503 1.00 0.00 H new ATOM 0 HB2 MET A 549 -4.751 1.240 -11.175 1.00 0.00 H new ATOM 0 HB3 MET A 549 -4.319 2.923 -11.409 1.00 0.00 H new ATOM 0 HG2 MET A 549 -4.078 1.430 -13.904 1.00 0.00 H new ATOM 0 HG3 MET A 549 -5.677 1.241 -13.212 1.00 0.00 H new ATOM 0 HE1 MET A 549 -7.203 4.670 -13.074 1.00 0.00 H new ATOM 0 HE2 MET A 549 -7.002 3.104 -12.253 1.00 0.00 H new ATOM 0 HE3 MET A 549 -5.998 4.494 -11.776 1.00 0.00 H new ATOM 157 N TYR A 550 -1.251 2.725 -13.318 1.00 0.00 N ATOM 158 CA TYR A 550 -0.426 3.836 -13.771 1.00 0.00 C ATOM 159 C TYR A 550 -1.114 4.594 -14.900 1.00 0.00 C ATOM 160 O TYR A 550 -1.606 3.994 -15.855 1.00 0.00 O ATOM 161 CB TYR A 550 0.947 3.348 -14.231 1.00 0.00 C ATOM 162 CG TYR A 550 1.915 4.474 -14.504 1.00 0.00 C ATOM 163 CD1 TYR A 550 1.996 5.052 -15.763 1.00 0.00 C ATOM 164 CD2 TYR A 550 2.743 4.963 -13.503 1.00 0.00 C ATOM 165 CE1 TYR A 550 2.876 6.086 -16.018 1.00 0.00 C ATOM 166 CE2 TYR A 550 3.627 5.997 -13.748 1.00 0.00 C ATOM 167 CZ TYR A 550 3.690 6.556 -15.007 1.00 0.00 C ATOM 168 OH TYR A 550 4.569 7.584 -15.257 1.00 0.00 O ATOM 0 H TYR A 550 -1.303 1.941 -13.969 1.00 0.00 H new ATOM 0 HA TYR A 550 -0.288 4.512 -12.927 1.00 0.00 H new ATOM 0 HB2 TYR A 550 1.367 2.693 -13.468 1.00 0.00 H new ATOM 0 HB3 TYR A 550 0.829 2.751 -15.135 1.00 0.00 H new ATOM 0 HD1 TYR A 550 1.361 4.687 -16.557 1.00 0.00 H new ATOM 0 HD2 TYR A 550 2.696 4.528 -12.516 1.00 0.00 H new ATOM 0 HE1 TYR A 550 2.927 6.525 -17.004 1.00 0.00 H new ATOM 0 HE2 TYR A 550 4.265 6.365 -12.958 1.00 0.00 H new ATOM 0 HH TYR A 550 4.619 8.170 -14.473 1.00 0.00 H new ATOM 178 N SER A 551 -1.148 5.915 -14.778 1.00 0.00 N ATOM 179 CA SER A 551 -1.781 6.758 -15.786 1.00 0.00 C ATOM 180 C SER A 551 -0.743 7.371 -16.721 1.00 0.00 C ATOM 181 O SER A 551 -0.358 8.529 -16.562 1.00 0.00 O ATOM 182 CB SER A 551 -2.595 7.865 -15.111 1.00 0.00 C ATOM 183 OG SER A 551 -3.665 8.288 -15.937 1.00 0.00 O ATOM 0 H SER A 551 -0.745 6.426 -13.992 1.00 0.00 H new ATOM 0 HA SER A 551 -2.447 6.132 -16.380 1.00 0.00 H new ATOM 0 HB2 SER A 551 -2.987 7.504 -14.160 1.00 0.00 H new ATOM 0 HB3 SER A 551 -1.947 8.713 -14.888 1.00 0.00 H new ATOM 0 HG SER A 551 -4.170 8.994 -15.482 1.00 0.00 H new ATOM 189 N THR A 552 -0.299 6.588 -17.700 1.00 0.00 N ATOM 190 CA THR A 552 0.688 7.060 -18.666 1.00 0.00 C ATOM 191 C THR A 552 0.236 8.373 -19.284 1.00 0.00 C ATOM 192 O THR A 552 1.032 9.295 -19.467 1.00 0.00 O ATOM 193 CB THR A 552 0.910 6.022 -19.765 1.00 0.00 C ATOM 194 OG1 THR A 552 -0.015 6.206 -20.823 1.00 0.00 O ATOM 195 CG2 THR A 552 0.774 4.597 -19.282 1.00 0.00 C ATOM 0 H THR A 552 -0.606 5.626 -17.845 1.00 0.00 H new ATOM 0 HA THR A 552 1.629 7.218 -18.139 1.00 0.00 H new ATOM 0 HB THR A 552 1.935 6.177 -20.103 1.00 0.00 H new ATOM 0 HG1 THR A 552 0.144 5.533 -21.517 1.00 0.00 H new ATOM 0 HG21 THR A 552 0.944 3.913 -20.114 1.00 0.00 H new ATOM 0 HG22 THR A 552 1.508 4.406 -18.499 1.00 0.00 H new ATOM 0 HG23 THR A 552 -0.229 4.442 -18.884 1.00 0.00 H new ATOM 203 N GLN A 553 -1.053 8.455 -19.592 1.00 0.00 N ATOM 204 CA GLN A 553 -1.620 9.656 -20.175 1.00 0.00 C ATOM 205 C GLN A 553 -0.992 10.885 -19.540 1.00 0.00 C ATOM 206 O GLN A 553 -0.665 11.859 -20.217 1.00 0.00 O ATOM 207 CB GLN A 553 -3.130 9.669 -19.956 1.00 0.00 C ATOM 208 CG GLN A 553 -3.895 10.340 -21.076 1.00 0.00 C ATOM 209 CD GLN A 553 -4.519 11.657 -20.653 1.00 0.00 C ATOM 210 OE1 GLN A 553 -5.574 12.046 -21.153 1.00 0.00 O ATOM 211 NE2 GLN A 553 -3.866 12.353 -19.726 1.00 0.00 N ATOM 0 H GLN A 553 -1.723 7.700 -19.446 1.00 0.00 H new ATOM 0 HA GLN A 553 -1.414 9.668 -21.245 1.00 0.00 H new ATOM 0 HB2 GLN A 553 -3.483 8.643 -19.849 1.00 0.00 H new ATOM 0 HB3 GLN A 553 -3.349 10.181 -19.019 1.00 0.00 H new ATOM 0 HG2 GLN A 553 -3.223 10.515 -21.916 1.00 0.00 H new ATOM 0 HG3 GLN A 553 -4.678 9.669 -21.429 1.00 0.00 H new ATOM 0 HE21 GLN A 553 -2.994 11.993 -19.338 1.00 0.00 H new ATOM 0 HE22 GLN A 553 -4.237 13.246 -19.403 1.00 0.00 H new ATOM 220 N GLN A 554 -0.825 10.816 -18.229 1.00 0.00 N ATOM 221 CA GLN A 554 -0.231 11.906 -17.470 1.00 0.00 C ATOM 222 C GLN A 554 1.237 11.613 -17.199 1.00 0.00 C ATOM 223 O GLN A 554 2.088 12.500 -17.262 1.00 0.00 O ATOM 224 CB GLN A 554 -1.007 12.108 -16.162 1.00 0.00 C ATOM 225 CG GLN A 554 -0.265 11.669 -14.909 1.00 0.00 C ATOM 226 CD GLN A 554 0.713 12.717 -14.414 1.00 0.00 C ATOM 227 OE1 GLN A 554 0.515 13.914 -14.621 1.00 0.00 O ATOM 228 NE2 GLN A 554 1.777 12.271 -13.756 1.00 0.00 N ATOM 0 H GLN A 554 -1.095 10.010 -17.664 1.00 0.00 H new ATOM 0 HA GLN A 554 -0.289 12.828 -18.049 1.00 0.00 H new ATOM 0 HB2 GLN A 554 -1.262 13.163 -16.066 1.00 0.00 H new ATOM 0 HB3 GLN A 554 -1.946 11.558 -16.224 1.00 0.00 H new ATOM 0 HG2 GLN A 554 -0.986 11.450 -14.122 1.00 0.00 H new ATOM 0 HG3 GLN A 554 0.273 10.744 -15.115 1.00 0.00 H new ATOM 0 HE21 GLN A 554 1.902 11.270 -13.607 1.00 0.00 H new ATOM 0 HE22 GLN A 554 2.469 12.930 -13.400 1.00 0.00 H new ATOM 237 N GLY A 555 1.516 10.355 -16.900 1.00 0.00 N ATOM 238 CA GLY A 555 2.876 9.937 -16.623 1.00 0.00 C ATOM 239 C GLY A 555 3.123 9.703 -15.147 1.00 0.00 C ATOM 240 O GLY A 555 4.234 9.908 -14.657 1.00 0.00 O ATOM 0 H GLY A 555 0.821 9.610 -16.844 1.00 0.00 H new ATOM 0 HA2 GLY A 555 3.090 9.021 -17.173 1.00 0.00 H new ATOM 0 HA3 GLY A 555 3.567 10.697 -16.988 1.00 0.00 H new ATOM 244 N GLY A 556 2.087 9.273 -14.436 1.00 0.00 N ATOM 245 CA GLY A 556 2.226 9.021 -13.012 1.00 0.00 C ATOM 246 C GLY A 556 1.630 7.692 -12.589 1.00 0.00 C ATOM 247 O GLY A 556 0.839 7.098 -13.319 1.00 0.00 O ATOM 0 H GLY A 556 1.158 9.095 -14.817 1.00 0.00 H new ATOM 0 HA2 GLY A 556 3.283 9.041 -12.746 1.00 0.00 H new ATOM 0 HA3 GLY A 556 1.742 9.824 -12.457 1.00 0.00 H new ATOM 251 N LEU A 557 2.009 7.230 -11.400 1.00 0.00 N ATOM 252 CA LEU A 557 1.506 5.968 -10.873 1.00 0.00 C ATOM 253 C LEU A 557 0.303 6.211 -9.972 1.00 0.00 C ATOM 254 O LEU A 557 0.139 7.301 -9.424 1.00 0.00 O ATOM 255 CB LEU A 557 2.602 5.239 -10.091 1.00 0.00 C ATOM 256 CG LEU A 557 2.102 4.169 -9.118 1.00 0.00 C ATOM 257 CD1 LEU A 557 1.625 2.939 -9.875 1.00 0.00 C ATOM 258 CD2 LEU A 557 3.194 3.799 -8.127 1.00 0.00 C ATOM 0 H LEU A 557 2.663 7.713 -10.784 1.00 0.00 H new ATOM 0 HA LEU A 557 1.199 5.345 -11.713 1.00 0.00 H new ATOM 0 HB2 LEU A 557 3.284 4.772 -10.801 1.00 0.00 H new ATOM 0 HB3 LEU A 557 3.179 5.976 -9.532 1.00 0.00 H new ATOM 0 HG LEU A 557 1.258 4.576 -8.562 1.00 0.00 H new ATOM 0 HD11 LEU A 557 1.273 2.189 -9.166 1.00 0.00 H new ATOM 0 HD12 LEU A 557 0.810 3.217 -10.544 1.00 0.00 H new ATOM 0 HD13 LEU A 557 2.449 2.528 -10.458 1.00 0.00 H new ATOM 0 HD21 LEU A 557 2.821 3.037 -7.443 1.00 0.00 H new ATOM 0 HD22 LEU A 557 4.058 3.411 -8.666 1.00 0.00 H new ATOM 0 HD23 LEU A 557 3.486 4.683 -7.561 1.00 0.00 H new ATOM 270 N ILE A 558 -0.536 5.196 -9.819 1.00 0.00 N ATOM 271 CA ILE A 558 -1.719 5.312 -8.978 1.00 0.00 C ATOM 272 C ILE A 558 -1.800 4.157 -7.989 1.00 0.00 C ATOM 273 O ILE A 558 -1.700 2.990 -8.367 1.00 0.00 O ATOM 274 CB ILE A 558 -3.014 5.356 -9.812 1.00 0.00 C ATOM 275 CG1 ILE A 558 -2.774 6.081 -11.143 1.00 0.00 C ATOM 276 CG2 ILE A 558 -4.124 6.033 -9.019 1.00 0.00 C ATOM 277 CD1 ILE A 558 -2.944 7.582 -11.062 1.00 0.00 C ATOM 0 H ILE A 558 -0.420 4.286 -10.265 1.00 0.00 H new ATOM 0 HA ILE A 558 -1.625 6.251 -8.433 1.00 0.00 H new ATOM 0 HB ILE A 558 -3.322 4.335 -10.036 1.00 0.00 H new ATOM 0 HG12 ILE A 558 -1.765 5.858 -11.491 1.00 0.00 H new ATOM 0 HG13 ILE A 558 -3.463 5.687 -11.890 1.00 0.00 H new ATOM 0 HG21 ILE A 558 -5.035 6.059 -9.617 1.00 0.00 H new ATOM 0 HG22 ILE A 558 -4.308 5.474 -8.101 1.00 0.00 H new ATOM 0 HG23 ILE A 558 -3.824 7.051 -8.770 1.00 0.00 H new ATOM 0 HD11 ILE A 558 -2.758 8.023 -12.041 1.00 0.00 H new ATOM 0 HD12 ILE A 558 -3.960 7.817 -10.746 1.00 0.00 H new ATOM 0 HD13 ILE A 558 -2.236 7.990 -10.340 1.00 0.00 H new ATOM 289 N VAL A 559 -1.981 4.495 -6.718 1.00 0.00 N ATOM 290 CA VAL A 559 -2.075 3.495 -5.663 1.00 0.00 C ATOM 291 C VAL A 559 -3.433 3.562 -4.980 1.00 0.00 C ATOM 292 O VAL A 559 -3.813 4.599 -4.446 1.00 0.00 O ATOM 293 CB VAL A 559 -0.973 3.702 -4.613 1.00 0.00 C ATOM 294 CG1 VAL A 559 -0.768 2.443 -3.791 1.00 0.00 C ATOM 295 CG2 VAL A 559 0.324 4.125 -5.282 1.00 0.00 C ATOM 0 H VAL A 559 -2.066 5.458 -6.393 1.00 0.00 H new ATOM 0 HA VAL A 559 -1.950 2.516 -6.125 1.00 0.00 H new ATOM 0 HB VAL A 559 -1.288 4.498 -3.938 1.00 0.00 H new ATOM 0 HG11 VAL A 559 0.017 2.613 -3.054 1.00 0.00 H new ATOM 0 HG12 VAL A 559 -1.696 2.187 -3.280 1.00 0.00 H new ATOM 0 HG13 VAL A 559 -0.477 1.623 -4.448 1.00 0.00 H new ATOM 0 HG21 VAL A 559 1.095 4.268 -4.524 1.00 0.00 H new ATOM 0 HG22 VAL A 559 0.642 3.352 -5.982 1.00 0.00 H new ATOM 0 HG23 VAL A 559 0.168 5.060 -5.821 1.00 0.00 H new ATOM 305 N GLY A 560 -4.168 2.460 -5.008 1.00 0.00 N ATOM 306 CA GLY A 560 -5.484 2.443 -4.397 1.00 0.00 C ATOM 307 C GLY A 560 -5.575 1.535 -3.188 1.00 0.00 C ATOM 308 O GLY A 560 -5.408 0.320 -3.297 1.00 0.00 O ATOM 0 H GLY A 560 -3.880 1.582 -5.440 1.00 0.00 H new ATOM 0 HA2 GLY A 560 -5.752 3.457 -4.101 1.00 0.00 H new ATOM 0 HA3 GLY A 560 -6.216 2.123 -5.138 1.00 0.00 H new ATOM 312 N ILE A 561 -5.864 2.127 -2.034 1.00 0.00 N ATOM 313 CA ILE A 561 -6.005 1.370 -0.798 1.00 0.00 C ATOM 314 C ILE A 561 -7.475 1.089 -0.526 1.00 0.00 C ATOM 315 O ILE A 561 -8.188 1.930 0.022 1.00 0.00 O ATOM 316 CB ILE A 561 -5.397 2.126 0.397 1.00 0.00 C ATOM 317 CG1 ILE A 561 -3.995 2.632 0.047 1.00 0.00 C ATOM 318 CG2 ILE A 561 -5.353 1.231 1.626 1.00 0.00 C ATOM 319 CD1 ILE A 561 -3.152 1.624 -0.706 1.00 0.00 C ATOM 0 H ILE A 561 -6.005 3.132 -1.930 1.00 0.00 H new ATOM 0 HA ILE A 561 -5.465 0.431 -0.919 1.00 0.00 H new ATOM 0 HB ILE A 561 -6.028 2.986 0.623 1.00 0.00 H new ATOM 0 HG12 ILE A 561 -4.085 3.537 -0.553 1.00 0.00 H new ATOM 0 HG13 ILE A 561 -3.479 2.909 0.966 1.00 0.00 H new ATOM 0 HG21 ILE A 561 -4.920 1.781 2.462 1.00 0.00 H new ATOM 0 HG22 ILE A 561 -6.364 0.916 1.883 1.00 0.00 H new ATOM 0 HG23 ILE A 561 -4.743 0.353 1.415 1.00 0.00 H new ATOM 0 HD11 ILE A 561 -2.173 2.054 -0.918 1.00 0.00 H new ATOM 0 HD12 ILE A 561 -3.030 0.727 -0.100 1.00 0.00 H new ATOM 0 HD13 ILE A 561 -3.645 1.365 -1.643 1.00 0.00 H new ATOM 331 N ILE A 562 -7.930 -0.088 -0.937 1.00 0.00 N ATOM 332 CA ILE A 562 -9.324 -0.468 -0.764 1.00 0.00 C ATOM 333 C ILE A 562 -9.671 -0.726 0.697 1.00 0.00 C ATOM 334 O ILE A 562 -10.397 0.053 1.314 1.00 0.00 O ATOM 335 CB ILE A 562 -9.676 -1.716 -1.593 1.00 0.00 C ATOM 336 CG1 ILE A 562 -9.137 -1.578 -3.018 1.00 0.00 C ATOM 337 CG2 ILE A 562 -11.181 -1.935 -1.609 1.00 0.00 C ATOM 338 CD1 ILE A 562 -7.964 -2.488 -3.310 1.00 0.00 C ATOM 0 H ILE A 562 -7.353 -0.795 -1.392 1.00 0.00 H new ATOM 0 HA ILE A 562 -9.914 0.377 -1.118 1.00 0.00 H new ATOM 0 HB ILE A 562 -9.207 -2.585 -1.130 1.00 0.00 H new ATOM 0 HG12 ILE A 562 -9.939 -1.794 -3.724 1.00 0.00 H new ATOM 0 HG13 ILE A 562 -8.835 -0.544 -3.185 1.00 0.00 H new ATOM 0 HG21 ILE A 562 -11.413 -2.821 -2.199 1.00 0.00 H new ATOM 0 HG22 ILE A 562 -11.539 -2.074 -0.589 1.00 0.00 H new ATOM 0 HG23 ILE A 562 -11.670 -1.067 -2.050 1.00 0.00 H new ATOM 0 HD11 ILE A 562 -7.633 -2.337 -4.338 1.00 0.00 H new ATOM 0 HD12 ILE A 562 -7.146 -2.257 -2.628 1.00 0.00 H new ATOM 0 HD13 ILE A 562 -8.267 -3.526 -3.175 1.00 0.00 H new ATOM 350 N ARG A 563 -9.171 -1.827 1.247 1.00 0.00 N ATOM 351 CA ARG A 563 -9.467 -2.165 2.633 1.00 0.00 C ATOM 352 C ARG A 563 -8.523 -3.231 3.177 1.00 0.00 C ATOM 353 O ARG A 563 -7.673 -3.756 2.459 1.00 0.00 O ATOM 354 CB ARG A 563 -10.912 -2.656 2.748 1.00 0.00 C ATOM 355 CG ARG A 563 -11.072 -4.150 2.511 1.00 0.00 C ATOM 356 CD ARG A 563 -12.244 -4.452 1.593 1.00 0.00 C ATOM 357 NE ARG A 563 -13.360 -3.535 1.811 1.00 0.00 N ATOM 358 CZ ARG A 563 -14.329 -3.749 2.697 1.00 0.00 C ATOM 359 NH1 ARG A 563 -14.318 -4.843 3.447 1.00 0.00 N ATOM 360 NH2 ARG A 563 -15.311 -2.867 2.833 1.00 0.00 N ATOM 0 H ARG A 563 -8.568 -2.492 0.762 1.00 0.00 H new ATOM 0 HA ARG A 563 -9.328 -1.262 3.228 1.00 0.00 H new ATOM 0 HB2 ARG A 563 -11.291 -2.412 3.740 1.00 0.00 H new ATOM 0 HB3 ARG A 563 -11.528 -2.115 2.030 1.00 0.00 H new ATOM 0 HG2 ARG A 563 -10.156 -4.549 2.075 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -11.218 -4.656 3.465 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -11.918 -4.386 0.555 1.00 0.00 H new ATOM 0 HD3 ARG A 563 -12.579 -5.476 1.757 1.00 0.00 H new ATOM 0 HE ARG A 563 -13.398 -2.682 1.252 1.00 0.00 H new ATOM 0 HH11 ARG A 563 -13.565 -5.523 3.345 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -15.063 -5.004 4.125 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -15.323 -2.025 2.258 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -16.054 -3.031 3.512 1.00 0.00 H new ATOM 374 N CYS A 564 -8.703 -3.553 4.453 1.00 0.00 N ATOM 375 CA CYS A 564 -7.899 -4.568 5.120 1.00 0.00 C ATOM 376 C CYS A 564 -8.809 -5.538 5.864 1.00 0.00 C ATOM 377 O CYS A 564 -9.964 -5.219 6.145 1.00 0.00 O ATOM 378 CB CYS A 564 -6.915 -3.918 6.090 1.00 0.00 C ATOM 379 SG CYS A 564 -7.643 -2.627 7.127 1.00 0.00 S ATOM 0 H CYS A 564 -9.407 -3.120 5.051 1.00 0.00 H new ATOM 0 HA CYS A 564 -7.330 -5.116 4.369 1.00 0.00 H new ATOM 0 HB2 CYS A 564 -6.492 -4.690 6.733 1.00 0.00 H new ATOM 0 HB3 CYS A 564 -6.090 -3.490 5.521 1.00 0.00 H new ATOM 0 HG CYS A 564 -7.262 -1.460 6.699 1.00 0.00 H new ATOM 385 N VAL A 565 -8.299 -6.723 6.173 1.00 0.00 N ATOM 386 CA VAL A 565 -9.100 -7.721 6.873 1.00 0.00 C ATOM 387 C VAL A 565 -8.269 -8.558 7.836 1.00 0.00 C ATOM 388 O VAL A 565 -7.101 -8.852 7.582 1.00 0.00 O ATOM 389 CB VAL A 565 -9.805 -8.661 5.881 1.00 0.00 C ATOM 390 CG1 VAL A 565 -10.710 -7.869 4.955 1.00 0.00 C ATOM 391 CG2 VAL A 565 -8.787 -9.465 5.088 1.00 0.00 C ATOM 0 H VAL A 565 -7.347 -7.015 5.954 1.00 0.00 H new ATOM 0 HA VAL A 565 -9.842 -7.165 7.447 1.00 0.00 H new ATOM 0 HB VAL A 565 -10.421 -9.361 6.445 1.00 0.00 H new ATOM 0 HG11 VAL A 565 -11.202 -8.548 4.259 1.00 0.00 H new ATOM 0 HG12 VAL A 565 -11.463 -7.344 5.543 1.00 0.00 H new ATOM 0 HG13 VAL A 565 -10.116 -7.145 4.397 1.00 0.00 H new ATOM 0 HG21 VAL A 565 -9.306 -10.124 4.392 1.00 0.00 H new ATOM 0 HG22 VAL A 565 -8.141 -8.786 4.532 1.00 0.00 H new ATOM 0 HG23 VAL A 565 -8.183 -10.062 5.771 1.00 0.00 H new ATOM 401 N HIS A 566 -8.897 -8.946 8.939 1.00 0.00 N ATOM 402 CA HIS A 566 -8.245 -9.765 9.955 1.00 0.00 C ATOM 403 C HIS A 566 -6.986 -9.092 10.489 1.00 0.00 C ATOM 404 O HIS A 566 -5.900 -9.672 10.459 1.00 0.00 O ATOM 405 CB HIS A 566 -7.895 -11.140 9.381 1.00 0.00 C ATOM 406 CG HIS A 566 -8.681 -12.259 9.990 1.00 0.00 C ATOM 407 ND1 HIS A 566 -8.114 -13.227 10.793 1.00 0.00 N ATOM 408 CD2 HIS A 566 -9.998 -12.562 9.912 1.00 0.00 C ATOM 409 CE1 HIS A 566 -9.048 -14.078 11.180 1.00 0.00 C ATOM 410 NE2 HIS A 566 -10.199 -13.696 10.660 1.00 0.00 N ATOM 0 H HIS A 566 -9.864 -8.705 9.154 1.00 0.00 H new ATOM 0 HA HIS A 566 -8.943 -9.885 10.783 1.00 0.00 H new ATOM 0 HB2 HIS A 566 -8.066 -11.130 8.305 1.00 0.00 H new ATOM 0 HB3 HIS A 566 -6.832 -11.328 9.533 1.00 0.00 H new ATOM 0 HD2 HIS A 566 -10.750 -12.014 9.364 1.00 0.00 H new ATOM 0 HE1 HIS A 566 -8.895 -14.939 11.814 1.00 0.00 H new ATOM 0 HE2 HIS A 566 -11.094 -14.167 10.792 1.00 0.00 H new ATOM 419 N LEU A 567 -7.136 -7.868 10.983 1.00 0.00 N ATOM 420 CA LEU A 567 -6.009 -7.124 11.528 