USER MOD reduce.3.24.130724 H: found=0, std=0, add=1088, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1080 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 588 TYR OH : rot 180:sc= -0.475 USER MOD Set 1.2: A 622 GLN : amide:sc= -6.42! C(o=-6.9!,f=-16!) USER MOD Set 2.1: A 589 ASN : amide:sc= -2.66! K(o=-2.3!,f=-0.36) USER MOD Set 2.2: A 611 SER OG : rot 39:sc= 0.35 USER MOD Set 3.1: A 579 ASN : amide:sc= -5.09 K(o=-8.1,f=-5.5!) USER MOD Set 3.2: A 581 ASN : amide:sc= -2.97! C(o=-8.1!,f=-5.5!) USER MOD Set 4.1: A 553 GLN : amide:sc= -0.344 X(o=-0.34,f=-0.16) USER MOD Set 4.2: A 565 HIS : no HD1:sc= 0 X(o=-0.34,f=-0.16) USER MOD Single : A 544 HIS : no HD1:sc= -0.141 X(o=-0.14,f=-0.27) USER MOD Single : A 545 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 546 GLN : amide:sc= -0.321 X(o=-0.32,f=0) USER MOD Single : A 551 HIS : no HD1:sc= -0.494 X(o=-0.49,f=-0.94) USER MOD Single : A 558 ASN : amide:sc= -0.977 K(o=-0.98,f=-1.8) USER MOD Single : A 560 MET CE :methyl 146:sc= -0.483 (180deg=-1.64) USER MOD Single : A 567 SER OG : rot 180:sc= 0 USER MOD Single : A 571 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 575 THR OG1 : rot 71:sc= 0.426 USER MOD Single : A 576 HIS : no HD1:sc= -13.1! C(o=-13!,f=-13!) USER MOD Single : A 577 HIS : no HE2:sc= -8.61! C(o=-8.6!,f=-8.2!) USER MOD Single : A 583 ASN : amide:sc= -0.215 X(o=-0.21,f=-0.21) USER MOD Single : A 585 SER OG : rot -77:sc= 0.377 USER MOD Single : A 586 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 587 TYR OH : rot -66:sc= 0.398 USER MOD Single : A 591 SER OG : rot -174:sc= -0.722 USER MOD Single : A 598 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 599 LYS NZ :NH3+ 141:sc= -0.0829 (180deg=-1.16!) USER MOD Single : A 602 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 605 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 614 ASN : amide:sc= -4.14! K(o=-4.1!,f=-2.5) USER MOD Single : A 623 MET CE :methyl -120:sc= -0.0387 (180deg=-1.17) USER MOD Single : A 625 TYR OH : rot -160:sc= 0.304 USER MOD Single : A 626 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 627 SER OG : rot -53:sc= 0.646 USER MOD Single : A 629 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 634 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 637 SER OG : rot 170:sc= -1.28 USER MOD Single : A 638 MET CE :methyl -140:sc= -10.5! (180deg=-12.1!) USER MOD Single : A 642 THR OG1 : rot -90:sc= 0.744 USER MOD Single : A 644 GLN : amide:sc= -0.655 X(o=-0.66,f=-0.43) USER MOD Single : A 648 GLN : amide:sc= -4.28! K(o=-4.3!,f=-1.6) USER MOD Single : A 650 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 653 SER OG : rot 180:sc= 0 USER MOD Single : A 658 SER OG : rot 180:sc= 0 USER MOD Single : A 666 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 667 HIS : no HE2:sc= -4.24! C(o=-4.2!,f=-2.7!) USER MOD Single : A 668 CYS SG : rot 94:sc= -3.23! USER MOD Single : A 671 ASN : amide:sc= -1.48! K(o=-1.5!,f=-0.12) USER MOD Single : A 673 SER OG : rot 180:sc= 0 USER MOD Single : A 676 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 542 1.181 1.158 -3.490 1.00 3.35 N ATOM 2 CA GLY A 542 1.587 2.147 -2.505 1.00 13.01 C ATOM 3 C GLY A 542 2.513 1.528 -1.456 1.00 43.52 C ATOM 4 O GLY A 542 3.694 1.868 -1.388 1.00 15.12 O ATOM 0 HA2 GLY A 542 2.096 2.973 -3.002 1.00 13.01 H new ATOM 0 HA3 GLY A 542 0.705 2.563 -2.017 1.00 13.01 H new ATOM 8 N PRO A 543 1.929 0.608 -0.644 1.00 75.41 N ATOM 9 CA PRO A 543 2.689 -0.061 0.398 1.00 74.40 C ATOM 10 C PRO A 543 3.616 -1.123 -0.196 1.00 23.41 C ATOM 11 O PRO A 543 3.789 -1.192 -1.412 1.00 4.32 O ATOM 12 CB PRO A 543 1.643 -0.643 1.336 1.00 62.14 C ATOM 13 CG PRO A 543 0.347 -0.680 0.543 1.00 13.20 C ATOM 14 CD PRO A 543 0.533 0.181 -0.696 1.00 64.51 C ATOM 0 HA PRO A 543 3.353 0.616 0.935 1.00 74.40 H new ATOM 0 HB2 PRO A 543 1.927 -1.642 1.666 1.00 62.14 H new ATOM 0 HB3 PRO A 543 1.536 -0.030 2.231 1.00 62.14 H new ATOM 0 HG2 PRO A 543 0.100 -1.704 0.263 1.00 13.20 H new ATOM 0 HG3 PRO A 543 -0.480 -0.307 1.146 1.00 13.20 H new ATOM 0 HD2 PRO A 543 0.325 -0.383 -1.605 1.00 64.51 H new ATOM 0 HD3 PRO A 543 -0.143 1.036 -0.689 1.00 64.51 H new ATOM 22 N HIS A 544 4.188 -1.926 0.690 1.00 43.42 N ATOM 23 CA HIS A 544 5.094 -2.981 0.268 1.00 32.15 C ATOM 24 C HIS A 544 4.460 -4.344 0.551 1.00 33.52 C ATOM 25 O HIS A 544 3.566 -4.456 1.389 1.00 53.23 O ATOM 26 CB HIS A 544 6.464 -2.816 0.928 1.00 24.40 C ATOM 27 CG HIS A 544 7.306 -1.715 0.328 1.00 21.24 C ATOM 28 ND1 HIS A 544 7.319 -1.435 -1.027 1.00 11.12 N ATOM 29 CD2 HIS A 544 8.162 -0.828 0.913 1.00 33.42 C ATOM 30 CE1 HIS A 544 8.149 -0.424 -1.237 1.00 11.20 C ATOM 31 NE2 HIS A 544 8.671 -0.050 -0.033 1.00 54.35 N ATOM 0 H HIS A 544 4.042 -1.867 1.698 1.00 43.42 H new ATOM 0 HA HIS A 544 5.263 -2.913 -0.807 1.00 32.15 H new ATOM 0 HB2 HIS A 544 6.322 -2.614 1.990 1.00 24.40 H new ATOM 0 HB3 HIS A 544 7.008 -3.758 0.853 1.00 24.40 H new ATOM 0 HD2 HIS A 544 8.387 -0.769 1.968 1.00 33.42 H new ATOM 0 HE1 HIS A 544 8.373 0.025 -2.193 1.00 11.20 H new ATOM 0 HE2 HIS A 544 9.342 0.704 0.115 1.00 54.35 H new ATOM 39 N MET A 545 4.947 -5.348 -0.164 1.00 5.34 N ATOM 40 CA MET A 545 4.440 -6.699 0.000 1.00 72.32 C ATOM 41 C MET A 545 5.203 -7.443 1.098 1.00 40.20 C ATOM 42 O MET A 545 5.712 -8.539 0.872 1.00 70.44 O ATOM 43 CB MET A 545 4.576 -7.459 -1.321 1.00 63.20 C ATOM 44 CG MET A 545 3.406 -7.148 -2.256 1.00 51.01 C ATOM 45 SD MET A 545 3.663 -7.934 -3.838 1.00 53.21 S ATOM 46 CE MET A 545 2.829 -9.486 -3.552 1.00 54.23 C ATOM 0 H MET A 545 5.688 -5.252 -0.859 1.00 5.34 H new ATOM 0 HA MET A 545 3.391 -6.640 0.290 1.00 72.32 H new ATOM 0 HB2 MET A 545 5.515 -7.189 -1.805 1.00 63.20 H new ATOM 0 HB3 MET A 545 4.615 -8.531 -1.126 1.00 63.20 H new ATOM 0 HG2 MET A 545 2.473 -7.498 -1.814 1.00 51.01 H new ATOM 0 HG3 MET A 545 3.311 -6.070 -2.387 1.00 51.01 H new ATOM 0 HE1 MET A 545 2.894 -10.104 -4.447 1.00 54.23 H new ATOM 0 HE2 MET A 545 3.302 -10.005 -2.718 1.00 54.23 H new ATOM 0 HE3 MET A 545 1.782 -9.298 -3.316 1.00 54.23 H new ATOM 56 N GLN A 546 5.258 -6.816 2.264 1.00 45.01 N ATOM 57 CA GLN A 546 5.951 -7.404 3.398 1.00 70.43 C ATOM 58 C GLN A 546 4.954 -7.757 4.504 1.00 44.51 C ATOM 59 O GLN A 546 3.969 -7.048 4.705 1.00 22.23 O ATOM 60 CB GLN A 546 7.042 -6.467 3.920 1.00 33.54 C ATOM 61 CG GLN A 546 6.448 -5.385 4.823 1.00 11.55 C ATOM 62 CD GLN A 546 7.294 -4.111 4.781 1.00 2.50 C ATOM 63 OE1 GLN A 546 6.790 -3.000 4.752 1.00 73.02 O ATOM 64 NE2 GLN A 546 8.606 -4.332 4.779 1.00 14.04 N ATOM 0 H GLN A 546 4.834 -5.907 2.448 1.00 45.01 H new ATOM 0 HA GLN A 546 6.436 -8.322 3.067 1.00 70.43 H new ATOM 0 HB2 GLN A 546 7.785 -7.041 4.474 1.00 33.54 H new ATOM 0 HB3 GLN A 546 7.559 -6.002 3.081 1.00 33.54 H new ATOM 0 HG2 GLN A 546 5.430 -5.160 4.506 1.00 11.55 H new ATOM 0 HG3 GLN A 546 6.389 -5.753 5.847 1.00 11.55 H new ATOM 0 HE21 GLN A 546 8.962 -5.287 4.804 1.00 14.04 H new ATOM 0 HE22 GLN A 546 9.256 -3.546 4.752 1.00 14.04 H new ATOM 73 N PHE A 547 5.245 -8.851 5.192 1.00 1.20 N ATOM 74 CA PHE A 547 4.387 -9.305 6.273 1.00 73.53 C ATOM 75 C PHE A 547 5.143 -10.243 7.216 1.00 10.12 C ATOM 76 O PHE A 547 5.305 -11.426 6.923 1.00 61.30 O ATOM 77 CB PHE A 547 3.229 -10.072 5.631 1.00 35.33 C ATOM 78 CG PHE A 547 2.761 -9.490 4.296 1.00 72.42 C ATOM 79 CD1 PHE A 547 3.497 -9.693 3.171 1.00 43.24 C ATOM 80 CD2 PHE A 547 1.608 -8.771 4.234 1.00 44.30 C ATOM 81 CE1 PHE A 547 3.063 -9.153 1.931 1.00 1.21 C ATOM 82 CE2 PHE A 547 1.174 -8.231 2.995 1.00 43.35 C ATOM 83 CZ PHE A 547 1.911 -8.433 1.869 1.00 33.13 C ATOM 0 H PHE A 547 6.063 -9.436 5.022 1.00 1.20 H new ATOM 0 HA PHE A 547 4.038 -8.452 6.855 1.00 73.53 H new ATOM 0 HB2 PHE A 547 3.533 -11.107 5.477 1.00 35.33 H new ATOM 0 HB3 PHE A 547 2.388 -10.087 6.324 1.00 35.33 H new ATOM 0 HD1 PHE A 547 4.412 -10.265 3.220 1.00 43.24 H new ATOM 0 HD2 PHE A 547 1.023 -8.611 5.127 1.00 44.30 H new ATOM 0 HE1 PHE A 547 3.648 -9.314 1.037 1.00 1.21 H new ATOM 0 HE2 PHE A 547 0.259 -7.660 2.946 1.00 43.35 H new ATOM 0 HZ PHE A 547 1.581 -8.022 0.926 1.00 33.13 H new ATOM 93 N PRO A 548 5.597 -9.663 8.360 1.00 64.54 N ATOM 94 CA PRO A 548 6.333 -10.434 9.348 1.00 14.11 C ATOM 95 C PRO A 548 5.394 -11.345 10.142 1.00 63.22 C ATOM 96 O PRO A 548 4.257 -10.974 10.427 1.00 73.14 O ATOM 97 CB PRO A 548 7.029 -9.398 10.216 1.00 62.25 C ATOM 98 CG PRO A 548 6.294 -8.090 9.975 1.00 74.03 C ATOM 99 CD PRO A 548 5.424 -8.265 8.740 1.00 10.34 C ATOM 0 HA PRO A 548 7.060 -11.111 8.898 1.00 14.11 H new ATOM 0 HB2 PRO A 548 6.989 -9.680 11.268 1.00 62.25 H new ATOM 0 HB3 PRO A 548 8.082 -9.309 9.949 1.00 62.25 H new ATOM 0 HG2 PRO A 548 5.682 -7.831 10.839 1.00 74.03 H new ATOM 0 HG3 PRO A 548 7.003 -7.275 9.830 1.00 74.03 H new ATOM 0 HD2 PRO A 548 4.380 -8.040 8.956 1.00 10.34 H new ATOM 0 HD3 PRO A 548 5.735 -7.595 7.938 1.00 10.34 H new ATOM 107 N VAL A 549 5.906 -12.521 10.477 1.00 41.53 N ATOM 108 CA VAL A 549 5.128 -13.488 11.232 1.00 1.31 C ATOM 109 C VAL A 549 4.546 -12.809 12.474 1.00 24.50 C ATOM 110 O VAL A 549 3.374 -12.995 12.795 1.00 34.33 O ATOM 111 CB VAL A 549 5.990 -14.707 11.565 1.00 22.13 C ATOM 112 CG1 VAL A 549 6.432 -15.431 10.292 1.00 51.32 C ATOM 113 CG2 VAL A 549 7.197 -14.309 12.417 1.00 44.24 C ATOM 0 H VAL A 549 6.850 -12.825 10.239 1.00 41.53 H new ATOM 0 HA VAL A 549 4.290 -13.852 10.638 1.00 1.31 H new ATOM 0 HB VAL A 549 5.381 -15.398 12.148 1.00 22.13 H new ATOM 0 HG11 VAL A 549 7.043 -16.293 10.558 1.00 51.32 H new ATOM 0 HG12 VAL A 549 5.554 -15.765 9.740 1.00 51.32 H new ATOM 0 HG13 VAL A 549 7.014 -14.751 9.670 1.00 51.32 H new ATOM 0 HG21 VAL A 549 7.793 -15.194 12.640 1.00 44.24 H new ATOM 0 HG22 VAL A 549 7.806 -13.589 11.871 1.00 44.24 H new ATOM 0 HG23 VAL A 549 6.853 -13.860 13.349 1.00 44.24 H new ATOM 123 N GLU A 550 5.393 -12.037 13.139 1.00 62.23 N ATOM 124 CA GLU A 550 4.978 -11.330 14.338 1.00 32.33 C ATOM 125 C GLU A 550 3.731 -10.491 14.055 1.00 53.44 C ATOM 126 O GLU A 550 2.923 -10.249 14.951 1.00 64.32 O ATOM 127 CB GLU A 550 6.112 -10.460 14.883 1.00 65.14 C ATOM 128 CG GLU A 550 6.755 -9.636 13.765 1.00 4.35 C ATOM 129 CD GLU A 550 7.378 -8.353 14.320 1.00 42.22 C ATOM 130 OE1 GLU A 550 6.711 -7.605 15.049 1.00 15.51 O ATOM 131 OE2 GLU A 550 8.602 -8.145 13.969 1.00 50.02 O ATOM 0 H GLU A 550 6.365 -11.886 12.870 1.00 62.23 H new ATOM 0 HA GLU A 550 4.731 -12.067 15.102 1.00 32.33 H new ATOM 0 HB2 GLU A 550 5.726 -9.794 15.655 1.00 65.14 H new ATOM 0 HB3 GLU A 550 6.865 -11.091 15.354 1.00 65.14 H new ATOM 0 HG2 GLU A 550 7.520 -10.229 13.265 1.00 4.35 H new ATOM 0 HG3 GLU A 550 6.005 -9.386 13.015 1.00 4.35 H new ATOM 139 N HIS A 551 3.612 -10.068 12.804 1.00 23.54 N ATOM 140 CA HIS A 551 2.477 -9.261 12.391 1.00 1.14 C ATOM 141 C HIS A 551 1.354 -10.172 11.891 1.00 43.30 C ATOM 142 O HIS A 551 0.190 -9.774 11.869 1.00 25.24 O ATOM 143 CB HIS A 551 2.901 -8.218 11.355 1.00 13.24 C ATOM 144 CG HIS A 551 3.341 -6.903 11.953 1.00 51.53 C ATOM 145 ND1 HIS A 551 3.572 -5.772 11.188 1.00 33.05 N ATOM 146 CD2 HIS A 551 3.589 -6.550 13.247 1.00 51.13 C ATOM 147 CE1 HIS A 551 3.942 -4.790 11.996 1.00 3.44 C ATOM 148 NE2 HIS A 551 3.953 -5.274 13.271 1.00 11.25 N ATOM 0 H HIS A 551 4.284 -10.270 12.063 1.00 23.54 H new ATOM 0 HA HIS A 551 2.092 -8.704 13.245 1.00 1.14 H new ATOM 0 HB2 HIS A 551 3.717 -8.625 10.758 1.00 13.24 H new ATOM 0 HB3 HIS A 551 2.068 -8.036 10.676 1.00 13.24 H new ATOM 0 HD2 HIS A 551 3.504 -7.199 14.106 1.00 51.13 H new ATOM 0 HE1 HIS A 551 4.191 -3.782 11.698 1.00 3.44 H new ATOM 0 HE2 HIS A 551 4.200 -4.743 14.106 1.00 11.25 H new ATOM 156 N VAL A 552 1.743 -11.377 11.501 1.00 50.32 N ATOM 157 CA VAL A 552 0.784 -12.348 11.002 1.00 52.51 C ATOM 158 C VAL A 552 0.313 -13.233 12.157 1.00 21.23 C ATOM 159 O VAL A 552 1.127 -13.845 12.847 1.00 65.23 O ATOM 160 CB VAL A 552 1.397 -13.145 9.849 1.00 5.32 C ATOM 161 CG1 VAL A 552 0.547 -14.373 9.518 1.00 51.52 C ATOM 162 CG2 VAL A 552 1.591 -12.262 8.614 1.00 22.34 C ATOM 0 H VAL A 552 2.709 -11.703 11.520 1.00 50.32 H new ATOM 0 HA VAL A 552 -0.095 -11.844 10.599 1.00 52.51 H new ATOM 0 HB VAL A 552 2.379 -13.494 10.168 1.00 5.32 H new ATOM 0 HG11 VAL A 552 1.005 -14.922 8.695 1.00 51.52 H new ATOM 0 HG12 VAL A 552 0.484 -15.019 10.394 1.00 51.52 H new ATOM 0 HG13 VAL A 552 -0.455 -14.055 9.229 1.00 51.52 H new ATOM 0 HG21 VAL A 552 2.028 -12.853 7.809 1.00 22.34 H new ATOM 0 HG22 VAL A 552 0.627 -11.869 8.293 1.00 22.34 H new ATOM 0 HG23 VAL A 552 2.257 -11.435 8.859 1.00 22.34 H new ATOM 172 N GLN A 553 -0.999 -13.273 12.333 1.00 34.33 N ATOM 173 CA GLN A 553 -1.588 -14.074 13.393 1.00 13.14 C ATOM 174 C GLN A 553 -2.353 -15.259 12.801 1.00 73.10 C ATOM 175 O GLN A 553 -2.907 -15.161 11.707 1.00 11.31 O ATOM 176 CB GLN A 553 -2.498 -13.223 14.282 1.00 21.21 C ATOM 177 CG GLN A 553 -3.075 -14.054 15.430 1.00 0.43 C ATOM 178 CD GLN A 553 -3.502 -13.157 16.594 1.00 31.34 C ATOM 179 OE1 GLN A 553 -3.093 -13.334 17.730 1.00 31.12 O ATOM 180 NE2 GLN A 553 -4.345 -12.188 16.250 1.00 71.11 N ATOM 0 H GLN A 553 -1.671 -12.764 11.759 1.00 34.33 H new ATOM 0 HA GLN A 553 -0.784 -14.462 14.018 1.00 13.14 H new ATOM 0 HB2 GLN A 553 -1.935 -12.381 14.685 1.00 21.21 H new ATOM 0 HB3 GLN A 553 -3.310 -12.807 13.685 1.00 21.21 H new ATOM 0 HG2 GLN A 553 -3.931 -14.627 15.074 1.00 0.43 H new ATOM 0 HG3 GLN A 553 -2.331 -14.773 15.774 1.00 0.43 H new ATOM 0 HE21 GLN A 553 -4.648 -12.096 15.280 1.00 71.11 H new ATOM 0 HE22 GLN A 553 -4.689 -11.537 16.956 1.00 71.11 H new ATOM 189 N LEU A 554 -2.359 -16.352 13.550 1.00 74.24 N ATOM 190 CA LEU A 554 -3.047 -17.555 13.112 1.00 13.01 C ATOM 191 C LEU A 554 -4.500 -17.509 13.591 1.00 23.41 C ATOM 192 O LEU A 554 -4.764 -17.585 14.790 1.00 75.11 O ATOM 193 CB LEU A 554 -2.288 -18.802 13.569 1.00 71.44 C ATOM 194 CG LEU A 554 -1.049 -19.170 12.750 1.00 25.15 C ATOM 195 CD1 LEU A 554 -0.919 -20.687 12.604 1.00 63.33 C ATOM 196 CD2 LEU A 554 -1.057 -18.462 11.394 1.00 2.34 C ATOM 0 H LEU A 554 -1.899 -16.430 14.457 1.00 74.24 H new ATOM 0 HA LEU A 554 -3.071 -17.606 12.023 1.00 13.01 H new ATOM 0 HB2 LEU A 554 -1.984 -18.659 14.606 1.00 71.44 H new ATOM 0 HB3 LEU A 554 -2.975 -19.648 13.552 1.00 71.44 H new ATOM 0 HG LEU A 554 -0.168 -18.822 13.289 1.00 25.15 H new ATOM 0 HD11 LEU A 554 -0.030 -20.921 12.018 1.00 63.33 H new ATOM 0 HD12 LEU A 554 -0.833 -21.141 13.591 1.00 63.33 H new ATOM 0 HD13 LEU A 554 -1.801 -21.081 12.099 1.00 63.33 H new ATOM 0 HD21 LEU A 554 -0.165 -18.741 10.833 1.00 2.34 H new ATOM 0 HD22 LEU A 554 -1.945 -18.757 10.835 1.00 2.34 H new ATOM 0 HD23 LEU A 554 -1.066 -17.383 11.547 1.00 2.34 H new ATOM 208 N LEU A 555 -5.403 -17.386 12.629 1.00 2.15 N ATOM 209 CA LEU A 555 -6.822 -17.329 12.938 1.00 64.30 C ATOM 210 C LEU A 555 -7.577 -18.297 12.024 1.00 3.23 C ATOM 211 O LEU A 555 -7.004 -18.967 11.166 1.00 44.10 O ATOM 212 CB LEU A 555 -7.329 -15.888 12.861 1.00 34.15 C ATOM 213 CG LEU A 555 -6.310 -14.799 13.199 1.00 4.34 C ATOM 214 CD1 LEU A 555 -5.797 -14.115 11.931 1.00 53.35 C ATOM 215 CD2 LEU A 555 -6.890 -13.795 14.197 1.00 12.24 C ATOM 0 H LEU A 555 -5.180 -17.324 11.636 1.00 2.15 H new ATOM 0 HA LEU A 555 -7.003 -17.651 13.963 1.00 64.30 H new ATOM 0 HB2 LEU A 555 -7.702 -15.709 11.853 1.00 34.15 H new ATOM 0 HB3 LEU A 555 -8.178 -15.786 13.537 1.00 34.15 H new ATOM 0 HG LEU A 555 -5.453 -15.271 13.679 1.00 4.34 H new ATOM 0 HD11 LEU A 555 -5.074 -13.345 12.200 1.00 53.35 H new ATOM 0 HD12 LEU A 555 -5.318 -14.853 11.288 1.00 53.35 H new ATOM 0 HD13 LEU A 555 -6.633 -13.659 11.400 1.00 53.35 H new ATOM 0 HD21 LEU A 555 -6.145 -13.032 14.420 1.00 12.24 H new ATOM 0 HD22 LEU A 555 -7.774 -13.324 13.767 1.00 12.24 H new ATOM 0 HD23 LEU A 555 -7.165 -14.313 15.116 1.00 12.24 H new ATOM 227 N CYS A 556 -8.889 -18.355 12.230 1.00 61.22 N ATOM 228 CA CYS A 556 -9.749 -19.230 11.442 1.00 45.44 C ATOM 229 C CYS A 556 -10.597 -18.422 10.463 1.00 22.03 C ATOM 230 O CYS A 556 -11.620 -17.871 10.867 1.00 42.04 O ATOM 231 CB CYS A 556 -10.654 -20.052 12.360 1.00 72.43 C ATOM 232 SG CYS A 556 -11.158 -21.658 11.662 1.00 73.15 S ATOM 0 H CYS A 556 -9.380 -17.806 12.936 1.00 61.22 H new ATOM 0 HA CYS A 556 -9.112 -19.906 10.871 1.00 45.44 H new ATOM 0 HB2 CYS A 556 -10.136 -20.224 13.304 1.00 72.43 H new ATOM 0 HB3 CYS A 556 -11.547 -19.470 12.588 1.00 72.43 H new ATOM 237 N ILE A 557 -10.159 -18.369 9.214 1.00 23.51 N ATOM 238 CA ILE A 557 -10.885 -17.629 8.197 1.00 51.32 C ATOM 239 C ILE A 557 -12.382 -17.670 8.513 1.00 65.21 C ATOM 240 O ILE A 557 -13.086 -16.678 8.330 1.00 21.44 O ATOM 241 CB ILE A 557 -10.537 -18.152 6.802 1.00 44.32 C ATOM 242 CG1 ILE A 557 -11.496 -19.266 6.378 1.00 11.33 C ATOM 243 CG2 ILE A 557 -9.075 -18.598 6.733 1.00 44.51 C ATOM 244 CD1 ILE A 557 -11.249 -19.680 4.926 1.00 10.42 C ATOM 0 H ILE A 557 -9.310 -18.827 8.883 