USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1053 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 657 HIS : no HE2:sc= -14.5! C(o=-23!,f=-24!) USER MOD Set 1.2: A 673 HIS : no HE2:sc= -8.32! C(o=-23!,f=-23!) USER MOD Single : A 543 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 547 SER OG : rot -3:sc= -1.69! USER MOD Single : A 549 MET CE :methyl -160:sc= -3.01! (180deg=-4.37!) USER MOD Single : A 550 TYR OH : rot -27:sc= 0.891 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 552 THR OG1 : rot 180:sc=-0.000608 USER MOD Single : A 553 GLN : amide:sc= -1.26 K(o=-1.3,f=-0.36) USER MOD Single : A 554 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 564 CYS SG : rot -111:sc= -5.48! USER MOD Single : A 566 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 570 MET CE :methyl -174:sc= 0 (180deg=-0.0198) USER MOD Single : A 573 ASN : amide:sc= -0.414 X(o=-0.41,f=-0.37) USER MOD Single : A 575 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 SER OG : rot -67:sc= -1.92! USER MOD Single : A 581 LYS NZ :NH3+ -109:sc= 1.95 (180deg=-0.201) USER MOD Single : A 585 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 593 LYS NZ :NH3+ 166:sc= -0.353 (180deg=-1.01) USER MOD Single : A 594 HIS : no HD1:sc= -3.91 K(o=-3.9,f=-3.3) USER MOD Single : A 595 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot 146:sc= 1.36 USER MOD Single : A 597 GLN : amide:sc= -1.03 K(o=-1,f=-4.3!) USER MOD Single : A 599 LYS NZ :NH3+ -124:sc= -0.511 (180deg=-3.75!) USER MOD Single : A 600 LYS NZ :NH3+ 153:sc= -0.145 (180deg=-0.844) USER MOD Single : A 601 LYS NZ :NH3+ -109:sc= 0.838 (180deg=0.00446) USER MOD Single : A 602 THR OG1 : rot 180:sc= 0 USER MOD Single : A 604 ASN : amide:sc= 0.902 K(o=0.9,f=-7.2!) USER MOD Single : A 608 ASN : amide:sc= -0.353 K(o=-0.35,f=-2.9!) USER MOD Single : A 613 TYR OH : rot 90:sc= -0.321 USER MOD Single : A 616 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.1) USER MOD Single : A 617 HIS : no HD1:sc= -3.21! C(o=-3.2!,f=-13!) USER MOD Single : A 618 SER OG : rot -14:sc= 0.239 USER MOD Single : A 622 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 623 LYS NZ :NH3+ -114:sc= -3.38! (180deg=-6.22!) USER MOD Single : A 624 SER OG : rot 34:sc= 0.53 USER MOD Single : A 628 SER OG : rot -160:sc= -0.112 USER MOD Single : A 632 TYR OH : rot 180:sc= 0 USER MOD Single : A 636 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 637 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -0.341 X(o=-0.34,f=-0.49) USER MOD Single : A 640 TYR OH : rot 180:sc= 0 USER MOD Single : A 644 CYS SG : rot 96:sc= 0.899 USER MOD Single : A 645 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 649 SER OG : rot 180:sc= 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 -28:sc= -2.47! USER MOD Single : A 663 LYS NZ :NH3+ -142:sc= -0.121 (180deg=-0.316) USER MOD Single : A 664 ASN : amide:sc= -4.27! C(o=-4.3!,f=-7.7!) USER MOD Single : A 665 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ -168:sc= -0.0478 (180deg=-0.195) USER MOD Single : A 668 LYS NZ :NH3+ -161:sc= 0.535 (180deg=0.17) USER MOD Single : A 674 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 676 GLN : amide:sc= -0.981 K(o=-0.98,f=-0.063) USER MOD Single : A 677 ASN : amide:sc= -0.0577 K(o=-0.058,f=-0.8) USER MOD ----------------------------------------------------------------- ATOM 27 N GLY A 542 -2.833 -8.811 9.518 1.00 0.00 N ATOM 28 CA GLY A 542 -3.844 -9.184 8.548 1.00 0.00 C ATOM 29 C GLY A 542 -3.384 -8.983 7.118 1.00 0.00 C ATOM 30 O GLY A 542 -2.207 -9.162 6.804 1.00 0.00 O ATOM 0 HA2 GLY A 542 -4.114 -10.230 8.695 1.00 0.00 H new ATOM 0 HA3 GLY A 542 -4.744 -8.594 8.722 1.00 0.00 H new ATOM 34 N LYS A 543 -4.316 -8.605 6.249 1.00 0.00 N ATOM 35 CA LYS A 543 -4.007 -8.372 4.843 1.00 0.00 C ATOM 36 C LYS A 543 -4.609 -7.049 4.383 1.00 0.00 C ATOM 37 O LYS A 543 -5.550 -6.544 4.993 1.00 0.00 O ATOM 38 CB LYS A 543 -4.547 -9.517 3.984 1.00 0.00 C ATOM 39 CG LYS A 543 -3.547 -10.642 3.772 1.00 0.00 C ATOM 40 CD LYS A 543 -4.239 -11.939 3.389 1.00 0.00 C ATOM 41 CE LYS A 543 -5.002 -12.533 4.564 1.00 0.00 C ATOM 42 NZ LYS A 543 -4.337 -13.754 5.099 1.00 0.00 N ATOM 0 H LYS A 543 -5.294 -8.453 6.495 1.00 0.00 H new ATOM 0 HA LYS A 543 -2.924 -8.326 4.729 1.00 0.00 H new ATOM 0 HB2 LYS A 543 -5.443 -9.922 4.455 1.00 0.00 H new ATOM 0 HB3 LYS A 543 -4.848 -9.122 3.014 1.00 0.00 H new ATOM 0 HG2 LYS A 543 -2.842 -10.360 2.990 1.00 0.00 H new ATOM 0 HG3 LYS A 543 -2.969 -10.793 4.684 1.00 0.00 H new ATOM 0 HD2 LYS A 543 -4.926 -11.756 2.563 1.00 0.00 H new ATOM 0 HD3 LYS A 543 -3.499 -12.656 3.035 1.00 0.00 H new ATOM 0 HE2 LYS A 543 -5.086 -11.789 5.356 1.00 0.00 H new ATOM 0 HE3 LYS A 543 -6.016 -12.780 4.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 -4.888 -14.128 5.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 -4.280 -14.474 4.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 -3.378 -13.514 5.422 1.00 0.00 H new ATOM 56 N ILE A 544 -4.063 -6.489 3.309 1.00 0.00 N ATOM 57 CA ILE A 544 -4.560 -5.223 2.786 1.00 0.00 C ATOM 58 C ILE A 544 -4.710 -5.261 1.271 1.00 0.00 C ATOM 59 O ILE A 544 -3.757 -5.548 0.546 1.00 0.00 O ATOM 60 CB ILE A 544 -3.644 -4.047 3.180 1.00 0.00 C ATOM 61 CG1 ILE A 544 -4.429 -2.733 3.137 1.00 0.00 C ATOM 62 CG2 ILE A 544 -2.430 -3.977 2.265 1.00 0.00 C ATOM 63 CD1 ILE A 544 -4.417 -2.061 1.781 1.00 0.00 C ATOM 0 H ILE A 544 -3.283 -6.888 2.788 1.00 0.00 H new ATOM 0 HA ILE A 544 -5.542 -5.069 3.233 1.00 0.00 H new ATOM 0 HB ILE A 544 -3.289 -4.210 4.198 1.00 0.00 H new ATOM 0 HG12 ILE A 544 -5.462 -2.927 3.427 1.00 0.00 H new ATOM 0 HG13 ILE A 544 -4.014 -2.048 3.876 1.00 0.00 H new ATOM 0 HG21 ILE A 544 -1.798 -3.140 2.562 1.00 0.00 H new ATOM 0 HG22 ILE A 544 -1.863 -4.905 2.342 1.00 0.00 H new ATOM 0 HG23 ILE A 544 -2.758 -3.836 1.235 1.00 0.00 H new ATOM 0 HD11 ILE A 544 -4.993 -1.137 1.828 1.00 0.00 H new ATOM 0 HD12 ILE A 544 -3.390 -1.834 1.496 1.00 0.00 H new ATOM 0 HD13 ILE A 544 -4.860 -2.727 1.041 1.00 0.00 H new ATOM 75 N LEU A 545 -5.916 -4.962 0.802 1.00 0.00 N ATOM 76 CA LEU A 545 -6.204 -4.953 -0.625 1.00 0.00 C ATOM 77 C LEU A 545 -5.707 -3.661 -1.260 1.00 0.00 C ATOM 78 O LEU A 545 -6.126 -2.568 -0.878 1.00 0.00 O ATOM 79 CB LEU A 545 -7.709 -5.097 -0.860 1.00 0.00 C ATOM 80 CG LEU A 545 -8.114 -5.423 -2.299 1.00 0.00 C ATOM 81 CD1 LEU A 545 -7.776 -6.865 -2.634 1.00 0.00 C ATOM 82 CD2 LEU A 545 -9.597 -5.162 -2.505 1.00 0.00 C ATOM 0 H LEU A 545 -6.712 -4.722 1.393 1.00 0.00 H new ATOM 0 HA LEU A 545 -5.687 -5.795 -1.086 1.00 0.00 H new ATOM 0 HB2 LEU A 545 -8.090 -5.881 -0.206 1.00 0.00 H new ATOM 0 HB3 LEU A 545 -8.198 -4.169 -0.563 1.00 0.00 H new ATOM 0 HG LEU A 545 -7.552 -4.774 -2.971 1.00 0.00 H new ATOM 0 HD11 LEU A 545 -8.071 -7.079 -3.661 1.00 0.00 H new ATOM 0 HD12 LEU A 545 -6.703 -7.022 -2.525 1.00 0.00 H new ATOM 0 HD13 LEU A 545 -8.311 -7.531 -1.957 1.00 0.00 H new ATOM 0 HD21 LEU A 545 -9.869 -5.399 -3.534 1.00 0.00 H new ATOM 0 HD22 LEU A 545 -10.174 -5.787 -1.824 1.00 0.00 H new ATOM 0 HD23 LEU A 545 -9.813 -4.112 -2.305 1.00 0.00 H new ATOM 94 N VAL A 546 -4.811 -3.792 -2.229 1.00 0.00 N ATOM 95 CA VAL A 546 -4.259 -2.631 -2.912 1.00 0.00 C ATOM 96 C VAL A 546 -4.595 -2.657 -4.398 1.00 0.00 C ATOM 97 O VAL A 546 -4.504 -3.699 -5.047 1.00 0.00 O ATOM 98 CB VAL A 546 -2.730 -2.556 -2.745 1.00 0.00 C ATOM 99 CG1 VAL A 546 -2.152 -1.441 -3.604 1.00 0.00 C ATOM 100 CG2 VAL A 546 -2.362 -2.357 -1.282 1.00 0.00 C ATOM 0 H VAL A 546 -4.452 -4.688 -2.559 1.00 0.00 H new ATOM 0 HA VAL A 546 -4.711 -1.751 -2.455 1.00 0.00 H new ATOM 0 HB VAL A 546 -2.300 -3.500 -3.079 1.00 0.00 H new ATOM 0 HG11 VAL A 546 -1.071 -1.404 -3.472 1.00 0.00 H new ATOM 0 HG12 VAL A 546 -2.384 -1.632 -4.652 1.00 0.00 H new ATOM 0 HG13 VAL A 546 -2.587 -0.488 -3.304 1.00 0.00 H new ATOM 0 HG21 VAL A 546 -1.278 -2.306 -1.183 1.00 0.00 H new ATOM 0 HG22 VAL A 546 -2.803 -1.429 -0.919 1.00 0.00 H new ATOM 0 HG23 VAL A 546 -2.741 -3.193 -0.694 1.00 0.00 H new ATOM 110 N SER A 547 -4.976 -1.503 -4.933 1.00 0.00 N ATOM 111 CA SER A 547 -5.319 -1.393 -6.344 1.00 0.00 C ATOM 112 C SER A 547 -4.296 -0.528 -7.075 1.00 0.00 C ATOM 113 O SER A 547 -4.108 0.640 -6.740 1.00 0.00 O ATOM 114 CB SER A 547 -6.718 -0.796 -6.508 1.00 0.00 C ATOM 115 OG SER A 547 -6.661 0.614 -6.636 1.00 0.00 O ATOM 0 H SER A 547 -5.055 -0.631 -4.410 1.00 0.00 H new ATOM 0 HA SER A 547 -5.309 -2.393 -6.778 1.00 0.00 H new ATOM 0 HB2 SER A 547 -7.198 -1.225 -7.388 1.00 0.00 H new ATOM 0 HB3 SER A 547 -7.333 -1.061 -5.648 1.00 0.00 H new ATOM 0 HG SER A 547 -5.733 0.914 -6.537 1.00 0.00 H new ATOM 121 N LEU A 548 -3.633 -1.107 -8.070 1.00 0.00 N ATOM 122 CA LEU A 548 -2.625 -0.380 -8.834 1.00 0.00 C ATOM 123 C LEU A 548 -3.179 0.103 -10.170 1.00 0.00 C ATOM 124 O LEU A 548 -4.159 -0.437 -10.683 1.00 0.00 O ATOM 125 CB LEU A 548 -1.397 -1.261 -9.068 1.00 0.00 C ATOM 126 CG LEU A 548 -0.561 -1.553 -7.821 1.00 0.00 C ATOM 127 CD1 LEU A 548 0.805 -2.094 -8.211 1.00 0.00 C ATOM 128 CD2 LEU A 548 -0.418 -0.299 -6.974 1.00 0.00 C ATOM 0 H LEU A 548 -3.774 -2.073 -8.366 1.00 0.00 H new ATOM 0 HA LEU A 548 -2.335 0.494 -8.251 1.00 0.00 H new ATOM 0 HB2 LEU A 548 -1.725 -2.208 -9.497 1.00 0.00 H new ATOM 0 HB3 LEU A 548 -0.759 -0.779 -9.809 1.00 0.00 H new ATOM 0 HG LEU A 548 -1.074 -2.312 -7.230 1.00 0.00 H new ATOM 0 HD11 LEU A 548 1.387 -2.296 -7.312 1.00 0.00 H new ATOM 0 HD12 LEU A 548 0.682 -3.016 -8.779 1.00 0.00 H new ATOM 0 HD13 LEU A 548 1.327 -1.358 -8.823 1.00 0.00 H new ATOM 0 HD21 LEU A 548 0.179 -0.523 -6.090 1.00 0.00 H new ATOM 0 HD22 LEU A 548 0.074 0.480 -7.557 1.00 0.00 H new ATOM 0 HD23 LEU A 548 -1.405 0.047 -6.667 1.00 0.00 H new ATOM 140 N MET A 549 -2.537 1.125 -10.727 1.00 0.00 N ATOM 141 CA MET A 549 -2.945 1.696 -12.006 1.00 0.00 C ATOM 142 C MET A 549 -2.094 2.916 -12.338 1.00 0.00 C ATOM 143 O MET A 549 -1.991 3.846 -11.538 1.00 0.00 O ATOM 144 CB MET A 549 -4.423 2.091 -11.973 1.00 0.00 C ATOM 145 CG MET A 549 -5.078 2.121 -13.346 1.00 0.00 C ATOM 146 SD MET A 549 -6.441 3.299 -13.443 1.00 0.00 S ATOM 147 CE MET A 549 -6.825 3.521 -11.707 1.00 0.00 C ATOM 0 H MET A 549 -1.725 1.578 -10.308 1.00 0.00 H new ATOM 0 HA MET A 549 -2.800 0.940 -12.777 1.00 0.00 H new ATOM 0 HB2 MET A 549 -4.963 1.390 -11.337 1.00 0.00 H new ATOM 0 HB3 MET A 549 -4.517 3.075 -11.514 1.00 0.00 H new ATOM 0 HG2 MET A 549 -4.329 2.376 -14.096 1.00 0.00 H new ATOM 0 HG3 MET A 549 -5.447 1.125 -13.590 1.00 0.00 H new ATOM 0 HE1 MET A 549 -7.835 3.919 -11.606 1.00 0.00 H new ATOM 0 HE2 MET A 549 -6.760 2.561 -11.194 1.00 0.00 H new ATOM 0 HE3 MET A 549 -6.114 4.218 -11.263 1.00 0.00 H new ATOM 157 N TYR A 550 -1.480 2.908 -13.516 1.00 0.00 N ATOM 158 CA TYR A 550 -0.636 4.021 -13.934 1.00 0.00 C ATOM 159 C TYR A 550 -1.338 4.892 -14.969 1.00 0.00 C ATOM 160 O TYR A 550 -1.879 4.392 -15.956 1.00 0.00 O ATOM 161 CB TYR A 550 0.687 3.509 -14.502 1.00 0.00 C ATOM 162 CG TYR A 550 1.721 4.598 -14.667 1.00 0.00 C ATOM 163 CD1 TYR A 550 2.569 4.938 -13.621 1.00 0.00 C ATOM 164 CD2 TYR A 550 1.847 5.289 -15.865 1.00 0.00 C ATOM 165 CE1 TYR A 550 3.514 5.937 -13.763 1.00 0.00 C ATOM 166 CE2 TYR A 550 2.789 6.288 -16.016 1.00 0.00 C ATOM 167 CZ TYR A 550 3.619 6.609 -14.963 1.00 0.00 C ATOM 168 OH TYR A 550 4.559 7.604 -15.110 1.00 0.00 O ATOM 0 H TYR A 550 -1.550 2.149 -14.194 1.00 0.00 H new ATOM 0 HA TYR A 550 -0.435 4.629 -13.052 1.00 0.00 H new ATOM 0 HB2 TYR A 550 1.084 2.736 -13.844 1.00 0.00 H new ATOM 0 HB3 TYR A 550 0.504 3.041 -15.469 1.00 0.00 H new ATOM 0 HD1 TYR A 550 2.489 4.413 -12.681 1.00 0.00 H new ATOM 0 HD2 TYR A 550 1.198 5.041 -16.692 1.00 0.00 H new ATOM 0 HE1 TYR A 550 4.166 6.190 -12.940 1.00 0.00 H new ATOM 0 HE2 TYR A 550 2.875 6.815 -16.955 1.00 0.00 H new ATOM 0 HH TYR A 550 4.750 8.005 -14.236 1.00 0.00 H new ATOM 178 N SER A 551 -1.319 6.199 -14.736 1.00 0.00 N ATOM 179 CA SER A 551 -1.947 7.149 -15.646 1.00 0.00 C ATOM 180 C SER A 551 -0.898 7.874 -16.485 1.00 0.00 C ATOM 181 O SER A 551 -0.567 9.030 -16.220 1.00 0.00 O ATOM 182 CB SER A 551 -2.777 8.167 -14.862 1.00 0.00 C ATOM 183 OG SER A 551 -4.142 8.114 -15.239 1.00 0.00 O ATOM 0 H SER A 551 -0.875 6.626 -13.923 1.00 0.00 H new ATOM 0 HA SER A 551 -2.603 6.592 -16.315 1.00 0.00 H new ATOM 0 HB2 SER A 551 -2.684 7.971 -13.794 1.00 0.00 H new ATOM 0 HB3 SER A 551 -2.387 9.170 -15.037 1.00 0.00 H new ATOM 0 HG SER A 551 -4.650 8.773 -14.722 1.00 0.00 H new ATOM 189 N THR A 552 -0.379 7.189 -17.500 1.00 0.00 N ATOM 190 CA THR A 552 0.630 7.776 -18.377 1.00 0.00 C ATOM 191 C THR A 552 0.242 9.198 -18.748 1.00 0.00 C ATOM 192 O THR A 552 1.096 10.077 -18.872 1.00 0.00 O ATOM 193 CB THR A 552 0.803 6.939 -19.646 1.00 0.00 C ATOM 194 OG1 THR A 552 -0.076 7.385 -20.665 1.00 0.00 O ATOM 195 CG2 THR A 552 0.543 5.467 -19.429 1.00 0.00 C ATOM 0 H THR A 552 -0.639 6.231 -17.735 1.00 0.00 H new ATOM 0 HA THR A 552 1.578 7.791 -17.839 1.00 0.00 H new ATOM 0 HB THR A 552 1.845 7.069 -19.939 1.00 0.00 H new ATOM 0 HG1 THR A 552 0.051 6.839 -21.469 1.00 0.00 H new ATOM 0 HG21 THR A 552 0.683 4.931 -20.368 1.00 0.00 H new ATOM 0 HG22 THR A 552 1.238 5.081 -18.683 1.00 0.00 H new ATOM 0 HG23 THR A 552 -0.480 5.326 -19.079 1.00 0.00 H new ATOM 203 N GLN A 553 -1.056 9.420 -18.906 1.00 0.00 N ATOM 204 CA GLN A 553 -1.569 10.734 -19.240 1.00 0.00 C ATOM 205 C GLN A 553 -1.060 11.744 -18.221 1.00 0.00 C ATOM 206 O GLN A 553 -0.411 12.730 -18.568 1.00 0.00 O ATOM 207 CB GLN A 553 -3.100 10.693 -19.252 1.00 0.00 C ATOM 208 CG GLN A 553 -3.766 11.926 -18.668 1.00 0.00 C ATOM 209 CD GLN A 553 -3.632 13.143 -19.561 1.00 0.00 C ATOM 210 OE1 GLN A 553 -4.375 13.302 -20.531 1.00 0.00 O ATOM 211 NE2 GLN A 553 -2.681 14.011 -19.237 1.00 0.00 N ATOM 0 H GLN A 553 -1.773 8.701 -18.807 1.00 0.00 H new ATOM 0 HA GLN A 553 -1.224 11.033 -20.230 1.00 0.00 H new ATOM 0 HB2 GLN A 553 -3.440 10.564 -20.280 1.00 0.00 H new ATOM 0 HB3 GLN A 553 -3.432 9.817 -18.694 1.00 0.00 H new ATOM 0 HG2 GLN A 553 -4.823 11.718 -18.501 1.00 0.00 H new ATOM 0 HG3 GLN A 553 -3.326 12.145 -17.695 1.00 0.00 H new ATOM 0 HE21 GLN A 553 -2.089 13.839 -18.425 1.00 0.00 H new ATOM 0 HE22 GLN A 553 -2.543 14.850 -19.800 1.00 0.00 H new ATOM 220 N GLN A 554 -1.353 11.467 -16.958 1.00 0.00 N ATOM 221 CA GLN A 554 -0.922 12.327 -15.866 1.00 0.00 C ATOM 222 C GLN A 554 0.574 12.163 -15.620 1.00 0.00 C ATOM 223 O GLN A 554 1.199 12.982 -14.946 1.00 0.00 O ATOM 224 CB GLN A 554 -1.702 12.001 -14.590 1.00 0.00 C ATOM 225 CG GLN A 554 -3.205 11.918 -14.800 1.00 0.00 C ATOM 226 CD GLN A 554 -3.961 12.969 -14.011 1.00 0.00 C ATOM 227 OE1 GLN A 554 -4.256 12.783 -12.830 1.00 0.00 O ATOM 228 NE2 GLN A 554 -4.281 14.082 -14.662 1.00 0.00 N ATOM 0 H GLN A 554 -1.889 10.651 -16.664 1.00 0.00 H new ATOM 0 HA GLN A 554 -1.121 13.362 -16.144 1.00 0.00 H new ATOM 0 HB2 GLN A 554 -1.347 11.052 -14.189 1.00 0.00 H new ATOM 0 HB3 GLN A 554 -1.490 12.763 -13.840 1.00 0.00 H new ATOM 0 HG2 GLN A 554 -3.427 12.035 -15.861 1.00 0.00 H new ATOM 0 HG3 GLN A 554 -3.555 10.928 -14.508 1.00 0.00 H new ATOM 0 HE21 GLN A 554 -4.017 14.194 -15.641 1.00 0.00 H new ATOM 0 HE22 GLN A 554 -4.791 14.824 -14.183 1.00 0.00 H new ATOM 237 N GLY A 555 1.140 11.095 -16.174 1.00 0.00 N ATOM 238 CA GLY A 555 2.558 10.834 -16.010 1.00 0.00 C ATOM 239 C GLY A 555 2.904 10.397 -14.602 1.00 0.00 C ATOM 240 O GLY A 555 3.909 10.830 -14.039 1.00 0.00 O ATOM 0 H GLY A 555 0.640 10.405 -16.735 1.00 0.00 H new ATOM 0 HA2 GLY A 555 2.866 10.061 -16.714 1.00 0.00 H new ATOM 0 HA3 GLY A 555 3.122 11.734 -16.257 1.00 0.00 H new ATOM 244 N GLY A 556 2.067 9.537 -14.032 1.00 0.00 N ATOM 245 CA GLY A 556 2.308 9.056 -12.684 1.00 0.00 C ATOM 246 C GLY A 556 1.569 7.769 -12.381 1.00 0.00 C ATOM 247 O GLY A 556 0.654 7.384 -13.109 1.00 0.00 O ATOM 0 H GLY A 556 1.228 9.165 -14.478 1.00 0.00 H new ATOM 0 HA2 GLY A 556 3.377 8.897 -12.545 1.00 0.00 H new ATOM 0 HA3 GLY A 556 2.004 9.821 -11.970 1.00 0.00 H new ATOM 251 N LEU A 557 1.964 7.104 -11.300 1.00 0.00 N ATOM 252 CA LEU A 557 1.335 5.853 -10.895 1.00 0.00 C ATOM 253 C LEU A 557 0.151 6.120 -9.974 1.00 0.00 C ATOM 254 O LEU A 557 0.062 7.179 -9.355 1.00 0.00 O ATOM 255 CB LEU A 557 2.354 4.955 -10.187 1.00 0.00 C ATOM 256 CG LEU A 557 1.757 3.777 -9.415 1.00 0.00 C ATOM 257 CD1 LEU A 557 1.323 2.675 -10.369 1.00 0.00 C ATOM 258 CD2 LEU A 557 2.760 3.242 -8.403 1.00 0.00 C ATOM 0 H LEU A 557 2.719 7.412 -10.687 1.00 0.00 H new ATOM 0 HA LEU A 557 0.973 5.346 -11.789 1.00 0.00 H new ATOM 0 HB2 LEU A 557 3.050 4.566 -10.930 1.00 0.00 H new ATOM 0 HB3 LEU A 557 2.934 5.566 -9.495 1.00 0.00 H new ATOM 0 HG LEU A 557 0.877 4.130 -8.877 1.00 0.00 H new ATOM 0 HD11 LEU A 557 0.901 1.846 -9.800 1.00 0.00 H new ATOM 0 HD12 LEU A 557 0.571 3.064 -11.056 1.00 0.00 H new ATOM 0 HD13 LEU A 557 2.185 2.324 -10.936 1.00 0.00 H new ATOM 0 HD21 LEU A 557 2.320 2.404 -7.862 1.00 0.00 H new ATOM 0 HD22 LEU A 557 3.658 2.907 -8.923 1.00 0.00 H new ATOM 0 HD23 LEU A 557 3.022 4.031 -7.698 1.00 0.00 H new ATOM 270 N ILE A 558 -0.754 5.153 -9.880 1.00 0.00 N ATOM 271 CA ILE A 558 -1.924 5.289 -9.023 1.00 0.00 C ATOM 272 C ILE A 558 -2.038 4.109 -8.067 1.00 0.00 C ATOM 273 O ILE A 558 -2.065 2.953 -8.490 1.00 0.00 O ATOM 274 CB ILE A 558 -3.225 5.405 -9.839 1.00 0.00 C ATOM 275 CG1 ILE A 558 -2.980 6.188 -11.131 1.00 0.00 C ATOM 276 CG2 ILE A 558 -4.307 6.073 -9.004 1.00 0.00 C ATOM 277 CD1 ILE A 558 -3.092 7.688 -10.960 1.00 0.00 C ATOM 0 H ILE A 558 -0.700 4.269 -10.385 1.00 0.00 H new ATOM 0 HA ILE A 558 -1.789 6.209 -8.454 1.00 0.00 H new ATOM 0 HB ILE A 558 -3.561 4.403 -10.107 1.00 0.00 H new ATOM 0 HG12 ILE A 558 -1.987 5.947 -11.510 1.00 0.00 H new ATOM 0 HG13 ILE A 558 -3.696 5.862 -11.885 1.00 0.00 H new ATOM 0 HG21 ILE A 558 -5.223 6.150 -9.590 1.00 0.00 H new ATOM 0 HG22 ILE A 558 -4.497 5.478 -8.111 1.00 0.00 H new ATOM 0 HG23 ILE A 558 -3.978 7.070 -8.712 1.00 0.00 H new ATOM 0 HD11 ILE A 558 -2.906 8.178 -11.916 1.00 0.00 H new ATOM 0 HD12 ILE A 558 -4.093 7.941 -10.611 1.00 0.00 H new ATOM 0 HD13 ILE A 558 -2.357 8.027 -10.230 1.00 0.00 H new ATOM 289 N VAL A 559 -2.102 4.410 -6.776 1.00 0.00 N ATOM 290 CA VAL A 559 -2.209 3.381 -5.752 1.00 0.00 C ATOM 291 C VAL A 559 -3.550 3.470 -5.038 1.00 0.00 C ATOM 292 O VAL A 559 -3.899 4.512 -4.492 1.00 0.00 O ATOM 293 CB VAL A 559 -1.080 3.518 -4.720 1.00 0.00 C ATOM 294 CG1 VAL A 559 -0.837 2.199 -4.007 1.00 0.00 C ATOM 295 CG2 VAL A 559 0.192 4.013 -5.389 1.00 0.00 C ATOM 0 H VAL A 559 -2.081 5.363 -6.413 1.00 0.00 H new ATOM 0 HA VAL A 559 -2.127 2.414 -6.247 1.00 0.00 H new ATOM 0 HB VAL A 559 -1.384 4.252 -3.974 1.00 0.00 H new ATOM 0 HG11 VAL A 559 -0.033 2.321 -3.281 1.00 0.00 H new ATOM 0 HG12 VAL A 559 -1.747 1.890 -3.493 1.00 0.00 H new ATOM 0 HG13 VAL A 559 -0.556 1.438 -4.735 1.00 0.00 H new ATOM 0 HG21 VAL A 559 0.983 4.105 -4.644 1.00 0.00 H new ATOM 0 HG22 VAL A 559 0.498 3.304 -6.158 1.00 0.00 H new ATOM 0 HG23 VAL A 559 0.008 4.986 -5.845 1.00 0.00 H new ATOM 305 N GLY A 560 -4.305 2.381 -5.051 1.00 0.00 N ATOM 306 CA GLY A 560 -5.606 2.384 -4.409 1.00 0.00 C ATOM 307 C GLY A 560 -5.673 1.500 -3.181 1.00 0.00 C ATOM 308 O GLY A 560 -5.556 0.280 -3.275 1.00 0.00 O ATOM 0 H GLY A 560 -4.043 1.499 -5.492 1.00 0.00 H new ATOM 0 HA2 GLY A 560 -5.861 3.405 -4.127 1.00 0.00 H new ATOM 0 HA3 GLY A 560 -6.358 2.054 -5.126 1.00 0.00 H new ATOM 312 N ILE A 561 -5.885 2.122 -2.026 1.00 0.00 N ATOM 313 CA ILE A 561 -5.995 1.391 -0.771 1.00 0.00 C ATOM 314 C ILE A 561 -7.454 1.055 -0.493 1.00 0.00 C ATOM 315 O ILE A 561 -8.194 1.870 0.055 1.00 0.00 O ATOM 316 CB ILE A 561 -5.425 2.205 0.406 1.00 0.00 C ATOM 317 CG1 ILE A 561 -3.980 2.613 0.115 1.00 0.00 C ATOM 318 CG2 ILE A 561 -5.505 1.403 1.695 1.00 0.00 C ATOM 319 CD1 ILE A 561 -3.077 1.444 -0.208 1.00 0.00 C ATOM 0 H ILE A 561 -5.984 3.133 -1.934 1.00 0.00 H new ATOM 0 HA ILE A 561 -5.414 0.474 -0.867 1.00 0.00 H new ATOM 0 HB ILE A 561 -6.023 3.108 0.528 1.00 0.00 H new ATOM 0 HG12 ILE A 561 -3.970 3.312 -0.721 1.00 0.00 H new ATOM 0 HG13 ILE A 561 -3.580 3.144 0.979 1.00 0.00 H new ATOM 0 HG21 ILE A 561 -5.098 1.993 2.516 1.00 0.00 H new ATOM 0 HG22 ILE A 561 -6.546 1.156 1.906 1.00 0.00 H new ATOM 0 HG23 ILE A 561 -4.929 0.484 1.588 1.00 0.00 H new ATOM 0 HD11 ILE A 561 -2.068 1.807 -0.404 1.00 0.00 H new ATOM 0 HD12 ILE A 561 -3.058 0.755 0.636 1.00 0.00 H new ATOM 0 HD13 ILE A 561 -3.454 0.926 -1.090 1.00 0.00 H new ATOM 331 N ILE A 562 -7.868 -0.139 -0.902 1.00 0.00 N ATOM 332 CA ILE A 562 -9.249 -0.569 -0.725 1.00 0.00 C ATOM 333 C ILE A 562 -9.574 -0.898 0.726 1.00 0.00 C ATOM 334 O ILE A 562 -10.262 -0.133 1.401 1.00 0.00 O ATOM 335 CB ILE A 562 -9.573 -1.792 -1.603 1.00 0.00 C ATOM 336 CG1 ILE A 562 -9.068 -1.571 -3.029 1.00 0.00 C ATOM 337 CG2 ILE A 562 -11.069 -2.064 -1.600 1.00 0.00 C ATOM 338 CD1 ILE A 562 -7.908 -2.468 -3.403 1.00 0.00 C ATOM 0 H ILE A 562 -7.267 -0.826 -1.358 1.00 0.00 H new ATOM 0 HA ILE A 562 -9.867 0.274 -1.033 1.00 0.00 H new ATOM 0 HB ILE A 562 -9.065 -2.663 -1.190 1.00 0.00 H new ATOM 0 HG12 ILE A 562 -9.888 -1.740 -3.727 1.00 0.00 H new ATOM 0 HG13 ILE A 562 -8.764 -0.530 -3.141 1.00 0.00 H new ATOM 0 HG21 ILE A 562 -11.282 -2.931 -2.225 1.00 0.00 H new ATOM 0 HG22 ILE A 562 -11.401 -2.261 -0.581 1.00 0.00 H new ATOM 0 HG23 ILE A 562 -11.598 -1.195 -1.992 1.00 0.00 H new ATOM 0 HD11 ILE A 562 -7.601 -2.258 -4.427 1.00 0.00 H new ATOM 0 HD12 ILE A 562 -7.072 -2.282 -2.728 1.00 0.00 H new ATOM 0 HD13 ILE A 562 -8.214 -3.511 -3.323 1.00 0.00 H new ATOM 350 N ARG A 563 -9.099 -2.045 1.203 1.00 0.00 N ATOM 351 CA ARG A 563 -9.380 -2.457 2.574 1.00 0.00 C ATOM 352 C ARG A 563 -8.333 -3.431 3.106 1.00 0.00 C ATOM 353 O ARG A 563 -7.417 -3.835 2.392 1.00 0.00 O ATOM 354 CB ARG A 563 -10.769 -3.107 2.646 1.00 0.00 C ATOM 355 CG ARG A 563 -10.752 -4.622 2.487 1.00 0.00 C ATOM 356 CD ARG A 563 -11.973 -5.124 1.735 1.00 0.00 C ATOM 357 NE ARG A 563 -13.182 -5.063 2.552 1.00 0.00 N ATOM 358 CZ ARG A 563 -14.219 -5.879 2.394 1.00 0.00 C ATOM 359 NH1 ARG A 563 -14.200 -6.803 1.444 1.00 0.00 N ATOM 360 NH2 ARG A 563 -15.280 -5.769 3.184 1.00 0.00 N ATOM 0 H ARG A 563 -8.525 -2.698 0.669 1.00 0.00 H new ATOM 0 HA ARG A 563 -9.350 -1.564 3.198 1.00 0.00 H new ATOM 0 HB2 ARG A 563 -11.227 -2.857 3.603 1.00 0.00 H new ATOM 0 HB3 ARG A 563 -11.401 -2.677 1.869 1.00 0.00 H new ATOM 0 HG2 ARG A 563 -9.849 -4.922 1.955 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -10.713 -5.090 3.470 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -12.114 -4.528 0.834 1.00 0.00 H new ATOM 0 HD3 ARG A 563 -11.804 -6.152 1.414 1.00 0.00 H new ATOM 0 HE ARG A 563 -13.233 -4.355 3.284 1.00 0.00 H new ATOM 0 HH11 ARG A 563 -13.388 -6.889 0.832 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -14.997 -7.428 1.325 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -15.301 -5.057 3.914 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -16.075 -6.396 3.061 1.00 0.00 H new ATOM 374 N CYS A 564 -8.500 -3.814 4.368 1.00 0.00 N ATOM 375 CA CYS A 564 -7.605 -4.757 5.022 1.00 0.00 C ATOM 376 C CYS A 564 -8.418 -5.776 5.809 1.00 0.00 C ATOM 377 O CYS A 564 -9.579 -5.531 6.134 1.00 0.00 O ATOM 378 CB CYS A 564 -6.636 -4.025 5.947 1.00 0.00 C ATOM 379 SG CYS A 564 -7.428 -2.841 7.060 1.00 0.00 S ATOM 0 H CYS A 564 -9.258 -3.479 4.963 1.00 0.00 H new ATOM 0 HA CYS A 564 -7.023 -5.276 4.260 1.00 0.00 H new ATOM 0 HB2 CYS A 564 -6.094 -4.760 6.542 1.00 0.00 H new ATOM 0 HB3 CYS A 564 -5.899 -3.499 5.340 1.00 0.00 H new ATOM 0 HG CYS A 564 -7.098 -1.632 6.714 1.00 0.00 H new ATOM 385 N VAL A 565 -7.818 -6.923 6.106 1.00 0.00 N ATOM 386 CA VAL A 565 -8.526 -7.964 6.844 1.00 0.00 C ATOM 387 C VAL A 565 -7.598 -8.775 7.739 1.00 0.00 C ATOM 388 O VAL A 565 -6.442 -9.028 7.399 1.00 0.00 O ATOM 389 CB VAL A 565 -9.252 -8.923 5.886 1.00 0.00 C ATOM 390 CG1 VAL A 565 -10.260 -8.163 5.042 1.00 0.00 C ATOM 391 CG2 VAL A 565 -8.253 -9.657 5.005 1.00 0.00 C ATOM 0 H VAL A 565 -6.858 -7.155 5.852 1.00 0.00 H new ATOM 0 HA VAL A 565 -9.251 -7.448 7.474 1.00 0.00 H new ATOM 0 HB VAL A 565 -9.789 -9.664 6.478 1.00 0.00 H new ATOM 0 HG11 VAL A 565 -10.766 -8.855 4.369 1.00 0.00 H new ATOM 0 HG12 VAL A 565 -10.994 -7.687 5.692 1.00 0.00 H new ATOM 0 HG13 VAL A 565 -9.744 -7.400 4.458 1.00 0.00 H new ATOM 0 HG21 VAL A 565 -8.786 -10.331 4.334 1.00 0.00 H new ATOM 0 HG22 VAL A 565 -7.686 -8.934 4.418 1.00 0.00 H new ATOM 0 HG23 VAL A 565 -7.570 -10.233 5.630 1.00 0.00 H new ATOM 401 N HIS A 566 -8.129 -9.188 8.885 1.00 0.00 N ATOM 402 CA HIS A 566 -7.373 -9.988 9.846 1.00 0.00 C ATOM 403 C HIS A 566 -6.242 -9.181 10.469 1.00 0.00 C ATOM 404 O HIS A 566 -5.147 -9.699 10.693 1.00 0.00 O ATOM 405 CB HIS A 566 -6.806 -11.236 9.168 1.00 0.00 C ATOM 406 CG HIS A 566 -6.923 -12.473 10.002 1.00 0.00 C ATOM 407 ND1 HIS A 566 -8.096 -13.186 10.131 1.00 0.00 N ATOM 408 CD2 HIS A 566 -6.004 -13.126 10.752 1.00 0.00 C ATOM 409 CE1 HIS A 566 -7.895 -14.223 10.925 1.00 0.00 C ATOM 410 NE2 HIS A 566 -6.634 -14.209 11.316 1.00 0.00 N ATOM 0 H HIS A 566 -9.085 -8.981 9.173 1.00 0.00 H new ATOM 0 HA HIS A 566 -8.057 -10.288 10.640 1.00 0.00 H new ATOM 0 HB2 HIS A 566 -7.325 -11.394 8.223 1.00 0.00 H new ATOM 0 HB3 HIS A 566 -5.756 -11.065 8.930 1.00 0.00 H new ATOM 0 HD2 HIS A 566 -4.969 -12.847 10.883 1.00 0.00 H new ATOM 0 HE1 HIS A 566 -8.636 -14.957 11.206 1.00 0.00 H new ATOM 0 HE2 HIS A 566 -6.198 -14.891 11.936 1.00 0.00 H new ATOM 419 N LEU A 567 -6.510 -7.913 10.749 1.00 0.00 N ATOM 420 CA LEU A 567 -5.512 -7.036 11.345 1.00 0.00 C ATOM 421 C LEU A 567 -5.342 -7.320 12.833 1.00 0.00 C ATOM 422 O LEU A 567 -6.247 -7.841 13.485 1.00 0.00 O ATOM 423 CB LEU A 567 -5.905 -5.575 11.138 1.00 0.00 C ATOM 424 CG LEU A 567 -5.805 -5.079 9.697 1.00 0.00 C ATOM 425 CD1 LEU A 567 -5.719 -3.563 9.669 1.00 0.00 C ATOM 426 CD2 LEU A 567 -4.602 -5.700 9.001 1.00 0.00 C ATOM 0 H LEU A 567 -7.411 -7.468 10.573 1.00 0.00 H new ATOM 0 HA LEU A 567 -4.560 -7.229 10.851 1.00 0.00 H new ATOM 0 HB2 LEU A 567 -6.929 -5.437 11.484 1.00 0.00 H new ATOM 0 HB3 LEU A 567 -5.270 -4.951 11.766 1.00 0.00 H new ATOM 0 HG LEU A 567 -6.703 -5.384 9.159 1.00 0.00 H new ATOM 0 HD11 LEU A 567 -5.648 -3.222 8.636 1.00 0.00 H new ATOM 0 HD12 LEU A 567 -6.611 -3.139 10.131 1.00 0.00 H new ATOM 0 HD13 LEU A 567 -4.836 -3.238 10.220 1.00 0.00 H new ATOM 0 HD21 LEU A 567 -4.547 -5.335 7.975 1.00 0.00 H new ATOM 0 HD22 LEU A 567 -3.692 -5.425 9.534 1.00 0.00 H new ATOM 0 HD23 LEU A 567 -4.705 -6.785 8.995 1.00 0.00 H new ATOM 438 N ALA A 568 -4.176 -6.968 13.364 1.00 0.00 N ATOM 439 CA ALA A 568 -3.882 -7.178 14.775 1.00 0.00 C ATOM 440 C ALA A 568 -4.572 -6.127 15.638 1.00 0.00 C ATOM 441 O ALA A 568 -5.061 -5.118 15.133 1.00 0.00 O ATOM 442 CB ALA A 568 -2.379 -7.153 15.011 1.00 0.00 C ATOM 0 H ALA A 568 -3.418 -6.535 12.836 1.00 0.00 H new ATOM 0 HA ALA A 568 -4.266 -8.157 15.060 1.00 0.00 H new ATOM 0 HB1 ALA A 568 -2.174 -7.311 16.070 1.00 0.00 H new ATOM 0 HB2 ALA A 568 -1.906 -7.943 14.428 1.00 0.00 H new ATOM 0 HB3 ALA A 568 -1.979 -6.187 14.705 1.00 0.00 H new ATOM 448 N ALA A 569 -4.609 -6.373 16.943 1.00 0.00 N ATOM 449 CA ALA A 569 -5.241 -5.451 17.878 1.00 0.00 C ATOM 450 C ALA A 569 -4.251 -4.957 18.927 1.00 0.00 C ATOM 451 O ALA A 569 -3.695 -5.745 19.691 1.00 0.00 O ATOM 452 CB ALA A 569 -6.429 -6.119 18.549 1.00 0.00 C ATOM 0 H ALA A 569 -4.208 -7.204 17.377 1.00 0.00 H new ATOM 0 HA ALA A 569 -5.589 -4.586 17.314 1.00 0.00 H new ATOM 0 HB1 ALA A 569 -6.893 -5.421 19.245 1.00 0.00 H new ATOM 0 HB2 ALA A 569 -7.156 -6.414 17.792 1.00 0.00 H new ATOM 0 HB3 ALA A 569 -6.091 -7.002 19.092 1.00 0.00 H new ATOM 458 N MET A 570 -4.042 -3.645 18.962 1.00 0.00 N ATOM 459 CA MET A 570 -3.126 -3.041 19.922 1.00 0.00 C ATOM 460 C MET A 570 -3.865 -2.651 21.197 1.00 0.00 C ATOM 461 O MET A 570 -3.264 -2.531 22.264 1.00 0.00 O ATOM 462 CB MET A 570 -2.455 -1.807 19.318 1.00 0.00 C ATOM 463 CG MET A 570 -1.509 -2.122 18.174 1.00 0.00 C ATOM 464 SD MET A 570 -0.521 -3.600 18.473 1.00 0.00 S ATOM 465 CE MET A 570 -0.689 -4.431 16.897 1.00 0.00 C ATOM 0 H MET A 570 -4.495 -2.979 18.336 1.00 0.00 H new ATOM 0 HA MET A 570 -2.361 -3.777 20.168 1.00 0.00 H new ATOM 0 HB2 MET A 570 -3.226 -1.124 18.962 1.00 0.00 H new ATOM 0 HB3 MET A 570 -1.903 -1.286 20.100 1.00 0.00 H new ATOM 0 HG2 MET A 570 -2.085 -2.254 17.258 1.00 0.00 H new ATOM 0 HG3 MET A 570 -0.845 -1.273 18.013 1.00 0.00 H new ATOM 0 HE1 MET A 570 -0.223 -5.415 16.953 1.00 0.00 H new ATOM 0 HE2 MET A 570 -1.746 -4.543 16.656 1.00 0.00 H new ATOM 0 HE3 MET A 570 -0.200 -3.842 16.121 1.00 0.00 H new ATOM 475 N ASP A 571 -5.172 -2.448 21.073 1.00 0.00 N ATOM 476 CA ASP A 571 -5.998 -2.065 22.213 1.00 0.00 C ATOM 477 C ASP A 571 -6.337 -3.276 23.075 1.00 0.00 C ATOM 478 O ASP A 571 -6.118 -4.419 22.672 1.00 0.00 O ATOM 479 CB ASP A 571 -7.284 -1.390 21.733 1.00 0.00 C ATOM 480 CG ASP A 571 -7.020 -0.079 21.020 1.00 0.00 C ATOM 481 OD1 ASP A 571 -5.835 0.288 20.873 1.00 0.00 O ATOM 482 OD2 ASP A 571 -7.997 0.581 20.609 1.00 0.00 O ATOM 0 H ASP A 571 -5.683 -2.542 20.195 1.00 0.00 H new ATOM 0 HA ASP A 571 -5.429 -1.360 22.820 1.00 0.00 H new ATOM 0 HB2 ASP A 571 -7.816 -2.064 21.062 1.00 0.00 H new ATOM 0 HB3 ASP A 571 -7.937 -1.210 22.587 1.00 0.00 H new ATOM 487 N ALA A 572 -6.876 -3.018 24.261 1.00 0.00 N ATOM 488 CA ALA A 572 -7.250 -4.087 25.180 1.00 0.00 C ATOM 489 C ALA A 572 -8.607 -4.675 24.813 1.00 0.00 C ATOM 490 O ALA A 572 -9.010 -5.711 25.343 1.00 0.00 O ATOM 491 CB ALA A 572 -7.266 -3.570 26.611 1.00 0.00 C ATOM 0 H ALA A 572 -7.064 -2.078 24.609 1.00 0.00 H new ATOM 0 HA ALA A 572 -6.506 -4.880 25.100 1.00 0.00 H new ATOM 0 HB1 ALA A 572 -7.547 -4.378 27.287 1.00 0.00 H new ATOM 0 HB2 ALA A 572 -6.275 -3.203 26.876 1.00 0.00 H new ATOM 0 HB3 ALA A 572 -7.988 -2.758 26.696 1.00 0.00 H new ATOM 497 N ASN A 573 -9.309 -4.009 23.901 1.00 0.00 N ATOM 498 CA ASN A 573 -10.622 -4.469 23.462 1.00 0.00 C ATOM 499 C ASN A 573 -10.489 -5.568 22.412 1.00 0.00 C ATOM 500 O ASN A 573 -11.473 -6.208 22.042 1.00 0.00 O ATOM 501 CB ASN A 573 -11.430 -3.301 22.895 1.00 0.00 C ATOM 502 CG ASN A 573 -12.772 -3.741 22.344 1.00 0.00 C ATOM 503 OD1 ASN A 573 -13.646 -4.189 23.086 1.00 0.00 O ATOM 504 ND2 ASN A 573 -12.943 -3.615 21.033 1.00 0.00 N ATOM 0 H ASN A 573 -8.991 -3.150 23.452 1.00 0.00 H new ATOM 0 HA ASN A 573 -11.145 -4.878 24.326 1.00 0.00 H new ATOM 0 HB2 ASN A 573 -11.587 -2.558 23.677 1.00 