1.00 0.00 C ATOM 421 C LEU A 567 -5.842 -7.409 13.019 1.00 0.00 C ATOM 422 O LEU A 567 -6.815 -7.682 13.721 1.00 0.00 O ATOM 423 CB LEU A 567 -6.206 -5.625 11.304 1.00 0.00 C ATOM 424 CG LEU A 567 -6.173 -5.182 9.842 1.00 0.00 C ATOM 425 CD1 LEU A 567 -6.113 -3.667 9.747 1.00 0.00 C ATOM 426 CD2 LEU A 567 -4.990 -5.811 9.125 1.00 0.00 C ATOM 0 H LEU A 567 -8.026 -7.371 11.017 1.00 0.00 H new ATOM 0 HA LEU A 567 -5.106 -7.446 11.010 1.00 0.00 H new ATOM 0 HB2 LEU A 567 -7.163 -5.331 11.736 1.00 0.00 H new ATOM 0 HB3 LEU A 567 -5.431 -5.086 11.849 1.00 0.00 H new ATOM 0 HG LEU A 567 -7.089 -5.519 9.356 1.00 0.00 H new ATOM 0 HD11 LEU A 567 -6.090 -3.369 8.699 1.00 0.00 H new ATOM 0 HD12 LEU A 567 -6.992 -3.237 10.227 1.00 0.00 H new ATOM 0 HD13 LEU A 567 -5.214 -3.306 10.247 1.00 0.00 H new ATOM 0 HD21 LEU A 567 -4.980 -5.486 8.085 1.00 0.00 H new ATOM 0 HD22 LEU A 567 -4.064 -5.502 9.610 1.00 0.00 H new ATOM 0 HD23 LEU A 567 -5.076 -6.897 9.165 1.00 0.00 H new ATOM 438 N ALA A 568 -4.602 -7.347 13.495 1.00 0.00 N ATOM 439 CA ALA A 568 -4.311 -7.601 14.902 1.00 0.00 C ATOM 440 C ALA A 568 -4.768 -6.442 15.783 1.00 0.00 C ATOM 441 O ALA A 568 -4.764 -5.286 15.360 1.00 0.00 O ATOM 442 CB ALA A 568 -2.824 -7.856 15.093 1.00 0.00 C ATOM 0 H ALA A 568 -3.784 -7.123 12.928 1.00 0.00 H new ATOM 0 HA ALA A 568 -4.866 -8.489 15.205 1.00 0.00 H new ATOM 0 HB1 ALA A 568 -2.620 -8.044 16.147 1.00 0.00 H new ATOM 0 HB2 ALA A 568 -2.525 -8.724 14.505 1.00 0.00 H new ATOM 0 HB3 ALA A 568 -2.260 -6.983 14.764 1.00 0.00 H new ATOM 448 N ALA A 569 -5.161 -6.762 17.013 1.00 0.00 N ATOM 449 CA ALA A 569 -5.620 -5.755 17.964 1.00 0.00 C ATOM 450 C ALA A 569 -4.662 -5.635 19.142 1.00 0.00 C ATOM 451 O ALA A 569 -4.580 -6.535 19.978 1.00 0.00 O ATOM 452 CB ALA A 569 -7.009 -6.097 18.467 1.00 0.00 C ATOM 0 H ALA A 569 -5.170 -7.715 17.375 1.00 0.00 H new ATOM 0 HA ALA A 569 -5.652 -4.797 17.445 1.00 0.00 H new ATOM 0 HB1 ALA A 569 -7.337 -5.336 19.175 1.00 0.00 H new ATOM 0 HB2 ALA A 569 -7.702 -6.133 17.626 1.00 0.00 H new ATOM 0 HB3 ALA A 569 -6.988 -7.068 18.961 1.00 0.00 H new ATOM 458 N MET A 570 -3.945 -4.521 19.213 1.00 0.00 N ATOM 459 CA MET A 570 -3.002 -4.294 20.299 1.00 0.00 C ATOM 460 C MET A 570 -3.704 -3.684 21.505 1.00 0.00 C ATOM 461 O MET A 570 -3.258 -3.836 22.641 1.00 0.00 O ATOM 462 CB MET A 570 -1.865 -3.387 19.838 1.00 0.00 C ATOM 463 CG MET A 570 -0.764 -4.141 19.122 1.00 0.00 C ATOM 464 SD MET A 570 -0.346 -3.414 17.529 1.00 0.00 S ATOM 465 CE MET A 570 -1.878 -3.674 16.644 1.00 0.00 C ATOM 0 H MET A 570 -3.998 -3.763 18.533 1.00 0.00 H new ATOM 0 HA MET A 570 -2.585 -5.257 20.593 1.00 0.00 H new ATOM 0 HB2 MET A 570 -2.265 -2.620 19.174 1.00 0.00 H new ATOM 0 HB3 MET A 570 -1.444 -2.873 20.702 1.00 0.00 H new ATOM 0 HG2 MET A 570 0.125 -4.162 19.752 1.00 0.00 H new ATOM 0 HG3 MET A 570 -1.074 -5.175 18.974 1.00 0.00 H new ATOM 0 HE1 MET A 570 -1.681 -3.688 15.572 1.00 0.00 H new ATOM 0 HE2 MET A 570 -2.315 -4.626 16.945 1.00 0.00 H new ATOM 0 HE3 MET A 570 -2.573 -2.867 16.875 1.00 0.00 H new ATOM 475 N ASP A 571 -4.809 -2.996 21.245 1.00 0.00 N ATOM 476 CA ASP A 571 -5.584 -2.364 22.306 1.00 0.00 C ATOM 477 C ASP A 571 -6.223 -3.417 23.204 1.00 0.00 C ATOM 478 O ASP A 571 -6.531 -4.522 22.758 1.00 0.00 O ATOM 479 CB ASP A 571 -6.663 -1.459 21.710 1.00 0.00 C ATOM 480 CG ASP A 571 -6.082 -0.364 20.836 1.00 0.00 C ATOM 481 OD1 ASP A 571 -4.966 -0.555 20.309 1.00 0.00 O ATOM 482 OD2 ASP A 571 -6.742 0.684 20.680 1.00 0.00 O ATOM 0 H ASP A 571 -5.189 -2.861 20.308 1.00 0.00 H new ATOM 0 HA ASP A 571 -4.908 -1.757 22.908 1.00 0.00 H new ATOM 0 HB2 ASP A 571 -7.354 -2.062 21.121 1.00 0.00 H new ATOM 0 HB3 ASP A 571 -7.241 -1.008 22.516 1.00 0.00 H new ATOM 487 N ALA A 572 -6.420 -3.068 24.470 1.00 0.00 N ATOM 488 CA ALA A 572 -7.022 -3.986 25.429 1.00 0.00 C ATOM 489 C ALA A 572 -8.488 -4.248 25.098 1.00 0.00 C ATOM 490 O ALA A 572 -9.132 -5.094 25.718 1.00 0.00 O ATOM 491 CB ALA A 572 -6.888 -3.438 26.841 1.00 0.00 C ATOM 0 H ALA A 572 -6.172 -2.157 24.856 1.00 0.00 H new ATOM 0 HA ALA A 572 -6.489 -4.935 25.367 1.00 0.00 H new ATOM 0 HB1 ALA A 572 -7.342 -4.134 27.546 1.00 0.00 H new ATOM 0 HB2 ALA A 572 -5.833 -3.312 27.084 1.00 0.00 H new ATOM 0 HB3 ALA A 572 -7.393 -2.474 26.907 1.00 0.00 H new ATOM 497 N ASN A 573 -9.010 -3.519 24.117 1.00 0.00 N ATOM 498 CA ASN A 573 -10.400 -3.678 23.707 1.00 0.00 C ATOM 499 C ASN A 573 -10.550 -4.839 22.730 1.00 0.00 C ATOM 500 O ASN A 573 -11.664 -5.254 22.412 1.00 0.00 O ATOM 501 CB ASN A 573 -10.915 -2.388 23.067 1.00 0.00 C ATOM 502 CG ASN A 573 -12.345 -2.078 23.462 1.00 0.00 C ATOM 503 OD1 ASN A 573 -12.712 -2.169 24.634 1.00 0.00 O ATOM 504 ND2 ASN A 573 -13.164 -1.711 22.483 1.00 0.00 N ATOM 0 H ASN A 573 -8.492 -2.814 23.592 1.00 0.00 H new ATOM 0 HA ASN A 573 -10.992 -3.896 24.596 1.00 0.00 H new ATOM 0 HB2 ASN A 573 -10.272 -1.558 23.360 1.00 0.00 H new ATOM 0 HB3 ASN A 573 -10.851 -2.473 21.982 1.00 0.00 H new ATOM 0 HD21 ASN A 573 -14.139 -1.492 22.689 1.00 0.00 H new ATOM 0 HD22 ASN A 573 -12.818 -1.648 21.525 1.00 0.00 H new ATOM 511 N GLY A 574 -9.422 -5.358 22.254 1.00 0.00 N ATOM 512 CA GLY A 574 -9.455 -6.464 21.317 1.00 0.00 C ATOM 513 C GLY A 574 -9.429 -5.996 19.878 1.00 0.00 C ATOM 514 O GLY A 574 -9.544 -6.799 18.952 1.00 0.00 O ATOM 0 H GLY A 574 -8.487 -5.032 22.501 1.00 0.00 H new ATOM 0 HA2 GLY A 574 -8.603 -7.118 21.500 1.00 0.00 H new ATOM 0 HA3 GLY A 574 -10.354 -7.056 21.488 1.00 0.00 H new ATOM 518 N TYR A 575 -9.281 -4.687 19.687 1.00 0.00 N ATOM 519 CA TYR A 575 -9.244 -4.108 18.350 1.00 0.00 C ATOM 520 C TYR A 575 -7.983 -3.281 18.126 1.00 0.00 C ATOM 521 O TYR A 575 -7.050 -3.320 18.928 1.00 0.00 O ATOM 522 CB TYR A 575 -10.476 -3.241 18.124 1.00 0.00 C ATOM 523 CG TYR A 575 -11.598 -3.993 17.464 1.00 0.00 C ATOM 524 CD1 TYR A 575 -11.985 -5.233 17.938 1.00 0.00 C ATOM 525 CD2 TYR A 575 -12.265 -3.463 16.373 1.00 0.00 C ATOM 526 CE1 TYR A 575 -13.015 -5.934 17.341 1.00 0.00 C ATOM 527 CE2 TYR A 575 -13.297 -4.154 15.767 1.00 0.00 C ATOM 528 CZ TYR A 575 -13.668 -5.390 16.255 1.00 0.00 C ATOM 529 OH TYR A 575 -14.696 -6.081 15.656 1.00 0.00 O ATOM 0 H TYR A 575 -9.185 -4.009 20.443 1.00 0.00 H new ATOM 0 HA TYR A 575 -9.236 -4.930 17.634 1.00 0.00 H new ATOM 0 HB2 TYR A 575 -10.820 -2.848 19.081 1.00 0.00 H new ATOM 0 HB3 TYR A 575 -10.205 -2.384 17.507 1.00 0.00 H new ATOM 0 HD1 TYR A 575 -11.474 -5.660 18.788 1.00 0.00 H new ATOM 0 HD2 TYR A 575 -11.975 -2.496 15.990 1.00 0.00 H new ATOM 0 HE1 TYR A 575 -13.307 -6.901 17.722 1.00 0.00 H new ATOM 0 HE2 TYR A 575 -13.810 -3.729 14.917 1.00 0.00 H new ATOM 0 HH TYR A 575 -15.049 -5.558 14.906 1.00 0.00 H new ATOM 539 N SER A 576 -7.964 -2.534 17.023 1.00 0.00 N ATOM 540 CA SER A 576 -6.816 -1.699 16.686 1.00 0.00 C ATOM 541 C SER A 576 -7.237 -0.498 15.840 1.00 0.00 C ATOM 542 O SER A 576 -8.401 -0.370 15.460 1.00 0.00 O ATOM 543 CB SER A 576 -5.771 -2.522 15.932 1.00 0.00 C ATOM 544 OG SER A 576 -4.775 -3.014 16.812 1.00 0.00 O ATOM 0 H SER A 576 -8.729 -2.491 16.350 1.00 0.00 H new ATOM 0 HA SER A 576 -6.384 -1.329 17.616 1.00 0.00 H new ATOM 0 HB2 SER A 576 -6.257 -3.356 15.426 1.00 0.00 H new ATOM 0 HB3 SER A 576 -5.307 -1.907 15.161 1.00 0.00 H new ATOM 0 HG SER A 576 -4.483 -3.900 16.513 1.00 0.00 H new ATOM 550 N ASP A 577 -6.275 0.371 15.535 1.00 0.00 N ATOM 551 CA ASP A 577 -6.532 1.557 14.718 1.00 0.00 C ATOM 552 C ASP A 577 -5.605 1.554 13.509 1.00 0.00 C ATOM 553 O ASP A 577 -4.760 2.432 13.353 1.00 0.00 O ATOM 554 CB ASP A 577 -6.318 2.833 15.537 1.00 0.00 C ATOM 555 CG ASP A 577 -7.136 2.845 16.814 1.00 0.00 C ATOM 556 OD1 ASP A 577 -7.690 1.784 17.174 1.00 0.00 O ATOM 557 OD2 ASP A 577 -7.224 3.914 17.453 1.00 0.00 O ATOM 0 H ASP A 577 -5.307 0.276 15.842 1.00 0.00 H new ATOM 0 HA ASP A 577 -7.569 1.534 14.382 1.00 0.00 H new ATOM 0 HB2 ASP A 577 -5.261 2.929 15.785 1.00 0.00 H new ATOM 0 HB3 ASP A 577 -6.583 3.699 14.931 1.00 0.00 H new ATOM 562 N PRO A 578 -5.740 0.531 12.658 1.00 0.00 N ATOM 563 CA PRO A 578 -4.894 0.357 11.472 1.00 0.00 C ATOM 564 C PRO A 578 -5.093 1.393 10.373 1.00 0.00 C ATOM 565 O PRO A 578 -6.207 1.828 10.083 1.00 0.00 O ATOM 566 CB PRO A 578 -5.287 -1.025 10.950 1.00 0.00 C ATOM 567 CG PRO A 578 -6.654 -1.268 11.487 1.00 0.00 C ATOM 568 CD PRO A 578 -6.709 -0.565 12.814 1.00 0.00 C ATOM 0 HA PRO A 578 -3.846 0.472 11.749 1.00 0.00 H new ATOM 0 HB2 PRO A 578 -5.281 -1.051 9.860 1.00 0.00 H new ATOM 0 HB3 PRO A 578 -4.588 -1.789 11.291 1.00 0.00 H new ATOM 0 HG2 PRO A 578 -7.414 -0.881 10.809 1.00 0.00 H new ATOM 0 HG3 PRO A 578 -6.844 -2.335 11.603 1.00 0.00 H new ATOM 0 HD2 PRO A 578 -7.709 -0.190 13.029 1.00 0.00 H new ATOM 0 HD3 PRO A 578 -6.435 -1.230 13.633 1.00 0.00 H new ATOM 576 N PHE A 579 -3.976 1.725 9.738 1.00 0.00 N ATOM 577 CA PHE A 579 -3.931 2.651 8.615 1.00 0.00 C ATOM 578 C PHE A 579 -2.855 2.156 7.660 1.00 0.00 C ATOM 579 O PHE A 579 -2.020 1.341 8.050 1.00 0.00 O ATOM 580 CB PHE A 579 -3.636 4.083 9.069 1.00 0.00 C ATOM 581 CG PHE A 579 -2.261 4.277 9.636 1.00 0.00 C ATOM 582 CD1 PHE A 579 -1.942 3.800 10.896 1.00 0.00 C ATOM 583 CD2 PHE A 579 -1.287 4.947 8.911 1.00 0.00 C ATOM 584 CE1 PHE A 579 -0.677 3.983 11.422 1.00 0.00 C ATOM 585 CE2 PHE A 579 -0.022 5.134 9.431 1.00 0.00 C ATOM 586 CZ PHE A 579 0.285 4.651 10.688 1.00 0.00 C ATOM 0 H PHE A 579 -3.062 1.352 9.993 1.00 0.00 H new ATOM 0 HA PHE A 579 -4.903 2.680 8.123 1.00 0.00 H new ATOM 0 HB2 PHE A 579 -3.765 4.755 8.221 1.00 0.00 H new ATOM 0 HB3 PHE A 579 -4.371 4.373 9.820 1.00 0.00 H new ATOM 0 HD1 PHE A 579 -2.690 3.279 11.475 1.00 0.00 H new ATOM 0 HD2 PHE A 579 -1.521 5.327 7.928 1.00 0.00 H new ATOM 0 HE1 PHE A 579 -0.440 3.604 12.405 1.00 0.00 H new ATOM 0 HE2 PHE A 579 0.727 5.658 8.855 1.00 0.00 H new ATOM 0 HZ PHE A 579 1.274 4.795 11.096 1.00 0.00 H new ATOM 596 N VAL A 580 -2.868 2.606 6.417 1.00 0.00 N ATOM 597 CA VAL A 580 -1.870 2.133 5.466 1.00 0.00 C ATOM 598 C VAL A 580 -0.926 3.234 5.003 1.00 0.00 C ATOM 599 O VAL A 580 -1.355 4.297 4.556 1.00 0.00 O ATOM 600 CB VAL A 580 -2.519 1.481 4.230 1.00 0.00 C ATOM 601 CG1 VAL A 580 -1.454 0.851 3.349 1.00 0.00 C ATOM 602 CG2 VAL A 580 -3.550 0.442 4.649 1.00 0.00 C ATOM 0 H VAL A 580 -3.538 3.280 6.047 1.00 0.00 H new ATOM 0 HA VAL A 580 -1.289 1.387 6.008 1.00 0.00 H new ATOM 0 HB VAL A 580 -3.031 2.255 3.658 1.00 0.00 H new ATOM 0 HG11 VAL A 580 -1.925 0.394 2.479 1.00 0.00 H new ATOM 0 HG12 VAL A 580 -0.753 1.618 3.021 1.00 0.00 H new ATOM 0 HG13 VAL A 580 -0.918 0.088 3.914 1.00 0.00 H new ATOM 0 HG21 VAL A 580 -3.996 -0.006 3.761 1.00 0.00 H new ATOM 0 HG22 VAL A 580 -3.065 -0.333 5.242 1.00 0.00 H new ATOM 0 HG23 VAL A 580 -4.328 0.921 5.244 1.00 0.00 H new ATOM 612 N LYS A 581 0.370 2.948 5.096 1.00 0.00 N ATOM 613 CA LYS A 581 1.404 3.882 4.672 1.00 0.00 C ATOM 614 C LYS A 581 2.109 3.335 3.437 1.00 0.00 C ATOM 615 O LYS A 581 2.519 2.175 3.410 1.00 0.00 O ATOM 616 CB LYS A 581 2.417 4.112 5.795 1.00 0.00 C ATOM 617 CG LYS A 581 1.784 4.478 7.128 1.00 0.00 C ATOM 618 CD LYS A 581 2.095 3.441 8.190 1.00 0.00 C ATOM 619 CE LYS A 581 2.758 4.070 9.405 1.00 0.00 C ATOM 620 NZ LYS A 581 4.241 4.089 9.282 1.00 0.00 N ATOM 0 H LYS A 581 0.729 2.068 5.465 1.00 0.00 H new ATOM 0 HA LYS A 581 0.938 4.837 4.431 1.00 0.00 H new ATOM 0 HB2 LYS A 581 3.014 3.209 5.923 1.00 0.00 H new ATOM 0 HB3 LYS A 581 3.101 4.907 5.498 1.00 0.00 H new ATOM 0 HG2 LYS A 581 2.149 5.453 7.451 1.00 0.00 H new ATOM 0 HG3 LYS A 581 0.704 4.566 7.008 1.00 0.00 H new ATOM 0 HD2 LYS A 581 1.175 2.942 8.494 1.00 0.00 H new ATOM 0 HD3 LYS A 581 2.749 2.676 7.772 1.00 0.00 H new ATOM 0 HE2 LYS A 581 2.391 5.089 9.532 1.00 0.00 H new ATOM 0 HE3 LYS A 581 2.475 3.516 10.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 4.636 4.776 9.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 4.619 3.143 9.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 4.506 4.361 8.314 1.00 0.00 H new ATOM 634 N LEU A 582 2.231 4.165 2.411 1.00 0.00 N ATOM 635 CA LEU A 582 2.867 3.747 1.170 1.00 0.00 C ATOM 636 C LEU A 582 4.012 4.673 0.793 1.00 0.00 C ATOM 637 O LEU A 582 3.874 5.896 0.835 1.00 0.00 O ATOM 638 CB LEU A 582 1.839 3.713 0.045 1.00 0.00 C ATOM 639 CG LEU A 582 0.386 3.651 0.511 1.00 0.00 C ATOM 640 CD1 LEU A 582 -0.296 4.995 0.312 1.00 0.00 C ATOM 641 CD2 LEU A 582 -0.354 2.553 -0.227 1.00 0.00 C ATOM 0 H LEU A 582 1.899 5.129 2.413 1.00 0.00 H new ATOM 0 HA LEU A 582 3.276 2.748 1.323 1.00 0.00 H new ATOM 0 HB2 LEU A 582 1.970 4.599 -0.576 1.00 0.00 H new ATOM 0 HB3 LEU A 582 2.041 2.849 -0.587 1.00 0.00 H new ATOM 0 HG LEU A 582 0.369 3.420 1.576 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -1.330 4.932 0.650 1.00 0.00 H new ATOM 0 HD12 LEU A 582 0.228 5.758 0.888 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -0.275 5.261 -0.745 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -1.389 2.519 0.114 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -0.331 2.755 -1.298 1.00 0.00 H new ATOM 0 HD23 LEU A 582 0.125 1.594 -0.029 1.00 0.00 H new ATOM 653 N TRP A 583 5.141 4.084 0.418 1.00 0.00 N ATOM 654 CA TRP A 583 6.308 4.863 0.027 1.00 0.00 C ATOM 655 C TRP A 583 7.033 4.217 -1.151 1.00 0.00 C ATOM 656 O TRP A 583 7.557 3.108 -1.040 1.00 0.00 O ATOM 657 CB TRP A 583 7.264 5.018 1.209 1.00 0.00 C ATOM 658 CG TRP A 583 8.620 5.504 0.810 1.00 0.00 C ATOM 659 CD1 TRP A 583 8.968 6.092 -0.371 1.00 0.00 C ATOM 660 CD2 TRP A 583 9.808 5.452 1.598 1.00 0.00 C ATOM 661 NE1 TRP A 583 10.303 6.392 -0.372 1.00 0.00 N ATOM 662 CE2 TRP A 583 10.843 6.016 0.831 1.00 0.00 C ATOM 663 CE3 TRP A 583 10.094 4.980 2.879 1.00 0.00 C ATOM 664 CZ2 TRP A 583 12.147 6.121 1.307 1.00 0.00 C ATOM 665 CZ3 TRP A 583 11.387 5.085 3.352 1.00 0.00 C ATOM 666 CH2 TRP A 583 12.399 5.653 2.567 1.00 0.00 C ATOM 0 H TRP A 583 5.273 3.073 0.377 1.00 0.00 H new ATOM 0 HA TRP A 583 5.963 5.849 -0.284 1.00 0.00 H new ATOM 0 HB2 TRP A 583 6.833 5.714 1.928 1.00 0.00 H new ATOM 0 HB3 TRP A 583 7.364 4.058 1.716 1.00 0.00 H new ATOM 0 HD1 TRP A 583 8.289 6.292 -1.186 1.00 0.00 H new ATOM 0 HE1 TRP A 583 10.813 6.825 -1.142 1.00 0.00 H new ATOM 0 HE3 TRP A 583 9.319 4.541 3.