1.00 23.51 H new ATOM 0 HA ILE A 557 -10.586 -16.581 8.203 1.00 51.32 H new ATOM 0 HB ILE A 557 -10.659 -17.335 6.091 1.00 44.32 H new ATOM 0 HG12 ILE A 557 -11.369 -20.128 7.032 1.00 11.33 H new ATOM 0 HG13 ILE A 557 -12.526 -18.928 6.493 1.00 11.33 H new ATOM 0 HG21 ILE A 557 -8.854 -18.965 5.731 1.00 44.51 H new ATOM 0 HG22 ILE A 557 -8.426 -17.753 6.961 1.00 44.51 H new ATOM 0 HG23 ILE A 557 -8.903 -19.394 7.458 1.00 44.51 H new ATOM 0 HD11 ILE A 557 -11.944 -20.473 4.651 1.00 10.42 H new ATOM 0 HD12 ILE A 557 -11.401 -18.821 4.272 1.00 10.42 H new ATOM 0 HD13 ILE A 557 -10.226 -20.041 4.820 1.00 10.42 H new ATOM 256 N ASN A 558 -12.823 -18.828 8.982 1.00 61.14 N ATOM 257 CA ASN A 558 -14.223 -19.012 9.325 1.00 42.11 C ATOM 258 C ASN A 558 -14.536 -18.234 10.605 1.00 60.14 C ATOM 259 O ASN A 558 -15.330 -17.295 10.586 1.00 51.11 O ATOM 260 CB ASN A 558 -14.539 -20.487 9.579 1.00 25.11 C ATOM 261 CG ASN A 558 -14.807 -21.225 8.266 1.00 51.43 C ATOM 262 OD1 ASN A 558 -14.489 -20.757 7.185 1.00 51.33 O ATOM 263 ND2 ASN A 558 -15.409 -22.401 8.419 1.00 43.20 N ATOM 0 H ASN A 558 -12.236 -19.648 9.133 1.00 61.14 H new ATOM 0 HA ASN A 558 -14.825 -18.653 8.490 1.00 42.11 H new ATOM 0 HB2 ASN A 558 -13.705 -20.957 10.100 1.00 25.11 H new ATOM 0 HB3 ASN A 558 -15.409 -20.569 10.230 1.00 25.11 H new ATOM 0 HD21 ASN A 558 -15.632 -22.970 7.602 1.00 43.20 H new ATOM 0 HD22 ASN A 558 -15.648 -22.734 9.353 1.00 43.20 H new ATOM 270 N CYS A 559 -13.896 -18.654 11.686 1.00 44.12 N ATOM 271 CA CYS A 559 -14.096 -18.008 12.972 1.00 22.31 C ATOM 272 C CYS A 559 -13.353 -16.671 12.959 1.00 24.14 C ATOM 273 O CYS A 559 -13.976 -15.611 12.932 1.00 43.12 O ATOM 274 CB CYS A 559 -13.644 -18.901 14.130 1.00 71.35 C ATOM 275 SG CYS A 559 -14.140 -20.657 13.983 1.00 14.43 S ATOM 0 H CYS A 559 -13.239 -19.434 11.698 1.00 44.12 H new ATOM 0 HA CYS A 559 -15.160 -17.830 13.131 1.00 22.31 H new ATOM 0 HB2 CYS A 559 -12.558 -18.850 14.207 1.00 71.35 H new ATOM 0 HB3 CYS A 559 -14.049 -18.500 15.059 1.00 71.35 H new ATOM 280 N MET A 560 -12.031 -16.765 12.980 1.00 12.41 N ATOM 281 CA MET A 560 -11.196 -15.575 12.971 1.00 35.32 C ATOM 282 C MET A 560 -11.122 -14.947 14.364 1.00 14.03 C ATOM 283 O MET A 560 -11.271 -13.735 14.511 1.00 2.22 O ATOM 284 CB MET A 560 -11.768 -14.558 11.982 1.00 41.32 C ATOM 285 CG MET A 560 -12.086 -15.218 10.639 1.00 44.04 C ATOM 286 SD MET A 560 -12.850 -14.035 9.542 1.00 1.34 S ATOM 287 CE MET A 560 -14.570 -14.432 9.808 1.00 62.34 C ATOM 0 H MET A 560 -11.518 -17.646 13.003 1.00 12.41 H new ATOM 0 HA MET A 560 -10.189 -15.862 12.669 1.00 35.32 H new ATOM 0 HB2 MET A 560 -12.673 -14.113 12.396 1.00 41.32 H new ATOM 0 HB3 MET A 560 -11.053 -13.748 11.833 1.00 41.32 H new ATOM 0 HG2 MET A 560 -11.172 -15.605 10.189 1.00 44.04 H new ATOM 0 HG3 MET A 560 -12.751 -16.068 10.791 1.00 44.04 H new ATOM 0 HE1 MET A 560 -15.168 -13.524 9.736 1.00 62.34 H new ATOM 0 HE2 MET A 560 -14.900 -15.145 9.052 1.00 62.34 H new ATOM 0 HE3 MET A 560 -14.693 -14.870 10.798 1.00 62.34 H new ATOM 297 N VAL A 561 -10.893 -15.800 15.352 1.00 50.02 N ATOM 298 CA VAL A 561 -10.798 -15.344 16.728 1.00 5.40 C ATOM 299 C VAL A 561 -9.375 -15.576 17.240 1.00 23.23 C ATOM 300 O VAL A 561 -9.131 -15.538 18.445 1.00 1.43 O ATOM 301 CB VAL A 561 -11.861 -16.034 17.584 1.00 74.55 C ATOM 302 CG1 VAL A 561 -13.130 -16.302 16.771 1.00 64.23 C ATOM 303 CG2 VAL A 561 -11.318 -17.328 18.195 1.00 54.23 C ATOM 0 H VAL A 561 -10.770 -16.805 15.226 1.00 50.02 H new ATOM 0 HA VAL A 561 -10.996 -14.274 16.790 1.00 5.40 H new ATOM 0 HB VAL A 561 -12.122 -15.361 18.401 1.00 74.55 H new ATOM 0 HG11 VAL A 561 -13.870 -16.793 17.403 1.00 64.23 H new ATOM 0 HG12 VAL A 561 -13.534 -15.358 16.406 1.00 64.23 H new ATOM 0 HG13 VAL A 561 -12.891 -16.946 15.925 1.00 64.23 H new ATOM 0 HG21 VAL A 561 -12.094 -17.799 18.799 1.00 54.23 H new ATOM 0 HG22 VAL A 561 -11.016 -18.008 17.398 1.00 54.23 H new ATOM 0 HG23 VAL A 561 -10.457 -17.100 18.824 1.00 54.23 H new ATOM 313 N ALA A 562 -8.472 -15.812 16.299 1.00 34.53 N ATOM 314 CA ALA A 562 -7.080 -16.051 16.640 1.00 33.34 C ATOM 315 C ALA A 562 -6.968 -17.365 17.417 1.00 51.20 C ATOM 316 O ALA A 562 -7.378 -17.443 18.574 1.00 1.21 O ATOM 317 CB ALA A 562 -6.536 -14.859 17.430 1.00 52.13 C ATOM 0 H ALA A 562 -8.678 -15.843 15.300 1.00 34.53 H new ATOM 0 HA ALA A 562 -6.475 -16.148 15.738 1.00 33.34 H new ATOM 0 HB1 ALA A 562 -5.492 -15.038 17.686 1.00 52.13 H new ATOM 0 HB2 ALA A 562 -6.611 -13.956 16.824 1.00 52.13 H new ATOM 0 HB3 ALA A 562 -7.117 -14.732 18.344 1.00 52.13 H new ATOM 323 N VAL A 563 -6.411 -18.364 16.749 1.00 21.22 N ATOM 324 CA VAL A 563 -6.240 -19.670 17.362 1.00 25.43 C ATOM 325 C VAL A 563 -4.759 -19.891 17.677 1.00 4.00 C ATOM 326 O VAL A 563 -4.396 -20.880 18.312 1.00 61.23 O ATOM 327 CB VAL A 563 -6.826 -20.755 16.456 1.00 11.21 C ATOM 328 CG1 VAL A 563 -8.336 -20.885 16.664 1.00 53.13 C ATOM 329 CG2 VAL A 563 -6.496 -20.480 14.988 1.00 40.23 C ATOM 0 H VAL A 563 -6.072 -18.295 15.789 1.00 21.22 H new ATOM 0 HA VAL A 563 -6.785 -19.723 18.305 1.00 25.43 H new ATOM 0 HB VAL A 563 -6.367 -21.705 16.730 1.00 11.21 H new ATOM 0 HG11 VAL A 563 -8.728 -21.663 16.008 1.00 53.13 H new ATOM 0 HG12 VAL A 563 -8.539 -21.149 17.702 1.00 53.13 H new ATOM 0 HG13 VAL A 563 -8.819 -19.936 16.430 1.00 53.13 H new ATOM 0 HG21 VAL A 563 -6.924 -21.266 14.365 1.00 40.23 H new ATOM 0 HG22 VAL A 563 -6.914 -19.517 14.695 1.00 40.23 H new ATOM 0 HG23 VAL A 563 -5.414 -20.461 14.856 1.00 40.23 H new ATOM 339 N GLY A 564 -3.943 -18.953 17.219 1.00 50.14 N ATOM 340 CA GLY A 564 -2.510 -19.032 