0.00 H new ATOM 0 HB3 ASN A 573 -10.857 -2.816 22.105 1.00 0.00 H new ATOM 0 HD21 ASN A 573 -13.825 -3.895 20.605 1.00 0.00 H new ATOM 0 HD22 ASN A 573 -12.192 -3.239 20.455 1.00 0.00 H new ATOM 511 N GLY A 574 -9.265 -5.782 21.937 1.00 0.00 N ATOM 512 CA GLY A 574 -9.028 -6.805 20.936 1.00 0.00 C ATOM 513 C GLY A 574 -9.047 -6.252 19.524 1.00 0.00 C ATOM 514 O GLY A 574 -9.032 -7.010 18.554 1.00 0.00 O ATOM 0 H GLY A 574 -8.435 -5.266 22.228 1.00 0.00 H new ATOM 0 HA2 GLY A 574 -8.064 -7.277 21.125 1.00 0.00 H new ATOM 0 HA3 GLY A 574 -9.787 -7.582 21.029 1.00 0.00 H new ATOM 518 N TYR A 575 -9.086 -4.928 19.408 1.00 0.00 N ATOM 519 CA TYR A 575 -9.112 -4.276 18.104 1.00 0.00 C ATOM 520 C TYR A 575 -7.912 -3.356 17.909 1.00 0.00 C ATOM 521 O TYR A 575 -6.961 -3.384 18.691 1.00 0.00 O ATOM 522 CB TYR A 575 -10.405 -3.488 17.942 1.00 0.00 C ATOM 523 CG TYR A 575 -11.472 -4.269 17.228 1.00 0.00 C ATOM 524 CD1 TYR A 575 -11.765 -5.567 17.611 1.00 0.00 C ATOM 525 CD2 TYR A 575 -12.181 -3.714 16.177 1.00 0.00 C ATOM 526 CE1 TYR A 575 -12.742 -6.299 16.962 1.00 0.00 C ATOM 527 CE2 TYR A 575 -13.162 -4.434 15.520 1.00 0.00 C ATOM 528 CZ TYR A 575 -13.439 -5.727 15.918 1.00 0.00 C ATOM 529 OH TYR A 575 -14.413 -6.448 15.268 1.00 0.00 O ATOM 0 H TYR A 575 -9.100 -4.286 20.201 1.00 0.00 H new ATOM 0 HA TYR A 575 -9.061 -5.054 17.342 1.00 0.00 H new ATOM 0 HB2 TYR A 575 -10.772 -3.193 18.925 1.00 0.00 H new ATOM 0 HB3 TYR A 575 -10.200 -2.571 17.390 1.00 0.00 H new ATOM 0 HD1 TYR A 575 -11.222 -6.015 18.430 1.00 0.00 H new ATOM 0 HD2 TYR A 575 -11.965 -2.703 15.865 1.00 0.00 H new ATOM 0 HE1 TYR A 575 -12.958 -7.311 17.270 1.00 0.00 H new ATOM 0 HE2 TYR A 575 -13.708 -3.988 14.701 1.00 0.00 H new ATOM 0 HH TYR A 575 -14.808 -5.899 14.559 1.00 0.00 H new ATOM 539 N SER A 576 -7.962 -2.541 16.856 1.00 0.00 N ATOM 540 CA SER A 576 -6.873 -1.614 16.558 1.00 0.00 C ATOM 541 C SER A 576 -7.349 -0.461 15.676 1.00 0.00 C ATOM 542 O SER A 576 -8.499 -0.431 15.239 1.00 0.00 O ATOM 543 CB SER A 576 -5.722 -2.353 15.867 1.00 0.00 C ATOM 544 OG SER A 576 -4.744 -2.765 16.805 1.00 0.00 O ATOM 0 H SER A 576 -8.741 -2.504 16.199 1.00 0.00 H new ATOM 0 HA SER A 576 -6.522 -1.199 17.503 1.00 0.00 H new ATOM 0 HB2 SER A 576 -6.110 -3.222 15.337 1.00 0.00 H new ATOM 0 HB3 SER A 576 -5.264 -1.703 15.121 1.00 0.00 H new ATOM 0 HG SER A 576 -4.296 -1.977 17.178 1.00 0.00 H new ATOM 550 N ASP A 577 -6.444 0.476 15.409 1.00 0.00 N ATOM 551 CA ASP A 577 -6.744 1.631 14.567 1.00 0.00 C ATOM 552 C ASP A 577 -5.776 1.659 13.394 1.00 0.00 C ATOM 553 O ASP A 577 -5.030 2.619 13.202 1.00 0.00 O ATOM 554 CB ASP A 577 -6.630 2.925 15.379 1.00 0.00 C ATOM 555 CG ASP A 577 -7.605 2.966 16.539 1.00 0.00 C ATOM 556 OD1 ASP A 577 -8.008 1.883 17.014 1.00 0.00 O ATOM 557 OD2 ASP A 577 -7.965 4.080 16.972 1.00 0.00 O ATOM 0 H ASP A 577 -5.489 0.458 15.767 1.00 0.00 H new ATOM 0 HA ASP A 577 -7.765 1.550 14.193 1.00 0.00 H new ATOM 0 HB2 ASP A 577 -5.613 3.024 15.759 1.00 0.00 H new ATOM 0 HB3 ASP A 577 -6.811 3.778 14.725 1.00 0.00 H new ATOM 562 N PRO A 578 -5.757 0.570 12.619 1.00 0.00 N ATOM 563 CA PRO A 578 -4.850 0.407 11.478 1.00 0.00 C ATOM 564 C PRO A 578 -5.107 1.342 10.302 1.00 0.00 C ATOM 565 O PRO A 578 -6.246 1.602 9.916 1.00 0.00 O ATOM 566 CB PRO A 578 -5.079 -1.041 11.043 1.00 0.00 C ATOM 567 CG PRO A 578 -6.434 -1.389 11.553 1.00 0.00 C ATOM 568 CD PRO A 578 -6.601 -0.618 12.829 1.00 0.00 C ATOM 0 HA PRO A 578 -3.831 0.649 11.780 1.00 0.00 H new ATOM 0 HB2 PRO A 578 -5.028 -1.140 9.959 1.00 0.00 H new ATOM 0 HB3 PRO A 578 -4.319 -1.703 11.459 1.00 0.00 H new ATOM 0 HG2 PRO A 578 -7.205 -1.121 10.830 1.00 0.00 H new ATOM 0 HG3 PRO A 578 -6.522 -2.461 11.730 1.00 0.00 H new ATOM 0 HD2 PRO A 578 -7.642 -0.346 13.002 1.00 0.00 H new ATOM 0 HD3 PRO A 578 -6.275 -1.196 13.694 1.00 0.00 H new ATOM 576 N PHE A 579 -4.003 1.790 9.713 1.00 0.00 N ATOM 577 CA PHE A 579 -4.010 2.648 8.537 1.00 0.00 C ATOM 578 C PHE A 579 -2.889 2.178 7.619 1.00 0.00 C ATOM 579 O PHE A 579 -2.008 1.442 8.062 1.00 0.00 O ATOM 580 CB PHE A 579 -3.823 4.122 8.910 1.00 0.00 C ATOM 581 CG PHE A 579 -2.545 4.419 9.643 1.00 0.00 C ATOM 582 CD1 PHE A 579 -2.373 4.011 10.956 1.00 0.00 C ATOM 583 CD2 PHE A 579 -1.521 5.119 9.023 1.00 0.00 C ATOM 584 CE1 PHE A 579 -1.203 4.293 11.636 1.00 0.00 C ATOM 585 CE2 PHE A 579 -0.352 5.406 9.698 1.00 0.00 C ATOM 586 CZ PHE A 579 -0.192 4.992 11.006 1.00 0.00 C ATOM 0 H PHE A 579 -3.066 1.563 10.045 1.00 0.00 H new ATOM 0 HA PHE A 579 -4.975 2.576 8.035 1.00 0.00 H new ATOM 0 HB2 PHE A 579 -3.853 4.721 8.000 1.00 0.00 H new ATOM 0 HB3 PHE A 579 -4.664 4.437 9.528 1.00 0.00 H new ATOM 0 HD1 PHE A 579 -3.162 3.467 11.454 1.00 0.00 H new ATOM 0 HD2 PHE A 579 -1.640 5.443 8.000 1.00 0.00 H new ATOM 0 HE1 PHE A 579 -1.080 3.967 12.658 1.00 0.00 H new ATOM 0 HE2 PHE A 579 0.437 5.954 9.204 1.00 0.00 H new ATOM 0 HZ PHE A 579 0.723 5.215 11.535 1.00 0.00 H new ATOM 596 N VAL A 580 -2.909 2.560 6.349 1.00 0.00 N ATOM 597 CA VAL A 580 -1.865 2.104 5.440 1.00 0.00 C ATOM 598 C VAL A 580 -0.988 3.241 4.937 1.00 0.00 C ATOM 599 O VAL A 580 -1.474 4.313 4.575 1.00 0.00 O ATOM 600 CB VAL A 580 -2.447 1.351 4.232 1.00 0.00 C ATOM 601 CG1 VAL A 580 -1.333 0.721 3.413 1.00 0.00 C ATOM 602 CG2 VAL A 580 -3.437 0.294 4.689 1.00 0.00 C ATOM 0 H VAL A 580 -3.615 3.167 5.933 1.00 0.00 H new ATOM 0 HA VAL A 580 -1.247 1.424 6.027 1.00 0.00 H new ATOM 0 HB VAL A 580 -2.976 2.066 3.602 1.00 0.00 H new ATOM 0 HG11 VAL A 580 -1.762 0.192 2.562 1.00 0.00 H new ATOM 0 HG12 VAL A 580 -0.660 1.500 3.055 1.00 0.00 H new ATOM 0 HG13 VAL A 580 -0.777 0.019 4.034 1.00 0.00 H new ATOM 0 HG21 VAL A 580 -3.838 -0.228 3.821 1.00 0.00 H new ATOM 0 HG22 VAL A 580 -2.933 -0.420 5.341 1.00 0.00 H new ATOM 0 HG23 VAL A 580 -4.252 0.770 5.234 1.00 0.00 H new ATOM 612 N LYS A 581 0.314 2.978 4.906 1.00 0.00 N ATOM 613 CA LYS A 581 1.292 3.947 4.437 1.00 0.00 C ATOM 614 C LYS A 581 1.996 3.410 3.198 1.00 0.00 C ATOM 615 O LYS A 581 2.429 2.258 3.170 1.00 0.00 O ATOM 616 CB LYS A 581 2.316 4.244 5.533 1.00 0.00 C ATOM 617 CG LYS A 581 1.704 4.372 6.917 1.00 0.00 C ATOM 618 CD LYS A 581 2.456 5.386 7.761 1.00 0.00 C ATOM 619 CE LYS A 581 2.533 4.963 9.219 1.00 0.00 C ATOM 620 NZ LYS A 581 3.900 4.509 9.593 1.00 0.00 N ATOM 0 H LYS A 581 0.718 2.090 5.204 1.00 0.00 H new ATOM 0 HA LYS A 581 0.776 4.873 4.184 1.00 0.00 H new ATOM 0 HB2 LYS A 581 3.062 3.450 5.547 1.00 0.00 H new ATOM 0 HB3 LYS A 581 2.839 5.169 5.289 1.00 0.00 H new ATOM 0 HG2 LYS A 581 0.660 4.672 6.829 1.00 0.00 H new ATOM 0 HG3 LYS A 581 1.716 3.402 7.414 1.00 0.00 H new ATOM 0 HD2 LYS A 581 3.464 5.512 7.366 1.00 0.00 H new ATOM 0 HD3 LYS A 581 1.963 6.355 7.690 1.00 0.00 H new ATOM 0 HE2 LYS A 581 2.241 5.798 9.855 1.00 0.00 H new ATOM 0 HE3 LYS A 581 1.820 4.159 9.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 3.896 3.479 9.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 4.566 4.749 8.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 4.194 4.981 10.472 1.00 0.00 H new ATOM 634 N LEU A 582 2.097 4.240 2.170 1.00 0.00 N ATOM 635 CA LEU A 582 2.737 3.827 0.929 1.00 0.00 C ATOM 636 C LEU A 582 3.939 4.701 0.606 1.00 0.00 C ATOM 637 O LEU A 582 3.879 5.926 0.706 1.00 0.00 O ATOM 638 CB LEU A 582 1.731 3.878 -0.217 1.00 0.00 C ATOM 639 CG LEU A 582 0.278 3.658 0.201 1.00 0.00 C ATOM 640 CD1 LEU A 582 -0.515 4.947 0.069 1.00 0.00 C ATOM 641 CD2 LEU A 582 -0.349 2.549 -0.627 1.00 0.00 C ATOM 0 H LEU A 582 1.746 5.198 2.170 1.00 0.00 H new ATOM 0 HA LEU A 582 3.091 2.804 1.057 1.00 0.00 H new ATOM 0 HB2 LEU A 582 1.811 4.847 -0.710 1.00 0.00 H new ATOM 0 HB3 LEU A 582 2.002 3.122 -0.954 1.00 0.00 H new ATOM 0 HG LEU A 582 0.259 3.354 1.248 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -1.548 4.771 0.371 1.00 0.00 H new ATOM 0 HD12 LEU A 582 -0.075 5.712 0.709 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -0.492 5.284 -0.967 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -1.384 2.404 -0.317 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -0.321 2.822 -1.682 1.00 0.00 H new ATOM 0 HD23 LEU A 582 0.207 1.624 -0.477 1.00 0.00 H new ATOM 653 N TRP A 583 5.032 4.058 0.213 1.00 0.00 N ATOM 654 CA TRP A 583 6.253 4.770 -0.133 1.00 0.00 C ATOM 655 C TRP A 583 6.992 4.059 -1.261 1.00 0.00 C ATOM 656 O TRP A 583 7.410 2.909 -1.117 1.00 0.00 O ATOM 657 CB TRP A 583 7.157 4.903 1.095 1.00 0.00 C ATOM 658 CG TRP A 583 8.589 5.175 0.755 1.00 0.00 C ATOM 659 CD1 TRP A 583 9.072 5.718 -0.400 1.00 0.00 C ATOM 660 CD2 TRP A 583 9.727 4.915 1.581 1.00 0.00 C ATOM 661 NE1 TRP A 583 10.439 5.798 -0.349 1.00 0.00 N ATOM 662 CE2 TRP A 583 10.867 5.317 0.861 1.00 0.00 C ATOM 663 CE3 TRP A 583 9.891 4.380 2.861 1.00 0.00 C ATOM 664 CZ2 TRP A 583 12.155 5.199 1.380 1.00 0.00 C ATOM 665 CZ3 TRP A 583 11.167 4.265 3.375 1.00 0.00 C ATOM 666 CH2 TRP A 583 12.285 4.673 2.637 1.00 0.00 C ATOM 0 H TRP A 583 5.096 3.044 0.126 1.00 0.00 H new ATOM 0 HA TRP A 583 5.982 5.768 -0.478 1.00 0.00 H new ATOM 0 HB2 TRP A 583 6.782 5.708 1.727 1.00 0.00 H new ATOM 0 HB3 TRP A 583 7.099 3.985 1.680 1.00 0.00 H new ATOM 0 HD1 TRP A 583 8.465 6.038 -1.234 1.00 0.00 H new ATOM 0 HE1 TRP A 583 11.040 6.157 -1.091 1.00 0.00 H new ATOM 0 HE3 TRP A 583 9.035 4.062 3.438 1.00 0.00 H new ATOM 0 HZ2 TRP A 583 13.019 5.511 0.811 1.00 0.00 H new ATOM 0 HZ3 TRP A 583 11.306 3.853 4.364 1.00 0.00 H new ATOM 0 HH2 TRP A 583 13.270 4.571 3.068 1.00 0.00 H new ATOM 677 N LEU A 584 7.149 4.753 -2.381 1.00 0.00 N ATOM 678 CA LEU A 584 7.837 4.197 -3.538 1.00 0.00 C ATOM 679 C LEU A 584 9.325 4.523 -3.498 1.00 0.00 C ATOM 680 O LEU A 584 9.729 5.668 -3.704 1.00 0.00 O ATOM 681 CB LEU A 584 7.211 4.730 -4.830 1.00 0.00 C ATOM 682 CG LEU A 584 7.701 4.070 -6.118 1.00 0.00 C ATOM 683 CD1 LEU A 584 7.138 2.663 -6.240 1.00 0.00 C ATOM 684 CD2 LEU A 584 7.307 4.908 -7.326 1.00 0.00 C ATOM 0 H LEU A 584 6.808 5.705 -2.512 1.00 0.00 H new ATOM 0 HA LEU A 584 7.727 3.113 -3.512 1.00 0.00 H new ATOM 0 HB2 LEU A 584 6.130 4.607 -4.767 1.00 0.00 H new ATOM 0 HB3 LEU A 584 7.406 5.800 -4.893 1.00 0.00 H new ATOM 0 HG LEU A 584 8.788 4.005 -6.083 1.00 0.00 H new ATOM 0 HD11 LEU A 584 7.496 2.206 -7.163 1.00 0.00 H new ATOM 0 HD12 LEU A 584 7.464 2.065 -5.389 1.00 0.00 H new ATOM 0 HD13 LEU A 584 6.049 2.707 -6.256 1.00 0.00 H new ATOM 0 HD21 LEU A 584 7.663 4.425 -8.236 1.00 0.00 H new ATOM 0 HD22 LEU A 584 6.222 5.001 -7.366 1.00 0.00 H new ATOM 0 HD23 LEU A 584 7.754 5.899 -7.243 1.00 0.00 H new ATOM 696 N LYS A 585 10.135 3.505 -3.226 1.00 0.00 N ATOM 697 CA LYS A 585 11.580 3.672 -3.154 1.00 0.00 C ATOM 698 C LYS A 585 12.201 3.647 -4.546 1.00 0.00 C ATOM 699 O LYS A 585 11.620 3.103 -5.486 1.00 0.00 O ATOM 700 CB LYS A 585 12.194 2.569 -2.288 1.00 0.00 C ATOM 701 CG LYS A 585 11.331 2.181 -1.098 1.00 0.00 C ATOM 702 CD LYS A 585 11.943 1.029 -0.319 1.00 0.00 C ATOM 703 CE LYS A 585 13.364 1.345 0.121 1.00 0.00 C ATOM 704 NZ LYS A 585 14.375 0.639 -0.713 1.00 0.00 N ATOM 0 H LYS A 585 9.813 2.553 -3.051 1.00 0.00 H new ATOM 0 HA LYS A 585 11.789 4.642 -2.702 1.00 0.00 H new ATOM 0 HB2 LYS A 585 12.366 1.687 -2.905 1.00 0.00 H new ATOM 0 HB3 LYS A 585 13.168 2.901 -1.928 1.00 0.00 H new ATOM 0 HG2 LYS A 585 11.208 3.042 -0.440 1.00 0.00 H new ATOM 0 HG3 LYS A 585 10.337 1.900 -1.445 1.00 0.00 H new ATOM 0 HD2 LYS A 585 11.330 0.814 0.556 1.00 0.00 H new ATOM 0 HD3 LYS A 585 11.944 0.131 -0.936 1.00 0.00 H new ATOM 0 HE2 LYS A 585 13.532 2.420 0.061 1.00 0.00 H new ATOM 0 HE3 LYS A 585 13.492 1.060 1.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 585 15.330 0.881 -0.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 585 14.232 -0.388 -0.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 585 14.270 0.930 -1.706 1.00 0.00 H new ATOM 812 N ALA A 592 7.546 10.594 -1.037 1.00 0.00 N ATOM 813 CA ALA A 592 7.094 9.291 -1.505 1.00 0.00 C ATOM 814 C ALA A 592 6.239 8.594 -0.452 1.00 0.00 C ATOM 815 O ALA A 592 5.404 7.749 -0.775 1.00 0.00 O ATOM 816 CB ALA A 592 8.287 8.423 -1.878 1.00 0.00 C ATOM 0 HA ALA A 592 6.478 9.444 -2.391 1.00 0.00 H new ATOM 0 HB1 ALA A 592 7.936 7.452 -2.226 1.00 0.00 H new ATOM 0 HB2 ALA A 592 8.856 8.908 -2.671 1.00 0.00 H new ATOM 0 HB3 ALA A 592 8.925 8.286 -1.005 1.00 0.00 H new ATOM 822 N LYS A 593 6.451 8.956 0.809 1.00 0.00 N ATOM 823 CA LYS A 593 5.701 8.368 1.910 1.00 0.00 C ATOM 824 C LYS A 593 4.228 8.758 1.835 1.00 0.00 C ATOM 825 O LYS A 593 3.881 9.804 1.286 1.00 0.00 O ATOM 826 CB LYS A 593 6.296 8.822 3.244 1.00 0.00 C ATOM 827 CG LYS A 593 7.801 8.626 3.336 1.00 0.00 C ATOM 828 CD LYS A 593 8.159 7.200 3.722 1.00 0.00 C ATOM 829 CE LYS A 593 9.619 7.082 4.133 1.00 0.00 C ATOM 830 NZ LYS A 593 10.098 8.304 4.836 1.00 0.00 N ATOM 0 H LYS A 593 7.137 9.655 1.093 1.00 0.00 H new ATOM 0 HA LYS A 593 5.771 7.283 1.834 1.00 0.00 H new ATOM 0 HB2 LYS A 593 6.065 9.876 3.395 1.00 0.00 H new ATOM 0 HB3 LYS A 593 5.816 8.271 4.053 1.00 0.00 H new ATOM 0 HG2 LYS A 593 8.259 8.870 2.377 1.00 0.00 H new ATOM 0 HG3 LYS A 593 8.214 9.317 4.071 1.00 0.00 H new ATOM 0 HD2 LYS A 593 7.521 6.874 4.544 1.00 0.00 H new ATOM 0 HD3 LYS A 593 7.962 6.534 2.882 1.00 0.00 H new ATOM 0 HE2 LYS A 593 9.744 6.216 4.783 1.00 0.00 H new ATOM 0 HE3 LYS A 593 10.232 6.908 3.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 593 11.005 8.102 5.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 593 10.227 9.072 4.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 593 9.397 8.592 5.548 1.00 0.00 H new ATOM 844 N HIS A 594 3.363 7.912 2.388 1.00 0.00 N ATOM 845 CA HIS A 594 1.927 8.177 2.379 1.00 0.00 C ATOM 846 C HIS A 594 1.227 7.495 3.547 1.00 0.00 C ATOM 847 O HIS A 594 1.815 6.672 4.245 1.00 0.00 O ATOM 848 CB HIS A 594 1.303 7.703 1.065 1.00 0.00 C ATOM 849 CG HIS A 594 1.302 8.744 -0.009 1.00 0.00 C ATOM 850 ND1 HIS A 594 1.127 10.089 0.244 1.00 0.00 N ATOM 851 CD2 HIS A 594 1.462 8.633 -1.349 1.00 0.00 C ATOM 852 CE1 HIS A 594 1.179 10.758 -0.894 1.00 0.00 C ATOM 853 NE2 HIS A 594 1.382 9.899 -1.874 1.00 0.00 N ATOM 0 H HIS A 594 3.630 7.041 2.846 1.00 0.00 H new ATOM 0 HA HIS A 594 1.794 9.254 2.477 1.00 0.00 H new ATOM 0 HB2 HIS A 594 1.846 6.827 0.710 1.00 0.00 H new ATOM 0 HB3 HIS A 594 0.277 7.387 1.253 1.00 0.00 H new ATOM 0 HD2 HIS A 594 1.623 7.719 -1.902 1.00 0.00 H new ATOM 0 HE1 HIS A 594 1.073 11.827 -1.003 1.00 0.00 H new ATOM 0 HE2 HIS A 594 1.466 10.137 -2.862 1.00 0.00 H new ATOM 862 N LYS A 595 -0.041 7.843 3.745 1.00 0.00 N ATOM 863 CA LYS A 595 -0.841 7.271 4.821 1.00 0.00 C ATOM 864 C LYS A 595 -2.331 7.458 4.530 1.00 0.00 C ATOM 865 O LYS A 595 -2.783 8.572 4.265 1.00 0.00 O ATOM 866 CB LYS A 595 -0.451 7.911 6.166 1.00 0.00 C ATOM 867 CG LYS A 595 -1.612 8.504 6.955 1.00 0.00 C ATOM 868 CD LYS A 595 -1.936 9.915 6.490 1.00 0.00 C ATOM 869 CE LYS A 595 -3.390 10.270 6.757 1.00 0.00 C ATOM 870 NZ LYS A 595 -3.526 11.260 7.861 1.00 0.00 N ATOM 0 H LYS A 595 -0.538 8.523 3.170 1.00 0.00 H new ATOM 0 HA LYS A 595 -0.643 6.201 4.884 1.00 0.00 H new ATOM 0 HB2 LYS A 595 0.040 7.157 6.782 1.00 0.00 H new ATOM 0 HB3 LYS A 595 0.281 8.697 5.979 1.00 0.00 H new ATOM 0 HG2 LYS A 595 -2.492 7.871 6.841 1.00 0.00 H new ATOM 0 HG3 LYS A 595 -1.364 8.517 8.016 1.00 0.00 H new ATOM 0 HD2 LYS A 595 -1.287 10.626 7.002 1.00 0.00 H new ATOM 0 HD3 LYS A 595 -1.729 10.004 5.424 1.00 0.00 H new ATOM 0 HE2 LYS A 595 -3.837 10.675 5.849 1.00 0.00 H new ATOM 0 HE3 LYS A 595 -3.944 9.366 7.