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 583 12.930 6.556 0.704 1.00 0.00 H new ATOM 0 HZ3 TRP A 583 11.622 4.724 4.342 1.00 0.00 H new ATOM 0 HH2 TRP A 583 13.400 5.723 2.966 1.00 0.00 H new ATOM 677 N LEU A 584 7.064 4.925 -2.277 1.00 0.00 N ATOM 678 CA LEU A 584 7.731 4.430 -3.475 1.00 0.00 C ATOM 679 C LEU A 584 9.153 4.972 -3.572 1.00 0.00 C ATOM 680 O LEU A 584 9.366 6.184 -3.623 1.00 0.00 O ATOM 681 CB LEU A 584 6.937 4.822 -4.724 1.00 0.00 C ATOM 682 CG LEU A 584 7.451 4.224 -6.036 1.00 0.00 C ATOM 683 CD1 LEU A 584 6.818 2.863 -6.283 1.00 0.00 C ATOM 684 CD2 LEU A 584 7.168 5.165 -7.199 1.00 0.00 C ATOM 0 H LEU A 584 6.634 5.844 -2.384 1.00 0.00 H new ATOM 0 HA LEU A 584 7.781 3.343 -3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 584 5.900 4.518 -4.586 1.00 0.00 H new ATOM 0 HB3 LEU A 584 6.941 5.908 -4.812 1.00 0.00 H new ATOM 0 HG LEU A 584 8.530 4.093 -5.956 1.00 0.00 H new ATOM 0 HD11 LEU A 584 7.194 2.451 -7.220 1.00 0.00 H new ATOM 0 HD12 LEU A 584 7.071 2.190 -5.464 1.00 0.00 H new ATOM 0 HD13 LEU A 584 5.735 2.971 -6.343 1.00 0.00 H new ATOM 0 HD21 LEU A 584 7.540 4.723 -8.123 1.00 0.00 H new ATOM 0 HD22 LEU A 584 6.093 5.328 -7.282 1.00 0.00 H new ATOM 0 HD23 LEU A 584 7.667 6.118 -7.026 1.00 0.00 H new ATOM 696 N LYS A 585 10.123 4.063 -3.604 1.00 0.00 N ATOM 697 CA LYS A 585 11.526 4.449 -3.701 1.00 0.00 C ATOM 698 C LYS A 585 12.032 4.279 -5.132 1.00 0.00 C ATOM 699 O LYS A 585 11.307 3.785 -5.996 1.00 0.00 O ATOM 700 CB LYS A 585 12.379 3.614 -2.743 1.00 0.00 C ATOM 701 CG LYS A 585 11.564 2.814 -1.738 1.00 0.00 C ATOM 702 CD LYS A 585 12.457 1.964 -0.849 1.00 0.00 C ATOM 703 CE LYS A 585 11.654 0.928 -0.080 1.00 0.00 C ATOM 704 NZ LYS A 585 12.333 0.523 1.181 1.00 0.00 N ATOM 0 H LYS A 585 9.963 3.056 -3.564 1.00 0.00 H new ATOM 0 HA LYS A 585 11.610 5.499 -3.422 1.00 0.00 H new ATOM 0 HB2 LYS A 585 12.997 2.929 -3.324 1.00 0.00 H new ATOM 0 HB3 LYS A 585 13.057 4.275 -2.203 1.00 0.00 H new ATOM 0 HG2 LYS A 585 10.976 3.494 -1.121 1.00 0.00 H new ATOM 0 HG3 LYS A 585 10.859 2.173 -2.267 1.00 0.00 H new ATOM 0 HD2 LYS A 585 13.209 1.463 -1.459 1.00 0.00 H new ATOM 0 HD3 LYS A 585 12.991 2.606 -0.148 1.00 0.00 H new ATOM 0 HE2 LYS A 585 10.668 1.332 0.152 1.00 0.00 H new ATOM 0 HE3 LYS A 585 11.499 0.050 -0.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 585 11.753 -0.185 1.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 585 13.263 0.114 0.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 585 12.458 1.356 1.791 1.00 0.00 H new ATOM 718 N PRO A 586 13.286 4.687 -5.407 1.00 0.00 N ATOM 719 CA PRO A 586 14.181 5.281 -4.403 1.00 0.00 C ATOM 720 C PRO A 586 13.622 6.572 -3.819 1.00 0.00 C ATOM 721 O PRO A 586 14.133 7.082 -2.823 1.00 0.00 O ATOM 722 CB PRO A 586 15.470 5.567 -5.184 1.00 0.00 C ATOM 723 CG PRO A 586 15.390 4.706 -6.397 1.00 0.00 C ATOM 724 CD PRO A 586 13.929 4.597 -6.726 1.00 0.00 C ATOM 0 HA PRO A 586 14.324 4.617 -3.551 1.00 0.00 H new ATOM 0 HB2 PRO A 586 15.542 6.621 -5.453 1.00 0.00 H new ATOM 0 HB3 PRO A 586 16.352 5.329 -4.589 1.00 0.00 H new ATOM 0 HG2 PRO A 586 15.946 5.145 -7.226 1.00 0.00 H new ATOM 0 HG3 PRO A 586 15.823 3.724 -6.208 1.00 0.00 H new ATOM 0 HD2 PRO A 586 13.604 5.398 -7.389 1.00 0.00 H new ATOM 0 HD3 PRO A 586 13.697 3.656 -7.225 1.00 0.00 H new ATOM 732 N ASP A 587 12.565 7.083 -4.448 1.00 0.00 N ATOM 733 CA ASP A 587 11.904 8.307 -4.008 1.00 0.00 C ATOM 734 C ASP A 587 12.425 9.524 -4.765 1.00 0.00 C ATOM 735 O ASP A 587 13.625 9.663 -4.999 1.00 0.00 O ATOM 736 CB ASP A 587 12.058 8.495 -2.491 1.00 0.00 C ATOM 737 CG ASP A 587 13.192 9.433 -2.110 1.00 0.00 C ATOM 738 OD1 ASP A 587 14.247 9.396 -2.776 1.00 0.00 O ATOM 739 OD2 ASP A 587 13.020 10.206 -1.143 1.00 0.00 O ATOM 0 H ASP A 587 12.144 6.660 -5.275 1.00 0.00 H new ATOM 0 HA ASP A 587 10.842 8.210 -4.233 1.00 0.00 H new ATOM 0 HB2 ASP A 587 11.124 8.882 -2.084 1.00 0.00 H new ATOM 0 HB3 ASP A 587 12.229 7.523 -2.028 1.00 0.00 H new ATOM 744 N MET A 588 11.504 10.398 -5.146 1.00 0.00 N ATOM 745 CA MET A 588 11.849 11.611 -5.879 1.00 0.00 C ATOM 746 C MET A 588 11.871 12.817 -4.946 1.00 0.00 C ATOM 747 O MET A 588 12.733 13.689 -5.062 1.00 0.00 O ATOM 748 CB MET A 588 10.847 11.848 -7.012 1.00 0.00 C ATOM 749 CG MET A 588 9.414 12.010 -6.533 1.00 0.00 C ATOM 750 SD MET A 588 8.231 11.131 -7.571 1.00 0.00 S ATOM 751 CE MET A 588 8.437 9.455 -6.974 1.00 0.00 C ATOM 0 H MET A 588 10.507 10.290 -4.959 1.00 0.00 H new ATOM 0 HA MET A 588 12.844 11.481 -6.304 1.00 0.00 H new ATOM 0 HB2 MET A 588 11.140 12.741 -7.564 1.00 0.00 H new ATOM 0 HB3 MET A 588 10.896 11.012 -7.710 1.00 0.00 H new ATOM 0 HG2 MET A 588 9.334 11.645 -5.509 1.00 0.00 H new ATOM 0 HG3 MET A 588 9.159 13.070 -6.515 1.00 0.00 H new ATOM 0 HE1 MET A 588 7.697 8.808 -7.444 1.00 0.00 H new ATOM 0 HE2 MET A 588 9.438 9.101 -7.221 1.00 0.00 H new ATOM 0 HE3 MET A 588 8.302 9.435 -5.893 1.00 0.00 H new ATOM 761 N GLY A 589 10.917 12.858 -4.022 1.00 0.00 N ATOM 762 CA GLY A 589 10.843 13.959 -3.078 1.00 0.00 C ATOM 763 C GLY A 589 10.512 13.493 -1.675 1.00 0.00 C ATOM 764 O GLY A 589 11.002 12.456 -1.227 1.00 0.00 O ATOM 0 H GLY A 589 10.193 12.148 -3.910 1.00 0.00 H new ATOM 0 HA2 GLY A 589 11.795 14.490 -3.067 1.00 0.00 H new ATOM 0 HA3 GLY A 589 10.086 14.669 -3.410 1.00 0.00 H new ATOM 768 N LYS A 590 9.676 14.256 -0.980 1.00 0.00 N ATOM 769 CA LYS A 590 9.278 13.911 0.379 1.00 0.00 C ATOM 770 C LYS A 590 7.804 13.522 0.434 1.00 0.00 C ATOM 771 O LYS A 590 7.255 13.289 1.510 1.00 0.00 O ATOM 772 CB LYS A 590 9.544 15.082 1.327 1.00 0.00 C ATOM 773 CG LYS A 590 10.807 15.860 0.994 1.00 0.00 C ATOM 774 CD LYS A 590 11.099 16.921 2.042 1.00 0.00 C ATOM 775 CE LYS A 590 10.035 18.008 2.045 1.00 0.00 C ATOM 776 NZ LYS A 590 10.213 18.963 0.916 1.00 0.00 N ATOM 0 H LYS A 590 9.261 15.117 -1.335 1.00 0.00 H new ATOM 0 HA LYS A 590 9.873 13.055 0.696 1.00 0.00 H new ATOM 0 HB2 LYS A 590 8.692 15.761 1.301 1.00 0.00 H new ATOM 0 HB3 LYS A 590 9.619 14.704 2.346 1.00 0.00 H new ATOM 0 HG2 LYS A 590 11.651 15.174 0.924 1.00 0.00 H new ATOM 0 HG3 LYS A 590 10.698 16.332 0.017 1.00 0.00 H new ATOM 0 HD2 LYS A 590 11.150 16.457 3.027 1.00 0.00 H new ATOM 0 HD3 LYS A 590 12.075 17.366 1.849 1.00 0.00 H new ATOM 0 HE2 LYS A 590 9.048 17.550 1.981 1.00 0.00 H new ATOM 0 HE3 LYS A 590 10.074 18.551 2.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 590 9.468 19.688 0.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 590 11.145 19.419 0.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 590 10.151 18.449 0.014 1.00 0.00 H new ATOM 790 N LYS A 591 7.170 13.452 -0.731 1.00 0.00 N ATOM 791 CA LYS A 591 5.762 13.088 -0.813 1.00 0.00 C ATOM 792 C LYS A 591 5.598 11.632 -1.238 1.00 0.00 C ATOM 793 O LYS A 591 4.481 11.122 -1.318 1.00 0.00 O ATOM 794 CB LYS A 591 5.035 13.999 -1.801 1.00 0.00 C ATOM 795 CG LYS A 591 5.163 15.479 -1.478 1.00 0.00 C ATOM 796 CD LYS A 591 3.938 16.256 -1.931 1.00 0.00 C ATOM 797 CE LYS A 591 3.957 17.682 -1.406 1.00 0.00 C ATOM 798 NZ LYS A 591 4.281 17.736 0.047 1.00 0.00 N ATOM 0 H LYS A 591 7.610 13.643 -1.631 1.00 0.00 H new ATOM 0 HA LYS A 591 5.325 13.211 0.178 1.00 0.00 H new ATOM 0 HB2 LYS A 591 5.427 13.820 -2.802 1.00 0.00 H new ATOM 0 HB3 LYS A 591 3.979 13.730 -1.819 1.00 0.00 H new ATOM 0 HG2 LYS A 591 5.300 15.608 -0.404 1.00 0.00 H new ATOM 0 HG3 LYS A 591 6.051 15.883 -1.963 1.00 0.00 H new ATOM 0 HD2 LYS A 591 3.896 16.269 -3.020 1.00 0.00 H new ATOM 0 HD3 LYS A 591 3.037 15.751 -1.583 1.00 0.00 H new ATOM 0 HE2 LYS A 591 4.691 18.264 -1.963 1.00 0.00 H new ATOM 0 HE3 LYS A 591 2.985 18.145 -1.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 591 3.962 18.644 0.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 591 3.799 16.957 0.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 591 5.309 17.644 0.177 1.00 0.00 H new ATOM 812 N ALA A 592 6.716 10.967 -1.511 1.00 0.00 N ATOM 813 CA ALA A 592 6.687 9.572 -1.930 1.00 0.00 C ATOM 814 C ALA A 592 5.968 8.706 -0.903 1.00 0.00 C ATOM 815 O ALA A 592 5.469 7.629 -1.227 1.00 0.00 O ATOM 816 CB ALA A 592 8.100 9.055 -2.156 1.00 0.00 C ATOM 0 H ALA A 592 7.651 11.371 -1.450 1.00 0.00 H new ATOM 0 HA ALA A 592 6.136 9.515 -2.869 1.00 0.00 H new ATOM 0 HB1 ALA A 592 8.060 8.012 -2.468 1.00 0.00 H new ATOM 0 HB2 ALA A 592 8.585 9.648 -2.932 1.00 0.00 H new ATOM 0 HB3 ALA A 592 8.669 9.135 -1.230 1.00 0.00 H new ATOM 822 N LYS A 593 5.920 9.181 0.336 1.00 0.00 N ATOM 823 CA LYS A 593 5.264 8.444 1.411 1.00 0.00 C ATOM 824 C LYS A 593 3.807 8.867 1.557 1.00 0.00 C ATOM 825 O LYS A 593 3.394 9.901 1.032 1.00 0.00 O ATOM 826 CB LYS A 593 6.003 8.657 2.733 1.00 0.00 C ATOM 827 CG LYS A 593 7.362 7.978 2.786 1.00 0.00 C ATOM 828 CD LYS A 593 8.470 8.983 3.052 1.00 0.00 C ATOM 829 CE LYS A 593 9.774 8.297 3.433 1.00 0.00 C ATOM 830 NZ LYS A 593 10.106 8.497 4.870 1.00 0.00 N ATOM 0 H LYS A 593 6.327 10.072 0.622 1.00 0.00 H new ATOM 0 HA LYS A 593 5.291 7.385 1.154 1.00 0.00 H new ATOM 0 HB2 LYS A 593 6.134 9.726 2.899 1.00 0.00 H new ATOM 0 HB3 LYS A 593 5.386 8.281 3.549 1.00 0.00 H new ATOM 0 HG2 LYS A 593 7.361 7.218 3.568 1.00 0.00 H new ATOM 0 HG3 LYS A 593 7.552 7.465 1.843 1.00 0.00 H new ATOM 0 HD2 LYS A 593 8.627 9.595 2.164 1.00 0.00 H new ATOM 0 HD3 LYS A 593 8.166 9.656 3.853 1.00 0.00 H new ATOM 0 HE2 LYS A 593 9.698 7.230 3.223 1.00 0.00 H new ATOM 0 HE3 LYS A 593 10.583 8.687 2.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 593 11.001 8.015 5.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 593 10.204 9.514 5.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 593 9.346 8.102 5.460 1.00 0.00 H new ATOM 844 N HIS A 594 3.032 8.060 2.274 1.00 0.00 N ATOM 845 CA HIS A 594 1.619 8.352 2.491 1.00 0.00 C ATOM 846 C HIS A 594 1.067 7.587 3.690 1.00 0.00 C ATOM 847 O HIS A 594 1.751 6.749 4.277 1.00 0.00 O ATOM 848 CB HIS A 594 0.801 8.000 1.246 1.00 0.00 C ATOM 849 CG HIS A 594 0.987 8.960 0.112 1.00 0.00 C ATOM 850 ND1 HIS A 594 1.112 10.322 0.290 1.00 0.00 N ATOM 851 CD2 HIS A 594 1.071 8.748 -1.223 1.00 0.00 C ATOM 852 CE1 HIS A 594 1.263 10.905 -0.887 1.00 0.00 C ATOM 853 NE2 HIS A 594 1.243 9.972 -1.820 1.00 0.00 N ATOM 0 H HIS A 594 3.358 7.200 2.714 1.00 0.00 H new ATOM 0 HA HIS A 594 1.536 9.420 2.693 1.00 0.00 H new ATOM 0 HB2 HIS A 594 1.076 7.000 0.912 1.00 0.00 H new ATOM 0 HB3 HIS A 594 -0.255 7.968 1.513 1.00 0.00 H new ATOM 0 HD2 HIS A 594 1.013 7.793 -1.725 1.00 0.00 H new ATOM 0 HE1 HIS A 594 1.382 11.965 -1.056 1.00 0.00 H new ATOM 0 HE2 HIS A 594 1.340 10.134 -2.822 1.00 0.00 H new ATOM 862 N LYS A 595 -0.184 7.879 4.036 1.00 0.00 N ATOM 863 CA LYS A 595 -0.855 7.224 5.154 1.00 0.00 C ATOM 864 C LYS A 595 -2.369 7.369 5.022 1.00 0.00 C ATOM 865 O LYS A 595 -2.911 8.466 5.162 1.00 0.00 O ATOM 866 CB LYS A 595 -0.389 7.816 6.486 1.00 0.00 C ATOM 867 CG LYS A 595 1.090 7.610 6.758 1.00 0.00 C ATOM 868 CD LYS A 595 1.930 8.721 6.150 1.00 0.00 C ATOM 869 CE LYS A 595 2.412 9.698 7.210 1.00 0.00 C ATOM 870 NZ LYS A 595 1.432 10.796 7.440 1.00 0.00 N ATOM 0 H LYS A 595 -0.757 8.571 3.553 1.00 0.00 H new ATOM 0 HA LYS A 595 -0.596 6.165 5.134 1.00 0.00 H new ATOM 0 HB2 LYS A 595 -0.606 8.884 6.495 1.00 0.00 H new ATOM 0 HB3 LYS A 595 -0.965 7.367 7.295 1.00 0.00 H new ATOM 0 HG2 LYS A 595 1.261 7.571 7.834 1.00 0.00 H new ATOM 0 HG3 LYS A 595 1.405 6.650 6.350 1.00 0.00 H new ATOM 0 HD2 LYS A 595 2.788 8.289 5.634 1.00 0.00 H new ATOM 0 HD3 LYS A 595 1.344 9.254 5.402 1.00 0.00 H new ATOM 0 HE2 LYS A 595 2.585 9.164 8.144 1.00 0.00 H new ATOM 0 HE3 LYS A 595 3.368 10.123 6.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 1.798 11.441 8.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 1.286 11.322 6.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 0.527 10.393 7.756 1.00 0.00 H new ATOM 884 N THR A 596 -3.048 6.259 4.747 1.00 0.00 N ATOM 885 CA THR A 596 -4.498 6.272 4.591 1.00 0.00 C ATOM 886 C THR A 596 -5.184 6.634 5.902 1.00 0.00 C ATOM 887 O THR A 596 -4.670 6.347 6.983 1.00 0.00 O ATOM 888 CB THR A 596 -4.995 4.911 4.103 1.00 0.00 C ATOM 889 OG1 THR A 596 -5.017 3.975 5.167 1.00 0.00 O ATOM 890 CG2 THR A 596 -4.149 4.328 2.994 1.00 0.00 C ATOM 0 H THR A 596 -2.618 5.342 4.628 1.00 0.00 H new ATOM 0 HA THR A 596 -4.749 7.030 3.848 1.00 0.00 H new ATOM 0 HB THR A 596 -5.998 5.091 3.715 1.00 0.00 H new ATOM 0 HG1 THR A 596 -5.930 3.641 5.290 1.00 0.00 H new ATOM 0 HG21 THR A 596 -4.557 3.362 2.695 1.00 0.00 H new ATOM 0 HG22 THR A 596 -4.153 5.004 2.139 1.00 0.00 H new ATOM 0 HG23 THR A 596 -3.126 4.196 3.347 1.00 0.00 H new ATOM 898 N GLN A 597 -6.349 7.263 5.800 1.00 0.00 N ATOM 899 CA GLN A 597 -7.104 7.658 6.981 1.00 0.00 C ATOM 900 C GLN A 597 -7.017 6.583 8.056 1.00 0.00 C ATOM 901 O GLN A 597 -7.068 5.389 7.760 1.00 0.00 O ATOM 902 CB GLN A 597 -8.566 7.920 6.620 1.00 0.00 C ATOM 903 CG GLN A 597 -8.794 9.253 5.927 1.00 0.00 C ATOM 904 CD GLN A 597 -9.804 10.122 6.651 1.00 0.00 C ATOM 905 OE1 GLN A 597 -9.780 10.229 7.877 1.00 0.00 O ATOM 906 NE2 GLN A 597 -10.696 10.749 5.893 1.00 0.00 N ATOM 0 H GLN A 597 -6.790 7.510 4.914 1.00 0.00 H new ATOM 0 HA GLN A 597 -6.669 8.578 7.371 1.00 0.00 H new ATOM 0 HB2 GLN A 597 -8.920 7.118 5.972 1.00 0.00 H new ATOM 0 HB3 GLN A 597 -9.167 7.885 7.528 1.00 0.00 H new ATOM 0 HG2 GLN A 597 -7.847 9.787 5.854 1.00 0.00 H new ATOM 0 HG3 GLN A 597 -9.138 9.074 4.908 1.00 0.00 H new ATOM 0 HE21 GLN A 597 -10.678 10.631 4.880 1.00 0.00 H new ATOM 0 HE22 GLN A 597 -11.399 11.349 6.324 1.00 0.00 H new ATOM 915 N ILE A 598 -6.883 7.013 9.304 1.00 0.00 N ATOM 916 CA ILE A 598 -6.785 6.087 10.423 1.00 0.00 C ATOM 917 C ILE A 598 -8.144 5.492 10.768 1.00 0.00 C ATOM 918 O ILE A 598 -9.073 6.215 11.128 1.00 0.00 O ATOM 919 CB ILE A 598 -6.232 6.777 11.685 1.00 0.00 C ATOM 920 CG1 ILE A 598 -5.077 7.719 11.331 1.00 0.00 C ATOM 921 CG2 ILE A 598 -5.791 5.734 12.703 1.00 0.00 C ATOM 922 CD1 ILE A 598 -3.722 7.048 11.307 1.00 0.00 C ATOM 0 H ILE A 598 -6.840 7.998 9.566 1.00 0.00 H new ATOM 0 HA ILE A 598 -6.102 5.298 10.108 1.00 0.00 H new ATOM 0 HB ILE A 598 -7.026 7.378 12.128 1.00 0.00 H new ATOM 0 HG12 ILE A 598 -5.269 8.162 10.354 1.00 0.00 H new ATOM 0 HG13 ILE A 598 -5.054 8.536 12.052 1.00 0.00 H new ATOM 0 HG21 ILE A 598 -5.402 6.233 13.590 1.00 0.00 H new ATOM 0 HG22 ILE A 598 -6.643 5.113 12.980 1.00 0.00 H new ATOM 0 HG23 ILE A 598 -5.012 5.108 12.268 1.00 0.00 H new ATOM 0 HD11 ILE A 598 -2.958 7.781 11.049 1.00 0.00 H new ATOM 0 HD12 ILE A 598 -3.506 6.629 12.290 1.00 0.00 H new ATOM 0 HD13 ILE A 598 -3.725 6.249 10.565 1.00 0.00 H new ATOM 934 N LYS A 599 -8.252 4.172 10.681 1.00 0.00 N ATOM 935 CA LYS A 599 -9.495 3.494 11.012 1.00 0.00 C ATOM 936 C LYS A 599 -9.429 2.983 12.444 1.00 0.00 C ATOM 937 O LYS A 599 -9.240 1.792 12.687 1.00 0.00 O ATOM 938 CB LYS A 599 -9.757 2.342 10.042 1.00 0.00 C ATOM 939 CG LYS A 599 -10.863 2.640 9.043 1.00 0.00 C ATOM 940 CD LYS A 599 -10.337 2.651 7.616 1.00 0.00 C ATOM 941 CE LYS A 599 -10.119 4.070 7.115 1.00 0.00 C ATOM 942 NZ LYS A 599 -10.971 4.378 5.932 1.00 0.00 N ATOM 0 H LYS A 599 -7.497 3.554 10.385 1.00 0.00 H new ATOM 0 HA LYS A 599 -10.320 4.201 10.923 1.00 0.00 H new ATOM 0 HB2 LYS A 599 -8.839 2.116 9.501 1.00 0.00 H new ATOM 0 HB3 LYS A 599 -10.020 1.450 10.610 1.00 0.00 H new ATOM 0 HG2 LYS A 599 -11.650 1.892 9.136 1.00 0.00 H new ATOM 0 HG3 LYS A 599 -11.313 3.606 9.274 1.00 0.00 H new ATOM 0 HD2 LYS A 599 -9.398 2.099 7.569 1.00 0.00 H new ATOM 0 HD3 LYS A 599 -11.042 2.137 6.963 1.00 0.00 H new ATOM 0 HE2 LYS A 599 -10.340 4.776 7.916 1.00 0.00 H new ATOM 0 HE3 LYS A 599 -9.070 4.205 6.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 -10.383 4.787 5.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 -11.417 3.504 5.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 -11.709 5.059 6.203 1.00 0.00 H new ATOM 956 N LYS A 600 -9.559 3.906 13.389 1.00 0.00 N ATOM 957 CA LYS A 600 -9.489 3.574 14.805 1.00 0.00 C ATOM 958 C LYS A 600 -10.639 2.668 15.233 1.00 0.00 C ATOM 959 O LYS A 600 -11.784 2.858 14.824 1.00 0.00 O ATOM 960 CB LYS A 600 -9.489 4.851 15.647 1.00 0.00 C ATOM 961 CG LYS A 600 -8.775 6.017 14.982 1.00 0.00 C ATOM 962 CD LYS A 600 -7.692 6.595 15.879 1.00 0.00 C ATOM 963 CE LYS A 600 -7.277 7.986 15.427 1.00 0.00 C ATOM 964 NZ LYS A 600 -8.325 8.638 14.594 1.00 0.00 N ATOM 0 H LYS A 600 -9.714 4.896 13.198 1.00 0.00 H new ATOM 0 HA LYS A 600 -8.559 3.030 14.969 1.00 0.00 H new ATOM 0 HB2 LYS A 600 -10.519 5.138 15.857 1.00 0.00 H new ATOM 0 HB3 LYS A 600 -9.014 4.644 16.606 1.00 0.00 H new ATOM 0 HG2 LYS A 600 -8.332 5.685 14.043 1.00 0.00 H new ATOM 0 HG3 LYS A 600 -9.498 6.795 14.736 1.00 0.00 H new ATOM 0 HD2 LYS A 600 -8.054 6.638 16.906 1.00 0.00 H new ATOM 0 HD3 LYS A 600 -6.824 5.936 15.874 1.00 0.00 H new ATOM 0 HE2 LYS A 600 -7.071 8.605 16.301 1.00 0.00 H new ATOM 0 HE3 LYS A 600 -6.350 7.921 14.