17.443 1.00 24.34 C ATOM 341 C GLY A 564 -1.794 -17.814 16.857 1.00 53.34 C ATOM 342 O GLY A 564 -2.408 -16.767 16.653 1.00 72.50 O ATOM 0 H GLY A 564 -4.248 -18.134 16.693 1.00 50.14 H new ATOM 0 HA2 GLY A 564 -2.309 -19.097 18.512 1.00 24.34 H new ATOM 0 HA3 GLY A 564 -2.117 -19.942 16.989 1.00 24.34 H new ATOM 346 N HIS A 565 -0.506 -17.990 16.601 1.00 12.22 N ATOM 347 CA HIS A 565 0.299 -16.918 16.042 1.00 43.41 C ATOM 348 C HIS A 565 1.054 -17.430 14.813 1.00 14.32 C ATOM 349 O HIS A 565 1.450 -18.593 14.764 1.00 71.11 O ATOM 350 CB HIS A 565 1.228 -16.325 17.104 1.00 62.44 C ATOM 351 CG HIS A 565 0.549 -15.359 18.044 1.00 54.31 C ATOM 352 ND1 HIS A 565 -0.366 -15.762 19.001 1.00 54.41 N ATOM 353 CD2 HIS A 565 0.661 -14.005 18.164 1.00 11.34 C ATOM 354 CE1 HIS A 565 -0.780 -14.690 19.661 1.00 34.21 C ATOM 355 NE2 HIS A 565 -0.143 -13.602 19.141 1.00 60.21 N ATOM 0 H HIS A 565 -0.000 -18.859 16.771 1.00 12.22 H new ATOM 0 HA HIS A 565 -0.349 -16.105 15.715 1.00 43.41 H new ATOM 0 HB2 HIS A 565 1.663 -17.138 17.686 1.00 62.44 H new ATOM 0 HB3 HIS A 565 2.052 -15.813 16.606 1.00 62.44 H new ATOM 0 HD2 HIS A 565 1.296 -13.368 17.566 1.00 11.34 H new ATOM 0 HE1 HIS A 565 -1.496 -14.680 20.469 1.00 34.21 H new ATOM 0 HE2 HIS A 565 -0.264 -12.638 19.451 1.00 60.21 H new ATOM 363 N GLY A 566 1.229 -16.536 13.851 1.00 3.44 N ATOM 364 CA GLY A 566 1.929 -16.882 12.626 1.00 70.40 C ATOM 365 C GLY A 566 3.439 -16.964 12.861 1.00 53.11 C ATOM 366 O GLY A 566 4.191 -17.333 11.961 1.00 65.30 O ATOM 0 H GLY A 566 0.898 -15.572 13.895 1.00 3.44 H new ATOM 0 HA2 GLY A 566 1.563 -17.838 12.252 1.00 70.40 H new ATOM 0 HA3 GLY A 566 1.717 -16.137 11.859 1.00 70.40 H new ATOM 370 N SER A 567 3.836 -16.613 14.075 1.00 2.20 N ATOM 371 CA SER A 567 5.242 -16.642 14.440 1.00 45.44 C ATOM 372 C SER A 567 5.492 -17.738 15.477 1.00 14.14 C ATOM 373 O SER A 567 6.579 -17.824 16.046 1.00 50.01 O ATOM 374 CB SER A 567 5.699 -15.285 14.980 1.00 21.24 C ATOM 375 OG SER A 567 5.335 -15.105 16.346 1.00 14.12 O ATOM 0 H SER A 567 3.208 -16.307 14.819 1.00 2.20 H new ATOM 0 HA SER A 567 5.823 -16.860 13.544 1.00 45.44 H new ATOM 0 HB2 SER A 567 6.781 -15.200 14.879 1.00 21.24 H new ATOM 0 HB3 SER A 567 5.259 -14.489 14.379 1.00 21.24 H new ATOM 0 HG SER A 567 5.646 -14.228 16.654 1.00 14.12 H new ATOM 381 N ASP A 568 4.466 -18.549 15.693 1.00 50.53 N ATOM 382 CA ASP A 568 4.560 -19.636 16.652 1.00 11.21 C ATOM 383 C ASP A 568 4.565 -20.971 15.905 1.00 42.35 C ATOM 384 O ASP A 568 4.988 -21.990 16.449 1.00 14.41 O ATOM 385 CB ASP A 568 3.364 -19.633 17.606 1.00 21.24 C ATOM 386 CG ASP A 568 3.647 -20.200 18.999 1.00 10.01 C ATOM 387 OD1 ASP A 568 3.267 -19.606 20.019 1.00 25.34 O ATOM 388 OD2 ASP A 568 4.295 -21.315 19.012 1.00 22.24 O ATOM 0 H ASP A 568 3.565 -18.475 15.220 1.00 50.53 H new ATOM 0 HA ASP A 568 5.478 -19.503 17.224 1.00 11.21 H new ATOM 0 HB2 ASP A 568 3.006 -18.609 17.713 1.00 21.24 H new ATOM 0 HB3 ASP A 568 2.556 -20.208 17.153 1.00 21.24 H new ATOM 394 N LEU A 569 4.091 -20.922 14.668 1.00 21.13 N ATOM 395 CA LEU A 569 4.036 -22.115 13.840 1.00 11.14 C ATOM 396 C LEU A 569 5.401 -22.341 13.187 1.00 11.14 C ATOM 397 O LEU A 569 6.238 -21.440 13.163 1.00 21.10 O ATOM 398 CB LEU A 569 2.883 -22.019 12.839 1.00 63.02 C ATOM 399 CG LEU A 569 2.850 -20.758 11.974 1.00 52.45 C ATOM 400 CD1 LEU A 569 4.266 -20.278 11.649 1.00 53.22 C ATOM 401 CD2 LEU A 569 2.017 -20.981 10.710 1.00 35.40 C ATOM 0 H LEU A 569 3.742 -20.075 14.220 1.00 21.13 H new ATOM 0 HA LEU A 569 3.825 -22.993 14.450 1.00 11.14 H new ATOM 0 HB2 LEU A 569 2.927 -22.886 12.180 1.00 63.02 H new ATOM 0 HB3 LEU A 569 1.944 -22.083 13.389 1.00 63.02 H new ATOM 0 HG LEU A 569 2.364 -19.966 12.544 1.00 52.45 H new ATOM 0 HD11 LEU A 569 4.213 -19.380 11.033 1.00 53.22 H new ATOM 0 HD12 LEU A 569 4.795 -20.052 12.575 1.00 53.22 H new ATOM 0 HD13 LEU A 569 4.800 -21.059 11.107 1.00 53.22 H new ATOM 0 HD21 LEU A 569 2.010 -20.069 10.113 1.00 35.40 H new ATOM 0 HD22 LEU A 569 2.451 -21.793 10.127 1.00 35.40 H new ATOM 0 HD23 LEU A 569 0.995 -21.240 10.988 1.00 35.40 H new ATOM 413 N ARG A 570 5.583 -23.549 12.674 1.00 0.31 N ATOM 414 CA ARG A 570 6.832 -23.904 12.023 1.00 61.44 C ATOM 415 C ARG A 570 6.566 -24.828 10.832 1.00 33.24 C ATOM 416 O ARG A 570 5.415 -25.131 10.523 1.00 55.14 O ATOM 417 CB ARG A 570 7.783 -24.602 12.998 1.00 52.42 C ATOM 418 CG ARG A 570 8.438 -23.591 13.941 1.00 22.24 C ATOM 419 CD ARG A 570 7.593 -23.389 15.201 1.00 50.34 C ATOM 420 NE ARG A 570 7.804 -22.026 15.738 1.00 21.01 N ATOM 421 CZ ARG A 570 7.523 -21.661 17.007 1.00 53.21 C ATOM 422 NH1 ARG A 570 7.015 -22.556 17.881 1.00 43.10 N ATOM 423 NH2 ARG A 570 7.751 -20.415 17.380 1.00 30.41 N ATOM 0 H ARG A 570 4.886 -24.294 12.696 1.00 0.31 H new ATOM 0 HA ARG A 570 7.298 -22.982 11.676 1.00 61.44 H new ATOM 0 HB2 ARG A 570 7.235 -25.344 13.578 1.00 52.42 H new ATOM 0 HB3 ARG A 570 8.552 -25.137 12.441 1.00 52.42 H new ATOM 0 HG2 ARG A 570 9.433 -23.939 14.218 1.00 22.24 H new ATOM 0 HG3 ARG A 570 8.565 -22.638 13.427 1.00 22.24 H new ATOM 0 HD2 ARG A 570 6.538 -23.539 14.970 1.00 50.34 H new ATOM 0 HD3 ARG A 570 7.863 -24.131 15.953 1.00 50.34 H new ATOM 0 HE ARG A 570 8.185 -21.318 15.110 1.00 21.01 H new ATOM 0 HH11 ARG A 570 6.841 -23.516 17.584 1.00 43.10 H new ATOM 0 HH12 ARG A 570 6.806 -22.272 18.838 1.00 43.10 H new ATOM 0 HH21 ARG A 570 8.134 -19.745 16.713 1.00 30.41 H new ATOM 0 HH22 ARG A 570 7.544 -20.123 18.335 1.00 30.41 H new ATOM 436 N LYS A 571 7.649 -25.250 10.198 1.00 64.43 N ATOM 437 CA LYS A 571 7.547 -26.134 9.048 1.00 1.44 C ATOM 