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 595 -4.532 11.476 8.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 595 -3.122 10.864 8.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 595 -3.019 12.132 7.609 1.00 0.00 H new ATOM 884 N THR A 596 -3.089 6.366 4.578 1.00 0.00 N ATOM 885 CA THR A 596 -4.523 6.427 4.317 1.00 0.00 C ATOM 886 C THR A 596 -5.293 6.756 5.587 1.00 0.00 C ATOM 887 O THR A 596 -4.763 6.651 6.693 1.00 0.00 O ATOM 888 CB THR A 596 -5.031 5.101 3.750 1.00 0.00 C ATOM 889 OG1 THR A 596 -5.389 4.214 4.797 1.00 0.00 O ATOM 890 CG2 THR A 596 -4.025 4.390 2.876 1.00 0.00 C ATOM 0 H THR A 596 -2.736 5.434 4.794 1.00 0.00 H new ATOM 0 HA THR A 596 -4.688 7.217 3.584 1.00 0.00 H new ATOM 0 HB THR A 596 -5.893 5.366 3.137 1.00 0.00 H new ATOM 0 HG1 THR A 596 -6.149 3.663 4.514 1.00 0.00 H new ATOM 0 HG21 THR A 596 -4.455 3.458 2.510 1.00 0.00 H new ATOM 0 HG22 THR A 596 -3.764 5.026 2.030 1.00 0.00 H new ATOM 0 HG23 THR A 596 -3.128 4.172 3.456 1.00 0.00 H new ATOM 898 N GLN A 597 -6.551 7.144 5.422 1.00 0.00 N ATOM 899 CA GLN A 597 -7.396 7.474 6.560 1.00 0.00 C ATOM 900 C GLN A 597 -7.232 6.427 7.655 1.00 0.00 C ATOM 901 O GLN A 597 -6.999 5.251 7.371 1.00 0.00 O ATOM 902 CB GLN A 597 -8.862 7.567 6.133 1.00 0.00 C ATOM 903 CG GLN A 597 -9.576 6.226 6.114 1.00 0.00 C ATOM 904 CD GLN A 597 -10.749 6.206 5.153 1.00 0.00 C ATOM 905 OE1 GLN A 597 -10.884 5.293 4.338 1.00 0.00 O ATOM 906 NE2 GLN A 597 -11.605 7.217 5.244 1.00 0.00 N ATOM 0 H GLN A 597 -7.007 7.237 4.514 1.00 0.00 H new ATOM 0 HA GLN A 597 -7.089 8.444 6.950 1.00 0.00 H new ATOM 0 HB2 GLN A 597 -9.387 8.239 6.811 1.00 0.00 H new ATOM 0 HB3 GLN A 597 -8.915 8.011 5.139 1.00 0.00 H new ATOM 0 HG2 GLN A 597 -8.868 5.445 5.835 1.00 0.00 H new ATOM 0 HG3 GLN A 597 -9.929 5.992 7.118 1.00 0.00 H new ATOM 0 HE21 GLN A 597 -11.454 7.952 5.935 1.00 0.00 H new ATOM 0 HE22 GLN A 597 -12.413 7.258 4.623 1.00 0.00 H new ATOM 915 N ILE A 598 -7.345 6.856 8.904 1.00 0.00 N ATOM 916 CA ILE A 598 -7.197 5.950 10.035 1.00 0.00 C ATOM 917 C ILE A 598 -8.473 5.154 10.286 1.00 0.00 C ATOM 918 O ILE A 598 -9.569 5.714 10.337 1.00 0.00 O ATOM 919 CB ILE A 598 -6.831 6.713 11.324 1.00 0.00 C ATOM 920 CG1 ILE A 598 -5.826 7.831 11.026 1.00 0.00 C ATOM 921 CG2 ILE A 598 -6.275 5.756 12.365 1.00 0.00 C ATOM 922 CD1 ILE A 598 -4.385 7.372 11.028 1.00 0.00 C ATOM 0 H ILE A 598 -7.538 7.824 9.160 1.00 0.00 H new ATOM 0 HA ILE A 598 -6.389 5.265 9.777 1.00 0.00 H new ATOM 0 HB ILE A 598 -7.737 7.169 11.723 1.00 0.00 H new ATOM 0 HG12 ILE A 598 -6.058 8.266 10.054 1.00 0.00 H new ATOM 0 HG13 ILE A 598 -5.947 8.622 11.766 1.00 0.00 H new ATOM 0 HG21 ILE A 598 -6.021 6.309 13.269 1.00 0.00 H new ATOM 0 HG22 ILE A 598 -7.024 5.000 12.601 1.00 0.00 H new ATOM 0 HG23 ILE A 598 -5.381 5.272 11.973 1.00 0.00 H new ATOM 0 HD11 ILE A 598 -3.733 8.218 10.810 1.00 0.00 H new ATOM 0 HD12 ILE A 598 -4.134 6.964 12.007 1.00 0.00 H new ATOM 0 HD13 ILE A 598 -4.247 6.602 10.269 1.00 0.00 H new ATOM 934 N LYS A 599 -8.318 3.845 10.457 1.00 0.00 N ATOM 935 CA LYS A 599 -9.451 2.965 10.718 1.00 0.00 C ATOM 936 C LYS A 599 -9.539 2.656 12.210 1.00 0.00 C ATOM 937 O LYS A 599 -9.168 1.571 12.655 1.00 0.00 O ATOM 938 CB LYS A 599 -9.312 1.669 9.916 1.00 0.00 C ATOM 939 CG LYS A 599 -9.287 1.887 8.412 1.00 0.00 C ATOM 940 CD LYS A 599 -10.633 2.371 7.898 1.00 0.00 C ATOM 941 CE LYS A 599 -10.664 3.884 7.758 1.00 0.00 C ATOM 942 NZ LYS A 599 -11.604 4.513 8.726 1.00 0.00 N ATOM 0 H LYS A 599 -7.416 3.370 10.419 1.00 0.00 H new ATOM 0 HA LYS A 599 -10.366 3.469 10.408 1.00 0.00 H new ATOM 0 HB2 LYS A 599 -8.396 1.161 10.217 1.00 0.00 H new ATOM 0 HB3 LYS A 599 -10.140 1.006 10.165 1.00 0.00 H new ATOM 0 HG2 LYS A 599 -8.517 2.617 8.162 1.00 0.00 H new ATOM 0 HG3 LYS A 599 -9.019 0.956 7.913 1.00 0.00 H new ATOM 0 HD2 LYS A 599 -10.842 1.911 6.932 1.00 0.00 H new ATOM 0 HD3 LYS A 599 -11.421 2.051 8.580 1.00 0.00 H new ATOM 0 HE2 LYS A 599 -9.662 4.283 7.914 1.00 0.00 H new ATOM 0 HE3 LYS A 599 -10.958 4.148 6.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 -12.297 5.092 8.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 -12.101 3.771 9.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 -11.071 5.116 9.385 1.00 0.00 H new ATOM 956 N LYS A 600 -10.015 3.632 12.974 1.00 0.00 N ATOM 957 CA LYS A 600 -10.137 3.494 14.423 1.00 0.00 C ATOM 958 C LYS A 600 -10.961 2.269 14.816 1.00 0.00 C ATOM 959 O LYS A 600 -11.919 1.899 14.136 1.00 0.00 O ATOM 960 CB LYS A 600 -10.765 4.754 15.022 1.00 0.00 C ATOM 961 CG LYS A 600 -10.074 6.042 14.600 1.00 0.00 C ATOM 962 CD LYS A 600 -8.796 6.274 15.390 1.00 0.00 C ATOM 963 CE LYS A 600 -8.479 7.756 15.515 1.00 0.00 C ATOM 964 NZ LYS A 600 -9.554 8.496 16.231 1.00 0.00 N ATOM 0 H LYS A 600 -10.325 4.534 12.612 1.00 0.00 H new ATOM 0 HA LYS A 600 -9.131 3.359 14.821 1.00 0.00 H new ATOM 0 HB2 LYS A 600 -11.814 4.802 14.728 1.00 0.00 H new ATOM 0 HB3 LYS A 600 -10.742 4.679 16.109 1.00 0.00 H new ATOM 0 HG2 LYS A 600 -9.842 6.000 13.536 1.00 0.00 H new ATOM 0 HG3 LYS A 600 -10.751 6.884 14.746 1.00 0.00 H new ATOM 0 HD2 LYS A 600 -8.897 5.837 16.384 1.00 0.00 H new ATOM 0 HD3 LYS A 600 -7.967 5.764 14.900 1.00 0.00 H new ATOM 0 HE2 LYS A 600 -7.536 7.882 16.047 1.00 0.00 H new ATOM 0 HE3 LYS A 600 -8.344 8.183 14.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 600 -9.149 9.335 16.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 600 -10.283 8.793 15.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 600 -9.982 7.877 16.949 1.00 0.00 H new ATOM 978 N LYS A 601 -10.577 1.656 15.934 1.00 0.00 N ATOM 979 CA LYS A 601 -11.264 0.478 16.459 1.00 0.00 C ATOM 980 C LYS A 601 -11.789 -0.420 15.344 1.00 0.00 C ATOM 981 O LYS A 601 -12.989 -0.446 15.068 1.00 0.00 O ATOM 982 CB LYS A 601 -12.419 0.904 17.369 1.00 0.00 C ATOM 983 CG LYS A 601 -12.405 0.222 18.727 1.00 0.00 C ATOM 984 CD LYS A 601 -11.202 0.649 19.554 1.00 0.00 C ATOM 985 CE LYS A 601 -11.626 1.401 20.805 1.00 0.00 C ATOM 986 NZ LYS A 601 -10.523 1.489 21.802 1.00 0.00 N ATOM 0 H LYS A 601 -9.784 1.960 16.499 1.00 0.00 H new ATOM 0 HA LYS A 601 -10.536 -0.096 17.033 1.00 0.00 H new ATOM 0 HB2 LYS A 601 -12.378 1.984 17.513 1.00 0.00 H new ATOM 0 HB3 LYS A 601 -13.363 0.684 16.871 1.00 0.00 H new ATOM 0 HG2 LYS A 601 -13.322 0.463 19.265 1.00 0.00 H new ATOM 0 HG3 LYS A 601 -12.389 -0.859 18.592 1.00 0.00 H new ATOM 0 HD2 LYS A 601 -10.622 -0.230 19.835 1.00 0.00 H new ATOM 0 HD3 LYS A 601 -10.550 1.281 18.951 1.00 0.00 H new ATOM 0 HE2 LYS A 601 -11.950 2.406 20.532 1.00 0.00 H new ATOM 0 HE3 LYS A 601 -12.483 0.901 21.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 601 -10.739 0.876 22.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 601 -9.632 1.180 21.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 601 -10.426 2.472 22.126 1.00 0.00 H new ATOM 1000 N THR A 602 -10.887 -1.163 14.712 1.00 0.00 N ATOM 1001 CA THR A 602 -11.264 -2.068 13.636 1.00 0.00 C ATOM 1002 C THR A 602 -10.040 -2.779 13.069 1.00 0.00 C ATOM 1003 O THR A 602 -8.961 -2.194 12.967 1.00 0.00 O ATOM 1004 CB THR A 602 -11.971 -1.297 12.529 1.00 0.00 C ATOM 1005 OG1 THR A 602 -12.742 -2.166 11.719 1.00 0.00 O ATOM 1006 CG2 THR A 602 -11.005 -0.567 11.634 1.00 0.00 C ATOM 0 H THR A 602 -9.890 -1.155 14.927 1.00 0.00 H new ATOM 0 HA THR A 602 -11.942 -2.818 14.044 1.00 0.00 H new ATOM 0 HB THR A 602 -12.612 -0.572 13.031 1.00 0.00 H new ATOM 0 HG1 THR A 602 -13.188 -1.649 11.016 1.00 0.00 H new ATOM 0 HG21 THR A 602 -11.558 -0.033 10.861 1.00 0.00 H new ATOM 0 HG22 THR A 602 -10.428 0.144 12.225 1.00 0.00 H new ATOM 0 HG23 THR A 602 -10.329 -1.283 11.167 1.00 0.00 H new ATOM 1014 N LEU A 603 -10.218 -4.041 12.702 1.00 0.00 N ATOM 1015 CA LEU A 603 -9.132 -4.839 12.143 1.00 0.00 C ATOM 1016 C LEU A 603 -9.453 -5.275 10.715 1.00 0.00 C ATOM 1017 O LEU A 603 -8.585 -5.768 9.994 1.00 0.00 O ATOM 1018 CB LEU A 603 -8.884 -6.067 13.017 1.00 0.00 C ATOM 1019 CG LEU A 603 -8.807 -5.784 14.520 1.00 0.00 C ATOM 1020 CD1 LEU A 603 -8.214 -6.973 15.261 1.00 0.00 C ATOM 1021 CD2 LEU A 603 -7.989 -4.529 14.784 1.00 0.00 C ATOM 0 H LEU A 603 -11.106 -4.536 12.781 1.00 0.00 H new ATOM 0 HA LEU A 603 -8.233 -4.223 12.120 1.00 0.00 H new ATOM 0 HB2 LEU A 603 -9.681 -6.789 12.838 1.00 0.00 H new ATOM 0 HB3 LEU A 603 -7.952 -6.537 12.702 1.00 0.00 H new ATOM 0 HG LEU A 603 -9.819 -5.621 14.890 1.00 0.00 H new ATOM 0 HD11 LEU A 603 -8.168 -6.751 16.327 1.00 0.00 H new ATOM 0 HD12 LEU A 603 -8.839 -7.851 15.100 1.00 0.00 H new ATOM 0 HD13 LEU A 603 -7.209 -7.170 14.888 1.00 0.00 H new ATOM 0 HD21 LEU A 603 -7.945 -4.343 15.857 1.00 0.00 H new ATOM 0 HD22 LEU A 603 -6.979 -4.665 14.397 1.00 0.00 H new ATOM 0 HD23 LEU A 603 -8.456 -3.679 14.287 1.00 0.00 H new ATOM 1033 N ASN A 604 -10.705 -5.087 10.317 1.00 0.00 N ATOM 1034 CA ASN A 604 -11.153 -5.457 8.978 1.00 0.00 C ATOM 1035 C ASN A 604 -11.927 -4.306 8.336 1.00 0.00 C ATOM 1036 O ASN A 604 -13.017 -4.498 7.801 1.00 0.00 O ATOM 1037 CB ASN A 604 -12.034 -6.706 9.039 1.00 0.00 C ATOM 1038 CG ASN A 604 -11.459 -7.777 9.944 1.00 0.00 C ATOM 1039 OD1 ASN A 604 -10.466 -8.424 9.609 1.00 0.00 O ATOM 1040 ND2 ASN A 604 -12.083 -7.971 11.101 1.00 0.00 N ATOM 0 H ASN A 604 -11.432 -4.679 10.905 1.00 0.00 H new ATOM 0 HA ASN A 604 -10.275 -5.672 8.370 1.00 0.00 H new ATOM 0 HB2 ASN A 604 -13.027 -6.430 9.394 1.00 0.00 H new ATOM 0 HB3 ASN A 604 -12.156 -7.111 8.034 1.00 0.00 H new ATOM 0 HD21 ASN A 604 -11.742 -8.679 11.752 1.00 0.00 H new ATOM 0 HD22 ASN A 604 -12.903 -7.412 11.338 1.00 0.00 H new ATOM 1047 N PRO A 605 -11.368 -3.087 8.403 1.00 0.00 N ATOM 1048 CA PRO A 605 -12.002 -1.882 7.849 1.00 0.00 C ATOM 1049 C PRO A 605 -11.907 -1.791 6.331 1.00 0.00 C ATOM 1050 O PRO A 605 -11.492 -2.735 5.661 1.00 0.00 O ATOM 1051 CB PRO A 605 -11.194 -0.752 8.480 1.00 0.00 C ATOM 1052 CG PRO A 605 -9.843 -1.341 8.690 1.00 0.00 C ATOM 1053 CD PRO A 605 -10.077 -2.785 9.045 1.00 0.00 C ATOM 0 HA PRO A 605 -13.070 -1.862 8.064 1.00 0.00 H new ATOM 0 HB2 PRO A 605 -11.151 0.120 7.827 1.00 0.00 H new ATOM 0 HB3 PRO A 605 -11.636 -0.424 9.421 1.00 0.00 H new ATOM 0 HG2 PRO A 605 -9.234 -1.253 7.790 1.00 0.00 H new ATOM 0 HG3 PRO A 605 -9.310 -0.823 9.488 1.00 0.00 H new ATOM 0 HD2 PRO A 605 -9.280 -3.426 8.668 1.00 0.00 H new ATOM 0 HD3 PRO A 605 -10.120 -2.932 10.124 1.00 0.00 H new ATOM 1061 N GLU A 606 -12.293 -0.630 5.806 1.00 0.00 N ATOM 1062 CA GLU A 606 -12.258 -0.373 4.372 1.00 0.00 C ATOM 1063 C GLU A 606 -11.709 1.025 4.101 1.00 0.00 C ATOM 1064 O GLU A 606 -12.332 2.025 4.458 1.00 0.00 O ATOM 1065 CB GLU A 606 -13.660 -0.507 3.779 1.00 0.00 C ATOM 1066 CG GLU A 606 -13.889 -1.817 3.044 1.00 0.00 C ATOM 1067 CD GLU A 606 -14.269 -1.611 1.591 1.00 0.00 C ATOM 1068 OE1 GLU A 606 -15.141 -0.758 1.320 1.00 0.00 O ATOM 1069 OE2 GLU A 606 -13.695 -2.302 0.723 1.00 0.00 O ATOM 0 H GLU A 606 -12.637 0.154 6.361 1.00 0.00 H new ATOM 0 HA GLU A 606 -11.603 -1.107 3.901 1.00 0.00 H new ATOM 0 HB2 GLU A 606 -14.394 -0.417 4.580 1.00 0.00 H new ATOM 0 HB3 GLU A 606 -13.835 0.321 3.092 1.00 0.00 H new ATOM 0 HG2 GLU A 606 -12.984 -2.422 3.097 1.00 0.00 H new ATOM 0 HG3 GLU A 606 -14.677 -2.378 3.546 1.00 0.00 H new ATOM 1076 N PHE A 607 -10.538 1.090 3.477 1.00 0.00 N ATOM 1077 CA PHE A 607 -9.907 2.367 3.172 1.00 0.00 C ATOM 1078 C PHE A 607 -10.519 3.001 1.928 1.00 0.00 C ATOM 1079 O PHE A 607 -11.026 4.122 1.977 1.00 0.00 O ATOM 1080 CB PHE A 607 -8.402 2.182 2.968 1.00 0.00 C ATOM 1081 CG PHE A 607 -7.700 1.594 4.159 1.00 0.00 C ATOM 1082 CD1 PHE A 607 -7.574 2.318 5.334 1.00 0.00 C ATOM 1083 CD2 PHE A 607 -7.168 0.317 4.101 1.00 0.00 C ATOM 1084 CE1 PHE A 607 -6.927 1.779 6.430 1.00 0.00 C ATOM 1085 CE2 PHE A 607 -6.519 -0.228 5.194 1.00 0.00 C ATOM 1086 CZ PHE A 607 -6.399 0.504 6.361 1.00 0.00 C ATOM 0 H PHE A 607 -10.008 0.274 3.173 1.00 0.00 H new ATOM 0 HA PHE A 607 -10.077 3.032 4.018 1.00 0.00 H new ATOM 0 HB2 PHE A 607 -8.238 1.537 2.105 1.00 0.00 H new ATOM 0 HB3 PHE A 607 -7.954 3.148 2.734 1.00 0.00 H new ATOM 0 HD1 PHE A 607 -7.986 3.315 5.394 1.00 0.00 H new ATOM 0 HD2 PHE A 607 -7.261 -0.260 3.193 1.00 0.00 H new ATOM 0 HE1 PHE A 607 -6.834 2.354 7.340 1.00 0.00 H new ATOM 0 HE2 PHE A 607 -6.106 -1.224 5.136 1.00 0.00 H new ATOM 0 HZ PHE A 607 -5.894 0.080 7.216 1.00 0.00 H new ATOM 1096 N ASN A 608 -10.462 2.283 0.811 1.00 0.00 N ATOM 1097 CA ASN A 608 -11.005 2.786 -0.443 1.00 0.00 C ATOM 1098 C ASN A 608 -10.384 4.136 -0.786 1.00 0.00 C ATOM 1099 O ASN A 608 -11.086 5.082 -1.144 1.00 0.00 O ATOM 1100 CB ASN A 608 -12.526 2.919 -0.349 1.00 0.00 C ATOM 1101 CG ASN A 608 -13.237 2.289 -1.532 1.00 0.00 C ATOM 1102 OD1 ASN A 608 -12.601 1.773 -2.449 1.00 0.00 O ATOM 1103 ND2 ASN A 608 -14.565 2.332 -1.514 1.00 0.00 N ATOM 0 H ASN A 608 -10.046 1.354 0.750 1.00 0.00 H new ATOM 0 HA ASN A 608 -10.762 2.076 -1.234 1.00 0.00 H new ATOM 0 HB2 ASN A 608 -12.873 2.449 0.572 1.00 0.00 H new ATOM 0 HB3 ASN A 608 -12.792 3.974 -0.289 1.00 0.00 H new ATOM 0 HD21 ASN A 608 -15.099 1.926 -2.283 1.00 0.00 H new ATOM 0 HD22 ASN A 608 -15.050 2.771 -0.732 1.00 0.00 H new ATOM 1110 N GLU A 609 -9.062 4.220 -0.664 1.00 0.00 N ATOM 1111 CA GLU A 609 -8.344 5.455 -0.953 1.00 0.00 C ATOM 1112 C GLU A 609 -7.577 5.352 -2.267 1.00 0.00 C ATOM 1113 O GLU A 609 -6.934 4.340 -2.545 1.00 0.00 O ATOM 1114 CB GLU A 609 -7.378 5.780 0.189 1.00 0.00 C ATOM 1115 CG GLU A 609 -7.951 6.747 1.214 1.00 0.00 C ATOM 1116 CD GLU A 609 -8.083 8.157 0.672 1.00 0.00 C ATOM 1117 OE1 GLU A 609 -7.129 8.639 0.027 1.00 0.00 O ATOM 1118 OE2 GLU A 609 -9.143 8.781 0.894 1.00 0.00 O ATOM 0 H GLU A 609 -8.467 3.446 -0.367 1.00 0.00 H new ATOM 0 HA GLU A 609 -9.076 6.257 -1.047 1.00 0.00 H new ATOM 0 HB2 GLU A 609 -7.098 4.854 0.692 1.00 0.00 H new ATOM 0 HB3 GLU A 609 -6.465 6.205 -0.228 1.00 0.00 H new ATOM 0 HG2 GLU A 609 -8.930 6.392 1.536 1.00 0.00 H new ATOM 0 HG3 GLU A 609 -7.310 6.759 2.096 1.00 0.00 H new ATOM 1125 N GLU A 610 -7.648 6.408 -3.070 1.00 0.00 N ATOM 1126 CA GLU A 610 -6.958 6.441 -4.354 1.00 0.00 C ATOM 1127 C GLU A 610 -5.761 7.387 -4.299 1.00 0.00 C ATOM 1128 O GLU A 610 -5.920 8.595 -4.116 1.00 0.00 O ATOM 1129 CB GLU A 610 -7.917 6.872 -5.464 1.00 0.00 C ATOM 1130 CG GLU A 610 -8.337 8.331 -5.371 1.00 0.00 C ATOM 1131 CD GLU A 610 -9.693 8.588 -5.999 1.00 0.00 C ATOM 1132 OE1 GLU A 610 -9.788 8.545 -7.244 1.00 0.00 O ATOM 1133 OE2 GLU A 610 -10.659 8.833 -5.247 1.00 0.00 O ATOM 0 H GLU A 610 -8.177 7.253 -2.854 1.00 0.00 H new ATOM 0 HA GLU A 610 -6.596 5.436 -4.572 1.00 0.00 H new ATOM 0 HB2 GLU A 610 -7.443 6.700 -6.430 1.00 0.00 H new ATOM 0 HB3 GLU A 610 -8.807 6.243 -5.429 1.00 0.00 H new ATOM 0 HG2 GLU A 610 -8.363 8.632 -4.324 1.00 0.00 H new ATOM 0 HG3 GLU A 610 -7.589 8.953 -5.863 1.00 0.00 H new ATOM 1140 N PHE A 611 -4.565 6.829 -4.446 1.00 0.00 N ATOM 1141 CA PHE A 611 -3.339 7.611 -4.399 1.00 0.00 C ATOM 1142 C PHE A 611 -2.821 7.948 -5.792 1.00 0.00 C ATOM 1143 O PHE A 611 -3.374 7.512 -6.801 1.00 0.00 O ATOM 1144 CB PHE A 611 -2.269 6.841 -3.642 1.00 0.00 C ATOM 1145 CG PHE A 611 -2.409 6.946 -2.160 1.00 0.00 C ATOM 1146 CD1 PHE A 611 -3.410 6.262 -1.499 1.00 0.00 C ATOM 1147 CD2 PHE A 611 -1.535 7.725 -1.430 1.00 0.00 C ATOM 1148 CE1 PHE A 611 -3.540 6.353 -0.127 1.00 0.00 C ATOM 1149 CE2 PHE A 611 -1.653 7.823 -0.059 1.00 0.00 C ATOM 1150 CZ PHE A 611 -2.659 7.135 0.597 1.00 0.00 C ATOM 0 H PHE A 611 -4.420 5.831 -4.600 1.00 0.00 H new ATOM 0 HA PHE A 611 -3.568 8.547 -3.889 1.00 0.00 H new ATOM 0 HB2 PHE A 611 -2.312 5.791 -3.931 1.00 0.00 H new ATOM 0 HB3 PHE A 611 -1.287 7.212 -3.935 1.00 0.00 H new ATOM 0 HD1 PHE A 611 -4.099 5.649 -2.061 1.00 0.00 H new ATOM 0 HD2 PHE A 611 -0.749 8.264 -1.938 1.00 0.00 H new ATOM 0 HE1 PHE A 611 -4.328 5.815 0.379 1.00 0.00 H new ATOM 0 HE2 PHE A 611 -0.962 8.435 0.501 1.00 0.00 H new ATOM 0 HZ PHE A 611 -2.755 7.209 1.670 1.00 0.00 H new ATOM 1160 N PHE A 612 -1.739 8.720 -5.824 1.00 0.00 N ATOM 1161 CA PHE A 612 -1.111 9.122 -7.076 1.00 0.00 C ATOM 1162 C PHE A 612 0.385 9.342 -6.872 1.00 0.00 C ATOM 1163 O PHE A 612 0.796 10.153 -6.043 1.00 0.00 O ATOM 1164 CB PHE A 612 -1.759 10.400 -7.612 1.00 0.00 C ATOM 1165 CG PHE A 612 -1.351 10.734 -9.018 1.00 0.00 C ATOM 1166 CD1 PHE A 612 -1.220 9.735 -9.970 1.00 0.00 C ATOM 1167 CD2 PHE A 612 -1.098 12.044 -9.388 1.00 0.00 C ATOM 1168 CE1 PHE A 612 -0.844 10.038 -11.265 1.00 0.00 C ATOM 1169 CE2 PHE A 612 -0.721 12.354 -10.681 1.00 0.00 C ATOM 1170 CZ PHE A 612 -0.594 11.349 -11.621 1.00 0.00 C ATOM 0 H PHE A 612 -1.277 9.081 -4.990 1.00 0.00 H new ATOM 0 HA PHE A 612 -1.254 8.324 -7.805 1.00 0.00 H new ATOM 0 HB2 PHE A 612 -2.843 10.292 -7.572 1.00 0.00 H new ATOM 0 HB3 PHE A 612 -1.497 11.232 -6.959 1.00 0.00 H new ATOM 0 HD1 PHE A 612 -1.414 8.708 -9.697 1.00 0.00 H new ATOM 0 HD2 PHE A 612 -1.196 12.833 -8.657 1.00 0.00 H new ATOM 0 HE1 PHE A 612 -0.746 9.251 -11.998 1.00 0.00 H new ATOM 0 HE2 PHE A 612 -0.526 13.380 -10.956 1.00 0.00 H new ATOM 0 HZ PHE A 612 -0.300 11.588 -12.632 1.00 0.00 H new ATOM 1180 N TYR A 613 1.195 8.608 -7.627 1.00 0.00 N ATOM 1181 CA TYR A 613 2.642 8.718 -7.525 1.00 0.00 C ATOM 1182 C TYR A 613 3.207 9.532 -8.678 1.00 0.00 C ATOM 1183 O TYR A 613 2.628 9.576 -9.763 1.00 0.00 O ATOM 1184 CB TYR A 613 3.273 7.327 -7.499 1.00 0.00 C ATOM 1185 CG TYR A 613 3.512 6.820 -6.100 1.00 0.00 C ATOM 1186 CD1 TYR A 613 2.499 6.196 -5.384 1.00 0.00 C ATOM 1187 CD2 TYR A 613 4.747 6.974 -5.497 1.00 0.00 C ATOM 1188 CE1 TYR A 613 2.713 5.737 -4.097 1.00 0.00 C ATOM 1189 CE2 TYR A 613 4.974 6.519 -4.212 1.00 0.00 C ATOM 1190 CZ TYR A 613 3.954 5.901 -3.516 1.00 0.00 C ATOM 1191 OH TYR A 613 4.176 5.447 -2.235 1.00 0.00 O ATOM 0 H TYR A 613 0.872 7.930 -8.317 1.00 0.00 H new ATOM 0 HA TYR A 613 2.882 9.234 -6.596 1.00 0.00 H new ATOM 0 HB2 TYR A 613 2.624 6.629 -8.028 1.00 0.00 H new ATOM 0 HB3 TYR A 613 4.220 7.353 -8.038 1.00 0.00 H new ATOM 0 HD1 TYR A 613 1.528 6.067 -5.839 1.00 0.00 H new ATOM 0 HD2 TYR A 613 5.547 7.457 -6.039 1.00 0.00 H new ATOM 0 HE1 TYR A 613 1.916 5.254 -3.551 1.00 0.00 H new ATOM 0 HE2 TYR A 613 5.944 6.646 -3.755 1.00 0.00 H new ATOM 0 HH TYR A 613 4.494 4.520 -2.267 1.00 0.00 H new ATOM 1201 N ASP A 614 4.337 10.184 -8.436 1.00 0.00 N ATOM 1202 CA ASP A 614 4.970 11.003 -9.458 1.00 0.00 C ATOM 1203 C ASP A 614 6.237 10.339 -9.988 1.00 0.00 C ATOM 1204 O ASP A 614 7.340 10.855 -9.809 1.00 0.00 O ATOM 1205 CB ASP A 614 5.299 12.389 -8.901 1.00 0.00 C ATOM 1206 CG ASP A 614 4.244 13.419 -9.250 1.00 0.00 C ATOM 1207 OD1 ASP A 614 3.070 13.218 -8.873 1.00 0.00 O ATOM 1208 OD2 ASP A 614 4.591 14.428 -9.899 1.00 0.00 O ATOM 0 H ASP A 614 4.831 10.161 -7.544 1.00 0.00 H new ATOM 0 HA ASP A 614 4.268 11.109 -10.285 1.00 0.00 H new ATOM 0 HB2 ASP A 614 5.398 12.328 -7.817 1.00 0.00 H new ATOM 0 HB3 ASP A 614 6.263 12.715 -9.291 1.00 0.00 H new ATOM 1213 N ILE A 615 6.070 9.198 -10.645 1.00 0.00 N ATOM 1214 CA ILE A 615 7.198 8.467 -11.206 1.00 0.00 C ATOM 1215 C ILE A 615 6.950 8.138 -12.674 1.00 0.00 C ATOM 1216 O ILE A 615 5.825 7.837 -13.072 1.00 0.00 O ATOM 1217 CB ILE A 615 7.473 7.162 -10.419 1.00 0.00 C ATOM 1218 CG1 ILE A 615 8.334 6.184 -11.233 1.00 0.00 C ATOM 1219 CG2 ILE A 615 6.169 6.503 -9.998 1.00 0.00 C ATOM 1220 CD1 ILE A 615 9.812 6.484 -11.179 1.00 0.00 C ATOM 0 H ILE A 615 5.163 8.759 -10.802 1.00 0.00 H new ATOM 0 HA ILE A 615 8.075 9.110 -11.126 1.00 0.00 H new ATOM 0 HB ILE A 615 8.032 7.430 -9.522 1.00 0.00 H new ATOM 0 HG12 ILE A 615 8.164 5.172 -10.865 1.00 0.00 H new ATOM 0 HG13 ILE A 615 8.006 6.204 -12.272 1.00 0.00 H new ATOM 0 HG21 ILE A 615 6.385 5.588 -9.447 1.00 0.00 H new ATOM 0 HG22 ILE A 615 5.605 7.185 -9.362 1.00 0.00 H new ATOM 0 HG23 ILE A 615 5.580 6.263 -10.883 1.00 0.00 H new ATOM 0 HD11 ILE A 615 10.354 5.751 -11.777 1.00 0.00 H new ATOM 0 HD12 ILE A 615 9.995 7.483 -11.575 1.00 0.00 H new ATOM 0 HD13 ILE A 615 10.156 6.435 -10.146 1.00 0.00 H new ATOM 1232 N LYS A 616 8.009 8.190 -13.473 1.00 0.00 N ATOM 1233 CA LYS A 616 7.907 7.889 -14.894 1.00 0.00 C ATOM 1234 C LYS A 616 7.728 6.392 -15.109 1.00 0.00 C ATOM 1235 O LYS A 616 8.453 5.582 -14.531 1.00 0.00 O ATOM 1236 CB LYS A 616 9.151 8.377 -15.637 1.00 0.00 C ATOM 1237 CG LYS A 616 9.121 9.858 -15.973 1.00 0.00 C ATOM 1238 CD LYS A 616 10.085 10.194 -17.099 1.00 0.00 C ATOM 1239 CE LYS A 616 9.921 11.631 -17.564 1.00 0.00 C ATOM 1240 NZ LYS A 616 10.130 12.603 -16.455 1.00 0.00 N ATOM 0 H LYS A 616 8.948 8.438 -13.160 1.00 0.00 H new ATOM 0 HA LYS A 616 7.035 8.409 -15.291 1.00 0.00 H new ATOM 0 HB2 LYS A 616 10.031 8.169 -15.029 1.00 0.00 H new ATOM 0 HB3 LYS A 616 9.259 7.807 -16.559 1.00 0.00 H new ATOM 0 HG2 LYS A 616 8.110 10.146 -16.260 1.00 0.00 H new ATOM 0 HG3 LYS A 616 9.378 10.438 -15.087 1.00 0.00 H new ATOM 0 HD2 LYS A 616 11.109 10.034 -16.762 1.00 0.00 H new ATOM 0 HD3 LYS A 616 9.916 9.518 -17.937 1.00 0.00 H new ATOM 0 HE2 LYS A 616 10.631 11.836 -18.365 1.00 0.00 H new ATOM 0 HE3 LYS A 616 8.923 11.766 -17.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 616 10.178 13.567 -16.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 616 9.339 12.539 -15.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 616 11.020 12.383 -15.964 1.00 0.00 H new ATOM 1254 N HIS A 617 6.759 6.031 -15.940 1.00 0.00 N ATOM 1255 CA HIS A 617 6.486 4.628 -16.224 1.00 0.00 C ATOM 1256 C HIS A 617 7.778 3.861 -16.484 1.00 0.00 C ATOM 1257 O HIS A 617 7.989 2.778 -15.939 1.00 0.00 O ATOM 1258 CB HIS A 617 5.556 4.500 -17.431 1.00 0.00 C ATOM 1259 CG HIS A 617 5.264 3.082 -17.802 1.00 0.00 C ATOM 1260 ND1 HIS A 617 5.961 2.398 -18.774 1.00 0.00 N ATOM 1261 CD2 HIS A 617 4.349 2.210 -17.313 1.00 0.00 C ATOM 1262 CE1 HIS A 617 5.489 1.169 -18.869 1.00 0.00 C ATOM 1263 NE2 HIS A 617 4.512 1.030 -17.993 1.00 0.00 N ATOM 0 H HIS A 617 6.150 6.688 -16.428 1.00 0.00 H new ATOM 0 HA HIS A 617 5.998 4.198 -15.349 1.00 0.00 H new ATOM 0 HB2 HIS A 617 4.619 5.013 -17.215 1.00 0.00 H new ATOM 0 HB3 HIS A 617 6.007 5.006 -18.284 1.00 0.00 H new ATOM 0 HD2 HIS A 617 3.627 2.407 -16.534 1.00 0.00 H new ATOM 0 HE1 HIS A 617 5.842 0.407 -19.548 1.00 0.00 H new ATOM 0 HE2 HIS A 617 3.966 0.181 -17.845 1.00 0.00 H new ATOM 1272 N SER A 618 8.639 4.429 -17.321 1.00 0.00 N ATOM 1273 CA SER A 618 9.911 3.797 -17.655 1.00 0.00 C ATOM 1274 C SER A 618 10.740 3.539 -16.401 1.00 0.00 C ATOM 1275 O SER A 618 11.699 2.767 -16.428 1.00 0.00 O ATOM 1276 CB SER A 618 10.699 4.672 -18.631 1.00 0.00 C ATOM 1277 OG SER A 618 11.975 4.118 -18.898 1.00 0.00 O ATOM 0 H SER A 618 8.480 5.326 -17.781 1.00 0.00 H new ATOM 0 HA SER A 618 9.697 2.839 -18.128 1.00 0.00 H new ATOM 0 HB2 SER A 618 10.142 4.775 -19.562 1.00 0.00 H new ATOM 0 HB3 SER A 618 10.814 5.673 -18.215 1.00 0.00 H new ATOM 0 HG SER A 618 12.173 3.420 -18.240 1.00 0.00 H new ATOM 1283 N ASP A 619 10.367 4.187 -15.301 1.00 0.00 N ATOM 1284 CA ASP A 619 11.081 4.019 -14.042 1.00 0.00 C ATOM 1285 C ASP A 619 10.270 3.167 -13.071 1.00 0.00 C ATOM 1286 O ASP A 619 10.832 2.469 -12.226 1.00 0.00 O ATOM 1287 CB ASP A 619 11.385 5.383 -13.420 1.00 0.00 C ATOM 1288 CG ASP A 619 12.384 6.179 -14.237 1.00 0.00 C ATOM 1289 OD1 ASP A 619 12.494 5.924 -15.455 1.00 0.00 O ATOM 1290 OD2 ASP A 619 13.058 7.057 -13.658 1.00 0.00 O ATOM 0 H ASP A 619 9.577 4.831 -15.257 1.00 0.00 H new ATOM 0 HA ASP A 619 12.021 3.507 -14.247 1.00 0.00 H new ATOM 0 HB2 ASP A 619 10.460 5.952 -13.327 1.00 0.00 H new ATOM 0 HB3 ASP A 619 11.774 5.241 -12.412 1.00 0.00 H new ATOM 1295 N LEU A 620 8.947 3.222 -13.205 1.00 0.00 N ATOM 1296 CA LEU A 620 8.054 2.450 -12.347 1.00 0.00 C ATOM 1297 C LEU A 620 8.677 1.099 -12.006 1.00 0.00 C ATOM 1298 O LEU A 620 9.036 0.838 -10.862 1.00 0.00 O ATOM 1299 CB LEU A 620 6.708 2.225 -13.049 1.00 0.00 C ATOM 1300 CG LEU A 620 5.541 3.138 -12.637 1.00 0.00 C ATOM 1301 CD1 LEU A 620 4.319 2.299 -12.308 1.00 0.00 C ATOM 1302 CD2 LEU A 620 5.899 4.030 -11.457 1.00 0.00 C ATOM 0 H LEU A 620 8.470 3.795 -13.901 1.00 0.00 H new ATOM 0 HA LEU A 620 7.894 3.013 -11.427 1.00 0.00 H new ATOM 0 HB2 LEU A 620 6.863 2.338 -14.122 1.00 0.00 H new ATOM 0 HB3 LEU A 620 6.406 1.192 -12.878 1.00 0.00 H new ATOM 0 HG LEU A 620 5.320 3.791 -13.481 1.00 0.00 H new ATOM 0 HD11 LEU A 620 3.497 2.952 -12.017 1.00 0.00 H new ATOM 0 HD12 LEU A 620 4.029 1.719 -13.184 1.00 0.00 H new ATOM 0 HD13 LEU A 620 4.553 1.622 -11.486 1.00 0.00 H new ATOM 0 HD21 LEU A 620 5.044 4.657 -11.202 1.00 0.00 H new ATOM 0 HD22 LEU A 620 6.163 3.411 -10.600 1.00 0.00 H new ATOM 0 HD23 LEU A 620 6.746 4.662 -11.723 1.00 0.00 H new ATOM 1314 N ALA A 621 8.802 0.250 -13.016 1.00 0.00 N ATOM 1315 CA ALA A 621 9.381 -1.079 -12.851 1.00 0.00 C ATOM 1316 C ALA A 621 10.524 -1.081 -11.830 1.00 0.00 C ATOM 1317 O ALA A 621 10.562 -1.919 -10.932 1.00 0.00 O ATOM 1318 CB ALA A 621 9.883 -1.579 -14.198 1.00 0.00 C ATOM 0 H ALA A 621 8.507 0.460 -13.970 1.00 0.00 H new ATOM 0 HA ALA A 621 8.605 -1.743 -12.471 1.00 0.00 H new ATOM 0 HB1 ALA A 621 10.316 -2.572 -14.079 1.00 0.00 H new ATOM 0 HB2 ALA A 621 9.051 -1.628 -14.901 1.00 0.00 H new ATOM 0 HB3 ALA A 621 10.641 -0.896 -14.580 1.00 0.00 H new ATOM 1324 N LYS A 622 11.459 -0.144 -11.980 1.00 0.00 N ATOM 1325 CA LYS A 622 12.608 -0.056 -11.083 1.00 0.00 C ATOM 1326 C LYS A 622 12.189 0.333 -9.674 1.00 0.00 C ATOM 1327 O LYS A 622 12.904 0.070 -8.707 1.00 0.00 O ATOM 1328 CB LYS A 622 13.619 0.958 -11.620 1.00 0.00 C ATOM 1329 CG LYS A 622 14.640 0.355 -12.572 1.00 0.00 C ATOM 1330 CD LYS A 622 13.993 -0.627 -13.536 1.00 0.00 C ATOM 1331 CE LYS A 622 13.164 0.090 -14.588 1.00 0.00 C ATOM 1332 NZ LYS A 622 13.468 -0.397 -15.962 1.00 0.00 N ATOM 0 H LYS A 622 11.443 0.564 -12.714 1.00 0.00 H new ATOM 0 HA LYS A 622 13.069 -1.043 -11.038 1.00 0.00 H new ATOM 0 HB2 LYS A 622 13.083 1.756 -12.134 1.00 0.00 H new ATOM 0 HB3 LYS A 622 14.143 1.415 -10.781 1.00 0.00 H new ATOM 0 HG2 LYS A 622 15.128 1.151 -13.135 1.00 0.00 H new ATOM 0 HG3 LYS A 622 15.416 -0.153 -12.000 1.00 0.00 H new ATOM 0 HD2 LYS A 622 14.765 -1.222 -14.023 1.00 0.00 H new ATOM 0 HD3 LYS A 622 13.359 -1.319 -12.981 1.00 0.00 H new ATOM 0 HE2 LYS A 622 12.105 -0.056 -14.377 1.00 0.00 H new ATOM 0 HE3 LYS A 622 13.355 1.162 -14.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 622 12.882 0.117 -16.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 622 14.473 -0.234 -16.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 622 13.262 -1.414 -16.023 1.00 0.00 H new ATOM 1346 N LYS A 623 11.030 0.964 -9.561 1.00 0.00 N ATOM 1347 CA LYS A 623 10.525 1.394 -8.269 1.00 0.00 C ATOM 1348 C LYS A 623 10.109 0.205 -7.412 1.00 0.00 C ATOM 1349 O LYS A 623 10.100 -0.938 -7.870 1.00 0.00 O ATOM 1350 CB LYS A 623 9.334 2.334 -8.439 1.00 0.00 C ATOM 1351 CG LYS A 623 9.558 3.431 -9.460 1.00 0.00 C ATOM 1352 CD LYS A 623 10.169 4.667 -8.825 1.00 0.00 C ATOM 1353 CE LYS A 623 11.580 4.911 -9.335 1.00 0.00 C ATOM 1354 NZ LYS A 623 11.947 6.354 -9.289 1.00 0.00 N ATOM 0 H LYS A 623 10.423 1.189 -10.349 1.00 0.00 H new ATOM 0 HA LYS A 623 11.334 1.923 -7.766 1.00 0.00 H new ATOM 0 HB2 LYS A 623 8.462 1.750 -8.733 1.00 0.00 H new ATOM 0 HB3 LYS A 623 9.103 2.789 -7.476 1.00 0.00 H new ATOM 0 HG2 LYS A 623 10.213 3.065 -10.250 1.00 0.00 H new ATOM 0 HG3 LYS A 623 8.609 3.693 -9.928 1.00 0.00 H new ATOM 0 HD2 LYS A 623 9.547 5.535 -9.042 1.00 0.00 H new ATOM 0 HD3 LYS A 623 10.187 4.550 -7.741 1.00 0.00 H new ATOM 0 HE2 LYS A 623 12.287 4.338 -8.735 1.00 0.00 H new ATOM 0 HE3 LYS A 623 11.663 4.548 -10.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 623 12.073 6.711 -10.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 623 11.190 6.890 -8.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 623 12.834 6.470 -8.759 1.00 0.00 H new ATOM 1368 N SER A 624 9.753 0.493 -6.166 1.00 0.00 N ATOM 1369 CA SER A 624 9.316 -0.535 -5.232 1.00 0.00 C ATOM 1370 C SER A 624 8.262 0.025 -4.284 1.00 0.00 C ATOM 1371 O SER A 624 8.576 0.790 -3.371 1.00 0.00 O ATOM 1372 CB SER A 624 10.503 -1.077 -4.436 1.00 0.00 C ATOM 1373 OG SER A 624 11.032 -0.089 -3.569 1.00 0.00 O ATOM 0 H SER A 624 9.759 1.436 -5.778 1.00 0.00 H new ATOM 0 HA SER A 624 8.877 -1.353 -5.803 1.00 0.00 H new ATOM 0 HB2 SER A 624 10.189 -1.944 -3.855 1.00 0.00 H new ATOM 0 HB3 SER A 624 11.279 -1.417 -5.122 1.00 0.00 H new ATOM 0 HG SER A 624 10.307 0.487 -3.248 1.00 0.00 H new ATOM 1379 N LEU A 625 7.010 -0.352 -4.514 1.00 0.00 N ATOM 1380 CA LEU A 625 5.906 0.122 -3.686 1.00 0.00 C ATOM 1381 C LEU A 625 5.830 -0.655 -2.378 1.00 0.00 C ATOM 1382 O LEU A 625 5.553 -1.855 -2.371 1.00 0.00 O ATOM 1383 CB LEU A 625 4.584 0.001 -4.445 1.00 0.00 C ATOM 1384 CG LEU A 625 3.374 0.616 -3.741 1.00 0.00 C ATOM 1385 CD1 LEU A 625 3.564 2.114 -3.564 1.00 0.00 C ATOM 1386 CD2 LEU A 625 2.100 0.327 -4.520 1.00 0.00 C ATOM 0 H LEU A 625 6.733 -0.984 -5.266 1.00 0.00 H new ATOM 0 HA LEU A 625 6.087 1.171 -3.451 1.00 0.00 H new ATOM 0 HB2 LEU A 625 4.698 0.475 -5.420 1.00 0.00 H new ATOM 0 HB3 LEU A 625 4.382 -1.055 -4.626 1.00 0.00 H new ATOM 0 HG LEU A 625 3.283 0.163 -2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 625 2.693 2.534 -3.061 1.00 0.00 H new ATOM 0 HD12 LEU A 625 4.454 2.299 -2.963 1.00 0.00 H new ATOM 0 HD13 LEU A 625 3.681 2.584 -4.541 1.00 0.00 H new ATOM 0 HD21 LEU A 625 1.249 0.772 -4.004 1.00 0.00 H new ATOM 0 HD22 LEU A 625 2.181 0.752 -5.520 1.00 0.00 H new ATOM 0 HD23 LEU A 625 1.956 -0.751 -4.594 1.00 0.00 H new ATOM 1398 N ASP A 626 6.077 0.038 -1.272 1.00 0.00 N ATOM 1399 CA ASP A 626 6.036 -0.583 0.045 1.00 0.00 C ATOM 1400 C ASP A 626 4.765 -0.193 0.793 1.00 0.00 C ATOM 1401 O ASP A 626 4.674 0.897 1.356 1.00 0.00 O ATOM 1402 CB ASP A 626 7.266 -0.180 0.860 1.00 0.00 C ATOM 1403 CG ASP A 626 7.468 -1.061 2.077 1.00 0.00 C ATOM 1404 OD1 ASP A 626 6.679 -0.937 3.037 1.00 0.00 O ATOM 1405 OD2 ASP A 626 8.415 -1.875 2.070 1.00 0.00 O ATOM 0 H ASP A 626 6.308 1.031 -1.262 1.00 0.00 H new ATOM 0 HA ASP A 626 6.037 -1.664 -0.091 1.00 0.00 H new ATOM 0 HB2 ASP A 626 8.151 -0.232 0.226 1.00 0.00 H new ATOM 0 HB3 ASP A 626 7.163 0.857 1.179 1.00 0.00 H new ATOM 1410 N ILE A 627 3.790 -1.095 0.796 1.00 0.00 N ATOM 1411 CA ILE A 627 2.526 -0.851 1.478 1.00 0.00 C ATOM 1412 