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 600 -8.063 9.629 14.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 600 -8.408 8.138 13.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 600 -9.237 8.603 15.093 1.00 0.00 H new ATOM 978 N LYS A 601 -10.317 1.689 16.072 1.00 0.00 N ATOM 979 CA LYS A 601 -11.309 0.750 16.582 1.00 0.00 C ATOM 980 C LYS A 601 -11.880 -0.126 15.473 1.00 0.00 C ATOM 981 O LYS A 601 -13.081 -0.101 15.207 1.00 0.00 O ATOM 982 CB LYS A 601 -12.440 1.503 17.284 1.00 0.00 C ATOM 983 CG LYS A 601 -12.002 2.203 18.561 1.00 0.00 C ATOM 984 CD LYS A 601 -11.663 3.663 18.307 1.00 0.00 C ATOM 985 CE LYS A 601 -12.194 4.558 19.414 1.00 0.00 C ATOM 986 NZ LYS A 601 -13.602 4.974 19.166 1.00 0.00 N ATOM 0 H LYS A 601 -9.370 1.525 16.415 1.00 0.00 H new ATOM 0 HA LYS A 601 -10.807 0.100 17.298 1.00 0.00 H new ATOM 0 HB2 LYS A 601 -12.854 2.242 16.598 1.00 0.00 H new ATOM 0 HB3 LYS A 601 -13.241 0.802 17.520 1.00 0.00 H new ATOM 0 HG2 LYS A 601 -12.796 2.137 19.304 1.00 0.00 H new ATOM 0 HG3 LYS A 601 -11.133 1.693 18.977 1.00 0.00 H new ATOM 0 HD2 LYS A 601 -10.582 3.779 18.231 1.00 0.00 H new ATOM 0 HD3 LYS A 601 -12.085 3.975 17.352 1.00 0.00 H new ATOM 0 HE2 LYS A 601 -12.134 4.032 20.367 1.00 0.00 H new ATOM 0 HE3 LYS A 601 -11.564 5.443 19.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 601 -13.926 5.583 19.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 601 -13.656 5.499 18.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 601 -14.208 4.131 19.111 1.00 0.00 H new ATOM 1000 N THR A 602 -11.017 -0.909 14.835 1.00 0.00 N ATOM 1001 CA THR A 602 -11.450 -1.797 13.763 1.00 0.00 C ATOM 1002 C THR A 602 -10.281 -2.607 13.211 1.00 0.00 C ATOM 1003 O THR A 602 -9.144 -2.135 13.177 1.00 0.00 O ATOM 1004 CB THR A 602 -12.093 -0.990 12.642 1.00 0.00 C ATOM 1005 OG1 THR A 602 -12.878 -1.823 11.807 1.00 0.00 O ATOM 1006 CG2 THR A 602 -11.077 -0.294 11.776 1.00 0.00 C ATOM 0 H THR A 602 -10.019 -0.947 15.040 1.00 0.00 H new ATOM 0 HA THR A 602 -12.182 -2.491 14.176 1.00 0.00 H new ATOM 0 HB THR A 602 -12.714 -0.240 13.133 1.00 0.00 H new ATOM 0 HG1 THR A 602 -13.283 -1.284 11.095 1.00 0.00 H new ATOM 0 HG21 THR A 602 -11.589 0.266 10.993 1.00 0.00 H new ATOM 0 HG22 THR A 602 -10.487 0.390 12.386 1.00 0.00 H new ATOM 0 HG23 THR A 602 -10.419 -1.034 11.321 1.00 0.00 H new ATOM 1014 N LEU A 603 -10.574 -3.826 12.774 1.00 0.00 N ATOM 1015 CA LEU A 603 -9.557 -4.709 12.215 1.00 0.00 C ATOM 1016 C LEU A 603 -9.887 -5.073 10.771 1.00 0.00 C ATOM 1017 O LEU A 603 -9.051 -5.615 10.048 1.00 0.00 O ATOM 1018 CB LEU A 603 -9.445 -5.982 13.056 1.00 0.00 C ATOM 1019 CG LEU A 603 -9.369 -5.755 14.567 1.00 0.00 C ATOM 1020 CD1 LEU A 603 -9.071 -7.062 15.287 1.00 0.00 C ATOM 1021 CD2 LEU A 603 -8.313 -4.711 14.895 1.00 0.00 C ATOM 0 H LEU A 603 -11.512 -4.227 12.796 1.00 0.00 H new ATOM 0 HA LEU A 603 -8.603 -4.181 12.230 1.00 0.00 H new ATOM 0 HB2 LEU A 603 -10.305 -6.617 12.842 1.00 0.00 H new ATOM 0 HB3 LEU A 603 -8.557 -6.530 12.741 1.00 0.00 H new ATOM 0 HG LEU A 603 -10.335 -5.386 14.911 1.00 0.00 H new ATOM 0 HD11 LEU A 603 -9.020 -6.882 16.361 1.00 0.00 H new ATOM 0 HD12 LEU A 603 -9.862 -7.782 15.076 1.00 0.00 H new ATOM 0 HD13 LEU A 603 -8.117 -7.459 14.940 1.00 0.00 H new ATOM 0 HD21 LEU A 603 -8.272 -4.562 15.974 1.00 0.00 H new ATOM 0 HD22 LEU A 603 -7.341 -5.052 14.539 1.00 0.00 H new ATOM 0 HD23 LEU A 603 -8.568 -3.770 14.408 1.00 0.00 H new ATOM 1033 N ASN A 604 -11.112 -4.770 10.360 1.00 0.00 N ATOM 1034 CA ASN A 604 -11.563 -5.062 9.003 1.00 0.00 C ATOM 1035 C ASN A 604 -12.257 -3.845 8.399 1.00 0.00 C ATOM 1036 O ASN A 604 -13.365 -3.944 7.871 1.00 0.00 O ATOM 1037 CB ASN A 604 -12.516 -6.258 9.006 1.00 0.00 C ATOM 1038 CG ASN A 604 -12.230 -7.221 10.142 1.00 0.00 C ATOM 1039 OD1 ASN A 604 -11.284 -8.005 10.083 1.00 0.00 O ATOM 1040 ND2 ASN A 604 -13.052 -7.168 11.183 1.00 0.00 N ATOM 0 H ASN A 604 -11.814 -4.321 10.948 1.00 0.00 H new ATOM 0 HA ASN A 604 -10.691 -5.306 8.396 1.00 0.00 H new ATOM 0 HB2 ASN A 604 -13.543 -5.901 9.086 1.00 0.00 H new ATOM 0 HB3 ASN A 604 -12.435 -6.786 8.056 1.00 0.00 H new ATOM 0 HD21 ASN A 604 -12.911 -7.794 11.976 1.00 0.00 H new ATOM 0 HD22 ASN A 604 -13.824 -6.502 11.190 1.00 0.00 H new ATOM 1047 N PRO A 605 -11.612 -2.673 8.484 1.00 0.00 N ATOM 1048 CA PRO A 605 -12.162 -1.417 7.961 1.00 0.00 C ATOM 1049 C PRO A 605 -12.075 -1.316 6.443 1.00 0.00 C ATOM 1050 O PRO A 605 -11.628 -2.245 5.771 1.00 0.00 O ATOM 1051 CB PRO A 605 -11.272 -0.358 8.606 1.00 0.00 C ATOM 1052 CG PRO A 605 -9.964 -1.042 8.804 1.00 0.00 C ATOM 1053 CD PRO A 605 -10.292 -2.479 9.112 1.00 0.00 C ATOM 0 HA PRO A 605 -13.223 -1.317 8.188 1.00 0.00 H new ATOM 0 HB2 PRO A 605 -11.169 0.518 7.966 1.00 0.00 H new ATOM 0 HB3 PRO A 605 -11.687 -0.013 9.553 1.00 0.00 H new ATOM 0 HG2 PRO A 605 -9.344 -0.966 7.911 1.00 0.00 H new ATOM 0 HG3 PRO A 605 -9.404 -0.586 9.620 1.00 0.00 H new ATOM 0 HD2 PRO A 605 -9.547 -3.158 8.698 1.00 0.00 H new ATOM 0 HD3 PRO A 605 -10.328 -2.661 10.186 1.00 0.00 H new ATOM 1061 N GLU A 606 -12.502 -0.171 5.917 1.00 0.00 N ATOM 1062 CA GLU A 606 -12.475 0.079 4.481 1.00 0.00 C ATOM 1063 C GLU A 606 -11.756 1.391 4.183 1.00 0.00 C ATOM 1064 O GLU A 606 -12.156 2.452 4.665 1.00 0.00 O ATOM 1065 CB GLU A 606 -13.899 0.121 3.919 1.00 0.00 C ATOM 1066 CG GLU A 606 -14.010 0.856 2.593 1.00 0.00 C ATOM 1067 CD GLU A 606 -14.554 2.262 2.751 1.00 0.00 C ATOM 1068 OE1 GLU A 606 -15.094 2.572 3.834 1.00 0.00 O ATOM 1069 OE2 GLU A 606 -14.442 3.053 1.791 1.00 0.00 O ATOM 0 H GLU A 606 -12.873 0.602 6.469 1.00 0.00 H new ATOM 0 HA GLU A 606 -11.933 -0.735 4.000 1.00 0.00 H new ATOM 0 HB2 GLU A 606 -14.260 -0.899 3.790 1.00 0.00 H new ATOM 0 HB3 GLU A 606 -14.553 0.601 4.647 1.00 0.00 H new ATOM 0 HG2 GLU A 606 -13.028 0.901 2.123 1.00 0.00 H new ATOM 0 HG3 GLU A 606 -14.659 0.292 1.922 1.00 0.00 H new ATOM 1076 N PHE A 607 -10.691 1.313 3.393 1.00 0.00 N ATOM 1077 CA PHE A 607 -9.914 2.495 3.041 1.00 0.00 C ATOM 1078 C PHE A 607 -10.492 3.190 1.813 1.00 0.00 C ATOM 1079 O PHE A 607 -10.851 4.367 1.866 1.00 0.00 O ATOM 1080 CB PHE A 607 -8.456 2.114 2.783 1.00 0.00 C ATOM 1081 CG PHE A 607 -7.746 1.597 4.001 1.00 0.00 C ATOM 1082 CD1 PHE A 607 -7.556 2.411 5.106 1.00 0.00 C ATOM 1083 CD2 PHE A 607 -7.268 0.297 4.040 1.00 0.00 C ATOM 1084 CE1 PHE A 607 -6.902 1.939 6.229 1.00 0.00 C ATOM 1085 CE2 PHE A 607 -6.613 -0.182 5.160 1.00 0.00 C ATOM 1086 CZ PHE A 607 -6.430 0.640 6.257 1.00 0.00 C ATOM 0 H PHE A 607 -10.346 0.444 2.985 1.00 0.00 H new ATOM 0 HA PHE A 607 -9.962 3.188 3.881 1.00 0.00 H new ATOM 0 HB2 PHE A 607 -8.420 1.355 2.002 1.00 0.00 H new ATOM 0 HB3 PHE A 607 -7.923 2.986 2.404 1.00 0.00 H new ATOM 0 HD1 PHE A 607 -7.923 3.427 5.090 1.00 0.00 H new ATOM 0 HD2 PHE A 607 -7.408 -0.349 3.186 1.00 0.00 H new ATOM 0 HE1 PHE A 607 -6.760 2.584 7.083 1.00 0.00 H new ATOM 0 HE2 PHE A 607 -6.245 -1.197 5.178 1.00 0.00 H new ATOM 0 HZ PHE A 607 -5.920 0.268 7.133 1.00 0.00 H new ATOM 1096 N ASN A 608 -10.575 2.459 0.705 1.00 0.00 N ATOM 1097 CA ASN A 608 -11.103 3.014 -0.535 1.00 0.00 C ATOM 1098 C ASN A 608 -10.437 4.351 -0.842 1.00 0.00 C ATOM 1099 O ASN A 608 -11.106 5.328 -1.177 1.00 0.00 O ATOM 1100 CB ASN A 608 -12.619 3.195 -0.436 1.00 0.00 C ATOM 1101 CG ASN A 608 -13.294 3.175 -1.793 1.00 0.00 C ATOM 1102 OD1 ASN A 608 -12.765 2.616 -2.754 1.00 0.00 O ATOM 1103 ND2 ASN A 608 -14.469 3.787 -1.878 1.00 0.00 N ATOM 0 H ASN A 608 -10.284 1.483 0.641 1.00 0.00 H new ATOM 0 HA ASN A 608 -10.885 2.317 -1.345 1.00 0.00 H new ATOM 0 HB2 ASN A 608 -13.037 2.403 0.186 1.00 0.00 H new ATOM 0 HB3 ASN A 608 -12.837 4.140 0.061 1.00 0.00 H new ATOM 0 HD21 ASN A 608 -14.971 3.807 -2.766 1.00 0.00 H new ATOM 0 HD22 ASN A 608 -14.870 4.237 -1.055 1.00 0.00 H new ATOM 1110 N GLU A 609 -9.115 4.385 -0.714 1.00 0.00 N ATOM 1111 CA GLU A 609 -8.353 5.603 -0.966 1.00 0.00 C ATOM 1112 C GLU A 609 -7.512 5.481 -2.233 1.00 0.00 C ATOM 1113 O GLU A 609 -6.665 4.594 -2.347 1.00 0.00 O ATOM 1114 CB GLU A 609 -7.452 5.917 0.230 1.00 0.00 C ATOM 1115 CG GLU A 609 -7.975 7.043 1.106 1.00 0.00 C ATOM 1116 CD GLU A 609 -6.884 8.006 1.532 1.00 0.00 C ATOM 1117 OE1 GLU A 609 -5.816 7.534 1.974 1.00 0.00 O ATOM 1118 OE2 GLU A 609 -7.099 9.232 1.425 1.00 0.00 O ATOM 0 H GLU A 609 -8.549 3.583 -0.437 1.00 0.00 H new ATOM 0 HA GLU A 609 -9.062 6.418 -1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 609 -7.340 5.018 0.836 1.00 0.00 H new ATOM 0 HB3 GLU A 609 -6.459 6.182 -0.133 1.00 0.00 H new ATOM 0 HG2 GLU A 609 -8.747 7.591 0.565 1.00 0.00 H new ATOM 0 HG3 GLU A 609 -8.447 6.619 1.993 1.00 0.00 H new ATOM 1125 N GLU A 610 -7.745 6.386 -3.180 1.00 0.00 N ATOM 1126 CA GLU A 610 -7.007 6.390 -4.437 1.00 0.00 C ATOM 1127 C GLU A 610 -5.853 7.388 -4.379 1.00 0.00 C ATOM 1128 O GLU A 610 -6.068 8.595 -4.271 1.00 0.00 O ATOM 1129 CB GLU A 610 -7.937 6.733 -5.602 1.00 0.00 C ATOM 1130 CG GLU A 610 -8.510 5.512 -6.303 1.00 0.00 C ATOM 1131 CD GLU A 610 -7.517 4.864 -7.248 1.00 0.00 C ATOM 1132 OE1 GLU A 610 -6.805 5.603 -7.960 1.00 0.00 O ATOM 1133 OE2 GLU A 610 -7.453 3.616 -7.278 1.00 0.00 O ATOM 0 H GLU A 610 -8.441 7.127 -3.099 1.00 0.00 H new ATOM 0 HA GLU A 610 -6.598 5.392 -4.595 1.00 0.00 H new ATOM 0 HB2 GLU A 610 -8.758 7.348 -5.232 1.00 0.00 H new ATOM 0 HB3 GLU A 610 -7.390 7.335 -6.328 1.00 0.00 H new ATOM 0 HG2 GLU A 610 -8.825 4.783 -5.556 1.00 0.00 H new ATOM 0 HG3 GLU A 610 -9.401 5.802 -6.860 1.00 0.00 H new ATOM 1140 N PHE A 611 -4.631 6.872 -4.437 1.00 0.00 N ATOM 1141 CA PHE A 611 -3.440 7.708 -4.378 1.00 0.00 C ATOM 1142 C PHE A 611 -2.899 8.015 -5.765 1.00 0.00 C ATOM 1143 O PHE A 611 -3.426 7.547 -6.773 1.00 0.00 O ATOM 1144 CB PHE A 611 -2.359 7.009 -3.566 1.00 0.00 C ATOM 1145 CG PHE A 611 -2.575 7.102 -2.090 1.00 0.00 C ATOM 1146 CD1 PHE A 611 -3.462 6.252 -1.455 1.00 0.00 C ATOM 1147 CD2 PHE A 611 -1.886 8.034 -1.341 1.00 0.00 C ATOM 1148 CE1 PHE A 611 -3.660 6.332 -0.089 1.00 0.00 C ATOM 1149 CE2 PHE A 611 -2.074 8.120 0.023 1.00 0.00 C ATOM 1150 CZ PHE A 611 -2.962 7.268 0.652 1.00 0.00 C ATOM 0 H PHE A 611 -4.439 5.874 -4.525 1.00 0.00 H new ATOM 0 HA PHE A 611 -3.721 8.648 -3.904 1.00 0.00 H new ATOM 0 HB2 PHE A 611 -2.319 5.959 -3.855 1.00 0.00 H new ATOM 0 HB3 PHE A 611 -1.391 7.444 -3.813 1.00 0.00 H new ATOM 0 HD1 PHE A 611 -4.005 5.518 -2.032 1.00 0.00 H new ATOM 0 HD2 PHE A 611 -1.192 8.703 -1.828 1.00 0.00 H new ATOM 0 HE1 PHE A 611 -4.357 5.666 0.398 1.00 0.00 H new ATOM 0 HE2 PHE A 611 -1.528 8.852 0.599 1.00 0.00 H new ATOM 0 HZ PHE A 611 -3.110 7.333 1.720 1.00 0.00 H new ATOM 1160 N PHE A 612 -1.827 8.797 -5.799 1.00 0.00 N ATOM 1161 CA PHE A 612 -1.186 9.169 -7.050 1.00 0.00 C ATOM 1162 C PHE A 612 0.294 9.451 -6.832 1.00 0.00 C ATOM 1163 O PHE A 612 0.668 10.219 -5.945 1.00 0.00 O ATOM 1164 CB PHE A 612 -1.862 10.394 -7.662 1.00 0.00 C ATOM 1165 CG PHE A 612 -1.354 10.710 -9.036 1.00 0.00 C ATOM 1166 CD1 PHE A 612 -1.181 9.699 -9.965 1.00 0.00 C ATOM 1167 CD2 PHE A 612 -1.041 12.010 -9.397 1.00 0.00 C ATOM 1168 CE1 PHE A 612 -0.708 9.975 -11.230 1.00 0.00 C ATOM 1169 CE2 PHE A 612 -0.564 12.295 -10.662 1.00 0.00 C ATOM 1170 CZ PHE A 612 -0.398 11.275 -11.580 1.00 0.00 C ATOM 0 H PHE A 612 -1.382 9.187 -4.968 1.00 0.00 H new ATOM 0 HA PHE A 612 -1.288 8.331 -7.740 1.00 0.00 H new ATOM 0 HB2 PHE A 612 -2.938 10.225 -7.707 1.00 0.00 H new ATOM 0 HB3 PHE A 612 -1.701 11.255 -7.013 1.00 0.00 H new ATOM 0 HD1 PHE A 612 -1.420 8.681 -9.695 1.00 0.00 H new ATOM 0 HD2 PHE A 612 -1.171 12.809 -8.682 1.00 0.00 H new ATOM 0 HE1 PHE A 612 -0.580 9.177 -11.946 1.00 0.00 H new ATOM 0 HE2 PHE A 612 -0.321 13.312 -10.933 1.00 0.00 H new ATOM 0 HZ PHE A 612 -0.026 11.494 -12.570 1.00 0.00 H new ATOM 1180 N TYR A 613 1.130 8.824 -7.647 1.00 0.00 N ATOM 1181 CA TYR A 613 2.569 9.002 -7.550 1.00 0.00 C ATOM 1182 C TYR A 613 3.088 9.826 -8.722 1.00 0.00 C ATOM 1183 O TYR A 613 2.452 9.893 -9.773 1.00 0.00 O ATOM 1184 CB TYR A 613 3.260 7.643 -7.503 1.00 0.00 C ATOM 1185 CG TYR A 613 3.478 7.144 -6.097 1.00 0.00 C ATOM 1186 CD1 TYR A 613 2.453 6.528 -5.390 1.00 0.00 C ATOM 1187 CD2 TYR A 613 4.707 7.295 -5.477 1.00 0.00 C ATOM 1188 CE1 TYR A 613 2.648 6.074 -4.099 1.00 0.00 C ATOM 1189 CE2 TYR A 613 4.914 6.844 -4.187 1.00 0.00 C ATOM 1190 CZ TYR A 613 3.882 6.234 -3.502 1.00 0.00 C ATOM 1191 OH TYR A 613 4.086 5.784 -2.218 1.00 0.00 O ATOM 0 H TYR A 613 0.834 8.185 -8.385 1.00 0.00 H new ATOM 0 HA TYR A 613 2.794 9.542 -6.630 1.00 0.00 H new ATOM 0 HB2 TYR A 613 2.660 6.917 -8.052 1.00 0.00 H new ATOM 0 HB3 TYR A 613 4.221 7.712 -8.012 1.00 0.00 H new ATOM 0 HD1 TYR A 613 1.487 6.402 -5.857 1.00 0.00 H new ATOM 0 HD2 TYR A 613 5.516 7.772 -6.010 1.00 0.00 H new ATOM 0 HE1 TYR A 613 1.841 5.598 -3.562 1.00 0.00 H new ATOM 0 HE2 TYR A 613 5.878 6.968 -3.717 1.00 0.00 H new ATOM 0 HH TYR A 613 4.255 6.547 -1.627 1.00 0.00 H new ATOM 1201 N ASP A 614 4.239 10.458 -8.533 1.00 0.00 N ATOM 1202 CA ASP A 614 4.829 11.283 -9.580 1.00 0.00 C ATOM 1203 C ASP A 614 6.100 10.646 -10.129 1.00 0.00 C ATOM 1204 O ASP A 614 7.172 11.248 -10.095 1.00 0.00 O ATOM 1205 CB ASP A 614 5.137 12.682 -9.043 1.00 0.00 C ATOM 1206 CG ASP A 614 3.920 13.587 -9.059 1.00 0.00 C ATOM 1207 OD1 ASP A 614 3.553 14.070 -10.151 1.00 0.00 O ATOM 1208 OD2 ASP A 614 3.335 13.816 -7.979 1.00 0.00 O ATOM 0 H ASP A 614 4.780 10.416 -7.670 1.00 0.00 H new ATOM 0 HA ASP A 614 4.107 11.363 -10.392 1.00 0.00 H new ATOM 0 HB2 ASP A 614 5.514 12.602 -8.023 1.00 0.00 H new ATOM 0 HB3 ASP A 614 5.929 13.132 -9.641 1.00 0.00 H new ATOM 1213 N ILE A 615 5.971 9.427 -10.642 1.00 0.00 N ATOM 1214 CA ILE A 615 7.110 8.714 -11.199 1.00 0.00 C ATOM 1215 C ILE A 615 6.868 8.362 -12.663 1.00 0.00 C ATOM 1216 O ILE A 615 5.754 8.013 -13.053 1.00 0.00 O ATOM 1217 CB ILE A 615 7.416 7.429 -10.395 1.00 0.00 C ATOM 1218 CG1 ILE A 615 8.320 6.476 -11.183 1.00 0.00 C ATOM 1219 CG2 ILE A 615 6.130 6.731 -9.983 1.00 0.00 C ATOM 1220 CD1 ILE A 615 9.790 6.776 -11.031 1.00 0.00 C ATOM 0 H ILE A 615 5.090 8.915 -10.683 1.00 0.00 H new ATOM 0 HA ILE A 615 7.973 9.377 -11.133 1.00 0.00 H new ATOM 0 HB ILE A 615 7.952 7.725 -9.493 1.00 0.00 H new ATOM 0 HG12 ILE A 615 8.130 5.454 -10.855 1.00 0.00 H new ATOM 0 HG13 ILE A 615 8.055 6.526 -12.239 1.00 0.00 H new ATOM 0 HG21 ILE A 615 6.370 5.830 -9.419 1.00 0.00 H new ATOM 0 HG22 ILE A 615 5.535 7.401 -9.362 1.00 0.00 H new ATOM 0 HG23 ILE A 615 5.561 6.461 -10.873 1.00 0.00 H new ATOM 0 HD11 ILE A 615 10.369 6.062 -11.616 1.00 0.00 H new ATOM 0 HD12 ILE A 615 9.994 7.786 -11.386 1.00 0.00 H new ATOM 0 HD13 ILE A 615 10.071 6.697 -9.981 1.00 0.00 H new ATOM 1232 N LYS A 616 7.924 8.448 -13.465 1.00 0.00 N ATOM 1233 CA LYS A 616 7.833 8.129 -14.883 1.00 0.00 C ATOM 1234 C LYS A 616 7.790 6.621 -15.088 1.00 0.00 C ATOM 1235 O LYS A 616 8.593 5.883 -14.514 1.00 0.00 O ATOM 1236 CB LYS A 616 9.018 8.725 -15.643 1.00 0.00 C ATOM 1237 CG LYS A 616 8.890 10.218 -15.897 1.00 0.00 C ATOM 1238 CD LYS A 616 9.588 10.625 -17.185 1.00 0.00 C ATOM 1239 CE LYS A 616 9.520 12.127 -17.404 1.00 0.00 C ATOM 1240 NZ LYS A 616 10.760 12.652 -18.039 1.00 0.00 N ATOM 0 H LYS A 616 8.852 8.736 -13.156 1.00 0.00 H new ATOM 0 HA LYS A 616 6.912 8.563 -15.272 1.00 0.00 H new ATOM 0 HB2 LYS A 616 9.932 8.538 -15.079 1.00 0.00 H new ATOM 0 HB3 LYS A 616 9.122 8.210 -16.598 1.00 0.00 H new ATOM 0 HG2 LYS A 616 7.836 10.490 -15.951 1.00 0.00 H new ATOM 0 HG3 LYS A 616 9.319 10.769 -15.060 1.00 0.00 H new ATOM 0 HD2 LYS A 616 10.630 10.308 -17.151 1.00 0.00 H new ATOM 0 HD3 LYS A 616 9.126 10.112 -18.028 1.00 0.00 H new ATOM 0 HE2 LYS A 616 8.662 12.364 -18.033 1.00 0.00 H new ATOM 0 HE3 LYS A 616 9.362 12.627 -16.