438 C LYS A 571 8.241 -27.460 9.366 1.00 13.25 C ATOM 439 O LYS A 571 9.086 -27.524 10.257 1.00 23.14 O ATOM 440 CB LYS A 571 8.085 -25.444 7.793 1.00 1.21 C ATOM 441 CG LYS A 571 7.666 -26.199 6.530 1.00 21.22 C ATOM 442 CD LYS A 571 7.630 -25.265 5.319 1.00 13.22 C ATOM 443 CE LYS A 571 8.851 -24.343 5.301 1.00 72.10 C ATOM 444 NZ LYS A 571 9.194 -23.965 3.912 1.00 60.02 N ATOM 0 H LYS A 571 8.602 -24.997 10.458 1.00 64.43 H new ATOM 0 HA LYS A 571 6.503 -26.363 8.835 1.00 1.44 H new ATOM 0 HB2 LYS A 571 7.714 -24.420 7.749 1.00 1.21 H new ATOM 0 HB3 LYS A 571 9.172 -25.387 7.843 1.00 1.21 H new ATOM 0 HG2 LYS A 571 8.363 -27.016 6.343 1.00 21.22 H new ATOM 0 HG3 LYS A 571 6.683 -26.646 6.678 1.00 21.22 H new ATOM 0 HD2 LYS A 571 7.601 -25.854 4.402 1.00 13.22 H new ATOM 0 HD3 LYS A 571 6.719 -24.667 5.343 1.00 13.22 H new ATOM 0 HE2 LYS A 571 8.647 -23.448 5.888 1.00 72.10 H new ATOM 0 HE3 LYS A 571 9.699 -24.844 5.768 1.00 72.10 H new ATOM 0 HZ1 LYS A 571 10.025 -23.339 3.918 1.00 60.02 H new ATOM 0 HZ2 LYS A 571 9.409 -24.821 3.362 1.00 60.02 H new ATOM 0 HZ3 LYS A 571 8.389 -23.468 3.479 1.00 60.02 H new ATOM 457 N VAL A 572 7.857 -28.485 8.621 1.00 71.35 N ATOM 458 CA VAL A 572 8.431 -29.806 8.812 1.00 63.22 C ATOM 459 C VAL A 572 8.985 -30.315 7.479 1.00 1.43 C ATOM 460 O VAL A 572 8.228 -30.558 6.541 1.00 43.34 O ATOM 461 CB VAL A 572 7.390 -30.746 9.424 1.00 5.21 C ATOM 462 CG1 VAL A 572 7.656 -32.197 9.018 1.00 12.14 C ATOM 463 CG2 VAL A 572 7.349 -30.601 10.947 1.00 43.23 C ATOM 0 H VAL A 572 7.155 -28.428 7.883 1.00 71.35 H new ATOM 0 HA VAL A 572 9.263 -29.762 9.515 1.00 63.22 H new ATOM 0 HB VAL A 572 6.412 -30.463 9.034 1.00 5.21 H new ATOM 0 HG11 VAL A 572 6.902 -32.844 9.466 1.00 12.14 H new ATOM 0 HG12 VAL A 572 7.611 -32.285 7.933 1.00 12.14 H new ATOM 0 HG13 VAL A 572 8.645 -32.497 9.366 1.00 12.14 H new ATOM 0 HG21 VAL A 572 6.601 -31.280 11.357 1.00 43.23 H new ATOM 0 HG22 VAL A 572 8.327 -30.845 11.362 1.00 43.23 H new ATOM 0 HG23 VAL A 572 7.090 -29.575 11.208 1.00 43.23 H new ATOM 473 N GLU A 573 10.301 -30.460 7.439 1.00 24.31 N ATOM 474 CA GLU A 573 10.965 -30.935 6.237 1.00 24.41 C ATOM 475 C GLU A 573 10.342 -30.292 4.997 1.00 44.32 C ATOM 476 O GLU A 573 10.213 -30.936 3.957 1.00 21.21 O ATOM 477 CB GLU A 573 10.912 -32.462 6.148 1.00 11.20 C ATOM 478 CG GLU A 573 9.479 -32.948 5.923 1.00 73.03 C ATOM 479 CD GLU A 573 9.436 -34.468 5.750 1.00 42.34 C ATOM 480 OE1 GLU A 573 8.386 -35.088 5.973 1.00 0.15 O ATOM 481 OE2 GLU A 573 10.545 -35.004 5.367 1.00 61.12 O ATOM 0 H GLU A 573 10.925 -30.257 8.220 1.00 24.31 H new ATOM 0 HA GLU A 573 12.014 -30.643 6.286 1.00 24.41 H new ATOM 0 HB2 GLU A 573 11.548 -32.805 5.332 1.00 11.20 H new ATOM 0 HB3 GLU A 573 11.308 -32.897 7.066 1.00 11.20 H new ATOM 0 HG2 GLU A 573 8.856 -32.657 6.768 1.00 73.03 H new ATOM 0 HG3 GLU A 573 9.062 -32.466 5.039 1.00 73.03 H new ATOM 489 N GLY A 574 9.973 -29.028 5.147 1.00 32.34 N ATOM 490 CA GLY A 574 9.366 -28.290 4.052 1.00 25.33 C ATOM 491 C GLY A 574 8.396 -29.174 3.267 1.00 73.14 C ATOM 492 O GLY A 574 8.524 -29.316 2.052 1.00 42.14 O ATOM 0 H GLY A 574 10.083 -28.496 6.010 1.00 32.34 H new ATOM 0 HA2 GLY A 574 8.837 -27.421 4.443 1.00 25.33 H new ATOM 0 HA3 GLY A 574 10.143 -27.916 3.386 1.00 25.33 H new ATOM 496 N THR A 575 7.446 -29.745 3.992 1.00 31.55 N ATOM 497 CA THR A 575 6.454 -30.612 3.379 1.00 52.44 C ATOM 498 C THR A 575 5.047 -30.215 3.831 1.00 20.51 C ATOM 499 O THR A 575 4.205 -29.854 3.010 1.00 65.41 O ATOM 500 CB THR A 575 6.816 -32.059 3.717 1.00 72.13 C ATOM 501 OG1 THR A 575 7.855 -32.381 2.796 1.00 32.23 O ATOM 502 CG2 THR A 575 5.694 -33.040 3.370 1.00 14.30 C ATOM 0 H THR A 575 7.342 -29.624 4.999 1.00 31.55 H new ATOM 0 HA THR A 575 6.454 -30.508 2.294 1.00 52.44 H new ATOM 0 HB THR A 575 7.050 -32.136 4.779 1.00 72.13 H new ATOM 0 HG1 THR A 575 8.668 -31.889 3.035 1.00 32.23 H new ATOM 0 HG21 THR A 575 6.003 -34.053 3.630 1.00 14.30 H new ATOM 0 HG22 THR A 575 4.796 -32.779 3.931 1.00 14.30 H new ATOM 0 HG23 THR A 575 5.483 -32.988 2.302 1.00 14.30 H new ATOM 510 N HIS A 576 4.835 -30.297 5.136 1.00 2.45 N ATOM 511 CA HIS A 576 3.545 -29.951 5.708 1.00 32.12 C ATOM 512 C HIS A 576 3.748 -29.042 6.922 1.00 21.21 C ATOM 513 O HIS A 576 4.469 -29.397 7.854 1.00 54.41 O ATOM 514 CB HIS A 576 2.742 -31.211 6.039 1.00 42.04 C ATOM 515 CG HIS A 576 3.594 -32.419 6.345 1.00 65.41 C ATOM 516 ND1 HIS A 576 3.371 -33.659 5.772 1.00 34.33 N ATOM 517 CD2 HIS A 576 4.672 -32.564 7.168 1.00 64.20 C ATOM 518 CE1 HIS A 576 4.278 -34.505 6.238 1.00 40.12 C ATOM 519 NE2 HIS A 576 5.084 -33.825 7.103 1.00 14.50 N ATOM 0 H HIS A 576 5.535 -30.598 5.814 1.00 2.45 H new ATOM 0 HA HIS A 576 2.957 -29.396 4.977 1.00 32.12 H new ATOM 0 HB2 HIS A 576 2.100 -31.006 6.895 1.00 42.04 H new ATOM 0 HB3 HIS A 576 2.088 -31.444 5.199 1.00 42.04 H new ATOM 0 HD2 HIS A 576 5.116 -31.785 7.771 1.00 64.20 H new ATOM 0 HE1 HIS A 576 4.364 -35.550 5.978 1.00 40.12 H new ATOM 0 HE2 HIS A 576 5.873 -34.220 7.615 1.00 14.50 H new ATOM 527 N HIS A 577 3.100 -27.888 6.872 1.00 41.33 N ATOM 528 CA HIS A 577 3.201 -26.925 7.956 1.00 74.14 C ATOM 529 C HIS A 577 2.490 -27.472 9.195 1.00 22.23 C ATOM 530 O HIS A 577 1.607 -28.321 9.085 1.00 22.52 O ATOM 531 CB HIS A 577 2.666 -25.559 7.520 1.00 22.23 C ATOM 532 CG HIS A 577 3.185 -25.095 6.180 1.00 21.51 C ATOM 533 ND1 HIS A 577 4.273 -24.250 6.049 1.00 11.00 N ATOM 534 CD2 HIS A 577 2.755 -25.369 4.915 1.00 40.42 C ATOM 535 CE1 HIS A 577 4.479 -24.030 4.759 1.00 73.11 C ATOM 536 NE2 HIS A 577 3.537 -24.724 4.058 1.00 53.24 N ATOM 0 H HIS