C ILE A 627 2.575 -1.379 2.909 1.00 0.00 C ATOM 1413 O ILE A 627 2.596 -2.589 3.133 1.00 0.00 O ATOM 1414 CB ILE A 627 1.350 -1.514 0.734 1.00 0.00 C ATOM 1415 CG1 ILE A 627 1.470 -1.270 -0.772 1.00 0.00 C ATOM 1416 CG2 ILE A 627 0.024 -0.983 1.259 1.00 0.00 C ATOM 1417 CD1 ILE A 627 1.999 -2.463 -1.539 1.00 0.00 C ATOM 0 H ILE A 627 3.851 -2.002 0.333 1.00 0.00 H new ATOM 0 HA ILE A 627 2.370 0.228 1.493 1.00 0.00 H new ATOM 0 HB ILE A 627 1.384 -2.589 0.913 1.00 0.00 H new ATOM 0 HG12 ILE A 627 0.491 -1.000 -1.167 1.00 0.00 H new ATOM 0 HG13 ILE A 627 2.128 -0.418 -0.942 1.00 0.00 H new ATOM 0 HG21 ILE A 627 -0.797 -1.461 0.724 1.00 0.00 H new ATOM 0 HG22 ILE A 627 -0.060 -1.203 2.323 1.00 0.00 H new ATOM 0 HG23 ILE A 627 -0.022 0.095 1.106 1.00 0.00 H new ATOM 0 HD11 ILE A 627 2.057 -2.217 -2.599 1.00 0.00 H new ATOM 0 HD12 ILE A 627 2.992 -2.721 -1.171 1.00 0.00 H new ATOM 0 HD13 ILE A 627 1.329 -3.311 -1.400 1.00 0.00 H new ATOM 1429 N SER A 628 2.602 -0.464 3.873 1.00 0.00 N ATOM 1430 CA SER A 628 2.660 -0.844 5.282 1.00 0.00 C ATOM 1431 C SER A 628 1.397 -0.422 6.022 1.00 0.00 C ATOM 1432 O SER A 628 0.728 0.538 5.637 1.00 0.00 O ATOM 1433 CB SER A 628 3.886 -0.218 5.950 1.00 0.00 C ATOM 1434 OG SER A 628 3.831 1.196 5.897 1.00 0.00 O ATOM 0 H SER A 628 2.585 0.542 3.706 1.00 0.00 H new ATOM 0 HA SER A 628 2.737 -1.930 5.331 1.00 0.00 H new ATOM 0 HB2 SER A 628 3.944 -0.544 6.989 1.00 0.00 H new ATOM 0 HB3 SER A 628 4.792 -0.568 5.455 1.00 0.00 H new ATOM 0 HG SER A 628 4.730 1.564 6.029 1.00 0.00 H new ATOM 1440 N VAL A 629 1.083 -1.146 7.090 1.00 0.00 N ATOM 1441 CA VAL A 629 -0.095 -0.854 7.894 1.00 0.00 C ATOM 1442 C VAL A 629 0.278 -0.706 9.366 1.00 0.00 C ATOM 1443 O VAL A 629 0.900 -1.595 9.950 1.00 0.00 O ATOM 1444 CB VAL A 629 -1.159 -1.956 7.752 1.00 0.00 C ATOM 1445 CG1 VAL A 629 -2.444 -1.558 8.463 1.00 0.00 C ATOM 1446 CG2 VAL A 629 -1.421 -2.252 6.284 1.00 0.00 C ATOM 0 H VAL A 629 1.630 -1.941 7.419 1.00 0.00 H new ATOM 0 HA VAL A 629 -0.510 0.085 7.527 1.00 0.00 H new ATOM 0 HB VAL A 629 -0.782 -2.864 8.223 1.00 0.00 H new ATOM 0 HG11 VAL A 629 -3.183 -2.351 8.350 1.00 0.00 H new ATOM 0 HG12 VAL A 629 -2.240 -1.400 9.522 1.00 0.00 H new ATOM 0 HG13 VAL A 629 -2.831 -0.637 8.027 1.00 0.00 H new ATOM 0 HG21 VAL A 629 -2.176 -3.034 6.200 1.00 0.00 H new ATOM 0 HG22 VAL A 629 -1.777 -1.349 5.789 1.00 0.00 H new ATOM 0 HG23 VAL A 629 -0.498 -2.586 5.810 1.00 0.00 H new ATOM 1456 N TRP A 630 -0.093 0.424 9.959 1.00 0.00 N ATOM 1457 CA TRP A 630 0.216 0.687 11.359 1.00 0.00 C ATOM 1458 C TRP A 630 -1.056 0.904 12.170 1.00 0.00 C ATOM 1459 O TRP A 630 -2.010 1.514 11.689 1.00 0.00 O ATOM 1460 CB TRP A 630 1.097 1.926 11.468 1.00 0.00 C ATOM 1461 CG TRP A 630 2.354 1.850 10.660 1.00 0.00 C ATOM 1462 CD1 TRP A 630 2.459 1.923 9.303 1.00 0.00 C ATOM 1463 CD2 TRP A 630 3.686 1.691 11.160 1.00 0.00 C ATOM 1464 NE1 TRP A 630 3.777 1.834 8.925 1.00 0.00 N ATOM 1465 CE2 TRP A 630 4.549 1.685 10.048 1.00 0.00 C ATOM 1466 CE3 TRP A 630 4.231 1.555 12.439 1.00 0.00 C ATOM 1467 CZ2 TRP A 630 5.930 1.549 10.179 1.00 0.00 C ATOM 1468 CZ3 TRP A 630 5.600 1.419 12.567 1.00 0.00 C ATOM 1469 CH2 TRP A 630 6.436 1.417 11.443 1.00 0.00 C ATOM 0 H TRP A 630 -0.607 1.171 9.492 1.00 0.00 H new ATOM 0 HA TRP A 630 0.741 -0.181 11.759 1.00 0.00 H new ATOM 0 HB2 TRP A 630 0.524 2.796 11.149 1.00 0.00 H new ATOM 0 HB3 TRP A 630 1.358 2.083 12.514 1.00 0.00 H new ATOM 0 HD1 TRP A 630 1.627 2.035 8.624 1.00 0.00 H new ATOM 0 HE1 TRP A 630 4.124 1.872 7.967 1.00 0.00 H new ATOM 0 HE3 TRP A 630 3.594 1.556 13.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 630 6.577 1.548 9.314 1.00 0.00 H new ATOM 0 HZ3 TRP A 630 6.033 1.312 13.551 1.00 0.00 H new ATOM 0 HH2 TRP A 630 7.502 1.309 11.577 1.00 0.00 H new ATOM 1480 N ASP A 631 -1.057 0.418 13.408 1.00 0.00 N ATOM 1481 CA ASP A 631 -2.212 0.579 14.285 1.00 0.00 C ATOM 1482 C ASP A 631 -2.162 1.936 14.986 1.00 0.00 C ATOM 1483 O ASP A 631 -1.358 2.154 15.892 1.00 0.00 O ATOM 1484 CB ASP A 631 -2.275 -0.565 15.310 1.00 0.00 C ATOM 1485 CG ASP A 631 -2.801 -0.131 16.669 1.00 0.00 C ATOM 1486 OD1 ASP A 631 -2.004 0.398 17.473 1.00 0.00 O ATOM 1487 OD2 ASP A 631 -4.009 -0.319 16.926 1.00 0.00 O ATOM 0 H ASP A 631 -0.275 -0.088 13.825 1.00 0.00 H new ATOM 0 HA ASP A 631 -3.117 0.540 13.679 1.00 0.00 H new ATOM 0 HB2 ASP A 631 -2.912 -1.358 14.919 1.00 0.00 H new ATOM 0 HB3 ASP A 631 -1.278 -0.988 15.433 1.00 0.00 H new ATOM 1492 N TYR A 632 -3.030 2.840 14.551 1.00 0.00 N ATOM 1493 CA TYR A 632 -3.101 4.179 15.121 1.00 0.00 C ATOM 1494 C TYR A 632 -3.414 4.125 16.612 1.00 0.00 C ATOM 1495 O TYR A 632 -3.830 3.090 17.134 1.00 0.00 O ATOM 1496 CB TYR A 632 -4.168 4.996 14.392 1.00 0.00 C ATOM 1497 CG TYR A 632 -4.266 6.428 14.858 1.00 0.00 C ATOM 1498 CD1 TYR A 632 -4.986 6.760 15.998 1.00 0.00 C ATOM 1499 CD2 TYR A 632 -3.642 7.450 14.154 1.00 0.00 C ATOM 1500 CE1 TYR A 632 -5.080 8.070 16.426 1.00 0.00 C ATOM 1501 CE2 TYR A 632 -3.731 8.763 14.575 1.00 0.00 C ATOM 1502 CZ TYR A 632 -4.451 9.069 15.711 1.00 0.00 C ATOM 1503 OH TYR A 632 -4.542 10.375 16.133 1.00 0.00 O ATOM 0 H TYR A 632 -3.699 2.668 13.800 1.00 0.00 H new ATOM 0 HA TYR A 632 -2.129 4.657 14.996 1.00 0.00 H new ATOM 0 HB2 TYR A 632 -3.952 4.986 13.324 1.00 0.00 H new ATOM 0 HB3 TYR A 632 -5.136 4.513 14.526 1.00 0.00 H new ATOM 0 HD1 TYR A 632 -5.481 5.981 16.559 1.00 0.00 H new ATOM 0 HD2 TYR A 632 -3.078 7.215 13.263 1.00 0.00 H new ATOM 0 HE1 TYR A 632 -5.643 8.311 17.316 1.00 0.00 H new ATOM 0 HE2 TYR A 632 -3.239 9.546 14.017 1.00 0.00 H new ATOM 0 HH TYR A 632 -4.042 10.953 15.519 1.00 0.00 H new ATOM 1513 N ASP A 633 -3.213 5.248 17.295 1.00 0.00 N ATOM 1514 CA ASP A 633 -3.476 5.332 18.726 1.00 0.00 C ATOM 1515 C ASP A 633 -3.675 6.780 19.158 1.00 0.00 C ATOM 1516 O ASP A 633 -2.776 7.610 19.017 1.00 0.00 O ATOM 1517 CB ASP A 633 -2.323 4.706 19.515 1.00 0.00 C ATOM 1518 CG ASP A 633 -2.342 3.191 19.464 1.00 0.00 C ATOM 1519 OD1 ASP A 633 -3.394 2.601 19.790 1.00 0.00 O ATOM 1520 OD2 ASP A 633 -1.307 2.596 19.099 1.00 0.00 O ATOM 0 H ASP A 633 -2.868 6.113 16.879 1.00 0.00 H new ATOM 0 HA ASP A 633 -4.392 4.780 18.935 1.00 0.00 H new ATOM 0 HB2 ASP A 633 -1.375 5.068 19.117 1.00 0.00 H new ATOM 0 HB3 ASP A 633 -2.378 5.032 20.554 1.00 0.00 H new ATOM 1525 N ILE A 634 -4.857 7.078 19.687 1.00 0.00 N ATOM 1526 CA ILE A 634 -5.173 8.428 20.141 1.00 0.00 C ATOM 1527 C ILE A 634 -4.543 8.709 21.501 1.00 0.00 C ATOM 1528 O ILE A 634 -4.563 7.860 22.393 1.00 0.00 O ATOM 1529 CB ILE A 634 -6.695 8.668 20.237 1.00 0.00 C ATOM 1530 CG1 ILE A 634 -7.430 7.376 20.603 1.00 0.00 C ATOM 1531 CG2 ILE A 634 -7.225 9.239 18.930 1.00 0.00 C ATOM 1532 CD1 ILE A 634 -7.832 6.543 19.404 1.00 0.00 C ATOM 0 H ILE A 634 -5.612 6.403 19.812 1.00 0.00 H new ATOM 0 HA ILE A 634 -4.760 9.107 19.395 1.00 0.00 H new ATOM 0 HB ILE A 634 -6.878 9.393 21.030 1.00 0.00 H new ATOM 0 HG12 ILE A 634 -6.792 6.777 21.253 1.00 0.00 H new ATOM 0 HG13 ILE A 634 -8.323 7.626 21.176 1.00 0.00 H new ATOM 0 HG21 ILE A 634 -8.299 9.403 19.014 1.00 0.00 H new ATOM 0 HG22 ILE A 634 -6.729 10.186 18.719 1.00 0.00 H new ATOM 0 HG23 ILE A 634 -7.027 8.538 18.120 1.00 0.00 H new ATOM 0 HD11 ILE A 634 -8.348 5.644 19.742 1.00 0.00 H new ATOM 0 HD12 ILE A 634 -8.496 7.123 18.764 1.00 0.00 H new ATOM 0 HD13 ILE A 634 -6.942 6.261 18.842 1.00 0.00 H new ATOM 1544 N GLY A 635 -3.987 9.906 21.654 1.00 0.00 N ATOM 1545 CA GLY A 635 -3.360 10.280 22.907 1.00 0.00 C ATOM 1546 C GLY A 635 -2.184 9.389 23.258 1.00 0.00 C ATOM 1547 O GLY A 635 -1.722 9.384 24.399 1.00 0.00 O ATOM 0 H GLY A 635 -3.960 10.625 20.931 1.00 0.00 H new ATOM 0 HA2 GLY A 635 -3.022 11.314 22.846 1.00 0.00 H new ATOM 0 HA3 GLY A 635 -4.099 10.233 23.707 1.00 0.00 H new ATOM 1551 N LYS A 636 -1.699 8.637 22.276 1.00 0.00 N ATOM 1552 CA LYS A 636 -0.568 7.739 22.490 1.00 0.00 C ATOM 1553 C LYS A 636 0.165 7.467 21.180 1.00 0.00 C ATOM 1554 O LYS A 636 -0.202 7.993 20.130 1.00 0.00 O ATOM 1555 CB LYS A 636 -1.044 6.421 23.106 1.00 0.00 C ATOM 1556 CG LYS A 636 -2.553 6.241 23.075 1.00 0.00 C ATOM 1557 CD LYS A 636 -2.975 4.954 23.762 1.00 0.00 C ATOM 1558 CE LYS A 636 -3.400 5.203 25.200 1.00 0.00 C ATOM 1559 NZ LYS A 636 -2.448 4.598 26.173 1.00 0.00 N ATOM 0 H LYS A 636 -2.070 8.631 21.326 1.00 0.00 H new ATOM 0 HA LYS A 636 0.124 8.224 23.179 1.00 0.00 H new ATOM 0 HB2 LYS A 636 -0.577 5.592 22.574 1.00 0.00 H new ATOM 0 HB3 LYS A 636 -0.702 6.369 24.140 1.00 0.00 H new ATOM 0 HG2 LYS A 636 -3.032 7.089 23.564 1.00 0.00 H new ATOM 0 HG3 LYS A 636 -2.898 6.233 22.041 1.00 0.00 H new ATOM 0 HD2 LYS A 636 -3.799 4.500 23.212 1.00 0.00 H new ATOM 0 HD3 LYS A 636 -2.149 4.243 23.744 1.00 0.00 H new ATOM 0 HE2 LYS A 636 -3.468 6.276 25.378 1.00 0.00 H new ATOM 0 HE3 LYS A 636 -4.396 4.790 25.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 636 -2.773 4.790 27.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 636 -2.402 3.570 26.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 636 -1.503 5.011 26.037 1.00 0.00 H new ATOM 1573 N SER A 637 1.205 6.642 21.251 1.00 0.00 N ATOM 1574 CA SER A 637 1.992 6.301 20.072 1.00 0.00 C ATOM 1575 C SER A 637 1.304 5.212 19.256 1.00 0.00 C ATOM 1576 O SER A 637 0.508 4.436 19.784 1.00 0.00 O ATOM 1577 CB SER A 637 3.391 5.836 20.483 1.00 0.00 C ATOM 1578 OG SER A 637 4.341 6.875 20.323 1.00 0.00 O ATOM 0 H SER A 637 1.522 6.198 22.113 1.00 0.00 H new ATOM 0 HA SER A 637 2.080 7.195 19.454 1.00 0.00 H new ATOM 0 HB2 SER A 637 3.378 5.508 21.522 1.00 0.00 H new ATOM 0 HB3 SER A 637 3.683 4.976 19.881 1.00 0.00 H new ATOM 0 HG SER A 637 5.226 6.553 20.594 1.00 0.00 H new ATOM 1584 N ASN A 638 1.618 5.161 17.965 1.00 0.00 N ATOM 1585 CA ASN A 638 1.031 4.167 17.075 1.00 0.00 C ATOM 1586 C ASN A 638 1.700 2.809 17.261 1.00 0.00 C ATOM 1587 O ASN A 638 2.373 2.568 18.263 1.00 0.00 O ATOM 1588 CB ASN A 638 1.159 4.616 15.618 1.00 0.00 C ATOM 1589 CG ASN A 638 1.044 6.120 15.466 1.00 0.00 C ATOM 1590 OD1 ASN A 638 -0.057 6.664 15.372 1.00 0.00 O ATOM 1591 ND2 ASN A 638 2.183 6.802 15.440 1.00 0.00 N ATOM 0 H ASN A 638 2.275 5.796 17.513 1.00 0.00 H new ATOM 0 HA ASN A 638 -0.025 4.070 17.326 1.00 0.00 H new ATOM 0 HB2 ASN A 638 2.119 4.286 15.222 1.00 0.00 H new ATOM 0 HB3 ASN A 638 0.385 4.133 15.022 1.00 0.00 H new ATOM 0 HD21 ASN A 638 2.168 7.817 15.339 1.00 0.00 H new ATOM 0 HD22 ASN A 638 3.073 6.311 15.521 1.00 0.00 H new ATOM 1598 N ASP A 639 1.510 1.924 16.288 1.00 0.00 N ATOM 1599 CA ASP A 639 2.092 0.589 16.342 1.00 0.00 C ATOM 1600 C ASP A 639 2.165 -0.027 14.950 1.00 0.00 C ATOM 1601 O ASP A 639 1.253 0.137 14.140 1.00 0.00 O ATOM 1602 CB ASP A 639 1.270 -0.312 17.263 1.00 0.00 C ATOM 1603 CG ASP A 639 1.051 0.303 18.631 1.00 0.00 C ATOM 1604 OD1 ASP A 639 2.045 0.498 19.362 1.00 0.00 O ATOM 1605 OD2 ASP A 639 -0.116 0.590 18.973 1.00 0.00 O ATOM 0 H ASP A 639 0.956 2.108 15.451 1.00 0.00 H new ATOM 0 HA ASP A 639 3.104 0.677 16.738 1.00 0.00 H new ATOM 0 HB2 ASP A 639 0.304 -0.515 16.800 1.00 0.00 H new ATOM 0 HB3 ASP A 639 1.777 -1.270 17.376 1.00 0.00 H new ATOM 1610 N TYR A 640 3.253 -0.738 14.678 1.00 0.00 N ATOM 1611 CA TYR A 640 3.439 -1.379 13.384 1.00 0.00 C ATOM 1612 C TYR A 640 2.715 -2.719 13.335 1.00 0.00 C ATOM 1613 O TYR A 640 3.051 -3.643 14.074 1.00 0.00 O ATOM 1614 CB TYR A 640 4.929 -1.582 13.100 1.00 0.00 C ATOM 1615 CG TYR A 640 5.253 -1.736 11.631 1.00 0.00 C ATOM 1616 CD1 TYR A 640 4.242 -1.844 10.684 1.00 0.00 C ATOM 1617 CD2 TYR A 640 6.570 -1.771 11.193 1.00 0.00 C ATOM 1618 CE1 TYR A 640 4.536 -1.985 9.340 1.00 0.00 C ATOM 1619 CE2 TYR A 640 6.872 -1.912 9.851 1.00 0.00 C ATOM 1620 CZ TYR A 640 5.852 -2.018 8.929 1.00 0.00 C ATOM 1621 OH TYR A 640 6.148 -2.158 7.593 1.00 0.00 O ATOM 0 H TYR A 640 4.018 -0.884 15.336 1.00 0.00 H new ATOM 0 HA TYR A 640 3.016 -0.727 12.619 1.00 0.00 H new ATOM 0 HB2 TYR A 640 5.485 -0.733 13.498 1.00 0.00 H new ATOM 0 HB3 TYR A 640 5.274 -2.467 13.634 1.00 0.00 H new ATOM 0 HD1 TYR A 640 3.210 -1.817 11.002 1.00 0.00 H new ATOM 0 HD2 TYR A 640 7.371 -1.687 11.912 1.00 0.00 H new ATOM 0 HE1 TYR A 640 3.739 -2.069 8.616 1.00 0.00 H new ATOM 0 HE2 TYR A 640 7.902 -1.939 9.526 1.00 0.00 H new ATOM 0 HH TYR A 640 7.121 -2.162 7.472 1.00 0.00 H new ATOM 1631 N ILE A 641 1.719 -2.816 12.462 1.00 0.00 N ATOM 1632 CA ILE A 641 0.948 -4.045 12.320 1.00 0.00 C ATOM 1633 C ILE A 641 1.555 -4.956 11.256 1.00 0.00 C ATOM 1634 O ILE A 641 1.620 -6.172 11.434 1.00 0.00 O ATOM 1635 CB ILE A 641 -0.521 -3.749 11.962 1.00 0.00 C ATOM 1636 CG1 ILE A 641 -1.237 -3.107 13.153 1.00 0.00 C ATOM 1637 CG2 ILE A 641 -1.233 -5.024 11.533 1.00 0.00 C ATOM 1638 CD1 ILE A 641 -2.681 -2.750 12.872 1.00 0.00 C ATOM 0 H ILE A 641 1.427 -2.060 11.843 1.00 0.00 H new ATOM 0 HA ILE A 641 0.979 -4.553 13.284 1.00 0.00 H new ATOM 0 HB ILE A 641 -0.542 -3.049 11.127 1.00 0.00 H new ATOM 0 HG12 ILE A 641 -1.199 -3.791 14.001 1.00 0.00 H new ATOM 0 HG13 ILE A 641 -0.699 -2.206 13.447 1.00 0.00 H new ATOM 0 HG21 ILE A 641 -2.269 -4.796 11.284 1.00 0.00 H new ATOM 0 HG22 ILE A 641 -0.734 -5.443 10.659 1.00 0.00 H new ATOM 0 HG23 ILE A 641 -1.207 -5.747 12.348 1.00 0.00 H new ATOM 0 HD11 ILE A 641 -3.124 -2.300 13.760 1.00 0.00 H new ATOM 0 HD12 ILE A 641 -2.726 -2.041 12.045 1.00 0.00 H new ATOM 0 HD13 ILE A 641 -3.234 -3.651 12.608 1.00 0.00 H new ATOM 1650 N GLY A 642 2.004 -4.361 10.154 1.00 0.00 N ATOM 1651 CA GLY A 642 2.602 -5.141 9.087 1.00 0.00 C ATOM 1652 C GLY A 642 2.486 -4.467 7.734 1.00 0.00 C ATOM 1653 O GLY A 642 1.767 -3.478 7.586 1.00 0.00 O ATOM 0 H GLY A 642 1.964 -3.356 9.982 1.00 0.00 H new ATOM 0 HA2 GLY A 642 3.654 -5.313 9.314 1.00 0.00 H new ATOM 0 HA3 GLY A 642 2.122 -6.118 9.044 1.00 0.00 H new ATOM 1657 N GLY A 643 3.196 -5.001 6.743 1.00 0.00 N ATOM 1658 CA GLY A 643 3.152 -4.428 5.410 1.00 0.00 C ATOM 1659 C GLY A 643 3.743 -5.348 4.361 1.00 0.00 C ATOM 1660 O GLY A 643 4.194 -6.450 4.673 1.00 0.00 O ATOM 0 H GLY A 643 3.799 -5.818 6.840 1.00 0.00 H new ATOM 0 HA2 GLY A 643 2.118 -4.203 5.149 1.00 0.00 H new ATOM 0 HA3 GLY A 643 3.695 -3.483 5.407 1.00 0.00 H new ATOM 1664 N CYS A 644 3.745 -4.896 3.111 1.00 0.00 N ATOM 1665 CA CYS A 644 4.288 -5.689 2.012 1.00 0.00 C ATOM 1666 C CYS A 644 4.977 -4.798 0.985 1.00 0.00 C ATOM 1667 O CYS A 644 4.710 -3.599 0.908 1.00 0.00 O ATOM 1668 CB CYS A 644 3.175 -6.495 1.339 1.00 0.00 C ATOM 1669 SG CYS A 644 3.460 -8.282 1.336 1.00 0.00 S ATOM 0 H CYS A 644 3.377 -3.986 2.833 1.00 0.00 H new ATOM 0 HA CYS A 644 5.027 -6.376 2.424 1.00 0.00 H new ATOM 0 HB2 CYS A 644 2.233 -6.288 1.847 1.00 0.00 H new ATOM 0 HB3 CYS A 644 3.064 -6.153 0.310 1.00 0.00 H new ATOM 0 HG CYS A 644 2.842 -8.822 2.344 1.00 0.00 H new ATOM 1675 N GLN A 645 5.863 -5.394 0.194 1.00 0.00 N ATOM 1676 CA GLN A 645 6.590 -4.656 -0.833 1.00 0.00 C ATOM 1677 C GLN A 645 6.108 -5.051 -2.224 1.00 0.00 C ATOM 1678 O GLN A 645 5.729 -6.198 -2.456 1.00 0.00 O ATOM 1679 CB GLN A 645 8.093 -4.910 -0.708 1.00 0.00 C ATOM 1680 CG GLN A 645 8.561 -6.167 -1.422 1.00 0.00 C ATOM 1681 CD GLN A 645 10.071 -6.259 -1.516 1.00 0.00 C ATOM 1682 OE1 GLN A 645 10.701 -5.542 -2.292 1.00 0.00 O ATOM 1683 NE2 GLN A 645 10.661 -7.145 -0.721 1.00 0.00 