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 616 10.674 13.680 -18.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 616 11.576 12.449 -17.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 616 10.898 12.194 -18.963 1.00 0.00 H new ATOM 1254 N HIS A 617 6.847 6.166 -15.902 1.00 0.00 N ATOM 1255 CA HIS A 617 6.698 4.743 -16.176 1.00 0.00 C ATOM 1256 C HIS A 617 8.054 4.078 -16.393 1.00 0.00 C ATOM 1257 O HIS A 617 8.330 3.012 -15.842 1.00 0.00 O ATOM 1258 CB HIS A 617 5.809 4.529 -17.399 1.00 0.00 C ATOM 1259 CG HIS A 617 5.525 3.088 -17.675 1.00 0.00 C ATOM 1260 ND1 HIS A 617 6.208 2.355 -18.621 1.00 0.00 N ATOM 1261 CD2 HIS A 617 4.634 2.237 -17.113 1.00 0.00 C ATOM 1262 CE1 HIS A 617 5.750 1.117 -18.630 1.00 0.00 C ATOM 1263 NE2 HIS A 617 4.797 1.018 -17.724 1.00 0.00 N ATOM 0 H HIS A 617 6.174 6.762 -16.384 1.00 0.00 H new ATOM 0 HA HIS A 617 6.228 4.282 -15.307 1.00 0.00 H new ATOM 0 HB2 HIS A 617 4.867 5.057 -17.252 1.00 0.00 H new ATOM 0 HB3 HIS A 617 6.290 4.972 -18.271 1.00 0.00 H new ATOM 0 HD2 HIS A 617 3.928 2.473 -16.331 1.00 0.00 H new ATOM 0 HE1 HIS A 617 6.097 0.320 -19.271 1.00 0.00 H new ATOM 0 HE2 HIS A 617 4.267 0.173 -17.511 1.00 0.00 H new ATOM 1272 N SER A 618 8.898 4.710 -17.201 1.00 0.00 N ATOM 1273 CA SER A 618 10.224 4.175 -17.490 1.00 0.00 C ATOM 1274 C SER A 618 10.983 3.876 -16.203 1.00 0.00 C ATOM 1275 O SER A 618 11.886 3.040 -16.184 1.00 0.00 O ATOM 1276 CB SER A 618 11.018 5.159 -18.349 1.00 0.00 C ATOM 1277 OG SER A 618 10.264 5.582 -19.472 1.00 0.00 O ATOM 0 H SER A 618 8.688 5.593 -17.667 1.00 0.00 H new ATOM 0 HA SER A 618 10.100 3.243 -18.041 1.00 0.00 H new ATOM 0 HB2 SER A 618 11.299 6.025 -17.749 1.00 0.00 H new ATOM 0 HB3 SER A 618 11.943 4.689 -18.684 1.00 0.00 H new ATOM 0 HG SER A 618 10.794 6.212 -20.004 1.00 0.00 H new ATOM 1283 N ASP A 619 10.612 4.562 -15.128 1.00 0.00 N ATOM 1284 CA ASP A 619 11.260 4.364 -13.837 1.00 0.00 C ATOM 1285 C ASP A 619 10.396 3.492 -12.930 1.00 0.00 C ATOM 1286 O ASP A 619 10.908 2.785 -12.063 1.00 0.00 O ATOM 1287 CB ASP A 619 11.535 5.711 -13.170 1.00 0.00 C ATOM 1288 CG ASP A 619 12.589 6.515 -13.905 1.00 0.00 C ATOM 1289 OD1 ASP A 619 12.245 7.159 -14.918 1.00 0.00 O ATOM 1290 OD2 ASP A 619 13.759 6.499 -13.469 1.00 0.00 O ATOM 0 H ASP A 619 9.867 5.259 -15.125 1.00 0.00 H new ATOM 0 HA ASP A 619 12.209 3.854 -14.003 1.00 0.00 H new ATOM 0 HB2 ASP A 619 10.610 6.286 -13.124 1.00 0.00 H new ATOM 0 HB3 ASP A 619 11.859 5.545 -12.143 1.00 0.00 H new ATOM 1295 N LEU A 620 9.085 3.544 -13.148 1.00 0.00 N ATOM 1296 CA LEU A 620 8.141 2.756 -12.363 1.00 0.00 C ATOM 1297 C LEU A 620 8.744 1.401 -12.005 1.00 0.00 C ATOM 1298 O LEU A 620 9.024 1.120 -10.845 1.00 0.00 O ATOM 1299 CB LEU A 620 6.844 2.547 -13.157 1.00 0.00 C ATOM 1300 CG LEU A 620 5.641 3.415 -12.762 1.00 0.00 C ATOM 1301 CD1 LEU A 620 4.545 2.552 -12.162 1.00 0.00 C ATOM 1302 CD2 LEU A 620 6.039 4.524 -11.798 1.00 0.00 C ATOM 0 H LEU A 620 8.651 4.126 -13.865 1.00 0.00 H new ATOM 0 HA LEU A 620 7.920 3.298 -11.444 1.00 0.00 H new ATOM 0 HB2 LEU A 620 7.059 2.724 -14.211 1.00 0.00 H new ATOM 0 HB3 LEU A 620 6.553 1.501 -13.063 1.00 0.00 H new ATOM 0 HG LEU A 620 5.262 3.890 -13.667 1.00 0.00 H new ATOM 0 HD11 LEU A 620 3.698 3.180 -11.886 1.00 0.00 H new ATOM 0 HD12 LEU A 620 4.224 1.810 -12.894 1.00 0.00 H new ATOM 0 HD13 LEU A 620 4.925 2.046 -11.275 1.00 0.00 H new ATOM 0 HD21 LEU A 620 5.160 5.116 -11.542 1.00 0.00 H new ATOM 0 HD22 LEU A 620 6.458 4.086 -10.892 1.00 0.00 H new ATOM 0 HD23 LEU A 620 6.784 5.165 -12.269 1.00 0.00 H new ATOM 1314 N ALA A 621 8.940 0.569 -13.017 1.00 0.00 N ATOM 1315 CA ALA A 621 9.512 -0.759 -12.830 1.00 0.00 C ATOM 1316 C ALA A 621 10.563 -0.773 -11.717 1.00 0.00 C ATOM 1317 O ALA A 621 10.446 -1.523 -10.750 1.00 0.00 O ATOM 1318 CB ALA A 621 10.128 -1.235 -14.138 1.00 0.00 C ATOM 0 H ALA A 621 8.709 0.792 -13.985 1.00 0.00 H new ATOM 0 HA ALA A 621 8.710 -1.434 -12.531 1.00 0.00 H new ATOM 0 HB1 ALA A 621 10.556 -2.228 -13.999 1.00 0.00 H new ATOM 0 HB2 ALA A 621 9.358 -1.276 -14.909 1.00 0.00 H new ATOM 0 HB3 ALA A 621 10.912 -0.542 -14.445 1.00 0.00 H new ATOM 1324 N LYS A 622 11.595 0.058 -11.865 1.00 0.00 N ATOM 1325 CA LYS A 622 12.676 0.129 -10.886 1.00 0.00 C ATOM 1326 C LYS A 622 12.170 0.581 -9.526 1.00 0.00 C ATOM 1327 O LYS A 622 12.836 0.384 -8.509 1.00 0.00 O ATOM 1328 CB LYS A 622 13.768 1.083 -11.375 1.00 0.00 C ATOM 1329 CG LYS A 622 14.830 0.408 -12.228 1.00 0.00 C ATOM 1330 CD LYS A 622 14.242 -0.142 -13.516 1.00 0.00 C ATOM 1331 CE LYS A 622 13.773 0.973 -14.436 1.00 0.00 C ATOM 1332 NZ LYS A 622 13.010 0.448 -15.602 1.00 0.00 N ATOM 0 H LYS A 622 11.704 0.692 -12.656 1.00 0.00 H new ATOM 0 HA LYS A 622 13.089 -0.874 -10.777 1.00 0.00 H new ATOM 0 HB2 LYS A 622 13.307 1.885 -11.952 1.00 0.00 H new ATOM 0 HB3 LYS A 622 14.247 1.546 -10.512 1.00 0.00 H new ATOM 0 HG2 LYS A 622 15.618 1.123 -12.463 1.00 0.00 H new ATOM 0 HG3 LYS A 622 15.292 -0.401 -11.663 1.00 0.00 H new ATOM 0 HD2 LYS A 622 14.989 -0.748 -14.029 1.00 0.00 H new ATOM 0 HD3 LYS A 622 13.404 -0.799 -13.283 1.00 0.00 H new ATOM 0 HE2 LYS A 622 13.147 1.667 -13.875 1.00 0.00 H new ATOM 0 HE3 LYS A 622 14.635 1.537 -14.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 622 13.621 0.445 -16.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 622 12.693 -0.522 -15.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 622 12.183 1.054 -15.777 1.00 0.00 H new ATOM 1346 N LYS A 623 10.996 1.192 -9.510 1.00 0.00 N ATOM 1347 CA LYS A 623 10.417 1.674 -8.268 1.00 0.00 C ATOM 1348 C LYS A 623 10.106 0.523 -7.322 1.00 0.00 C ATOM 1349 O LYS A 623 10.173 -0.647 -7.700 1.00 0.00 O ATOM 1350 CB LYS A 623 9.138 2.467 -8.530 1.00 0.00 C ATOM 1351 CG LYS A 623 9.329 3.656 -9.447 1.00 0.00 C ATOM 1352 CD LYS A 623 10.023 4.801 -8.732 1.00 0.00 C ATOM 1353 CE LYS A 623 11.486 4.901 -9.136 1.00 0.00 C ATOM 1354 NZ LYS A 623 12.092 6.200 -8.733 1.00 0.00 N ATOM 0 H LYS A 623 10.428 1.365 -10.339 1.00 0.00 H new ATOM 0 HA LYS A 623 11.155 2.327 -7.803 1.00 0.00 H new ATOM 0 HB2 LYS A 623 8.393 1.801 -8.965 1.00 0.00 H new ATOM 0 HB3 LYS A 623 8.737 2.816 -7.578 1.00 0.00 H new ATOM 0 HG2 LYS A 623 9.917 3.357 -10.315 1.00 0.00 H new ATOM 0 HG3 LYS A 623 8.360 3.991 -9.818 1.00 0.00 H new ATOM 0 HD2 LYS A 623 9.515 5.737 -8.963 1.00 0.00 H new ATOM 0 HD3 LYS A 623 9.951 4.656 -7.654 1.00 0.00 H new ATOM 0 HE2 LYS A 623 12.044 4.084 -8.679 1.00 0.00 H new ATOM 0 HE3 LYS A 623 11.572 4.781 -10.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 623 13.115 6.179 -8.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 623 11.656 6.971 -9.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 623 11.929 6.359 -7.718 1.00 0.00 H new ATOM 1368 N SER A 624 9.750 0.870 -6.093 1.00 0.00 N ATOM 1369 CA SER A 624 9.407 -0.122 -5.085 1.00 0.00 C ATOM 1370 C SER A 624 8.420 0.460 -4.082 1.00 0.00 C ATOM 1371 O SER A 624 8.795 1.236 -3.202 1.00 0.00 O ATOM 1372 CB SER A 624 10.660 -0.612 -4.370 1.00 0.00 C ATOM 1373 OG SER A 624 11.206 0.399 -3.539 1.00 0.00 O ATOM 0 H SER A 624 9.691 1.836 -5.770 1.00 0.00 H new ATOM 0 HA SER A 624 8.938 -0.971 -5.583 1.00 0.00 H new ATOM 0 HB2 SER A 624 10.419 -1.489 -3.769 1.00 0.00 H new ATOM 0 HB3 SER A 624 11.403 -0.923 -5.105 1.00 0.00 H new ATOM 0 HG SER A 624 12.008 0.057 -3.091 1.00 0.00 H new ATOM 1379 N LEU A 625 7.156 0.086 -4.229 1.00 0.00 N ATOM 1380 CA LEU A 625 6.104 0.576 -3.344 1.00 0.00 C ATOM 1381 C LEU A 625 6.000 -0.281 -2.089 1.00 0.00 C ATOM 1382 O LEU A 625 5.803 -1.492 -2.166 1.00 0.00 O ATOM 1383 CB LEU A 625 4.761 0.595 -4.074 1.00 0.00 C ATOM 1384 CG LEU A 625 3.584 1.124 -3.250 1.00 0.00 C ATOM 1385 CD1 LEU A 625 3.723 2.622 -3.025 1.00 0.00 C ATOM 1386 CD2 LEU A 625 2.266 0.807 -3.940 1.00 0.00 C ATOM 0 H LEU A 625 6.833 -0.556 -4.953 1.00 0.00 H new ATOM 0 HA LEU A 625 6.363 1.592 -3.046 1.00 0.00 H new ATOM 0 HB2 LEU A 625 4.861 1.206 -4.971 1.00 0.00 H new ATOM 0 HB3 LEU A 625 4.529 -0.418 -4.403 1.00 0.00 H new ATOM 0 HG LEU A 625 3.591 0.628 -2.279 1.00 0.00 H new ATOM 0 HD11 LEU A 625 2.878 2.982 -2.438 1.00 0.00 H new ATOM 0 HD12 LEU A 625 4.650 2.825 -2.489 1.00 0.00 H new ATOM 0 HD13 LEU A 625 3.740 3.134 -3.987 1.00 0.00 H new ATOM 0 HD21 LEU A 625 1.440 1.190 -3.341 1.00 0.00 H new ATOM 0 HD22 LEU A 625 2.248 1.276 -4.924 1.00 0.00 H new ATOM 0 HD23 LEU A 625 2.164 -0.273 -4.051 1.00 0.00 H new ATOM 1398 N ASP A 626 6.132 0.358 -0.932 1.00 0.00 N ATOM 1399 CA ASP A 626 6.050 -0.348 0.340 1.00 0.00 C ATOM 1400 C ASP A 626 4.742 -0.032 1.055 1.00 0.00 C ATOM 1401 O ASP A 626 4.605 1.015 1.687 1.00 0.00 O ATOM 1402 CB ASP A 626 7.237 0.025 1.230 1.00 0.00 C ATOM 1403 CG ASP A 626 7.114 -0.551 2.627 1.00 0.00 C ATOM 1404 OD1 ASP A 626 6.508 -1.633 2.772 1.00 0.00 O ATOM 1405 OD2 ASP A 626 7.625 0.081 3.576 1.00 0.00 O ATOM 0 H ASP A 626 6.296 1.361 -0.849 1.00 0.00 H new ATOM 0 HA ASP A 626 6.080 -1.418 0.136 1.00 0.00 H new ATOM 0 HB2 ASP A 626 8.158 -0.334 0.772 1.00 0.00 H new ATOM 0 HB3 ASP A 626 7.314 1.110 1.293 1.00 0.00 H new ATOM 1410 N ILE A 627 3.784 -0.949 0.954 1.00 0.00 N ATOM 1411 CA ILE A 627 2.487 -0.777 1.595 1.00 0.00 C ATOM 1412 C ILE A 627 2.485 -1.414 2.979 1.00 0.00 C ATOM 1413 O ILE A 627 2.370 -2.632 3.111 1.00 0.00 O ATOM 1414 CB ILE A 627 1.354 -1.395 0.754 1.00 0.00 C ATOM 1415 CG1 ILE A 627 1.505 -0.997 -0.715 1.00 0.00 C ATOM 1416 CG2 ILE A 627 -0.001 -0.962 1.290 1.00 0.00 C ATOM 1417 CD1 ILE A 627 2.216 -2.037 -1.554 1.00 0.00 C ATOM 0 H ILE A 627 3.883 -1.820 0.433 1.00 0.00 H new ATOM 0 HA ILE A 627 2.312 0.295 1.684 1.00 0.00 H new ATOM 0 HB ILE A 627 1.420 -2.481 0.825 1.00 0.00 H new ATOM 0 HG12 ILE A 627 0.517 -0.815 -1.137 1.00 0.00 H new ATOM 0 HG13 ILE A 627 2.054 -0.057 -0.774 1.00 0.00 H new ATOM 0 HG21 ILE A 627 -0.791 -1.407 0.685 1.00 0.00 H new ATOM 0 HG22 ILE A 627 -0.106 -1.292 2.323 1.00 0.00 H new ATOM 0 HG23 ILE A 627 -0.079 0.124 1.247 1.00 0.00 H new ATOM 0 HD11 ILE A 627 2.287 -1.687 -2.584 1.00 0.00 H new ATOM 0 HD12 ILE A 627 3.218 -2.202 -1.157 1.00 0.00 H new ATOM 0 HD13 ILE A 627 1.656 -2.972 -1.526 1.00 0.00 H new ATOM 1429 N SER A 628 2.625 -0.585 4.007 1.00 0.00 N ATOM 1430 CA SER A 628 2.653 -1.077 5.382 1.00 0.00 C ATOM 1431 C SER A 628 1.468 -0.560 6.188 1.00 0.00 C ATOM 1432 O SER A 628 1.163 0.631 6.177 1.00 0.00 O ATOM 1433 CB SER A 628 3.961 -0.668 6.061 1.00 0.00 C ATOM 1434 OG SER A 628 5.082 -1.069 5.292 1.00 0.00 O ATOM 0 H SER A 628 2.721 0.427 3.917 1.00 0.00 H new ATOM 0 HA SER A 628 2.586 -2.164 5.346 1.00 0.00 H new ATOM 0 HB2 SER A 628 3.980 0.413 6.200 1.00 0.00 H new ATOM 0 HB3 SER A 628 4.016 -1.118 7.052 1.00 0.00 H new ATOM 0 HG SER A 628 5.627 -1.696 5.811 1.00 0.00 H new ATOM 1440 N VAL A 629 0.816 -1.473 6.902 1.00 0.00 N ATOM 1441 CA VAL A 629 -0.326 -1.126 7.736 1.00 0.00 C ATOM 1442 C VAL A 629 0.096 -1.063 9.200 1.00 0.00 C ATOM 1443 O VAL A 629 0.684 -2.011 9.722 1.00 0.00 O ATOM 1444 CB VAL A 629 -1.468 -2.149 7.585 1.00 0.00 C ATOM 1445 CG1 VAL A 629 -2.749 -1.617 8.209 1.00 0.00 C ATOM 1446 CG2 VAL A 629 -1.683 -2.499 6.120 1.00 0.00 C ATOM 0 H VAL A 629 1.062 -2.463 6.918 1.00 0.00 H new ATOM 0 HA VAL A 629 -0.688 -0.151 7.409 1.00 0.00 H new ATOM 0 HB VAL A 629 -1.186 -3.060 8.113 1.00 0.00 H new ATOM 0 HG11 VAL A 629 -3.544 -2.354 8.092 1.00 0.00 H new ATOM 0 HG12 VAL A 629 -2.585 -1.425 9.269 1.00 0.00 H new ATOM 0 HG13 VAL A 629 -3.038 -0.690 7.713 1.00 0.00 H new ATOM 0 HG21 VAL A 629 -2.493 -3.223 6.034 1.00 0.00 H new ATOM 0 HG22 VAL A 629 -1.941 -1.597 5.565 1.00 0.00 H new ATOM 0 HG23 VAL A 629 -0.769 -2.928 5.710 1.00 0.00 H new ATOM 1456 N TRP A 630 -0.183 0.057 9.856 1.00 0.00 N ATOM 1457 CA TRP A 630 0.198 0.228 11.252 1.00 0.00 C ATOM 1458 C TRP A 630 -1.000 0.575 12.128 1.00 0.00 C ATOM 1459 O TRP A 630 -1.947 1.219 11.679 1.00 0.00 O ATOM 1460 CB TRP A 630 1.248 1.328 11.365 1.00 0.00 C ATOM 1461 CG TRP A 630 2.511 1.025 10.619 1.00 0.00 C ATOM 1462 CD1 TRP A 630 2.655 0.919 9.266 1.00 0.00 C ATOM 1463 CD2 TRP A 630 3.806 0.785 11.181 1.00 0.00 C ATOM 1464 NE1 TRP A 630 3.962 0.638 8.951 1.00 0.00 N ATOM 1465 CE2 TRP A 630 4.688 0.548 10.110 1.00 0.00 C ATOM 1466 CE3 TRP A 630 4.305 0.751 12.486 1.00 0.00 C ATOM 1467 CZ2 TRP A 630 6.040 0.280 10.304 1.00 0.00 C ATOM 1468 CZ3 TRP A 630 5.648 0.485 12.677 1.00 0.00 C ATOM 1469 CH2 TRP A 630 6.502 0.252 11.592 1.00 0.00 C ATOM 0 H TRP A 630 -0.668 0.855 9.447 1.00 0.00 H new ATOM 0 HA TRP A 630 0.607 -0.719 11.604 1.00 0.00 H new ATOM 0 HB2 TRP A 630 0.828 2.261 10.989 1.00 0.00 H new ATOM 0 HB3 TRP A 630 1.485 1.486 12.417 1.00 0.00 H new ATOM 0 HD1 TRP A 630 1.857 1.039 8.548 1.00 0.00 H new ATOM 0 HE1 TRP A 630 4.332 0.516 8.008 1.00 0.00 H new ATOM 0 HE3 TRP A 630 3.654 0.929 13.329 1.00 0.00 H new ATOM 0 HZ2 TRP A 630 6.700 0.101 9.