A 577 2.503 -27.598 6.098 1.00 41.33 H new ATOM 0 HA HIS A 577 4.248 -26.774 8.218 1.00 74.14 H new ATOM 0 HB2 HIS A 577 1.578 -25.602 7.481 1.00 22.23 H new ATOM 0 HB3 HIS A 577 2.929 -24.819 8.276 1.00 22.23 H new ATOM 0 HD1 HIS A 577 4.823 -23.862 6.816 1.00 11.00 H new ATOM 0 HD2 HIS A 577 1.920 -26.003 4.655 1.00 40.42 H new ATOM 0 HE1 HIS A 577 5.256 -23.410 4.337 1.00 73.11 H new ATOM 544 N VAL A 578 2.902 -26.963 10.347 1.00 42.01 N ATOM 545 CA VAL A 578 2.316 -27.390 11.606 1.00 3.23 C ATOM 546 C VAL A 578 2.506 -26.288 12.651 1.00 31.42 C ATOM 547 O VAL A 578 3.633 -25.974 13.029 1.00 3.22 O ATOM 548 CB VAL A 578 2.917 -28.730 12.035 1.00 34.30 C ATOM 549 CG1 VAL A 578 2.480 -29.853 11.092 1.00 63.12 C ATOM 550 CG2 VAL A 578 4.442 -28.646 12.119 1.00 70.11 C ATOM 0 H VAL A 578 3.635 -26.259 10.435 1.00 42.01 H new ATOM 0 HA VAL A 578 1.244 -27.551 11.493 1.00 3.23 H new ATOM 0 HB VAL A 578 2.540 -28.963 13.031 1.00 34.30 H new ATOM 0 HG11 VAL A 578 2.921 -30.795 11.419 1.00 63.12 H new ATOM 0 HG12 VAL A 578 1.393 -29.937 11.105 1.00 63.12 H new ATOM 0 HG13 VAL A 578 2.814 -29.628 10.079 1.00 63.12 H new ATOM 0 HG21 VAL A 578 4.843 -29.612 12.426 1.00 70.11 H new ATOM 0 HG22 VAL A 578 4.846 -28.379 11.142 1.00 70.11 H new ATOM 0 HG23 VAL A 578 4.725 -27.887 12.849 1.00 70.11 H new ATOM 560 N ASN A 579 1.385 -25.732 13.088 1.00 25.53 N ATOM 561 CA ASN A 579 1.414 -24.673 14.082 1.00 11.12 C ATOM 562 C ASN A 579 1.424 -25.292 15.481 1.00 12.03 C ATOM 563 O ASN A 579 0.435 -25.886 15.908 1.00 70.20 O ATOM 564 CB ASN A 579 0.178 -23.779 13.970 1.00 54.25 C ATOM 565 CG ASN A 579 0.034 -22.884 15.202 1.00 41.40 C ATOM 566 OD1 ASN A 579 -1.056 -22.583 15.659 1.00 13.13 O ATOM 567 ND2 ASN A 579 1.193 -22.476 15.712 1.00 14.03 N ATOM 0 H ASN A 579 0.452 -25.995 12.772 1.00 25.53 H new ATOM 0 HA ASN A 579 2.309 -24.075 13.911 1.00 11.12 H new ATOM 0 HB2 ASN A 579 0.251 -23.162 13.075 1.00 54.25 H new ATOM 0 HB3 ASN A 579 -0.713 -24.397 13.859 1.00 54.25 H new ATOM 0 HD21 ASN A 579 1.204 -21.874 16.535 1.00 14.03 H new ATOM 0 HD22 ASN A 579 2.070 -22.765 15.280 1.00 14.03 H new ATOM 574 N VAL A 580 2.552 -25.131 16.157 1.00 63.44 N ATOM 575 CA VAL A 580 2.704 -25.667 17.499 1.00 71.22 C ATOM 576 C VAL A 580 2.066 -24.705 18.502 1.00 14.15 C ATOM 577 O VAL A 580 2.202 -23.489 18.375 1.00 22.14 O ATOM 578 CB VAL A 580 4.181 -25.941 17.789 1.00 10.12 C ATOM 579 CG1 VAL A 580 4.339 -26.894 18.975 1.00 30.24 C ATOM 580 CG2 VAL A 580 4.892 -26.486 16.549 1.00 73.21 C ATOM 0 H VAL A 580 3.370 -24.637 15.800 1.00 63.44 H new ATOM 0 HA VAL A 580 2.187 -26.622 17.590 1.00 71.22 H new ATOM 0 HB VAL A 580 4.651 -24.994 18.055 1.00 10.12 H new ATOM 0 HG11 VAL A 580 5.398 -27.072 19.160 1.00 30.24 H new ATOM 0 HG12 VAL A 580 3.885 -26.450 19.861 1.00 30.24 H new ATOM 0 HG13 VAL A 580 3.846 -27.840 18.750 1.00 30.24 H new ATOM 0 HG21 VAL A 580 5.940 -26.672 16.783 1.00 73.21 H new ATOM 0 HG22 VAL A 580 4.419 -27.417 16.238 1.00 73.21 H new ATOM 0 HG23 VAL A 580 4.824 -25.757 15.741 1.00 73.21 H new ATOM 590 N ASN A 581 1.382 -25.285 19.478 1.00 62.31 N ATOM 591 CA ASN A 581 0.722 -24.494 20.503 1.00 64.41 C ATOM 592 C ASN A 581 -0.006 -25.428 21.471 1.00 33.22 C ATOM 593 O ASN A 581 -0.778 -26.287 21.048 1.00 35.23 O ATOM 594 CB ASN A 581 -0.312 -23.550 19.889 1.00 52.55 C ATOM 595 CG ASN A 581 0.306 -22.184 19.581 1.00 24.30 C ATOM 596 OD1 ASN A 581 1.129 -21.666 20.319 1.00 74.14 O ATOM 597 ND2 ASN A 581 -0.134 -21.633 18.454 1.00 45.33 N ATOM 0 H ASN A 581 1.271 -26.294 19.580 1.00 62.31 H new ATOM 0 HA ASN A 581 1.483 -23.908 21.019 1.00 64.41 H new ATOM 0 HB2 ASN A 581 -0.711 -23.987 18.974 1.00 52.55 H new ATOM 0 HB3 ASN A 581 -1.150 -23.427 20.575 1.00 52.55 H new ATOM 0 HD21 ASN A 581 0.218 -20.722 18.160 1.00 45.33 H new ATOM 0 HD22 ASN A 581 -0.824 -22.121 17.883 1.00 45.33 H new ATOM 604 N PRO A 582 0.272 -25.223 22.787 1.00 62.35 N ATOM 605 CA PRO A 582 -0.348 -26.037 23.818 1.00 10.34 C ATOM 606 C PRO A 582 -1.809 -25.635 24.029 1.00 11.44 C ATOM 607 O PRO A 582 -2.653 -26.479 24.325 1.00 23.53 O ATOM 608 CB PRO A 582 0.511 -25.826 25.055 1.00 54.23 C ATOM 609 CG PRO A 582 1.299 -24.551 24.802 1.00 63.11 C ATOM 610 CD PRO A 582 1.181 -24.215 23.324 1.00 24.52 C ATOM 0 HA PRO A 582 -0.388 -27.093 23.553 1.00 10.34 H new ATOM 0 HB2 PRO A 582 -0.107 -25.733 25.948 1.00 54.23 H new ATOM 0 HB3 PRO A 582 1.179 -26.672 25.216 1.00 54.23 H new ATOM 0 HG2 PRO A 582 0.910 -23.735 25.411 1.00 63.11 H new ATOM 0 HG3 PRO A 582 2.344 -24.687 25.080 1.00 63.11 H new ATOM 0 HD2 PRO A 582 0.788 -23.209 23.177 1.00 24.52 H new ATOM 0 HD3 PRO A 582 2.152 -24.254 22.830 1.00 24.52 H new ATOM 618 N ASN A 583 -2.063 -24.344 23.869 1.00 75.31 N ATOM 619 CA ASN A 583 -3.408 -23.820 24.038 1.00 50.21 C ATOM 620 C ASN A 583 -4.225 -24.106 22.776 1.00 21.54 C ATOM 621 O ASN A 583 -5.412 -23.788 22.715 1.00 24.54 O ATOM 622 CB ASN A 583 -3.385 -22.305 24.253 1.00 75.25 C ATOM 623 CG ASN A 583 -2.132 -21.879 25.019 1.00 11.34 C ATOM 624 OD1 ASN A 583 -1.906 -22.265 26.154 1.00 1.34 O ATOM 625 ND2 ASN A 583 -1.333 -21.063 24.338 1.00 4.12 N ATOM 0 H ASN A 583 -1.361 -23.646 23.624 1.00 75.31 H new ATOM 0 HA ASN A 583 -3.851 -24.302 24.910 1.00 50.21 H new ATOM 0 HB2 ASN A 583 -3.417 -21.797 23.289 1.00 75.25 H new ATOM 0 HB3 ASN A 583 -4.274 -21.999 24.804 1.00 75.25 H new ATOM 0 HD21 ASN A 583 -0.471 -20.721 24.763 1.00 4.12 H new ATOM 0 HD22 ASN A 583 -1.582 -20.779 23.391 1.00 4.12 H new ATOM 632 N PHE A 584 -3.557 -24.704 21.801 1.00 70.14 N ATOM 633 CA PHE A 584 -4.206 -25.037 20.544 1.00 32.21 C ATOM 634 