N ATOM 0 H GLN A 645 6.095 -6.386 0.244 1.00 0.00 H new ATOM 0 HA GLN A 645 6.398 -3.593 -0.688 1.00 0.00 H new ATOM 0 HB2 GLN A 645 8.632 -4.052 -1.110 1.00 0.00 H new ATOM 0 HB3 GLN A 645 8.354 -4.984 0.348 1.00 0.00 H new ATOM 0 HG2 GLN A 645 8.180 -7.042 -0.896 1.00 0.00 H new ATOM 0 HG3 GLN A 645 8.137 -6.189 -2.426 1.00 0.00 H new ATOM 0 HE21 GLN A 645 10.100 -7.720 -0.092 1.00 0.00 H new ATOM 0 HE22 GLN A 645 11.675 -7.251 -0.739 1.00 0.00 H new ATOM 1692 N LEU A 646 6.121 -4.095 -3.146 1.00 0.00 N ATOM 1693 CA LEU A 646 5.681 -4.351 -4.511 1.00 0.00 C ATOM 1694 C LEU A 646 6.617 -3.698 -5.523 1.00 0.00 C ATOM 1695 O LEU A 646 6.433 -2.541 -5.902 1.00 0.00 O ATOM 1696 CB LEU A 646 4.253 -3.842 -4.708 1.00 0.00 C ATOM 1697 CG LEU A 646 3.164 -4.744 -4.127 1.00 0.00 C ATOM 1698 CD1 LEU A 646 1.787 -4.166 -4.411 1.00 0.00 C ATOM 1699 CD2 LEU A 646 3.283 -6.151 -4.691 1.00 0.00 C ATOM 0 H LEU A 646 6.431 -3.139 -2.973 1.00 0.00 H new ATOM 0 HA LEU A 646 5.702 -5.428 -4.677 1.00 0.00 H new ATOM 0 HB2 LEU A 646 4.168 -2.855 -4.253 1.00 0.00 H new ATOM 0 HB3 LEU A 646 4.071 -3.718 -5.775 1.00 0.00 H new ATOM 0 HG LEU A 646 3.297 -4.796 -3.046 1.00 0.00 H new ATOM 0 HD11 LEU A 646 1.024 -4.821 -3.990 1.00 0.00 H new ATOM 0 HD12 LEU A 646 1.707 -3.178 -3.958 1.00 0.00 H new ATOM 0 HD13 LEU A 646 1.642 -4.085 -5.488 1.00 0.00 H new ATOM 0 HD21 LEU A 646 2.500 -6.780 -4.267 1.00 0.00 H new ATOM 0 HD22 LEU A 646 3.175 -6.119 -5.775 1.00 0.00 H new ATOM 0 HD23 LEU A 646 4.259 -6.564 -4.436 1.00 0.00 H new ATOM 1711 N GLY A 647 7.619 -4.453 -5.963 1.00 0.00 N ATOM 1712 CA GLY A 647 8.569 -3.943 -6.933 1.00 0.00 C ATOM 1713 C GLY A 647 8.844 -4.946 -8.035 1.00 0.00 C ATOM 1714 O GLY A 647 8.849 -6.152 -7.793 1.00 0.00 O ATOM 0 H GLY A 647 7.790 -5.413 -5.663 1.00 0.00 H new ATOM 0 HA2 GLY A 647 8.184 -3.021 -7.369 1.00 0.00 H new ATOM 0 HA3 GLY A 647 9.502 -3.692 -6.430 1.00 0.00 H new ATOM 1718 N ILE A 648 9.059 -4.454 -9.251 1.00 0.00 N ATOM 1719 CA ILE A 648 9.316 -5.320 -10.379 1.00 0.00 C ATOM 1720 C ILE A 648 10.560 -6.182 -10.156 1.00 0.00 C ATOM 1721 O ILE A 648 10.797 -7.146 -10.882 1.00 0.00 O ATOM 1722 CB ILE A 648 9.446 -4.494 -11.672 1.00 0.00 C ATOM 1723 CG1 ILE A 648 8.763 -5.207 -12.822 1.00 0.00 C ATOM 1724 CG2 ILE A 648 10.893 -4.189 -12.008 1.00 0.00 C ATOM 1725 CD1 ILE A 648 8.953 -4.522 -14.155 1.00 0.00 C ATOM 0 H ILE A 648 9.059 -3.458 -9.473 1.00 0.00 H new ATOM 0 HA ILE A 648 8.467 -5.995 -10.481 1.00 0.00 H new ATOM 0 HB ILE A 648 8.949 -3.538 -11.505 1.00 0.00 H new ATOM 0 HG12 ILE A 648 9.148 -6.225 -12.888 1.00 0.00 H new ATOM 0 HG13 ILE A 648 7.696 -5.282 -12.610 1.00 0.00 H new ATOM 0 HG21 ILE A 648 10.938 -3.605 -12.927 1.00 0.00 H new ATOM 0 HG22 ILE A 648 11.343 -3.620 -11.194 1.00 0.00 H new ATOM 0 HG23 ILE A 648 11.439 -5.122 -12.144 1.00 0.00 H new ATOM 0 HD11 ILE A 648 8.437 -5.087 -14.931 1.00 0.00 H new ATOM 0 HD12 ILE A 648 8.543 -3.513 -14.107 1.00 0.00 H new ATOM 0 HD13 ILE A 648 10.016 -4.470 -14.389 1.00 0.00 H new ATOM 1737 N SER A 649 11.343 -5.834 -9.141 1.00 0.00 N ATOM 1738 CA SER A 649 12.547 -6.589 -8.819 1.00 0.00 C ATOM 1739 C SER A 649 12.205 -7.763 -7.903 1.00 0.00 C ATOM 1740 O SER A 649 13.091 -8.394 -7.326 1.00 0.00 O ATOM 1741 CB SER A 649 13.581 -5.683 -8.148 1.00 0.00 C ATOM 1742 OG SER A 649 14.897 -6.163 -8.364 1.00 0.00 O ATOM 0 H SER A 649 11.166 -5.037 -8.529 1.00 0.00 H new ATOM 0 HA SER A 649 12.971 -6.977 -9.745 1.00 0.00 H new ATOM 0 HB2 SER A 649 13.491 -4.670 -8.541 1.00 0.00 H new ATOM 0 HB3 SER A 649 13.381 -5.629 -7.078 1.00 0.00 H new ATOM 0 HG SER A 649 15.539 -5.566 -7.926 1.00 0.00 H new ATOM 1748 N ALA A 650 10.910 -8.044 -7.777 1.00 0.00 N ATOM 1749 CA ALA A 650 10.433 -9.132 -6.936 1.00 0.00 C ATOM 1750 C ALA A 650 10.205 -10.399 -7.753 1.00 0.00 C ATOM 1751 O ALA A 650 10.657 -10.503 -8.893 1.00 0.00 O ATOM 1752 CB ALA A 650 9.147 -8.719 -6.235 1.00 0.00 C ATOM 0 H ALA A 650 10.170 -7.527 -8.252 1.00 0.00 H new ATOM 0 HA ALA A 650 11.197 -9.347 -6.188 1.00 0.00 H new ATOM 0 HB1 ALA A 650 8.796 -9.538 -5.607 1.00 0.00 H new ATOM 0 HB2 ALA A 650 9.336 -7.842 -5.616 1.00 0.00 H new ATOM 0 HB3 ALA A 650 8.387 -8.481 -6.979 1.00 0.00 H new ATOM 1802 N ARG A 654 4.280 -10.194 -5.990 1.00 0.00 N ATOM 1803 CA ARG A 654 4.838 -8.857 -5.849 1.00 0.00 C ATOM 1804 C ARG A 654 5.157 -8.264 -7.215 1.00 0.00 C ATOM 1805 O ARG A 654 5.078 -7.052 -7.414 1.00 0.00 O ATOM 1806 CB ARG A 654 6.103 -8.898 -4.991 1.00 0.00 C ATOM 1807 CG ARG A 654 5.966 -9.751 -3.740 1.00 0.00 C ATOM 1808 CD ARG A 654 5.976 -8.901 -2.488 1.00 0.00 C ATOM 1809 NE ARG A 654 6.411 -9.655 -1.315 1.00 0.00 N ATOM 1810 CZ ARG A 654 7.628 -10.173 -1.184 1.00 0.00 C ATOM 1811 NH1 ARG A 654 8.525 -10.012 -2.147 1.00 0.00 N ATOM 1812 NH2 ARG A 654 7.949 -10.849 -0.089 1.00 0.00 N ATOM 0 HA ARG A 654 4.097 -8.226 -5.358 1.00 0.00 H new ATOM 0 HB2 ARG A 654 6.927 -9.281 -5.593 1.00 0.00 H new ATOM 0 HB3 ARG A 654 6.367 -7.881 -4.700 1.00 0.00 H new ATOM 0 HG2 ARG A 654 5.038 -10.322 -3.787 1.00 0.00 H new ATOM 0 HG3 ARG A 654 6.782 -10.472 -3.698 1.00 0.00 H new ATOM 0 HD2 ARG A 654 6.637 -8.047 -2.635 1.00 0.00 H new ATOM 0 HD3 ARG A 654 4.976 -8.503 -2.312 1.00 0.00 H new ATOM 0 HE ARG A 654 5.744 -9.791 -0.555 1.00 0.00 H new ATOM 0 HH11 ARG A 654 8.281 -9.490 -2.989 1.00 0.00 H new ATOM 0 HH12 ARG A 654 9.459 -10.410 -2.046 1.00 0.00 H new ATOM 0 HH21 ARG A 654 7.261 -10.972 0.654 1.00 0.00 H new ATOM 0 HH22 ARG A 654 8.883 -11.246 0.010 1.00 0.00 H new ATOM 1826 N LEU A 655 5.518 -9.133 -8.152 1.00 0.00 N ATOM 1827 CA LEU A 655 5.852 -8.706 -9.504 1.00 0.00 C ATOM 1828 C LEU A 655 4.615 -8.702 -10.395 1.00 0.00 C ATOM 1829 O LEU A 655 4.359 -7.739 -11.118 1.00 0.00 O ATOM 1830 CB LEU A 655 6.918 -9.626 -10.100 1.00 0.00 C ATOM 1831 CG LEU A 655 7.442 -9.205 -11.474 1.00 0.00 C ATOM 1832 CD1 LEU A 655 8.461 -8.088 -11.331 1.00 0.00 C ATOM 1833 CD2 LEU A 655 8.048 -10.397 -12.200 1.00 0.00 C ATOM 0 H LEU A 655 5.587 -10.139 -7.999 1.00 0.00 H new ATOM 0 HA LEU A 655 6.243 -7.690 -9.452 1.00 0.00 H new ATOM 0 HB2 LEU A 655 7.759 -9.679 -9.408 1.00 0.00 H new ATOM 0 HB3 LEU A 655 6.506 -10.632 -10.178 1.00 0.00 H new ATOM 0 HG LEU A 655 6.606 -8.833 -12.067 1.00 0.00 H new ATOM 0 HD11 LEU A 655 8.825 -7.799 -12.317 1.00 0.00 H new ATOM 0 HD12 LEU A 655 7.994 -7.228 -10.850 1.00 0.00 H new ATOM 0 HD13 LEU A 655 9.297 -8.434 -10.723 1.00 0.00 H new ATOM 0 HD21 LEU A 655 8.416 -10.080 -13.176 1.00 0.00 H new ATOM 0 HD22 LEU A 655 8.874 -10.799 -11.614 1.00 0.00 H new ATOM 0 HD23 LEU A 655 7.288 -11.168 -12.331 1.00 0.00 H new ATOM 1845 N LYS A 656 3.854 -9.789 -10.340 1.00 0.00 N ATOM 1846 CA LYS A 656 2.645 -9.920 -11.144 1.00 0.00 C ATOM 1847 C LYS A 656 1.780 -8.667 -11.053 1.00 0.00 C ATOM 1848 O LYS A 656 1.601 -7.954 -12.038 1.00 0.00 O ATOM 1849 CB LYS A 656 1.839 -11.139 -10.691 1.00 0.00 C ATOM 1850 CG LYS A 656 1.944 -12.325 -11.637 1.00 0.00 C ATOM 1851 CD LYS A 656 0.756 -13.262 -11.488 1.00 0.00 C ATOM 1852 CE LYS A 656 1.205 -14.692 -11.227 1.00 0.00 C ATOM 1853 NZ LYS A 656 0.063 -15.646 -11.260 1.00 0.00 N ATOM 0 H LYS A 656 4.053 -10.594 -9.746 1.00 0.00 H new ATOM 0 HA LYS A 656 2.948 -10.051 -12.183 1.00 0.00 H new ATOM 0 HB2 LYS A 656 2.181 -11.443 -9.702 1.00 0.00 H new ATOM 0 HB3 LYS A 656 0.791 -10.855 -10.593 1.00 0.00 H new ATOM 0 HG2 LYS A 656 2.001 -11.968 -12.665 1.00 0.00 H new ATOM 0 HG3 LYS A 656 2.866 -12.870 -11.438 1.00 0.00 H new ATOM 0 HD2 LYS A 656 0.124 -12.922 -10.668 1.00 0.00 H new ATOM 0 HD3 LYS A 656 0.149 -13.229 -12.393 1.00 0.00 H new ATOM 0 HE2 LYS A 656 1.943 -14.983 -11.974 1.00 0.00 H new ATOM 0 HE3 LYS A 656 1.696 -14.747 -10.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 656 0.410 -16.609 -11.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 656 -0.630 -15.384 -10.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 656 -0.390 -15.613 -12.195 1.00 0.00 H new ATOM 1867 N HIS A 657 1.243 -8.407 -9.866 1.00 0.00 N ATOM 1868 CA HIS A 657 0.391 -7.244 -9.648 1.00 0.00 C ATOM 1869 C HIS A 657 1.107 -5.959 -10.043 1.00 0.00 C ATOM 1870 O HIS A 657 0.590 -5.159 -10.822 1.00 0.00 O ATOM 1871 CB HIS A 657 -0.035 -7.172 -8.181 1.00 0.00 C ATOM 1872 CG HIS A 657 -0.887 -5.984 -7.861 1.00 0.00 C ATOM 1873 ND1 HIS A 657 -1.362 -5.713 -6.595 1.00 0.00 N ATOM 1874 CD2 HIS A 657 -1.354 -4.992 -8.655 1.00 0.00 C ATOM 1875 CE1 HIS A 657 -2.088 -4.610 -6.625 1.00 0.00 C ATOM 1876 NE2 HIS A 657 -2.097 -4.151 -7.863 1.00 0.00 N ATOM 0 H HIS A 657 1.383 -8.987 -9.039 1.00 0.00 H new ATOM 0 HA HIS A 657 -0.494 -7.350 -10.276 1.00 0.00 H new ATOM 0 HB2 HIS A 657 -0.582 -8.080 -7.925 1.00 0.00 H new ATOM 0 HB3 HIS A 657 0.856 -7.149 -7.554 1.00 0.00 H new ATOM 0 HD1 HIS A 657 -1.181 -6.277 -5.764 1.00 0.00 H new ATOM 0 HD2 HIS A 657 -1.175 -4.882 -9.714 1.00 0.00 H new ATOM 0 HE1 HIS A 657 -2.589 -4.160 -5.781 1.00 0.00 H new ATOM 1885 N TRP A 658 2.297 -5.770 -9.494 1.00 0.00 N ATOM 1886 CA TRP A 658 3.093 -4.580 -9.774 1.00 0.00 C ATOM 1887 C TRP A 658 3.439 -4.479 -11.258 1.00 0.00 C ATOM 1888 O TRP A 658 2.850 -3.689 -11.993 1.00 0.00 O ATOM 1889 CB TRP A 658 4.376 -4.605 -8.943 1.00 0.00 C ATOM 1890 CG TRP A 658 5.328 -3.501 -9.286 1.00 0.00 C ATOM 1891 CD1 TRP A 658 6.547 -3.626 -9.888 1.00 0.00 C ATOM 1892 CD2 TRP A 658 5.138 -2.103 -9.044 1.00 0.00 C ATOM 1893 NE1 TRP A 658 7.129 -2.390 -10.036 1.00 0.00 N ATOM 1894 CE2 TRP A 658 6.282 -1.438 -9.525 1.00 0.00 C ATOM 1895 CE3 TRP A 658 4.111 -1.351 -8.468 1.00 0.00 C ATOM 1896 CZ2 TRP A 658 6.423 -0.054 -9.446 1.00 0.00 C ATOM 1897 CZ3 TRP A 658 4.254 0.022 -8.391 1.00 0.00 C ATOM 1898 CH2 TRP A 658 5.402 0.657 -8.878 1.00 0.00 C ATOM 0 H TRP A 658 2.736 -6.427 -8.849 1.00 0.00 H new ATOM 0 HA TRP A 658 2.500 -3.706 -9.504 1.00 0.00 H new ATOM 0 HB2 TRP A 658 4.117 -4.536 -7.886 1.00 0.00 H new ATOM 0 HB3 TRP A 658 4.875 -5.563 -9.087 1.00 0.00 H new ATOM 0 HD1 TRP A 658 6.989 -4.560 -10.202 1.00 0.00 H new ATOM 0 HE1 TRP A 658 8.041 -2.209 -10.456 1.00 0.00 H new ATOM 0 HE3 TRP A 658 3.222 -1.833 -8.090 1.00 0.00 H new ATOM 0 HZ2 TRP A 658 7.308 0.440 -9.820 1.00 0.00 H new ATOM 0 HZ3 TRP A 658 3.467 0.614 -7.948 1.00 0.00 H new ATOM 0 HH2 TRP A 658 5.483 1.731 -8.804 1.00 0.00 H new ATOM 1909 N TYR A 659 4.410 -5.277 -11.678 1.00 0.00 N ATOM 1910 CA TYR A 659 4.867 -5.288 -13.062 1.00 0.00 C ATOM 1911 C TYR A 659 3.706 -5.316 -14.055 1.00 0.00 C ATOM 1912 O TYR A 659 3.529 -4.379 -14.833 1.00 0.00 O ATOM 1913 CB TYR A 659 5.781 -6.494 -13.279 1.00 0.00 C ATOM 1914 CG TYR A 659 6.584 -6.474 -14.566 1.00 0.00 C ATOM 1915 CD1 TYR A 659 6.233 -5.658 -15.636 1.00 0.00 C ATOM 1916 CD2 TYR A 659 7.701 -7.288 -14.707 1.00 0.00 C ATOM 1917 CE1 TYR A 659 6.969 -5.655 -16.804 1.00 0.00 C ATOM 1918 CE2 TYR A 659 8.443 -7.291 -15.873 1.00 0.00 C ATOM 1919 CZ TYR A 659 8.072 -6.473 -16.918 1.00 0.00 C ATOM 1920 OH TYR A 659 8.808 -6.472 -18.081 1.00 0.00 O ATOM 0 H TYR A 659 4.902 -5.933 -11.072 1.00 0.00 H new ATOM 0 HA TYR A 659 5.416 -4.364 -13.244 1.00 0.00 H new ATOM 0 HB2 TYR A 659 6.473 -6.561 -12.439 1.00 0.00 H new ATOM 0 HB3 TYR A 659 5.172 -7.398 -13.264 1.00 0.00 H new ATOM 0 HD1 TYR A 659 5.369 -5.015 -15.552 1.00 0.00 H new ATOM 0 HD2 TYR A 659 7.995 -7.930 -13.890 1.00 0.00 H new ATOM 0 HE1 TYR A 659 6.682 -5.014 -17.625 1.00 0.00 H new ATOM 0 HE2 TYR A 659 9.308 -7.931 -15.965 1.00 0.00 H new ATOM 0 HH TYR A 659 9.553 -7.103 -17.997 1.00 0.00 H new ATOM 1930 N GLU A 660 2.923 -6.388 -14.048 1.00 0.00 N ATOM 1931 CA GLU A 660 1.812 -6.500 -14.977 1.00 0.00 C ATOM 1932 C GLU A 660 1.058 -5.180 -15.056 1.00 0.00 C ATOM 1933 O GLU A 660 0.530 -4.817 -16.106 1.00 0.00 O ATOM 1934 CB GLU A 660 0.873 -7.638 -14.572 1.00 0.00 C ATOM 1935 CG GLU A 660 -0.246 -7.207 -13.642 1.00 0.00 C ATOM 1936 CD GLU A 660 -0.889 -8.375 -12.921 1.00 0.00 C ATOM 1937 OE1 GLU A 660 -0.289 -9.470 -12.911 1.00 0.00 O ATOM 1938 OE2 GLU A 660 -1.993 -8.194 -12.364 1.00 0.00 O ATOM 0 H GLU A 660 3.036 -7.181 -13.417 1.00 0.00 H new ATOM 0 HA GLU A 660 2.211 -6.732 -15.964 1.00 0.00 H new ATOM 0 HB2 GLU A 660 0.438 -8.075 -15.471 1.00 0.00 H new ATOM 0 HB3 GLU A 660 1.455 -8.421 -14.086 1.00 0.00 H new ATOM 0 HG2 GLU A 660 0.148 -6.504 -12.908 1.00 0.00 H new ATOM 0 HG3 GLU A 660 -1.006 -6.676 -14.216 1.00 0.00 H new ATOM 1945 N CYS A 661 1.033 -4.453 -13.944 1.00 0.00 N ATOM 1946 CA CYS A 661 0.365 -3.161 -13.906 1.00 0.00 C ATOM 1947 C CYS A 661 1.055 -2.202 -14.865 1.00 0.00 C ATOM 1948 O CYS A 661 0.403 -1.462 -15.601 1.00 0.00 O ATOM 1949 CB CYS A 661 0.370 -2.585 -12.490 1.00 0.00 C ATOM 1950 SG CYS A 661 -0.772 -1.203 -12.257 1.00 0.00 S ATOM 0 H CYS A 661 1.465 -4.735 -13.064 1.00 0.00 H new ATOM 0 HA CYS A 661 -0.672 -3.296 -14.212 1.00 0.00 H new ATOM 0 HB2 CYS A 661 0.115 -3.377 -11.785 1.00 0.00 H new ATOM 0 HB3 CYS A 661 1.380 -2.254 -12.246 1.00 0.00 H new ATOM 0 HG CYS A 661 -0.929 -0.575 -13.384 1.00 0.00 H new ATOM 1956 N LEU A 662 2.385 -2.240 -14.864 1.00 0.00 N ATOM 1957 CA LEU A 662 3.173 -1.396 -15.748 1.00 0.00 C ATOM 1958 C LEU A 662 2.722 -1.595 -17.188 1.00 0.00 C ATOM 1959 O LEU A 662 2.782 -0.676 -18.003 1.00 0.00 O ATOM 1960 CB LEU A 662 4.661 -1.720 -15.606 1.00 0.00 C ATOM 1961 CG LEU A 662 5.424 -0.824 -14.628 1.00 0.00 C ATOM 1962 CD1 LEU A 662 5.694 -1.556 -13.323 1.00 0.00 C ATOM 1963 CD2 LEU A 662 6.724 -0.346 -15.250 1.00 0.00 C ATOM 0 H LEU A 662 2.937 -2.848 -14.259 1.00 0.00 H new ATOM 0 HA LEU A 662 3.021 -0.353 -15.471 1.00 0.00 H new ATOM 0 HB2 LEU A 662 4.763 -2.756 -15.283 1.00 0.00 H new ATOM 0 HB3 LEU A 662 5.130 -1.644 -16.587 1.00 0.00 H new ATOM 0 HG LEU A 662 4.805 0.046 -14.408 1.00 0.00 H new ATOM 0 HD11 LEU A 662 6.237 -0.900 -12.643 1.00 0.00 H new ATOM 0 HD12 LEU A 662 4.748 -1.848 -12.867 1.00 0.00 H new ATOM 0 HD13 LEU A 662 6.291 -2.446 -13.522 1.00 0.00 H new ATOM 0 HD21 LEU A 662 7.254 0.290 -14.541 1.00 0.00 H new ATOM 0 HD22 LEU A 662 7.345 -1.206 -15.501 1.00 0.00 H new ATOM 0 HD23 LEU A 662 6.507 0.222 -16.155 1.00 0.00 H new ATOM 1975 N LYS A 663 2.254 -2.802 -17.489 1.00 0.00 N ATOM 1976 CA LYS A 663 1.772 -3.120 -18.824 1.00 0.00 C ATOM 1977 C LYS A 663 0.342 -2.615 -18.988 1.00 0.00 C ATOM 1978 O LYS A 663 -0.030 -2.081 -20.031 1.00 0.00 O ATOM 1979 CB LYS A 663 1.855 -4.637 -19.067 1.00 0.00 C ATOM 1980 CG LYS A 663 0.508 -5.334 -19.219 1.00 0.00 C ATOM 1981 CD LYS A 663 0.668 -6.737 -19.782 1.00 0.00 C ATOM 1982 CE LYS A 663 1.570 -6.745 -21.005 1.00 0.00 C ATOM 1983 NZ LYS A 663 1.151 -5.730 -22.010 1.00 0.00 N ATOM 0 H LYS A 663 2.199 -3.574 -16.825 1.00 0.00 H new ATOM 0 HA LYS A 663 2.399 -2.624 -19.565 1.00 0.00 H new ATOM 0 HB2 LYS A 663 2.444 -4.815 -19.967 1.00 0.00 H new ATOM 0 HB3 LYS A 663 2.394 -5.095 -18.237 1.00 0.00 H new ATOM 0 HG2 LYS A 663 0.011 -5.384 -18.250 1.00 0.00 H new ATOM 0 HG3 LYS A 663 -0.134 -4.748 -19.876 1.00 0.00 H new ATOM 0 HD2 LYS A 663 1.084 -7.392 -19.017 1.00 0.00 H new ATOM 0 HD3 LYS A 663 -0.310 -7.138 -20.047 1.00 0.00 H new ATOM 0 HE2 LYS A 663 2.598 -6.550 -20.699 1.00 0.00 H new ATOM 0 HE3 LYS A 663 1.555 -7.735 -21.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 663 1.275 -6.117 -22.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 663 0.151 -5.487 -21.