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 630 6.046 0.456 13.681 1.00 0.00 H new ATOM 0 HH2 TRP A 630 7.546 0.046 11.775 1.00 0.00 H new ATOM 1480 N ASP A 631 -0.939 0.155 13.390 1.00 0.00 N ATOM 1481 CA ASP A 631 -2.005 0.433 14.341 1.00 0.00 C ATOM 1482 C ASP A 631 -1.805 1.810 14.966 1.00 0.00 C ATOM 1483 O ASP A 631 -0.858 2.034 15.720 1.00 0.00 O ATOM 1484 CB ASP A 631 -2.059 -0.653 15.425 1.00 0.00 C ATOM 1485 CG ASP A 631 -2.584 -0.144 16.756 1.00 0.00 C ATOM 1486 OD1 ASP A 631 -3.557 0.639 16.750 1.00 0.00 O ATOM 1487 OD2 ASP A 631 -2.022 -0.530 17.803 1.00 0.00 O ATOM 0 H ASP A 631 -0.160 -0.380 13.775 1.00 0.00 H new ATOM 0 HA ASP A 631 -2.957 0.428 13.810 1.00 0.00 H new ATOM 0 HB2 ASP A 631 -2.693 -1.470 15.080 1.00 0.00 H new ATOM 0 HB3 ASP A 631 -1.060 -1.064 15.569 1.00 0.00 H new ATOM 1492 N TYR A 632 -2.702 2.724 14.634 1.00 0.00 N ATOM 1493 CA TYR A 632 -2.643 4.087 15.137 1.00 0.00 C ATOM 1494 C TYR A 632 -3.075 4.158 16.598 1.00 0.00 C ATOM 1495 O TYR A 632 -3.675 3.221 17.126 1.00 0.00 O ATOM 1496 CB TYR A 632 -3.538 4.978 14.280 1.00 0.00 C ATOM 1497 CG TYR A 632 -3.596 6.413 14.737 1.00 0.00 C ATOM 1498 CD1 TYR A 632 -4.414 6.789 15.792 1.00 0.00 C ATOM 1499 CD2 TYR A 632 -2.842 7.392 14.108 1.00 0.00 C ATOM 1500 CE1 TYR A 632 -4.477 8.104 16.212 1.00 0.00 C ATOM 1501 CE2 TYR A 632 -2.898 8.709 14.519 1.00 0.00 C ATOM 1502 CZ TYR A 632 -3.715 9.060 15.572 1.00 0.00 C ATOM 1503 OH TYR A 632 -3.775 10.371 15.986 1.00 0.00 O ATOM 0 H TYR A 632 -3.489 2.543 14.011 1.00 0.00 H new ATOM 0 HA TYR A 632 -1.612 4.435 15.080 1.00 0.00 H new ATOM 0 HB2 TYR A 632 -3.181 4.950 13.250 1.00 0.00 H new ATOM 0 HB3 TYR A 632 -4.548 4.567 14.279 1.00 0.00 H new ATOM 0 HD1 TYR A 632 -5.011 6.042 16.293 1.00 0.00 H new ATOM 0 HD2 TYR A 632 -2.200 7.120 13.283 1.00 0.00 H new ATOM 0 HE1 TYR A 632 -5.118 8.382 17.036 1.00 0.00 H new ATOM 0 HE2 TYR A 632 -2.305 9.460 14.018 1.00 0.00 H new ATOM 0 HH TYR A 632 -3.178 10.916 15.433 1.00 0.00 H new ATOM 1513 N ASP A 633 -2.765 5.275 17.247 1.00 0.00 N ATOM 1514 CA ASP A 633 -3.121 5.472 18.646 1.00 0.00 C ATOM 1515 C ASP A 633 -3.108 6.955 19.006 1.00 0.00 C ATOM 1516 O ASP A 633 -2.124 7.654 18.763 1.00 0.00 O ATOM 1517 CB ASP A 633 -2.154 4.709 19.551 1.00 0.00 C ATOM 1518 CG ASP A 633 -2.024 3.250 19.160 1.00 0.00 C ATOM 1519 OD1 ASP A 633 -2.976 2.482 19.409 1.00 0.00 O ATOM 1520 OD2 ASP A 633 -0.971 2.877 18.603 1.00 0.00 O ATOM 0 H ASP A 633 -2.267 6.059 16.825 1.00 0.00 H new ATOM 0 HA ASP A 633 -4.130 5.088 18.797 1.00 0.00 H new ATOM 0 HB2 ASP A 633 -1.173 5.182 19.510 1.00 0.00 H new ATOM 0 HB3 ASP A 633 -2.497 4.776 20.583 1.00 0.00 H new ATOM 1525 N ILE A 634 -4.205 7.430 19.585 1.00 0.00 N ATOM 1526 CA ILE A 634 -4.316 8.831 19.975 1.00 0.00 C ATOM 1527 C ILE A 634 -3.582 9.099 21.283 1.00 0.00 C ATOM 1528 O ILE A 634 -3.670 8.316 22.229 1.00 0.00 O ATOM 1529 CB ILE A 634 -5.786 9.274 20.130 1.00 0.00 C ATOM 1530 CG1 ILE A 634 -6.657 8.114 20.621 1.00 0.00 C ATOM 1531 CG2 ILE A 634 -6.314 9.826 18.814 1.00 0.00 C ATOM 1532 CD1 ILE A 634 -7.235 7.270 19.503 1.00 0.00 C ATOM 0 H ILE A 634 -5.029 6.867 19.795 1.00 0.00 H new ATOM 0 HA ILE A 634 -3.858 9.409 19.172 1.00 0.00 H new ATOM 0 HB ILE A 634 -5.829 10.065 20.878 1.00 0.00 H new ATOM 0 HG12 ILE A 634 -6.062 7.476 21.275 1.00 0.00 H new ATOM 0 HG13 ILE A 634 -7.474 8.514 21.222 1.00 0.00 H new ATOM 0 HG21 ILE A 634 -7.352 10.134 18.939 1.00 0.00 H new ATOM 0 HG22 ILE A 634 -5.714 10.685 18.513 1.00 0.00 H new ATOM 0 HG23 ILE A 634 -6.255 9.055 18.046 1.00 0.00 H new ATOM 0 HD11 ILE A 634 -7.840 6.469 19.927 1.00 0.00 H new ATOM 0 HD12 ILE A 634 -7.857 7.893 18.861 1.00 0.00 H new ATOM 0 HD13 ILE A 634 -6.424 6.840 18.915 1.00 0.00 H new ATOM 1544 N GLY A 635 -2.859 10.214 21.330 1.00 0.00 N ATOM 1545 CA GLY A 635 -2.120 10.571 22.526 1.00 0.00 C ATOM 1546 C GLY A 635 -0.888 9.710 22.736 1.00 0.00 C ATOM 1547 O GLY A 635 -0.145 9.906 23.698 1.00 0.00 O ATOM 0 H GLY A 635 -2.772 10.877 20.560 1.00 0.00 H new ATOM 0 HA2 GLY A 635 -1.820 11.617 22.463 1.00 0.00 H new ATOM 0 HA3 GLY A 635 -2.774 10.478 23.393 1.00 0.00 H new ATOM 1551 N LYS A 636 -0.671 8.756 21.838 1.00 0.00 N ATOM 1552 CA LYS A 636 0.481 7.866 21.937 1.00 0.00 C ATOM 1553 C LYS A 636 1.111 7.633 20.568 1.00 0.00 C ATOM 1554 O LYS A 636 0.718 8.252 19.579 1.00 0.00 O ATOM 1555 CB LYS A 636 0.068 6.527 22.553 1.00 0.00 C ATOM 1556 CG LYS A 636 -1.189 6.609 23.404 1.00 0.00 C ATOM 1557 CD LYS A 636 -0.881 7.110 24.805 1.00 0.00 C ATOM 1558 CE LYS A 636 -2.129 7.144 25.672 1.00 0.00 C ATOM 1559 NZ LYS A 636 -3.252 7.856 25.001 1.00 0.00 N ATOM 0 H LYS A 636 -1.275 8.579 21.035 1.00 0.00 H new ATOM 0 HA LYS A 636 1.220 8.343 22.581 1.00 0.00 H new ATOM 0 HB2 LYS A 636 -0.091 5.803 21.754 1.00 0.00 H new ATOM 0 HB3 LYS A 636 0.887 6.151 23.166 1.00 0.00 H new ATOM 0 HG2 LYS A 636 -1.909 7.275 22.928 1.00 0.00 H new ATOM 0 HG3 LYS A 636 -1.655 5.625 23.462 1.00 0.00 H new ATOM 0 HD2 LYS A 636 -0.133 6.465 25.267 1.00 0.00 H new ATOM 0 HD3 LYS A 636 -0.449 8.109 24.748 1.00 0.00 H new ATOM 0 HE2 LYS A 636 -2.435 6.125 25.908 1.00 0.00 H new ATOM 0 HE3 LYS A 636 -1.901 7.636 26.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 636 -4.084 7.857 25.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 636 -2.970 8.836 24.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 636 -3.487 7.372 24.111 1.00 0.00 H new ATOM 1573 N SER A 637 2.089 6.734 20.518 1.00 0.00 N ATOM 1574 CA SER A 637 2.772 6.418 19.270 1.00 0.00 C ATOM 1575 C SER A 637 1.941 5.454 18.430 1.00 0.00 C ATOM 1576 O SER A 637 0.779 5.192 18.737 1.00 0.00 O ATOM 1577 CB SER A 637 4.147 5.809 19.555 1.00 0.00 C ATOM 1578 OG SER A 637 4.248 5.388 20.904 1.00 0.00 O ATOM 0 H SER A 637 2.426 6.212 21.327 1.00 0.00 H new ATOM 0 HA SER A 637 2.903 7.344 18.710 1.00 0.00 H new ATOM 0 HB2 SER A 637 4.317 4.961 18.892 1.00 0.00 H new ATOM 0 HB3 SER A 637 4.925 6.542 19.340 1.00 0.00 H new ATOM 0 HG SER A 637 5.135 5.001 21.060 1.00 0.00 H new ATOM 1584 N ASN A 638 2.543 4.929 17.369 1.00 0.00 N ATOM 1585 CA ASN A 638 1.854 3.994 16.486 1.00 0.00 C ATOM 1586 C ASN A 638 2.356 2.570 16.702 1.00 0.00 C ATOM 1587 O ASN A 638 3.281 2.338 17.481 1.00 0.00 O ATOM 1588 CB ASN A 638 2.039 4.395 15.018 1.00 0.00 C ATOM 1589 CG ASN A 638 3.021 5.538 14.840 1.00 0.00 C ATOM 1590 OD1 ASN A 638 4.038 5.611 15.530 1.00 0.00 O ATOM 1591 ND2 ASN A 638 2.720 6.437 13.911 1.00 0.00 N ATOM 0 H ASN A 638 3.505 5.134 17.099 1.00 0.00 H new ATOM 0 HA ASN A 638 0.792 4.030 16.729 1.00 0.00 H new ATOM 0 HB2 ASN A 638 2.387 3.531 14.451 1.00 0.00 H new ATOM 0 HB3 ASN A 638 1.074 4.683 14.600 1.00 0.00 H new ATOM 0 HD21 ASN A 638 3.343 7.228 13.746 1.00 0.00 H new ATOM 0 HD22 ASN A 638 1.866 6.337 13.362 1.00 0.00 H new ATOM 1598 N ASP A 639 1.741 1.622 16.004 1.00 0.00 N ATOM 1599 CA ASP A 639 2.122 0.220 16.114 1.00 0.00 C ATOM 1600 C ASP A 639 2.201 -0.426 14.736 1.00 0.00 C ATOM 1601 O ASP A 639 1.434 -0.085 13.836 1.00 0.00 O ATOM 1602 CB ASP A 639 1.120 -0.538 16.986 1.00 0.00 C ATOM 1603 CG ASP A 639 1.361 -0.321 18.467 1.00 0.00 C ATOM 1604 OD1 ASP A 639 2.356 0.349 18.814 1.00 0.00 O ATOM 1605 OD2 ASP A 639 0.555 -0.820 19.279 1.00 0.00 O ATOM 0 H ASP A 639 0.975 1.800 15.355 1.00 0.00 H new ATOM 0 HA ASP A 639 3.106 0.171 16.580 1.00 0.00 H new ATOM 0 HB2 ASP A 639 0.109 -0.218 16.735 1.00 0.00 H new ATOM 0 HB3 ASP A 639 1.182 -1.603 16.763 1.00 0.00 H new ATOM 1610 N TYR A 640 3.134 -1.358 14.574 1.00 0.00 N ATOM 1611 CA TYR A 640 3.303 -2.044 13.301 1.00 0.00 C ATOM 1612 C TYR A 640 2.433 -3.293 13.233 1.00 0.00 C ATOM 1613 O TYR A 640 2.690 -4.282 13.920 1.00 0.00 O ATOM 1614 CB TYR A 640 4.769 -2.424 13.087 1.00 0.00 C ATOM 1615 CG TYR A 640 5.150 -2.548 11.630 1.00 0.00 C ATOM 1616 CD1 TYR A 640 4.176 -2.597 10.641 1.00 0.00 C ATOM 1617 CD2 TYR A 640 6.482 -2.617 11.243 1.00 0.00 C ATOM 1618 CE1 TYR A 640 4.517 -2.712 9.307 1.00 0.00 C ATOM 1619 CE2 TYR A 640 6.832 -2.732 9.910 1.00 0.00 C ATOM 1620 CZ TYR A 640 5.846 -2.780 8.947 1.00 0.00 C ATOM 1621 OH TYR A 640 6.191 -2.895 7.620 1.00 0.00 O ATOM 0 H TYR A 640 3.781 -1.654 15.305 1.00 0.00 H new ATOM 0 HA TYR A 640 2.992 -1.360 12.511 1.00 0.00 H new ATOM 0 HB2 TYR A 640 5.404 -1.674 13.558 1.00 0.00 H new ATOM 0 HB3 TYR A 640 4.968 -3.371 13.589 1.00 0.00 H new ATOM 0 HD1 TYR A 640 3.134 -2.544 10.920 1.00 0.00 H new ATOM 0 HD2 TYR A 640 7.257 -2.580 11.995 1.00 0.00 H new ATOM 0 HE1 TYR A 640 3.747 -2.748 8.551 1.00 0.00 H new ATOM 0 HE2 TYR A 640 7.872 -2.784 9.625 1.00 0.00 H new ATOM 0 HH TYR A 640 6.868 -2.222 7.398 1.00 0.00 H new ATOM 1631 N ILE A 641 1.406 -3.243 12.393 1.00 0.00 N ATOM 1632 CA ILE A 641 0.499 -4.370 12.227 1.00 0.00 C ATOM 1633 C ILE A 641 1.013 -5.319 11.152 1.00 0.00 C ATOM 1634 O ILE A 641 0.910 -6.539 11.285 1.00 0.00 O ATOM 1635 CB ILE A 641 -0.919 -3.903 11.849 1.00 0.00 C ATOM 1636 CG1 ILE A 641 -1.563 -3.155 13.016 1.00 0.00 C ATOM 1637 CG2 ILE A 641 -1.775 -5.090 11.435 1.00 0.00 C ATOM 1638 CD1 ILE A 641 -2.975 -2.693 12.731 1.00 0.00 C ATOM 0 H ILE A 641 1.181 -2.433 11.816 1.00 0.00 H new ATOM 0 HA ILE A 641 0.454 -4.889 13.184 1.00 0.00 H new ATOM 0 HB ILE A 641 -0.846 -3.220 11.003 1.00 0.00 H new ATOM 0 HG12 ILE A 641 -1.571 -3.803 13.892 1.00 0.00 H new ATOM 0 HG13 ILE A 641 -0.949 -2.289 13.265 1.00 0.00 H new ATOM 0 HG21 ILE A 641 -2.774 -4.744 11.171 1.00 0.00 H new ATOM 0 HG22 ILE A 641 -1.322 -5.582 10.574 1.00 0.00 H new ATOM 0 HG23 ILE A 641 -1.843 -5.796 12.263 1.00 0.00 H new ATOM 0 HD11 ILE A 641 -3.370 -2.170 13.602 1.00 0.00 H new ATOM 0 HD12 ILE A 641 -2.971 -2.019 11.874 1.00 0.00 H new ATOM 0 HD13 ILE A 641 -3.603 -3.556 12.511 1.00 0.00 H new ATOM 1650 N GLY A 642 1.568 -4.750 10.087 1.00 0.00 N ATOM 1651 CA GLY A 642 2.092 -5.556 9.004 1.00 0.00 C ATOM 1652 C GLY A 642 2.080 -4.813 7.685 1.00 0.00 C ATOM 1653 O GLY A 642 1.427 -3.777 7.558 1.00 0.00 O ATOM 0 H GLY A 642 1.664 -3.743 9.956 1.00 0.00 H new ATOM 0 HA2 GLY A 642 3.112 -5.860 9.239 1.00 0.00 H new ATOM 0 HA3 GLY A 642 1.501 -6.467 8.912 1.00 0.00 H new ATOM 1657 N GLY A 643 2.803 -5.334 6.701 1.00 0.00 N ATOM 1658 CA GLY A 643 2.854 -4.686 5.405 1.00 0.00 C ATOM 1659 C GLY A 643 3.456 -5.564 4.327 1.00 0.00 C ATOM 1660 O GLY A 643 3.635 -6.766 4.518 1.00 0.00 O ATOM 0 H GLY A 643 3.353 -6.190 6.777 1.00 0.00 H new ATOM 0 HA2 GLY A 643 1.845 -4.397 5.109 1.00 0.00 H new ATOM 0 HA3 GLY A 643 3.437 -3.769 5.486 1.00 0.00 H new ATOM 1664 N CYS A 644 3.769 -4.953 3.189 1.00 0.00 N ATOM 1665 CA CYS A 644 4.357 -5.672 2.065 1.00 0.00 C ATOM 1666 C CYS A 644 4.871 -4.695 1.013 1.00 0.00 C ATOM 1667 O CYS A 644 4.303 -3.620 0.819 1.00 0.00 O ATOM 1668 CB CYS A 644 3.327 -6.617 1.442 1.00 0.00 C ATOM 1669 SG CYS A 644 3.399 -8.308 2.077 1.00 0.00 S ATOM 0 H CYS A 644 3.624 -3.957 3.021 1.00 0.00 H new ATOM 0 HA CYS A 644 5.197 -6.259 2.436 1.00 0.00 H new ATOM 0 HB2 CYS A 644 2.329 -6.216 1.618 1.00 0.00 H new ATOM 0 HB3 CYS A 644 3.476 -6.639 0.362 1.00 0.00 H new ATOM 0 HG CYS A 644 3.509 -8.281 3.372 1.00 0.00 H new ATOM 1675 N GLN A 645 5.950 -5.073 0.336 1.00 0.00 N ATOM 1676 CA GLN A 645 6.540 -4.226 -0.694 1.00 0.00 C ATOM 1677 C GLN A 645 6.018 -4.604 -2.076 1.00 0.00 C ATOM 1678 O GLN A 645 5.451 -5.680 -2.262 1.00 0.00 O ATOM 1679 CB GLN A 645 8.066 -4.341 -0.667 1.00 0.00 C ATOM 1680 CG GLN A 645 8.584 -5.660 -1.216 1.00 0.00 C ATOM 1681 CD GLN A 645 9.926 -5.515 -1.908 1.00 0.00 C ATOM 1682 OE1 GLN A 645 10.051 -5.773 -3.105 1.00 0.00 O ATOM 1683 NE2 GLN A 645 10.939 -5.102 -1.154 1.00 0.00 N ATOM 0 H GLN A 645 6.433 -5.959 0.482 1.00 0.00 H new ATOM 0 HA GLN A 645 6.255 -3.195 -0.486 1.00 0.00 H new ATOM 0 HB2 GLN A 645 8.494 -3.522 -1.245 1.00 0.00 H new ATOM 0 HB3 GLN A 645 8.413 -4.222 0.359 1.00 0.00 H new ATOM 0 HG2 GLN A 645 8.675 -6.378 -0.401 1.00 0.00 H new ATOM 0 HG3 GLN A 645 7.858 -6.067 -1.920 1.00 0.00 H new ATOM 0 HE21 GLN A 645 10.790 -4.900 -0.166 1.00 0.00 H new ATOM 0 HE22 GLN A 645 11.866 -4.987 -1.564 1.00 0.00 H new ATOM 1692 N LEU A 646 6.208 -3.710 -3.042 1.00 0.00 N ATOM 1693 CA LEU A 646 5.754 -3.952 -4.405 1.00 0.00 C ATOM 1694 C LEU A 646 6.640 -3.242 -5.423 1.00 0.00 C ATOM 1695 O LEU A 646 6.367 -2.110 -5.823 1.00 0.00 O ATOM 1696 CB LEU A 646 4.305 -3.499 -4.566 1.00 0.00 C ATOM 1697 CG LEU A 646 3.279 -4.407 -3.895 1.00 0.00 C ATOM 1698 CD1 LEU A 646 1.866 -3.906 -4.157 1.00 0.00 C ATOM 1699 CD2 LEU A 646 3.442 -5.840 -4.385 1.00 0.00 C ATOM 0 H LEU A 646 6.673 -2.813 -2.905 1.00 0.00 H new ATOM 0 HA LEU A 646 5.819 -5.024 -4.593 1.00 0.00 H new ATOM 0 HB2 LEU A 646 4.204 -2.494 -4.157 1.00 0.00 H new ATOM 0 HB3 LEU A 646 4.074 -3.435 -5.629 1.00 0.00 H new ATOM 0 HG LEU A 646 3.451 -4.388 -2.819 1.00 0.00 H new ATOM 0 HD11 LEU A 646 1.149 -4.567 -3.670 1.00 0.00 H new ATOM 0 HD12 LEU A 646 1.758 -2.897 -3.758 1.00 0.00 H new ATOM 0 HD13 LEU A 646 1.677 -3.894 -5.230 1.00 0.00 H new ATOM 0 HD21 LEU A 646 2.704 -6.477 -3.898 1.00 0.00 H new ATOM 0 HD22 LEU A 646 3.295 -5.874 -5.465 1.00 0.00 H new ATOM 0 HD23 LEU A 646 4.444 -6.195 -4.143 1.00 0.00 H new ATOM 1711 N GLY A 647 7.696 -3.927 -5.847 1.00 0.00 N ATOM 1712 CA GLY A 647 8.609 -3.369 -6.827 1.00 0.00 C ATOM 1713 C GLY A 647 9.023 -4.406 -7.849 1.00 0.00 C ATOM 1714 O GLY A 647 9.161 -5.584 -7.518 1.00 0.00 O ATOM 0 H GLY A 647 7.937 -4.865 -5.527 1.00 0.00 H new ATOM 0 HA2 GLY A 647 8.134 -2.528 -7.332 1.00 0.00 H new ATOM 0 HA3 GLY A 647 9.493 -2.980 -6.323 1.00 0.00 H new ATOM 1718 N ILE A 648 9.204 -3.985 -9.095 1.00 0.00 N ATOM 1719 CA ILE A 648 9.581 -4.901 -10.148 1.00 0.00 C ATOM 1720 C ILE A 648 10.871 -5.646 -9.813 1.00 0.00 C ATOM 1721 O ILE A 648 11.187 -6.666 -10.424 1.00 0.00 O ATOM 1722 CB ILE A 648 9.706 -4.161 -11.492 1.00 0.00 C ATOM 1723 CG1 ILE A 648 9.165 -5.030 -12.611 1.00 0.00 C ATOM 1724 CG2 ILE A 648 11.135 -3.735 -11.775 1.00 0.00 C ATOM 1725 CD1 ILE A 648 9.425 -4.478 -13.992 1.00 0.00 C ATOM 0 H ILE A 648 9.095 -3.016 -9.394 1.00 0.00 H new ATOM 0 HA ILE A 648 8.790 -5.646 -10.237 1.00 0.00 H new ATOM 0 HB ILE A 648 9.112 -3.249 -11.432 1.00 0.00 H new ATOM 0 HG12 ILE A 648 9.611 -6.022 -12.536 1.00 0.00 H new ATOM 0 HG13 ILE A 648 8.090 -5.153 -12.476 1.00 0.00 H new ATOM 0 HG21 ILE A 648 11.177 -3.217 -12.733 1.00 0.00 H new ATOM 0 HG22 ILE A 648 11.479 -3.067 -10.985 1.00 0.00 H new ATOM 0 HG23 ILE A 648 11.777 -4.615 -11.810 1.00 0.00 H new ATOM 0 HD11 ILE A 648 9.009 -5.154 -14.739 1.00 0.00 H new ATOM 0 HD12 ILE A 648 8.955 -3.499 -14.087 1.00 0.00 H new ATOM 0 HD13 ILE A 648 10.499 -4.381 -14.149 1.00 0.00 H new ATOM 1737 N SER A 649 11.605 -5.140 -8.828 1.00 0.00 N ATOM 1738 CA SER A 649 12.845 -5.775 -8.406 1.00 0.00 C ATOM 1739 C SER A 649 12.547 -6.993 -7.533 1.00 0.00 C ATOM 1740 O SER A 649 13.460 -7.660 -7.047 1.00 0.00 O ATOM 1741 CB SER A 649 13.718 -4.781 -7.639 1.00 0.00 C ATOM 1742 OG SER A 649 15.080 -5.170 -7.667 1.00 0.00 O ATOM 0 H SER A 649 11.363 -4.296 -8.310 1.00 0.00 H new ATOM 0 HA SER A 649 13.385 -6.103 -9.294 1.00 0.00 H new ATOM 0 HB2 SER A 649 13.611 -3.787 -8.074 1.00 0.00 H new ATOM 0 HB3 SER A 649 13.377 -4.715 -6.606 1.00 0.00 H new ATOM 0 HG SER A 649 15.153 -6.123 -7.449 1.00 0.00 H new ATOM 1748 N ALA A 650 11.258 -7.271 -7.337 1.00 0.00 N ATOM 1749 CA ALA A 650 10.828 -8.400 -6.523 1.00 0.00 C ATOM 1750 C ALA A 650 10.716 -9.673 -7.355 1.00 0.00 C ATOM 1751 O ALA A 650 11.186 -9.728 -8.492 1.00 0.00 O ATOM 1752 CB ALA A 650 9.492 -8.087 -5.868 1.00 0.00 C ATOM 0 H ALA A 650 10.493 -6.725 -7.734 1.00 0.00 H new ATOM 0 HA ALA A 650 11.580 -8.567 -5.752 1.00 0.00 H new ATOM 0 HB1 ALA A 650 9.177 -8.936 -5.261 1.00 0.00 H new ATOM 0 HB2 ALA A 650 9.595 -7.206 -5.234 1.00 0.00 H new ATOM 0 HB3 ALA A 650 8.745 -7.895 -6.638 1.00 0.00 H new ATOM 1758 N LYS A 651 10.086 -10.692 -6.779 1.00 0.00 N ATOM 1759 CA LYS A 651 9.904 -11.967 -7.462 1.00 0.00 C ATOM 1760 C LYS A 651 8.608 -12.639 -7.019 1.00 0.00 C ATOM 1761 O LYS A 651 8.341 -12.766 -5.824 1.00 0.00 O ATOM 1762 CB LYS A 651 11.089 -12.894 -7.185 1.00 0.00 C ATOM 1763 CG LYS A 651 12.435 -12.188 -7.199 1.00 0.00 C ATOM 1764 CD LYS A 651 13.498 -13.001 -6.479 1.00 0.00 C ATOM 1765 CE LYS A 651 14.890 -12.438 -6.719 1.00 0.00 C ATOM 1766 NZ LYS A 651 15.496 -11.902 -5.468 1.00 0.00 N ATOM 0 H LYS A 651 9.692 -10.659 -5.839 1.00 0.00 H new ATOM 0 HA LYS A 651 9.847 -11.771 -8.533 1.00 0.00 H new ATOM 0 HB2 LYS A 651 10.948 -13.369 -6.214 1.00 0.00 H new ATOM 0 HB3 LYS A 651 11.098 -13.689 -7.930 1.00 0.00 H new ATOM 0 HG2 LYS A 651 12.745 -12.014 -8.229 1.00 0.00 H new ATOM 0 HG3 LYS A 651 12.340 -11.211 -6.725 1.00 0.00 H new ATOM 0 HD2 LYS A 651 13.288 -13.010 -5.409 1.00 0.00 H new ATOM 0 HD3 LYS A 651 13.459 -14.035 -6.820 1.00 0.00 H new ATOM 0 HE2 LYS A 651 15.532 -13.219 -7.128 1.00 0.00 H new ATOM 0 HE3 LYS A 651 14.837 -11.645 -7.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 651 16.444 -11.528 -5.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 651 14.897 -11.140 -5.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 651 15.570 -12.664 -4.764 1.00 0.00 H new ATOM 1780 N GLY A 652 7.808 -13.070 -7.988 1.00 0.00 N ATOM 1781 CA GLY A 652 6.552 -13.726 -7.674 1.00 0.00 C ATOM 1782 C GLY A 652 5.366 -12.783 -7.744 1.00 0.00 C ATOM 1783 O GLY A 652 5.108 -12.175 -8.783 1.00 0.00 O ATOM 0 H GLY A 652 8.006 -12.977 -8.984 1.00 0.00 H new ATOM 0 HA2 GLY A 652 6.395 -14.553 -8.367 1.00 0.00 H new ATOM 0 HA3 GLY A 652 6.611 -14.155 -6.674 1.00 0.00 H new ATOM 1787 N GLU A 653 4.640 -12.666 -6.636 1.00 0.00 N ATOM 1788 CA GLU A 653 3.471 -11.796 -6.573 1.00 0.00 C ATOM 1789 C GLU A 653 3.879 -10.327 -6.621 1.00 0.00 C ATOM 1790 O GLU A 653 3.382 -9.561 -7.448 1.00 0.00 O ATOM 1791 CB GLU A 653 2.670 -12.075 -5.300 1.00 0.00 C ATOM 1792 CG GLU A 653 1.883 -13.374 -5.351 1.00 0.00 C ATOM 1793 CD GLU A 653 1.579 -13.926 -3.972 1.00 0.00 C ATOM 1794 OE1 GLU A 653 2.522 -14.056 -3.163 1.00 0.00 O ATOM 1795 OE2 GLU A 653 0.398 -14.228 -3.701 1.00 0.00 O ATOM 0 H GLU A 653 4.841 -13.164 -5.769 1.00 0.00 H new ATOM 0 HA GLU A 653 2.846 -12.007 -7.441 1.00 0.00 H new ATOM 0 HB2 GLU A 653 3.352 -12.106 -4.451 1.00 0.00 H new ATOM 0 HB3 GLU A 653 1.981 -11.249 -5.125 1.00 0.00 H new ATOM 0 HG2 GLU A 653 0.948 -13.207 -5.886 1.00 0.00 H new ATOM 0 HG3 GLU A 653 2.447 -14.114 -5.918 1.00 0.00 H new ATOM 1802 N ARG A 654 4.786 -9.940 -5.731 1.00 0.00 N ATOM 1803 CA ARG A 654 5.262 -8.565 -5.671 1.00 0.00 C ATOM 1804 C ARG A 654 5.574 -8.040 -7.067 1.00 0.00 C ATOM 1805 O ARG A 654 5.376 -6.860 -7.359 1.00 0.00 O ATOM 1806 CB ARG A 654 6.510 -8.478 -4.793 1.00 0.00 C ATOM 1807 CG ARG A 654 6.388 -9.243 -3.485 1.00 0.00 C ATOM 1808 CD ARG A 654 6.327 -8.302 -2.300 1.00 0.00 C ATOM 1809 NE ARG A 654 7.136 -8.774 -1.180 1.00 0.00 N ATOM 1810 CZ ARG A 654 6.726 -9.697 -0.314 1.00 0.00 C ATOM 1811 NH1 ARG A 654 5.525 -10.241 -0.441 1.00 0.00 N ATOM 1812 NH2 ARG A 654 7.520 -10.074 0.679 1.00 0.00 N ATOM 0 H ARG A 654 5.207 -10.561 -5.040 1.00 0.00 H new ATOM 0 HA ARG A 654 4.474 -7.949 -5.237 1.00 0.00 H new ATOM 0 HB2 ARG A 654 7.364 -8.862 -5.351 1.00 0.00 H new ATOM 0 HB3 ARG A 654 6.718 -7.431 -4.574 1.00 0.00 H new ATOM 0 HG2 ARG A 654 5.492 -9.863 -3.506 1.00 0.00 H new ATOM 0 HG3 ARG A 654 7.238 -9.916 -3.374 1.00 0.00 H new ATOM 0 HD2 ARG A 654 6.672 -7.314 -2.604 1.00 0.00 H new ATOM 0 HD3 ARG A 654 5.292 -8.193 -1.978 1.00 0.00 H new ATOM 0 HE ARG A 654 8.066 -8.374 -1.055 1.00 0.00 H new ATOM 0 HH11 ARG A 654 4.913 -9.952 -1.204 1.00 0.00 H new ATOM 0 HH12 ARG A 654 5.213 -10.948 0.224 1.00 0.00 H new ATOM 0 HH21 ARG A 654 8.445 -9.656 0.779 1.00 0.00 H new ATOM 0 HH22 ARG A 654 7.206 -10.782 1.343 1.00 0.00 H new ATOM 1826 N LEU A 655 6.065 -8.927 -7.925 1.00 0.00 N ATOM 1827 CA LEU A 655 6.408 -8.556 -9.293 1.00 0.00 C ATOM 1828 C LEU A 655 5.192 -8.656 -10.207 1.00 0.00 C ATOM 1829 O LEU A 655 4.922 -7.754 -11.000 1.00 0.00 O ATOM 1830 CB LEU A 655 7.529 -9.452 -9.824 1.00 0.00 C ATOM 1831 CG LEU A 655 8.108 -9.027 -11.174 1.00 0.00 C ATOM 1832 CD1 LEU A 655 8.948 -7.768 -11.020 1.00 0.00 C ATOM 1833 CD2 LEU A 655 8.936 -10.149 -11.779 1.00 0.00 C ATOM 0 H LEU A 655 6.234 -9.907 -7.698 1.00 0.00 H new ATOM 0 HA LEU A 655 6.751 -7.521 -9.283 1.00 0.00 H new ATOM 0 HB2 LEU A 655 8.335 -9.474 -9.090 1.00 0.00 H new ATOM 0 HB3 LEU A 655 7.150 -10.470 -9.912 1.00 0.00 H new ATOM 0 HG LEU A 655 7.280 -8.810 -11.849 1.00 0.00 H new ATOM 0 HD11 LEU A 655 9.352 -7.479 -11.990 1.00 0.00 H new ATOM 0 HD12 LEU A 655 8.327 -6.961 -10.631 1.00 0.00 H new ATOM 0 HD13 LEU A 655 9.768 -7.960 -10.328 1.00 0.00 H new ATOM 0 HD21 LEU A 655 9.339 -9.827 -12.739 1.00 0.00 H new ATOM 0 HD22 LEU A 655 9.757 -10.399 -11.106 1.00 0.00 H new ATOM 0 HD23 LEU A 655 8.307 -11.027 -11.926 1.00 0.00 H new ATOM 1845 N LYS A 656 4.461 -9.761 -10.093 1.00 0.00 N ATOM 1846 CA LYS A 656 3.275 -9.980 -10.912 1.00 0.00 C ATOM 1847 C LYS A 656 2.283 -8.834 -10.749 1.00 0.00 C ATOM 1848 O LYS A 656 1.841 -8.238 -11.728 1.00 0.00 O ATOM 1849 CB LYS A 656 2.618 -11.316 -10.543 1.00 0.00 C ATOM 1850 CG LYS A 656 1.462 -11.200 -9.560 1.00 0.00 C ATOM 1851 CD LYS A 656 0.686 -12.503 -9.463 1.00 0.00 C ATOM 1852 CE LYS A 656 -0.380 -12.440 -8.380 1.00 0.00 C ATOM 1853 NZ LYS A 656 -1.558 -13.289 -8.710 1.00 0.00 N ATOM 0 H LYS A 656 4.670 -10.518 -9.442 1.00 0.00 H new ATOM 0 HA LYS A 656 3.580 -10.016 -11.958 1.00 0.00 H new ATOM 0 HB2 LYS A 656 2.257 -11.793 -11.454 1.00 0.00 H new ATOM 0 HB3 LYS A 656 3.376 -11.974 -10.117 1.00 0.00 H new ATOM 0 HG2 LYS A 656 1.844 -10.928 -8.576 1.00 0.00 H new ATOM 0 HG3 LYS A 656 0.793 -10.399 -9.875 1.00 0.00 H new ATOM 0 HD2 LYS A 656 0.218 -12.721 -10.423 1.00 0.00 H new ATOM 0 HD3 LYS A 656 1.373 -13.322 -9.251 1.00 0.00 H new ATOM 0 HE2 LYS A 656 0.047 -12.765 -7.431 1.00 0.00 H new ATOM 0 HE3 LYS A 656 -0.703 -11.407 -8.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 656 -2.261 -13.218 -7.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 656 -1.981 -12.964 -9.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 656 -1.255 -14.279 -8.811 1.00 0.00 H new ATOM 1867 N HIS A 657 1.939 -8.531 -9.506 1.00 0.00 N ATOM 1868 CA HIS A 657 1.000 -7.456 -9.212 1.00 0.00 C ATOM 1869 C HIS A 657 1.555 -6.116 -9.682 1.00 0.00 C ATOM 1870 O HIS A 657 0.953 -5.431 -10.511 1.00 0.00 O ATOM 1871 CB HIS A 657 0.713 -7.404 -7.710 1.00 0.00 C ATOM 1872 CG HIS A 657 -0.544 -6.671 -7.360 1.00 0.00 C ATOM 1873 ND1 HIS A 657 -0.690 -5.941 -6.197 1.00 0.00 N ATOM 1874 CD2 HIS A 657 -1.722 -6.562 -8.018 1.00 0.00 C ATOM 1875 CE1 HIS A 657 -1.902 -5.417 -6.157 1.00 0.00 C ATOM 1876 NE2 HIS A 657 -2.547 -5.779 -7.250 1.00 0.00 N ATOM 0 H HIS A 657 2.296 -9.015 -8.682 1.00 0.00 H new ATOM 0 HA HIS A 657 0.071 -7.654 -9.746 1.00 0.00 H new ATOM 0 HB2 HIS A 657 0.647 -8.422 -7.327 1.00 0.00 H new ATOM 0 HB3 HIS A 657 1.553 -6.927 -7.205 1.00 0.00 H new ATOM 0 HD1 HIS A 657 0.026 -5.825 -5.480 1.00 0.00 H new ATOM 0 HD2 HIS A 657 -1.967 -7.008 -8.970 1.00 0.00 H new ATOM 0 HE1 HIS A 657 -2.297 -4.798 -5.365 1.00 0.00 H new ATOM 1885 N TRP A 658 2.712 -5.755 -9.144 1.00 0.00 N ATOM 1886 CA TRP A 658 3.369 -4.502 -9.493 1.00 0.00 C ATOM 1887 C TRP A 658 3.672 -4.434 -10.988 1.00 0.00 C ATOM 1888 O TRP A 658 2.925 -3.836 -11.763 1.00 0.00 O ATOM 1889 CB TRP A 658 4.665 -4.356 -8.691 1.00 0.00 C ATOM 1890 CG TRP A 658 5.521 -3.210 -9.134 1.00 0.00 C ATOM 1891 CD1 TRP A 658 6.724 -3.284 -9.776 1.00 0.00 C ATOM 1892 CD2 TRP A 658 5.241 -1.818 -8.963 1.00 0.00 C ATOM 1893 NE1 TRP A 658 7.209 -2.020 -10.015 1.00 0.00 N ATOM 1894 CE2 TRP A 658 6.313 -1.102 -9.527 1.00 0.00 C ATOM 1895 CE3 TRP A 658 4.185 -1.109 -8.388 1.00 0.00 C ATOM 1896 CZ2 TRP A 658 6.355 0.291 -9.530 1.00 0.00 C ATOM 1897 CZ3 TRP A 658 4.228 0.272 -8.393 1.00 0.00 C ATOM 1898 CH2 TRP A 658 5.305 0.959 -8.961 1.00 0.00 C ATOM 0 H TRP A 658 3.218 -6.316 -8.459 1.00 0.00 H new ATOM 0 HA TRP A 658 2.693 -3.683 -9.247 1.00 0.00 H new ATOM 0 HB2 TRP A 658 4.417 -4.227 -7.637 1.00 0.00 H new ATOM 0 HB3 TRP A 658 5.239 -5.279 -8.773 1.00 0.00 H new ATOM 0 HD1 TRP A 658 7.221 -4.201 -10.055 1.00 0.00 H new ATOM 0 HE1 TRP A 658 8.090 -1.800 -10.479 1.00 0.00 H new ATOM 0 HE3 TRP A 658 3.349 -1.631 -7.947 1.00 0.00 H new ATOM 0 HZ2 TRP A 658 7.187 0.824 -9.966 1.00 0.00 H new ATOM 0 HZ3 TRP A 658 3.416 0.830 -7.951 1.00 0.00 H new ATOM 0 HH2 TRP A 658 5.308 2.039 -8.950 1.00 0.00 H new ATOM 1909 N TYR A 659 4.782 -5.045 -11.379 1.00 0.00 N ATOM 1910 CA TYR A 659 5.220 -5.063 -12.770 1.00 0.00 C ATOM 1911 C TYR A 659 4.052 -5.104 -13.754 1.00 0.00 C ATOM 1912 O TYR A 659 3.864 -4.171 -14.534 1.00 0.00 O ATOM 1913 CB TYR A 659 6.137 -6.264 -12.992 1.00 0.00 C ATOM 1914 CG TYR A 659 6.956 -6.216 -14.267 1.00 0.00 C ATOM 1915 CD1 TYR A 659 6.592 -5.407 -15.339 1.00 0.00 C ATOM 1916 CD2 TYR A 659 8.098 -6.997 -14.398 1.00 0.00 C ATOM 1917 CE1 TYR A 659 7.340 -5.379 -16.498 1.00 0.00 C ATOM 1918 CE2 TYR A 659 8.852 -6.975 -15.555 1.00 0.00 C ATOM 1919 CZ TYR A 659 8.469 -6.165 -16.603 1.00 0.00 C ATOM 1920 OH TYR A 659 9.216 -6.142 -17.757 1.00 0.00 O ATOM 0 H TYR A 659 5.405 -5.542 -10.742 1.00 0.00 H new ATOM 0 HA TYR A 659 5.758 -4.135 -12.961 1.00 0.00 H new ATOM 0 HB2 TYR A 659 6.817 -6.345 -12.144 1.00 0.00 H new ATOM 0 HB3 TYR A 659 5.530 -7.169 -13.002 1.00 0.00 H new ATOM 0 HD1 TYR A 659 5.709 -4.790 -15.262 1.00 0.00 H new ATOM 0 HD2 TYR A 659 8.402 -7.633 -13.580 1.00 0.00 H new ATOM 0 HE1 TYR A 659 7.043 -4.744 -17.320 1.00 0.00 H new ATOM 0 HE2 TYR A 659 9.737 -7.589 -15.638 1.00 0.00 H new ATOM 0 HH TYR A 659 9.978 -6.752 -17.666 1.00 0.00 H new ATOM 1930 N GLU A 660 3.274 -6.181 -13.741 1.00 0.00 N ATOM 1931 CA GLU A 660 2.163 -6.293 -14.668 1.00 0.00 C ATOM 1932 C GLU A 660 1.393 -4.981 -14.716 1.00 0.00 C ATOM 1933 O GLU A 660 0.880 -4.589 -15.764 1.00 0.00 O ATOM 1934 CB GLU A 660 1.246 -7.457 -14.289 1.00 0.00 C ATOM 1935 CG GLU A 660 0.101 -7.058 -13.379 1.00 0.00 C ATOM 1936 CD GLU A 660 -0.917 -8.167 -13.197 1.00 0.00 C ATOM 1937 OE1 GLU A 660 -0.643 -9.101 -12.414 1.00 0.00 O ATOM 1938 OE2 GLU A 660 -1.987 -8.102 -13.837 1.00 0.00 O ATOM 0 H GLU A 660 3.391 -6.974 -13.110 1.00 0.00 H new ATOM 0 HA GLU A 660 2.558 -6.500 -15.662 1.00 0.00 H new ATOM 0 HB2 GLU A 660 0.839 -7.899 -15.199 1.00 0.00 H new ATOM 0 HB3 GLU A 660 1.838 -8.229 -13.797 1.00 0.00 H new ATOM 0 HG2 GLU A 660 0.499 -6.773 -12.405 1.00 0.00 H new ATOM 0 HG3 GLU A 660 -0.395 -6.179 -13.791 1.00 0.00 H new ATOM 1945 N CYS A 661 1.336 -4.293 -13.579 1.00 0.00 N ATOM 1946 CA CYS A 661 0.650 -3.011 -13.511 1.00 0.00 C ATOM 1947 C CYS A 661 1.283 -2.045 -14.504 1.00 0.00 C ATOM 1948 O CYS A 661 0.586 -1.322 -15.216 1.00 0.00 O ATOM 1949 CB CYS A 661 0.720 -2.433 -12.096 1.00 0.00 C ATOM 1950 SG CYS A 661 -0.367 -1.014 -11.832 1.00 0.00 S ATOM 0 H CYS A 661 1.753 -4.600 -12.700 1.00 0.00 H new ATOM 0 HA CYS A 661 -0.400 -3.159 -13.765 1.00 0.00 H new ATOM 0 HB2 CYS A 661 0.462 -3.214 -11.381 1.00 0.00 H new ATOM 0 HB3 CYS A 661 1.747 -2.136 -11.886 1.00 0.00 H new ATOM 0 HG CYS A 661 -0.565 -0.403 -12.962 1.00 0.00 H new ATOM 1956 N LEU A 662 2.612 -2.059 -14.559 1.00 0.00 N ATOM 1957 CA LEU A 662 3.350 -1.208 -15.480 1.00 0.00 C ATOM 1958 C LEU A 662 2.881 -1.453 -16.906 1.00 0.00 C ATOM 1959 O LEU A 662 2.918 -0.557 -17.748 1.00 0.00 O ATOM 1960 CB LEU A 662 4.852 -1.480 -15.368 1.00 0.00 C ATOM 1961 CG LEU A 662 5.608 -0.547 -14.424 1.00 0.00 C ATOM 1962 CD1 LEU A 662 5.933 -1.249 -13.116 1.00 0.00 C ATOM 1963 CD2 LEU A 662 6.878 -0.047 -15.087 1.00 0.00 C ATOM 0 H LEU A 662 3.199 -2.653 -13.974 1.00 0.00 H new ATOM 0 HA LEU A 662 3.163 -0.166 -15.219 1.00 0.00 H new ATOM 0 HB2 LEU A 662 4.996 -2.507 -15.032 1.00 0.00 H new ATOM 0 HB3 LEU A 662 5.295 -1.404 -16.361 1.00 0.00 H new ATOM 0 HG LEU A 662 4.969 0.307 -14.201 1.00 0.00 H new ATOM 0 HD11 LEU A 662 6.471 -0.565 -12.460 1.00 0.00 H new ATOM 0 HD12 LEU A 662 5.008 -1.563 -12.632 1.00 0.00 H new ATOM 0 HD13 LEU A 662 6.553 -2.123 -13.316 1.00 0.00 H new ATOM 0 HD21 LEU A 662 7.408 0.617 -14.404 1.00 0.00 H new ATOM 0 HD22 LEU A 662 7.516 -0.895 -15.337 1.00 0.00 H new ATOM 0 HD23 LEU A 662 6.624 0.496 -15.997 1.00 0.00 H new ATOM 1975 N LYS A 663 2.434 -2.676 -17.166 1.00 0.00 N ATOM 1976 CA LYS A 663 1.947 -3.048 -18.486 1.00 0.00 C ATOM 1977 C LYS A 663 0.493 -2.620 -18.645 1.00 0.00 C ATOM 1978 O LYS A 663 0.082 -2.141 -19.702 1.00 0.00 O ATOM 1979 CB LYS A 663 2.102 -4.564 -18.693 1.00 0.00 C ATOM 1980 CG LYS A 663 0.790 -5.334 -18.773 1.00 0.00 C ATOM 1981 CD LYS A 663 1.012 -6.830 -18.626 1.00 0.00 C ATOM 1982 CE LYS A 663 0.528 -7.588 -19.851 1.00 0.00 C ATOM 1983 NZ LYS A 663 1.619 -7.793 -20.843 1.00 0.00 N ATOM 0 H LYS A 663 2.399 -3.428 -16.477 1.00 0.00 H new ATOM 0 HA LYS A 663 2.537 -2.537 -19.246 1.00 0.00 H new ATOM 0 HB2 LYS A 663 2.665 -4.736 -19.611 1.00 0.00 H new ATOM 0 HB3 LYS A 663 2.696 -4.970 -17.874 1.00 0.00 H new ATOM 0 HG2 LYS A 663 0.115 -4.987 -17.991 1.00 0.00 H new ATOM 0 HG3 LYS A 663 0.304 -5.129 -19.727 1.00 0.00 H new ATOM 0 HD2 LYS A 663 2.072 -7.028 -18.470 1.00 0.00 H new ATOM 0 HD3 LYS A 663 0.487 -7.192 -17.742 1.00 0.00 H new ATOM 0 HE2 LYS A 663 0.129 -8.555 -19.545 1.00 0.00 H new ATOM 0 HE3 LYS A 663 -0.289 -7.039 -20.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 663 1.249 -8.314 -21.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 663 1.983 -6.870 -21.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 663 2.388 -8.339 -20.405 1.00 0.00 H new ATOM 1997 N ASN A 664 -0.275 -2.802 -17.579 1.00 0.00 N ATOM 1998 CA ASN A 664 -1.687 -2.442 -17.579 1.00 0.00 C ATOM 1999 C ASN A 664 -1.904 -1.079 -16.927 1.00 0.00 C ATOM 2000 O ASN A 664 -2.844 -0.893 -16.154 1.00 0.00 O ATOM 2001 CB ASN A 664 -2.503 -3.508 -16.845 1.00 0.00 C ATOM 2002 CG ASN A 664 -3.122 -4.516 -17.793 1.00 0.00 C ATOM 2003 OD1 ASN A 664 -2.948 -4.429 -19.008 1.00 0.00 O ATOM 2004 ND2 ASN A 664 -3.847 -5.481 -17.240 1.00 0.00 N ATOM 0 H ASN A 664 0.058 -3.198 -16.700 1.00 0.00 H new ATOM 0 HA ASN A 664 -2.022 -2.384 -18.615 1.00 0.00 H new ATOM 0 HB2 ASN A 664 -1.861 -4.028 -16.135 1.00 0.00 H new ATOM 0 HB3 ASN A 664 -3.291 -3.025 -16.267 1.00 0.00 H new ATOM 0 HD21 ASN A 664 -4.286 -6.189 -17.828 1.00 0.00 H new ATOM 0 HD22 ASN A 664 -3.964 -5.514 -16.227 1.00 0.00 H new ATOM 2011 N LYS A 665 -1.029 -0.130 -17.242 1.00 0.00 N ATOM 2012 CA LYS A 665 -1.125 1.217 -16.687 1.00 0.00 C ATOM 2013 C LYS A 665 -2.555 1.740 -16.763 1.00 0.00 C ATOM 2014 O LYS A 665 -3.201 1.966 -15.739 1.00 0.00 O ATOM 2015 CB LYS A 665 -0.185 2.166 -17.433 1.00 0.00 C ATOM 2016 CG LYS A 665 1.142 1.533 -17.814 1.00 0.00 C ATOM 2017 CD LYS A 665 1.160 1.118 -19.277 1.00 0.00 C ATOM 2018 CE LYS A 665 2.579 0.995 -19.808 1.00 0.00 C ATOM 2019 NZ LYS A 665 2.694 1.496 -21.205 1.00 0.00 N ATOM 0 H LYS A 665 -0.244 -0.268 -17.879 1.00 0.00 H new ATOM 0 HA LYS A 665 -0.830 1.170 -15.639 1.00 0.00 H new ATOM 0 HB2 LYS A 665 -0.682 2.520 -18.336 1.00 0.00 H new ATOM 0 HB3 LYS A 665 0.005 3.040 -16.810 1.00 0.00 H new ATOM 0 HG2 LYS A 665 1.951 2.239 -17.625 1.00 0.00 H new ATOM 0 HG3 LYS A 665 1.325 0.662 -17.185 1.00 0.00 H new ATOM 0 HD2 LYS A 665 0.645 0.164 -19.391 1.00 0.00 H new ATOM 0 HD3 LYS A 665 0.612 1.850 -19.870 1.00 0.00 H new ATOM 0 HE2 LYS A 665 3.257 1.555 -19.164 1.00 0.00 H new ATOM 0 HE3 LYS A 665 2.892 -0.048 -19.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 665 3.677 1.395 -21.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 665 2.066 0.945 -21.