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 663 1.734 -4.875 -21.904 1.00 0.00 H new ATOM 1997 N ASN A 664 -0.446 -2.787 -17.934 1.00 0.00 N ATOM 1998 CA ASN A 664 -1.835 -2.351 -17.932 1.00 0.00 C ATOM 1999 C ASN A 664 -1.978 -1.021 -17.197 1.00 0.00 C ATOM 2000 O ASN A 664 -2.555 -0.959 -16.111 1.00 0.00 O ATOM 2001 CB ASN A 664 -2.720 -3.409 -17.273 1.00 0.00 C ATOM 2002 CG ASN A 664 -3.295 -4.390 -18.276 1.00 0.00 C ATOM 2003 OD1 ASN A 664 -3.792 -3.996 -19.332 1.00 0.00 O ATOM 2004 ND2 ASN A 664 -3.230 -5.675 -17.951 1.00 0.00 N ATOM 0 H ASN A 664 -0.144 -3.228 -17.065 1.00 0.00 H new ATOM 0 HA ASN A 664 -2.154 -2.215 -18.965 1.00 0.00 H new ATOM 0 HB2 ASN A 664 -2.138 -3.953 -16.529 1.00 0.00 H new ATOM 0 HB3 ASN A 664 -3.535 -2.917 -16.742 1.00 0.00 H new ATOM 0 HD21 ASN A 664 -3.601 -6.381 -18.587 1.00 0.00 H new ATOM 0 HD22 ASN A 664 -2.809 -5.956 -17.065 1.00 0.00 H new ATOM 2011 N LYS A 665 -1.439 0.038 -17.792 1.00 0.00 N ATOM 2012 CA LYS A 665 -1.495 1.367 -17.192 1.00 0.00 C ATOM 2013 C LYS A 665 -2.936 1.812 -16.954 1.00 0.00 C ATOM 2014 O LYS A 665 -3.441 1.736 -15.836 1.00 0.00 O ATOM 2015 CB LYS A 665 -0.777 2.382 -18.084 1.00 0.00 C ATOM 2016 CG LYS A 665 0.682 2.043 -18.338 1.00 0.00 C ATOM 2017 CD LYS A 665 0.892 1.508 -19.745 1.00 0.00 C ATOM 2018 CE LYS A 665 2.361 1.248 -20.031 1.00 0.00 C ATOM 2019 NZ LYS A 665 2.738 1.647 -21.415 1.00 0.00 N ATOM 0 H LYS A 665 -0.958 0.002 -18.691 1.00 0.00 H new ATOM 0 HA LYS A 665 -0.992 1.316 -16.226 1.00 0.00 H new ATOM 0 HB2 LYS A 665 -1.298 2.446 -19.039 1.00 0.00 H new ATOM 0 HB3 LYS A 665 -0.837 3.367 -17.621 1.00 0.00 H new ATOM 0 HG2 LYS A 665 1.294 2.933 -18.191 1.00 0.00 H new ATOM 0 HG3 LYS A 665 1.016 1.302 -17.612 1.00 0.00 H new ATOM 0 HD2 LYS A 665 0.327 0.584 -19.872 1.00 0.00 H new ATOM 0 HD3 LYS A 665 0.501 2.223 -20.469 1.00 0.00 H new ATOM 0 HE2 LYS A 665 2.973 1.798 -19.316 1.00 0.00 H new ATOM 0 HE3 LYS A 665 2.577 0.189 -19.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 665 3.748 1.453 -21.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 665 2.173 1.104 -22.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 665 2.557 2.663 -21.545 1.00 0.00 H new ATOM 2033 N ASP A 666 -3.589 2.285 -18.012 1.00 0.00 N ATOM 2034 CA ASP A 666 -4.968 2.755 -17.923 1.00 0.00 C ATOM 2035 C ASP A 666 -5.858 1.771 -17.165 1.00 0.00 C ATOM 2036 O ASP A 666 -6.916 2.145 -16.660 1.00 0.00 O ATOM 2037 CB ASP A 666 -5.536 2.992 -19.323 1.00 0.00 C ATOM 2038 CG ASP A 666 -5.565 4.461 -19.695 1.00 0.00 C ATOM 2039 OD1 ASP A 666 -5.014 5.278 -18.929 1.00 0.00 O ATOM 2040 OD2 ASP A 666 -6.139 4.794 -20.753 1.00 0.00 O ATOM 0 H ASP A 666 -3.183 2.353 -18.945 1.00 0.00 H new ATOM 0 HA ASP A 666 -4.958 3.693 -17.368 1.00 0.00 H new ATOM 0 HB2 ASP A 666 -4.936 2.447 -20.052 1.00 0.00 H new ATOM 0 HB3 ASP A 666 -6.547 2.587 -19.375 1.00 0.00 H new ATOM 2045 N LYS A 667 -5.429 0.517 -17.088 1.00 0.00 N ATOM 2046 CA LYS A 667 -6.198 -0.508 -16.391 1.00 0.00 C ATOM 2047 C LYS A 667 -5.669 -0.713 -14.977 1.00 0.00 C ATOM 2048 O LYS A 667 -4.463 -0.854 -14.768 1.00 0.00 O ATOM 2049 CB LYS A 667 -6.158 -1.825 -17.166 1.00 0.00 C ATOM 2050 CG LYS A 667 -6.054 -1.637 -18.671 1.00 0.00 C ATOM 2051 CD LYS A 667 -6.157 -2.962 -19.409 1.00 0.00 C ATOM 2052 CE LYS A 667 -7.535 -3.152 -20.023 1.00 0.00 C ATOM 2053 NZ LYS A 667 -8.620 -2.989 -19.017 1.00 0.00 N ATOM 0 H LYS A 667 -4.556 0.186 -17.498 1.00 0.00 H new ATOM 0 HA LYS A 667 -7.233 -0.171 -16.326 1.00 0.00 H new ATOM 0 HB2 LYS A 667 -5.309 -2.415 -16.821 1.00 0.00 H new ATOM 0 HB3 LYS A 667 -7.057 -2.398 -16.940 1.00 0.00 H new ATOM 0 HG2 LYS A 667 -6.845 -0.968 -19.010 1.00 0.00 H new ATOM 0 HG3 LYS A 667 -5.106 -1.157 -18.914 1.00 0.00 H new ATOM 0 HD2 LYS A 667 -5.400 -3.003 -20.192 1.00 0.00 H new ATOM 0 HD3 LYS A 667 -5.948 -3.781 -18.720 1.00 0.00 H new ATOM 0 HE2 LYS A 667 -7.676 -2.431 -20.828 1.00 0.00 H new ATOM 0 HE3 LYS A 667 -7.600 -4.145 -20.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 667 -9.519 -3.322 -19.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 667 -8.393 -3.546 -18.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 667 -8.707 -1.985 -18.759 1.00 0.00 H new ATOM 2067 N LYS A 668 -6.576 -0.716 -14.009 1.00 0.00 N ATOM 2068 CA LYS A 668 -6.202 -0.891 -12.610 1.00 0.00 C ATOM 2069 C LYS A 668 -5.971 -2.360 -12.273 1.00 0.00 C ATOM 2070 O LYS A 668 -6.391 -3.254 -13.009 1.00 0.00 O ATOM 2071 CB LYS A 668 -7.279 -0.309 -11.689 1.00 0.00 C ATOM 2072 CG LYS A 668 -8.692 -0.435 -12.238 1.00 0.00 C ATOM 2073 CD LYS A 668 -8.963 -1.833 -12.771 1.00 0.00 C ATOM 2074 CE LYS A 668 -9.154 -2.832 -11.641 1.00 0.00 C ATOM 2075 NZ LYS A 668 -10.590 -3.172 -11.437 1.00 0.00 N ATOM 0 H LYS A 668 -7.577 -0.599 -14.166 1.00 0.00 H new ATOM 0 HA LYS A 668 -5.267 -0.354 -12.452 1.00 0.00 H new ATOM 0 HB2 LYS A 668 -7.228 -0.812 -10.723 1.00 0.00 H new ATOM 0 HB3 LYS A 668 -7.061 0.744 -11.511 1.00 0.00 H new ATOM 0 HG2 LYS A 668 -9.410 -0.199 -11.453 1.00 0.00 H new ATOM 0 HG3 LYS A 668 -8.840 0.294 -13.035 1.00 0.00 H new ATOM 0 HD2 LYS A 668 -9.854 -1.818 -13.399 1.00 0.00 H new ATOM 0 HD3 LYS A 668 -8.133 -2.150 -13.402 1.00 0.00 H new ATOM 0 HE2 LYS A 668 -8.594 -3.741 -11.861 1.00 0.00 H new ATOM 0 HE3 LYS A 668 -8.744 -2.420 -10.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 668 -10.719 -3.582 -10.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 668 -11.166 -2.310 -11.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 668 -10.889 -3.861 -12.156 1.00 0.00 H new ATOM 2089 N ILE A 669 -5.303 -2.599 -11.149 1.00 0.00 N ATOM 2090 CA ILE A 669 -5.015 -3.954 -10.698 1.00 0.00 C ATOM 2091 C ILE A 669 -5.233 -4.079 -9.197 1.00 0.00 C ATOM 2092 O ILE A 669 -4.564 -3.415 -8.408 1.00 0.00 O ATOM 2093 CB ILE A 669 -3.569 -4.367 -11.023 1.00 0.00 C ATOM 2094 CG1 ILE A 669 -3.313 -4.249 -12.533 1.00 0.00 C ATOM 2095 CG2 ILE A 669 -3.304 -5.779 -10.514 1.00 0.00 C ATOM 2096 CD1 ILE A 669 -2.610 -5.445 -13.142 1.00 0.00 C ATOM 0 H ILE A 669 -4.950 -1.868 -10.532 1.00 0.00 H new ATOM 0 HA ILE A 669 -5.699 -4.616 -11.229 1.00 0.00 H new ATOM 0 HB ILE A 669 -2.876 -3.695 -10.517 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -4.267 -4.105 -13.041 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -2.715 -3.357 -12.720 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -2.278 -6.064 -10.748 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -3.452 -5.810 -9.435 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -3.992 -6.474 -10.995 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -2.469 -5.279 -14.210 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -1.640 -5.579 -12.664 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -3.215 -6.339 -12.991 1.00 0.00 H new ATOM 2108 N GLU A 670 -6.175 -4.929 -8.809 1.00 0.00 N ATOM 2109 CA GLU A 670 -6.482 -5.131 -7.397 1.00 0.00 C ATOM 2110 C GLU A 670 -6.000 -6.492 -6.913 1.00 0.00 C ATOM 2111 O GLU A 670 -6.248 -7.514 -7.551 1.00 0.00 O ATOM 2112 CB GLU A 670 -7.988 -5.000 -7.159 1.00 0.00 C ATOM 2113 CG GLU A 670 -8.462 -3.562 -7.037 1.00 0.00 C ATOM 2114 CD GLU A 670 -9.131 -3.059 -8.301 1.00 0.00 C ATOM 2115 OE1 GLU A 670 -9.273 -3.853 -9.254 1.00 0.00 O ATOM 2116 OE2 GLU A 670 -9.512 -1.869 -8.338 1.00 0.00 O ATOM 0 H GLU A 670 -6.739 -5.488 -9.449 1.00 0.00 H new ATOM 0 HA GLU A 670 -5.957 -4.362 -6.830 1.00 0.00 H new ATOM 0 HB2 GLU A 670 -8.520 -5.481 -7.980 1.00 0.00 H new ATOM 0 HB3 GLU A 670 -8.252 -5.539 -6.249 1.00 0.00 H new ATOM 0 HG2 GLU A 670 -9.161 -3.483 -6.204 1.00 0.00 H new ATOM 0 HG3 GLU A 670 -7.612 -2.922 -6.801 1.00 0.00 H new ATOM 2123 N ARG A 671 -5.308 -6.494 -5.779 1.00 0.00 N ATOM 2124 CA ARG A 671 -4.789 -7.731 -5.205 1.00 0.00 C ATOM 2125 C ARG A 671 -4.661 -7.632 -3.689 1.00 0.00 C ATOM 2126 O ARG A 671 -4.643 -6.539 -3.124 1.00 0.00 O ATOM 2127 CB ARG A 671 -3.432 -8.063 -5.818 1.00 0.00 C ATOM 2128 CG ARG A 671 -3.497 -8.291 -7.314 1.00 0.00 C ATOM 2129 CD ARG A 671 -4.205 -9.596 -7.639 1.00 0.00 C ATOM 2130 NE ARG A 671 -3.312 -10.563 -8.270 1.00 0.00 N ATOM 2131 CZ ARG A 671 -3.718 -11.730 -8.760 1.00 0.00 C ATOM 2132 NH1 ARG A 671 -4.999 -12.069 -8.691 1.00 0.00 N ATOM 2133 NH2 ARG A 671 -2.846 -12.558 -9.318 1.00 0.00 N ATOM 0 H ARG A 671 -5.094 -5.655 -5.240 1.00 0.00 H new ATOM 0 HA ARG A 671 -5.497 -8.528 -5.433 1.00 0.00 H new ATOM 0 HB2 ARG A 671 -2.737 -7.249 -5.610 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -3.031 -8.955 -5.337 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -4.021 -7.462 -7.789 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -2.488 -8.309 -7.726 1.00 0.00 H new ATOM 0 HD2 ARG A 671 -4.613 -10.024 -6.724 1.00 0.00 H new ATOM 0 HD3 ARG A 671 -5.048 -9.396 -8.301 1.00 0.00 H new ATOM 0 HE ARG A 671 -2.321 -10.330 -8.339 1.00 0.00 H new ATOM 0 HH11 ARG A 671 -5.672 -11.434 -8.262 1.00 0.00 H new ATOM 0 HH12 ARG A 671 -5.311 -12.965 -9.067 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -1.861 -12.300 -9.372 1.00 0.00 H new ATOM 0 HH22 ARG A 671 -3.160 -13.453 -9.693 1.00 0.00 H new ATOM 2147 N TRP A 672 -4.570 -8.789 -3.038 1.00 0.00 N ATOM 2148 CA TRP A 672 -4.439 -8.845 -1.586 1.00 0.00 C ATOM 2149 C TRP A 672 -3.000 -9.150 -1.185 1.00 0.00 C ATOM 2150 O TRP A 672 -2.364 -10.040 -1.750 1.00 0.00 O ATOM 2151 CB TRP A 672 -5.380 -9.903 -1.006 1.00 0.00 C ATOM 2152 CG TRP A 672 -6.807 -9.455 -0.958 1.00 0.00 C ATOM 2153 CD1 TRP A 672 -7.760 -9.656 -1.914 1.00 0.00 C ATOM 2154 CD2 TRP A 672 -7.441 -8.719 0.095 1.00 0.00 C ATOM 2155 NE1 TRP A 672 -8.948 -9.091 -1.520 1.00 0.00 N ATOM 2156 CE2 TRP A 672 -8.778 -8.510 -0.291 1.00 0.00 C ATOM 2157 CE3 TRP A 672 -7.010 -8.219 1.328 1.00 0.00 C ATOM 2158 CZ2 TRP A 672 -9.685 -7.820 0.508 1.00 0.00 C ATOM 2159 CZ3 TRP A 672 -7.911 -7.535 2.122 1.00 0.00 C ATOM 2160 CH2 TRP A 672 -9.236 -7.341 1.709 1.00 0.00 C ATOM 0 H TRP A 672 -4.585 -9.701 -3.494 1.00 0.00 H new ATOM 0 HA TRP A 672 -4.712 -7.870 -1.182 1.00 0.00 H new ATOM 0 HB2 TRP A 672 -5.310 -10.811 -1.605 1.00 0.00 H new ATOM 0 HB3 TRP A 672 -5.052 -10.160 0.001 1.00 0.00 H new ATOM 0 HD1 TRP A 672 -7.603 -10.182 -2.844 1.00 0.00 H new ATOM 0 HE1 TRP A 672 -9.816 -9.102 -2.055 1.00 0.00 H new ATOM 0 HE3 TRP A 672 -5.991 -8.365 1.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 672 -10.706 -7.668 0.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 672 -7.589 -7.144 3.076 1.00 0.00 H new ATOM 0 HH2 TRP A 672 -9.917 -6.802 2.352 1.00 0.00 H new ATOM 2171 N HIS A 673 -2.491 -8.401 -0.213 1.00 0.00 N ATOM 2172 CA HIS A 673 -1.124 -8.591 0.255 1.00 0.00 C ATOM 2173 C HIS A 673 -1.089 -8.939 1.739 1.00 0.00 C ATOM 2174 O HIS A 673 -1.691 -8.251 2.563 1.00 0.00 O ATOM 2175 CB HIS A 673 -0.298 -7.331 -0.002 1.00 0.00 C ATOM 2176 CG HIS A 673 -0.188 -6.976 -1.453 1.00 0.00 C ATOM 2177 ND1 HIS A 673 0.363 -7.804 -2.405 1.00 0.00 N ATOM 2178 CD2 HIS A 673 -0.575 -5.854 -2.111 1.00 0.00 C ATOM 2179 CE1 HIS A 673 0.295 -7.175 -3.587 1.00 0.00 C ATOM 2180 NE2 HIS A 673 -0.266 -5.988 -3.462 1.00 0.00 N ATOM 0 H HIS A 673 -3.003 -7.659 0.265 1.00 0.00 H new ATOM 0 HA HIS A 673 -0.694 -9.425 -0.300 1.00 0.00 H new ATOM 0 HB2 HIS A 673 -0.747 -6.496 0.536 1.00 0.00 H new ATOM 0 HB3 HIS A 673 0.703 -7.472 0.407 1.00 0.00 H new ATOM 0 HD1 HIS A 673 0.754 -8.732 -2.240 1.00 0.00 H new ATOM 0 HD2 HIS A 673 -1.047 -4.994 -1.659 1.00 0.00 H new ATOM 0 HE1 HIS A 673 0.653 -7.586 -4.519 1.00 0.00 H new ATOM 2188 N GLN A 674 -0.373 -10.008 2.070 1.00 0.00 N ATOM 2189 CA GLN A 674 -0.247 -10.447 3.454 1.00 0.00 C ATOM 2190 C GLN A 674 0.718 -9.544 4.213 1.00 0.00 C ATOM 2191 O GLN A 674 1.884 -9.417 3.842 1.00 0.00 O ATOM 2192 CB GLN A 674 0.238 -11.897 3.511 1.00 0.00 C ATOM 2193 CG GLN A 674 -0.842 -12.912 3.180 1.00 0.00 C ATOM 2194 CD GLN A 674 -0.306 -14.329 3.106 1.00 0.00 C ATOM 2195 OE1 GLN A 674 0.438 -14.771 3.982 1.00 0.00 O ATOM 2196 NE2 GLN A 674 -0.681 -15.050 2.055 1.00 0.00 N ATOM 0 H GLN A 674 0.130 -10.587 1.397 1.00 0.00 H new ATOM 0 HA GLN A 674 -1.228 -10.386 3.925 1.00 0.00 H new ATOM 0 HB2 GLN A 674 1.068 -12.022 2.815 1.00 0.00 H new ATOM 0 HB3 GLN A 674 0.625 -12.103 4.509 1.00 0.00 H new ATOM 0 HG2 GLN A 674 -1.626 -12.863 3.936 1.00 0.00 H new ATOM 0 HG3 GLN A 674 -1.301 -12.651 2.227 1.00 0.00 H new ATOM 0 HE21 GLN A 674 -1.299 -14.644 1.352 1.00 0.00 H new ATOM 0 HE22 GLN A 674 -0.351 -16.009 1.951 1.00 0.00 H new ATOM 2205 N LEU A 675 0.221 -8.908 5.266 1.00 0.00 N ATOM 2206 CA LEU A 675 1.038 -8.006 6.065 1.00 0.00 C ATOM 2207 C LEU A 675 2.298 -8.694 6.571 1.00 0.00 C ATOM 2208 O LEU A 675 2.241 -9.767 7.172 1.00 0.00 O ATOM 2209 CB LEU A 675 0.236 -7.456 7.241 1.00 0.00 C ATOM 2210 CG LEU A 675 -0.980 -6.623 6.844 1.00 0.00 C ATOM 2211 CD1 LEU A 675 -1.759 -6.191 8.075 1.00 0.00 C ATOM 2212 CD2 LEU A 675 -0.550 -5.413 6.029 1.00 0.00 C ATOM 0 H LEU A 675 -0.743 -9.000 5.586 1.00 0.00 H new ATOM 0 HA LEU A 675 1.339 -7.180 5.421 1.00 0.00 H new ATOM 0 HB2 LEU A 675 -0.097 -8.290 7.859 1.00 0.00 H new ATOM 0 HB3 LEU A 675 0.894 -6.844 7.858 1.00 0.00 H new ATOM 0 HG LEU A 675 -1.634 -7.240 6.227 1.00 0.00 H new ATOM 0 HD11 LEU A 675 -2.622 -5.598 7.770 1.00 0.00 H new ATOM 0 HD12 LEU A 675 -2.098 -7.073 8.619 1.00 0.00 H new ATOM 0 HD13 LEU A 675 -1.117 -5.592 8.720 1.00 0.00 H new ATOM 0 HD21 LEU A 675 -1.428 -4.829 5.754 1.00 0.00 H new ATOM 0 HD22 LEU A 675 0.125 -4.796 6.622 1.00 0.00 H new ATOM 0 HD23 LEU A 675 -0.038 -5.746 5.126 1.00 0.00 H new ATOM 2224 N GLN A 676 3.433 -8.059 6.317 1.00 0.00 N ATOM 2225 CA GLN A 676 4.724 -8.587 6.733 1.00 0.00 C ATOM 2226 C GLN A 676 5.289 -7.791 7.908 1.00 0.00 C ATOM 2227 O GLN A 676 4.667 -6.843 8.383 1.00 0.00 O ATOM 2228 CB GLN A 676 5.697 -8.561 5.548 1.00 0.00 C ATOM 2229 CG GLN A 676 6.673 -7.391 5.556 1.00 0.00 C ATOM 2230 CD GLN A 676 7.607 -7.405 4.361 1.00 0.00 C ATOM 2231 OE1 GLN A 676 8.576 -8.163 4.325 1.00 0.00 O ATOM 2232 NE2 GLN A 676 7.318 -6.563 3.375 1.00 0.00 N ATOM 0 H GLN A 676 3.485 -7.170 5.820 1.00 0.00 H new ATOM 0 HA GLN A 676 4.590 -9.617 7.064 1.00 0.00 H new ATOM 0 HB2 GLN A 676 6.265 -9.491 5.540 1.00 0.00 H new ATOM 0 HB3 GLN A 676 5.122 -8.531 4.623 1.00 0.00 H new ATOM 0 HG2 GLN A 676 6.114 -6.456 5.565 1.00 0.00 H new ATOM 0 HG3 GLN A 676 7.261 -7.419 6.473 1.00 0.00 H new ATOM 0 HE21 GLN A 676 6.504 -5.953 3.448 1.00 0.00 H new ATOM 0 HE22 GLN A 676 7.910 -6.527 2.545 1.00 0.00 H new ATOM 2241 N ASN A 677 6.474 -8.180 8.365 1.00 0.00 N ATOM 2242 CA ASN A 677 7.128 -7.499 9.478 1.00 0.00 C ATOM 2243 C ASN A 677 8.492 -6.964 9.053 1.00 0.00 C ATOM 2244 O ASN A 677 9.398 -7.735 8.731 1.00 0.00 O ATOM 2245 CB ASN A 677 7.284 -8.450 10.665 1.00 0.00 C ATOM 2246 CG ASN A 677 6.199 -8.261 11.706 1.00 0.00 C ATOM 2247 OD1 ASN A 677 5.111 -7.770 11.404 1.00 0.00 O ATOM 2248 ND2 ASN A 677 6.491 -8.650 12.942 1.00 0.00 N ATOM 0 H ASN A 677 7.002 -8.964 7.982 1.00 0.00 H new ATOM 0 HA ASN A 677 6.503 -6.658 9.780 1.00 0.00 H new ATOM 0 HB2 ASN A 677 7.264 -9.479 10.307 1.00 0.00 H new ATOM 0 HB3 ASN A 677 8.258 -8.292 11.127 1.00 0.00 H new ATOM 0 HD21 ASN A 677 5.801 -8.547 13.686 1.00 0.00 H new ATOM 0 HD22 ASN A 677 7.406 -9.052 13.147 1.00 0.00 H new