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 665 2.420 2.499 -21.238 1.00 0.00 H new ATOM 2033 N ASP A 666 -3.043 1.932 -17.985 1.00 0.00 N ATOM 2034 CA ASP A 666 -4.396 2.431 -18.200 1.00 0.00 C ATOM 2035 C ASP A 666 -5.430 1.512 -17.555 1.00 0.00 C ATOM 2036 O ASP A 666 -6.589 1.891 -17.386 1.00 0.00 O ATOM 2037 CB ASP A 666 -4.678 2.564 -19.698 1.00 0.00 C ATOM 2038 CG ASP A 666 -5.712 3.629 -20.000 1.00 0.00 C ATOM 2039 OD1 ASP A 666 -6.866 3.482 -19.544 1.00 0.00 O ATOM 2040 OD2 ASP A 666 -5.370 4.612 -20.692 1.00 0.00 O ATOM 0 H ASP A 666 -2.521 1.749 -18.842 1.00 0.00 H new ATOM 0 HA ASP A 666 -4.472 3.412 -17.732 1.00 0.00 H new ATOM 0 HB2 ASP A 666 -3.751 2.803 -20.219 1.00 0.00 H new ATOM 0 HB3 ASP A 666 -5.024 1.606 -20.086 1.00 0.00 H new ATOM 2045 N LYS A 667 -5.004 0.306 -17.196 1.00 0.00 N ATOM 2046 CA LYS A 667 -5.894 -0.663 -16.566 1.00 0.00 C ATOM 2047 C LYS A 667 -5.641 -0.731 -15.063 1.00 0.00 C ATOM 2048 O LYS A 667 -4.530 -0.472 -14.600 1.00 0.00 O ATOM 2049 CB LYS A 667 -5.706 -2.046 -17.194 1.00 0.00 C ATOM 2050 CG LYS A 667 -6.364 -2.188 -18.557 1.00 0.00 C ATOM 2051 CD LYS A 667 -6.471 -3.645 -18.976 1.00 0.00 C ATOM 2052 CE LYS A 667 -5.569 -3.953 -20.160 1.00 0.00 C ATOM 2053 NZ LYS A 667 -6.339 -4.465 -21.327 1.00 0.00 N ATOM 0 H LYS A 667 -4.048 -0.024 -17.330 1.00 0.00 H new ATOM 0 HA LYS A 667 -6.922 -0.338 -16.729 1.00 0.00 H new ATOM 0 HB2 LYS A 667 -4.640 -2.250 -17.291 1.00 0.00 H new ATOM 0 HB3 LYS A 667 -6.115 -2.800 -16.522 1.00 0.00 H new ATOM 0 HG2 LYS A 667 -7.358 -1.742 -18.530 1.00 0.00 H new ATOM 0 HG3 LYS A 667 -5.787 -1.636 -19.300 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -6.203 -4.286 -18.137 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -7.504 -3.875 -19.235 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -5.029 -3.051 -20.449 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -4.823 -4.691 -19.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -5.687 -4.663 -22.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -6.834 -5.339 -21.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 -7.034 -3.751 -21.625 1.00 0.00 H new ATOM 2067 N LYS A 668 -6.677 -1.075 -14.307 1.00 0.00 N ATOM 2068 CA LYS A 668 -6.563 -1.167 -12.855 1.00 0.00 C ATOM 2069 C LYS A 668 -6.170 -2.574 -12.417 1.00 0.00 C ATOM 2070 O LYS A 668 -6.511 -3.561 -13.069 1.00 0.00 O ATOM 2071 CB LYS A 668 -7.881 -0.763 -12.193 1.00 0.00 C ATOM 2072 CG LYS A 668 -9.102 -1.425 -12.810 1.00 0.00 C ATOM 2073 CD LYS A 668 -10.252 -1.503 -11.819 1.00 0.00 C ATOM 2074 CE LYS A 668 -9.843 -2.233 -10.550 1.00 0.00 C ATOM 2075 NZ LYS A 668 -10.699 -3.425 -10.297 1.00 0.00 N ATOM 0 H LYS A 668 -7.603 -1.294 -14.673 1.00 0.00 H new ATOM 0 HA LYS A 668 -5.777 -0.481 -12.538 1.00 0.00 H new ATOM 0 HB2 LYS A 668 -7.838 -1.016 -11.134 1.00 0.00 H new ATOM 0 HB3 LYS A 668 -7.993 0.319 -12.258 1.00 0.00 H new ATOM 0 HG2 LYS A 668 -9.416 -0.864 -13.690 1.00 0.00 H new ATOM 0 HG3 LYS A 668 -8.842 -2.428 -13.147 1.00 0.00 H new ATOM 0 HD2 LYS A 668 -10.588 -0.497 -11.569 1.00 0.00 H new ATOM 0 HD3 LYS A 668 -11.097 -2.016 -12.279 1.00 0.00 H new ATOM 0 HE2 LYS A 668 -8.801 -2.544 -10.629 1.00 0.00 H new ATOM 0 HE3 LYS A 668 -9.909 -1.552 -9.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 668 -10.712 -3.633 -9.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 668 -11.667 -3.233 -10.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 668 -10.316 -4.243 -10.812 1.00 0.00 H new ATOM 2089 N ILE A 669 -5.449 -2.653 -11.303 1.00 0.00 N ATOM 2090 CA ILE A 669 -5.001 -3.929 -10.760 1.00 0.00 C ATOM 2091 C ILE A 669 -5.169 -3.963 -9.247 1.00 0.00 C ATOM 2092 O ILE A 669 -4.600 -3.136 -8.538 1.00 0.00 O ATOM 2093 CB ILE A 669 -3.523 -4.191 -11.095 1.00 0.00 C ATOM 2094 CG1 ILE A 669 -3.345 -4.358 -12.609 1.00 0.00 C ATOM 2095 CG2 ILE A 669 -3.025 -5.415 -10.337 1.00 0.00 C ATOM 2096 CD1 ILE A 669 -2.362 -5.441 -12.997 1.00 0.00 C ATOM 0 H ILE A 669 -5.161 -1.842 -10.756 1.00 0.00 H new ATOM 0 HA ILE A 669 -5.617 -4.703 -11.217 1.00 0.00 H new ATOM 0 HB ILE A 669 -2.925 -3.335 -10.781 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -4.313 -4.583 -13.056 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -3.012 -3.410 -13.032 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -1.978 -5.593 -10.581 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.124 -5.244 -9.265 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -3.616 -6.285 -10.622 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -2.292 -5.497 -14.083 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -1.381 -5.208 -12.582 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -2.703 -6.399 -12.606 1.00 0.00 H new ATOM 2108 N GLU A 670 -5.945 -4.918 -8.751 1.00 0.00 N ATOM 2109 CA GLU A 670 -6.169 -5.038 -7.313 1.00 0.00 C ATOM 2110 C GLU A 670 -5.931 -6.465 -6.833 1.00 0.00 C ATOM 2111 O GLU A 670 -6.156 -7.427 -7.568 1.00 0.00 O ATOM 2112 CB GLU A 670 -7.585 -4.590 -6.947 1.00 0.00 C ATOM 2113 CG GLU A 670 -8.657 -5.615 -7.274 1.00 0.00 C ATOM 2114 CD GLU A 670 -9.156 -5.502 -8.701 1.00 0.00 C ATOM 2115 OE1 GLU A 670 -8.362 -5.099 -9.577 1.00 0.00 O ATOM 2116 OE2 GLU A 670 -10.341 -5.816 -8.943 1.00 0.00 O ATOM 0 H GLU A 670 -6.427 -5.617 -9.317 1.00 0.00 H new ATOM 0 HA GLU A 670 -5.453 -4.386 -6.813 1.00 0.00 H new ATOM 0 HB2 GLU A 670 -7.621 -4.368 -5.880 1.00 0.00 H new ATOM 0 HB3 GLU A 670 -7.810 -3.662 -7.474 1.00 0.00 H new ATOM 0 HG2 GLU A 670 -8.259 -6.616 -7.111 1.00 0.00 H new ATOM 0 HG3 GLU A 670 -9.495 -5.490 -6.589 1.00 0.00 H new ATOM 2123 N ARG A 671 -5.472 -6.590 -5.592 1.00 0.00 N ATOM 2124 CA ARG A 671 -5.197 -7.894 -5.001 1.00 0.00 C ATOM 2125 C ARG A 671 -5.000 -7.776 -3.494 1.00 0.00 C ATOM 2126 O ARG A 671 -4.775 -6.684 -2.972 1.00 0.00 O ATOM 2127 CB ARG A 671 -3.954 -8.512 -5.643 1.00 0.00 C ATOM 2128 CG ARG A 671 -2.649 -7.994 -5.060 1.00 0.00 C ATOM 2129 CD ARG A 671 -1.995 -9.019 -4.147 1.00 0.00 C ATOM 2130 NE ARG A 671 -1.644 -10.248 -4.859 1.00 0.00 N ATOM 2131 CZ ARG A 671 -2.299 -11.403 -4.737 1.00 0.00 C ATOM 2132 NH1 ARG A 671 -3.357 -11.507 -3.940 1.00 0.00 N ATOM 2133 NH2 ARG A 671 -1.894 -12.464 -5.421 1.00 0.00 N ATOM 0 H ARG A 671 -5.282 -5.801 -4.974 1.00 0.00 H new ATOM 0 HA ARG A 671 -6.055 -8.540 -5.187 1.00 0.00 H new ATOM 0 HB2 ARG A 671 -3.992 -9.595 -5.522 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -3.970 -8.310 -6.714 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -1.965 -7.739 -5.869 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -2.838 -7.077 -4.501 1.00 0.00 H new ATOM 0 HD2 ARG A 671 -1.097 -8.588 -3.704 1.00 0.00 H new ATOM 0 HD3 ARG A 671 -2.672 -9.257 -3.327 1.00 0.00 H new ATOM 0 HE ARG A 671 -0.844 -10.219 -5.491 1.00 0.00 H new ATOM 0 HH11 ARG A 671 -3.679 -10.696 -3.411 1.00 0.00 H new ATOM 0 HH12 ARG A 671 -3.848 -12.397 -3.857 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -1.084 -12.395 -6.037 1.00 0.00 H new ATOM 0 HH22 ARG A 671 -2.392 -13.350 -5.331 1.00 0.00 H new ATOM 2147 N TRP A 672 -5.087 -8.905 -2.800 1.00 0.00 N ATOM 2148 CA TRP A 672 -4.916 -8.924 -1.351 1.00 0.00 C ATOM 2149 C TRP A 672 -3.488 -9.294 -0.973 1.00 0.00 C ATOM 2150 O TRP A 672 -2.933 -10.269 -1.480 1.00 0.00 O ATOM 2151 CB TRP A 672 -5.897 -9.908 -0.713 1.00 0.00 C ATOM 2152 CG TRP A 672 -7.303 -9.398 -0.684 1.00 0.00 C ATOM 2153 CD1 TRP A 672 -8.278 -9.635 -1.609 1.00 0.00 C ATOM 2154 CD2 TRP A 672 -7.889 -8.555 0.314 1.00 0.00 C ATOM 2155 NE1 TRP A 672 -9.437 -8.991 -1.246 1.00 0.00 N ATOM 2156 CE2 TRP A 672 -9.222 -8.322 -0.070 1.00 0.00 C ATOM 2157 CE3 TRP A 672 -7.416 -7.977 1.496 1.00 0.00 C ATOM 2158 CZ2 TRP A 672 -10.086 -7.534 0.684 1.00 0.00 C ATOM 2159 CZ3 TRP A 672 -8.275 -7.196 2.245 1.00 0.00 C ATOM 2160 CH2 TRP A 672 -9.598 -6.980 1.837 1.00 0.00 C ATOM 0 H TRP A 672 -5.274 -9.817 -3.216 1.00 0.00 H new ATOM 0 HA TRP A 672 -5.121 -7.922 -0.975 1.00 0.00 H new ATOM 0 HB2 TRP A 672 -5.869 -10.848 -1.264 1.00 0.00 H new ATOM 0 HB3 TRP A 672 -5.574 -10.125 0.305 1.00 0.00 H new ATOM 0 HD1 TRP A 672 -8.157 -10.240 -2.496 1.00 0.00 H new ATOM 0 HE1 TRP A 672 -10.314 -9.008 -1.767 1.00 0.00 H new ATOM 0 HE3 TRP A 672 -6.398 -8.138 1.818 1.00 0.00 H new ATOM 0 HZ2 TRP A 672 -11.106 -7.365 0.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 672 -7.921 -6.745 3.160 1.00 0.00 H new ATOM 0 HH2 TRP A 672 -10.245 -6.364 2.444 1.00 0.00 H new ATOM 2171 N HIS A 673 -2.900 -8.510 -0.077 1.00 0.00 N ATOM 2172 CA HIS A 673 -1.537 -8.756 0.373 1.00 0.00 C ATOM 2173 C HIS A 673 -1.521 -9.243 1.816 1.00 0.00 C ATOM 2174 O HIS A 673 -2.166 -8.656 2.686 1.00 0.00 O ATOM 2175 CB HIS A 673 -0.696 -7.486 0.249 1.00 0.00 C ATOM 2176 CG HIS A 673 -0.164 -7.253 -1.132 1.00 0.00 C ATOM 2177 ND1 HIS A 673 0.617 -8.158 -1.814 1.00 0.00 N ATOM 2178 CD2 HIS A 673 -0.317 -6.190 -1.960 1.00 0.00 C ATOM 2179 CE1 HIS A 673 0.910 -7.629 -3.010 1.00 0.00 C ATOM 2180 NE2 HIS A 673 0.366 -6.434 -3.148 1.00 0.00 N ATOM 0 H HIS A 673 -3.346 -7.699 0.352 1.00 0.00 H new ATOM 0 HA HIS A 673 -1.109 -9.532 -0.262 1.00 0.00 H new ATOM 0 HB2 HIS A 673 -1.301 -6.629 0.546 1.00 0.00 H new ATOM 0 HB3 HIS A 673 0.140 -7.544 0.947 1.00 0.00 H new ATOM 0 HD1 HIS A 673 0.919 -9.070 -1.470 1.00 0.00 H new ATOM 0 HD2 HIS A 673 -0.879 -5.296 -1.734 1.00 0.00 H new ATOM 0 HE1 HIS A 673 1.512 -8.116 -3.762 1.00 0.00 H new ATOM 2188 N GLN A 674 -0.778 -10.312 2.067 1.00 0.00 N ATOM 2189 CA GLN A 674 -0.675 -10.868 3.408 1.00 0.00 C ATOM 2190 C GLN A 674 0.306 -10.057 4.241 1.00 0.00 C ATOM 2191 O GLN A 674 1.521 -10.212 4.120 1.00 0.00 O ATOM 2192 CB GLN A 674 -0.236 -12.329 3.354 1.00 0.00 C ATOM 2193 CG GLN A 674 -0.935 -13.131 2.270 1.00 0.00 C ATOM 2194 CD GLN A 674 -2.441 -12.958 2.296 1.00 0.00 C ATOM 2195 OE1 GLN A 674 -2.955 -11.858 2.092 1.00 0.00 O ATOM 2196 NE2 GLN A 674 -3.158 -14.047 2.548 1.00 0.00 N ATOM 0 H GLN A 674 -0.238 -10.811 1.360 1.00 0.00 H new ATOM 0 HA GLN A 674 -1.659 -10.820 3.875 1.00 0.00 H new ATOM 0 HB2 GLN A 674 0.841 -12.371 3.189 1.00 0.00 H new ATOM 0 HB3 GLN A 674 -0.429 -12.794 4.321 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -0.555 -12.826 1.295 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -0.692 -14.187 2.391 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -2.691 -14.939 2.711 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -4.176 -13.992 2.578 1.00 0.00 H new ATOM 2205 N LEU A 675 -0.234 -9.184 5.076 1.00 0.00 N ATOM 2206 CA LEU A 675 0.581 -8.331 5.927 1.00 0.00 C ATOM 2207 C LEU A 675 1.710 -9.112 6.586 1.00 0.00 C ATOM 2208 O LEU A 675 1.485 -10.154 7.204 1.00 0.00 O ATOM 2209 CB LEU A 675 -0.283 -7.668 6.996 1.00 0.00 C ATOM 2210 CG LEU A 675 -1.357 -6.722 6.465 1.00 0.00 C ATOM 2211 CD1 LEU A 675 -2.279 -6.282 7.592 1.00 0.00 C ATOM 2212 CD2 LEU A 675 -0.716 -5.516 5.795 1.00 0.00 C ATOM 0 H LEU A 675 -1.239 -9.047 5.183 1.00 0.00 H new ATOM 0 HA LEU A 675 1.026 -7.563 5.294 1.00 0.00 H new ATOM 0 HB2 LEU A 675 -0.766 -8.447 7.585 1.00 0.00 H new ATOM 0 HB3 LEU A 675 0.366 -7.113 7.673 1.00 0.00 H new ATOM 0 HG LEU A 675 -1.952 -7.252 5.721 1.00 0.00 H new ATOM 0 HD11 LEU A 675 -3.039 -5.608 7.198 1.00 0.00 H new ATOM 0 HD12 LEU A 675 -2.761 -7.156 8.030 1.00 0.00 H new ATOM 0 HD13 LEU A 675 -1.698 -5.766 8.357 1.00 0.00 H new ATOM 0 HD21 LEU A 675 -1.494 -4.851 5.421 1.00 0.00 H new ATOM 0 HD22 LEU A 675 -0.099 -4.983 6.519 1.00 0.00 H new ATOM 0 HD23 LEU A 675 -0.094 -5.849 4.964 1.00 0.00 H new ATOM 2224 N GLN A 676 2.924 -8.593 6.455 1.00 0.00 N ATOM 2225 CA GLN A 676 4.100 -9.225 7.041 1.00 0.00 C ATOM 2226 C GLN A 676 4.786 -8.274 8.018 1.00 0.00 C ATOM 2227 O GLN A 676 4.378 -7.122 8.164 1.00 0.00 O ATOM 2228 CB GLN A 676 5.081 -9.648 5.946 1.00 0.00 C ATOM 2229 CG GLN A 676 4.824 -11.046 5.407 1.00 0.00 C ATOM 2230 CD GLN A 676 6.033 -11.951 5.541 1.00 0.00 C ATOM 2231 OE1 GLN A 676 6.981 -11.639 6.261 1.00 0.00 O ATOM 2232 NE2 GLN A 676 6.005 -13.081 4.844 1.00 0.00 N ATOM 0 H GLN A 676 3.121 -7.732 5.945 1.00 0.00 H new ATOM 0 HA GLN A 676 3.777 -10.113 7.585 1.00 0.00 H new ATOM 0 HB2 GLN A 676 5.025 -8.934 5.124 1.00 0.00 H new ATOM 0 HB3 GLN A 676 6.096 -9.600 6.341 1.00 0.00 H new ATOM 0 HG2 GLN A 676 3.982 -11.488 5.940 1.00 0.00 H new ATOM 0 HG3 GLN A 676 4.538 -10.980 4.357 1.00 0.00 H new ATOM 0 HE21 GLN A 676 5.198 -13.300 4.259 1.00 0.00 H new ATOM 0 HE22 GLN A 676 6.790 -13.730 4.893 1.00 0.00 H new ATOM 2241 N ASN A 677 5.826 -8.760 8.685 1.00 0.00 N ATOM 2242 CA ASN A 677 6.561 -7.946 9.646 1.00 0.00 C ATOM 2243 C ASN A 677 7.927 -7.549 9.097 1.00 0.00 C ATOM 2244 O ASN A 677 8.870 -8.340 9.119 1.00 0.00 O ATOM 2245 CB ASN A 677 6.728 -8.702 10.966 1.00 0.00 C ATOM 2246 CG ASN A 677 5.873 -8.122 12.075 1.00 0.00 C ATOM 2247 OD1 ASN A 677 4.898 -7.417 11.818 1.00 0.00 O ATOM 2248 ND2 ASN A 677 6.237 -8.417 13.319 1.00 0.00 N ATOM 0 H ASN A 677 6.179 -9.711 8.579 1.00 0.00 H new ATOM 0 HA ASN A 677 5.986 -7.037 9.826 1.00 0.00 H new ATOM 0 HB2 ASN A 677 6.465 -9.749 10.818 1.00 0.00 H new ATOM 0 HB3 ASN A 677 7.775 -8.676 11.267 1.00 0.00 H new ATOM 0 HD21 ASN A 677 5.700 -8.055 14.107 1.00 0.00 H new ATOM 0 HD22 ASN A 677 7.053 -9.006 13.486 1.00 0.00 H new ATOM 2255 N GLU A 678 8.026 -6.318 8.604 1.00 0.00 N ATOM 2256 CA GLU A 678 9.273 -5.814 8.048 1.00 0.00 C ATOM 2257 C GLU A 678 10.438 -6.053 9.004 1.00 0.00 C ATOM 2258 O GLU A 678 11.182 -7.023 8.862 1.00 0.00 O ATOM 2259 CB GLU A 678 9.142 -4.321 7.738 1.00 0.00 C ATOM 2260 CG GLU A 678 9.650 -3.933 6.365 1.00 0.00 C ATOM 2261 CD GLU A 678 10.721 -4.871 5.842 1.00 0.00 C ATOM 2262 OE1 GLU A 678 10.363 -5.914 5.256 1.00 0.00 O ATOM 2263 OE2 GLU A 678 11.918 -4.561 6.018 1.00 0.00 O ATOM 0 H GLU A 678 7.254 -5.651 8.579 1.00 0.00 H new ATOM 0 HA GLU A 678 9.478 -6.355 7.124 1.00 0.00 H new ATOM 0 HB2 GLU A 678 8.094 -4.033 7.822 1.00 0.00 H new ATOM 0 HB3 GLU A 678 9.690 -3.754 8.491 1.00 0.00 H new ATOM 0 HG2 GLU A 678 8.814 -3.919 5.665 1.00 0.00 H new ATOM 0 HG3 GLU A 678 10.050 -2.920 6.405 1.00 0.00 H new ATOM 2270 N ASN A 679 10.592 -5.161 9.979 1.00 0.00 N ATOM 2271 CA ASN A 679 11.667 -5.275 10.957 1.00 0.00 C ATOM 2272 C ASN A 679 11.171 -5.939 12.236 1.00 0.00 C ATOM 2273 O ASN A 679 11.461 -7.107 12.496 1.00 0.00 O ATOM 2274 CB ASN A 679 12.243 -3.894 11.275 1.00 0.00 C ATOM 2275 CG ASN A 679 12.685 -3.150 10.031 1.00 0.00 C ATOM 2276 OD1 ASN A 679 13.682 -3.507 9.402 1.00 0.00 O ATOM 2277 ND2 ASN A 679 11.944 -2.109 9.669 1.00 0.00 N ATOM 0 H ASN A 679 9.985 -4.352 10.112 1.00 0.00 H new ATOM 0 HA ASN A 679 12.451 -5.898 10.527 1.00 0.00 H new ATOM 0 HB2 ASN A 679 11.493 -3.303 11.801 1.00 0.00 H new ATOM 0 HB3 ASN A 679 13.092 -4.004 11.950 1.00 0.00 H new ATOM 0 HD21 ASN A 679 12.193 -1.570 8.840 1.00 0.00 H new ATOM 0 HD22 ASN A 679 11.126 -1.849 10.220 1.00 0.00 H new ATOM 2284 N HIS A 680 10.423 -5.186 13.031 1.00 0.00 N ATOM 2285 CA HIS A 680 9.883 -5.696 14.286 1.00 0.00 C ATOM 2286 C HIS A 680 8.383 -5.950 14.171 1.00 0.00 C ATOM 2287 O HIS A 680 7.690 -5.122 13.543 1.00 0.00 O ATOM 2288 CB HIS A 680 10.159 -4.710 15.422 1.00 0.00 C ATOM 2289 CG HIS A 680 11.617 -4.504 15.694 1.00 0.00 C ATOM 2290 ND1 HIS A 680 12.564 -4.420 14.695 1.00 0.00 N ATOM 2291 CD2 HIS A 680 12.291 -4.365 16.862 1.00 0.00 C ATOM 2292 CE1 HIS A 680 13.757 -4.239 15.236 1.00 0.00 C ATOM 2293 NE2 HIS A 680 13.617 -4.201 16.548 1.00 0.00 N ATOM 2294 OXT HIS A 680 7.915 -6.975 14.710 1.00 0.00 O ATOM 0 H HIS A 680 10.175 -4.217 12.829 1.00 0.00 H new ATOM 0 HA HIS A 680 10.377 -6.642 14.507 1.00 0.00 H new ATOM 0 HB2 HIS A 680 9.704 -3.750 15.178 1.00 0.00 H new ATOM 0 HB3 HIS A 680 9.676 -5.070 16.330 1.00 0.00 H new ATOM 0 HD2 HIS A 680 11.864 -4.380 17.854 1.00 0.00 H new ATOM 0 HE1 HIS A 680 14.687 -4.139 14.696 1.00 0.00 H new ATOM 0 HE2 HIS A 680 14.373 -4.071 17.220 1.00 0.00 H new TER 2303 HIS A 680