C PHE A 584 -5.231 -26.157 20.736 1.00 13.33 C ATOM 635 O PHE A 584 -6.254 -26.190 20.054 1.00 34.33 O ATOM 636 CB PHE A 584 -3.113 -25.522 19.590 1.00 5.42 C ATOM 637 CG PHE A 584 -3.391 -25.216 18.117 1.00 13.22 C ATOM 638 CD1 PHE A 584 -3.372 -23.930 17.674 1.00 22.21 C ATOM 639 CD2 PHE A 584 -3.658 -26.230 17.251 1.00 54.31 C ATOM 640 CE1 PHE A 584 -3.630 -23.646 16.307 1.00 74.30 C ATOM 641 CE2 PHE A 584 -3.917 -25.946 15.884 1.00 51.21 C ATOM 642 CZ PHE A 584 -3.898 -24.660 15.441 1.00 64.23 C ATOM 0 H PHE A 584 -2.573 -24.967 21.856 1.00 70.14 H new ATOM 0 HA PHE A 584 -4.729 -24.164 20.154 1.00 32.21 H new ATOM 0 HB2 PHE A 584 -2.167 -25.061 19.874 1.00 5.42 H new ATOM 0 HB3 PHE A 584 -2.992 -26.599 19.710 1.00 5.42 H new ATOM 0 HD1 PHE A 584 -3.161 -23.125 18.362 1.00 22.21 H new ATOM 0 HD2 PHE A 584 -3.673 -27.251 17.603 1.00 54.31 H new ATOM 0 HE1 PHE A 584 -3.613 -22.625 15.955 1.00 74.30 H new ATOM 0 HE2 PHE A 584 -4.129 -26.751 15.196 1.00 51.21 H new ATOM 0 HZ PHE A 584 -4.096 -24.444 14.401 1.00 64.23 H new ATOM 652 N SER A 585 -4.921 -27.046 21.668 1.00 12.24 N ATOM 653 CA SER A 585 -5.803 -28.164 21.959 1.00 43.20 C ATOM 654 C SER A 585 -7.192 -27.649 22.340 1.00 31.25 C ATOM 655 O SER A 585 -8.185 -28.359 22.187 1.00 22.31 O ATOM 656 CB SER A 585 -5.234 -29.037 23.079 1.00 1.23 C ATOM 657 OG SER A 585 -5.082 -28.311 24.296 1.00 25.23 O ATOM 0 H SER A 585 -4.071 -27.015 22.232 1.00 12.24 H new ATOM 0 HA SER A 585 -5.884 -28.778 21.062 1.00 43.20 H new ATOM 0 HB2 SER A 585 -5.893 -29.889 23.245 1.00 1.23 H new ATOM 0 HB3 SER A 585 -4.267 -29.437 22.772 1.00 1.23 H new ATOM 0 HG SER A 585 -4.285 -27.744 24.241 1.00 25.23 H new ATOM 663 N ASN A 586 -7.218 -26.418 22.830 1.00 33.53 N ATOM 664 CA ASN A 586 -8.470 -25.801 23.235 1.00 4.50 C ATOM 665 C ASN A 586 -9.104 -25.106 22.028 1.00 0.14 C ATOM 666 O ASN A 586 -10.299 -24.813 22.033 1.00 23.24 O ATOM 667 CB ASN A 586 -8.238 -24.746 24.319 1.00 21.54 C ATOM 668 CG ASN A 586 -8.244 -25.381 25.712 1.00 75.35 C ATOM 669 OD1 ASN A 586 -9.282 -25.671 26.285 1.00 4.22 O ATOM 670 ND2 ASN A 586 -7.032 -25.581 26.221 1.00 52.22 N ATOM 0 H ASN A 586 -6.393 -25.832 22.956 1.00 33.53 H new ATOM 0 HA ASN A 586 -9.121 -26.583 23.626 1.00 4.50 H new ATOM 0 HB2 ASN A 586 -7.285 -24.246 24.147 1.00 21.54 H new ATOM 0 HB3 ASN A 586 -9.013 -23.982 24.260 1.00 21.54 H new ATOM 0 HD21 ASN A 586 -6.930 -26.001 27.145 1.00 52.22 H new ATOM 0 HD22 ASN A 586 -6.204 -25.315 25.687 1.00 52.22 H new ATOM 677 N TYR A 587 -8.276 -24.862 21.023 1.00 22.14 N ATOM 678 CA TYR A 587 -8.741 -24.207 19.812 1.00 22.34 C ATOM 679 C TYR A 587 -9.186 -25.235 18.770 1.00 40.12 C ATOM 680 O TYR A 587 -9.574 -24.871 17.661 1.00 53.02 O ATOM 681 CB TYR A 587 -7.541 -23.431 19.266 1.00 54.42 C ATOM 682 CG TYR A 587 -7.410 -22.013 19.827 1.00 70.25 C ATOM 683 CD1 TYR A 587 -8.501 -21.167 19.827 1.00 22.42 C ATOM 684 CD2 TYR A 587 -6.201 -21.580 20.332 1.00 61.23 C ATOM 685 CE1 TYR A 587 -8.377 -19.833 20.355 1.00 71.41 C ATOM 686 CE2 TYR A 587 -6.077 -20.246 20.859 1.00 33.25 C ATOM 687 CZ TYR A 587 -7.172 -19.439 20.845 1.00 5.41 C ATOM 688 OH TYR A 587 -7.055 -18.179 21.343 1.00 2.45 O ATOM 0 H TYR A 587 -7.286 -25.106 21.022 1.00 22.14 H new ATOM 0 HA TYR A 587 -9.593 -23.562 20.026 1.00 22.34 H new ATOM 0 HB2 TYR A 587 -6.630 -23.985 19.491 1.00 54.42 H new ATOM 0 HB3 TYR A 587 -7.621 -23.375 18.180 1.00 54.42 H new ATOM 0 HD1 TYR A 587 -9.447 -21.506 19.431 1.00 22.42 H new ATOM 0 HD2 TYR A 587 -5.348 -22.242 20.332 1.00 61.23 H new ATOM 0 HE1 TYR A 587 -9.222 -19.161 20.361 1.00 71.41 H new ATOM 0 HE2 TYR A 587 -5.136 -19.894 21.256 1.00 33.25 H new ATOM 0 HH TYR A 587 -7.168 -17.529 20.618 1.00 2.45 H new ATOM 698 N TYR A 588 -9.115 -26.498 19.163 1.00 63.13 N ATOM 699 CA TYR A 588 -9.506 -27.581 18.276 1.00 45.10 C ATOM 700 C TYR A 588 -9.792 -28.860 19.065 1.00 1.14 C ATOM 701 O TYR A 588 -9.331 -29.013 20.195 1.00 3.54 O ATOM 702 CB TYR A 588 -8.310 -27.822 17.353 1.00 64.51 C ATOM 703 CG TYR A 588 -7.211 -28.689 17.972 1.00 41.21 C ATOM 704 CD1 TYR A 588 -7.442 -30.028 18.213 1.00 3.23 C ATOM 705 CD2 TYR A 588 -5.989 -28.131 18.289 1.00 63.23 C ATOM 706 CE1 TYR A 588 -6.408 -30.843 18.796 1.00 64.11 C ATOM 707 CE2 TYR A 588 -4.955 -28.947 18.871 1.00 4.53 C ATOM 708 CZ TYR A 588 -5.215 -30.262 19.096 1.00 31.22 C ATOM 709 OH TYR A 588 -4.238 -31.032 19.646 1.00 34.34 O ATOM 0 H TYR A 588 -8.793 -26.796 20.084 1.00 63.13 H new ATOM 0 HA TYR A 588 -10.412 -27.321 17.728 1.00 45.10 H new ATOM 0 HB2 TYR A 588 -8.661 -28.297 16.437 1.00 64.51 H new ATOM 0 HB3 TYR A 588 -7.883 -26.860 17.069 1.00 64.51 H new ATOM 0 HD1 TYR A 588 -8.398 -30.464 17.964 1.00 3.23 H new ATOM 0 HD2 TYR A 588 -5.808 -27.083 18.101 1.00 63.23 H new ATOM 0 HE1 TYR A 588 -6.576 -31.892 18.991 1.00 64.11 H new ATOM 0 HE2 TYR A 588 -3.994 -28.523 19.123 1.00 4.53 H new ATOM 0 HH TYR A 588 -3.441 -30.484 19.806 1.00 34.34 H new ATOM 719 N ASN A 589 -10.551 -29.746 18.439 1.00 75.42 N ATOM 720 CA ASN A 589 -10.905 -31.007 19.069 1.00 62.34 C ATOM 721 C ASN A 589 -10.572 -32.158 18.117 1.00 35.40 C ATOM 722 O ASN A 589 -10.971 -32.141 16.953 1.00 25.03 O ATOM 723 CB ASN A 589 -12.402 -31.068 19.379 1.00 43.41 C ATOM 724 CG ASN A 589 -13.225 -30.491 18.225 1.00 65.20 C ATOM 725 OD1 ASN A 589 -13.940 -31.192 17.528 1.00 11.20 O ATOM 726 ND2 ASN A 589 -13.083 -29.179 18.063 1.00 55.23 N ATOM 0 H ASN A 589 -10.931 -29.616 17.501 1.00 75.42 H new ATOM 0 HA ASN A 589 -10.341 -31.089 19.998 1.00 62.34 H new ATOM 0 HB2 ASN A 589 -12.698 -32.101 19.560 1.00 43.41 H new ATOM 0 HB3 ASN A 589 -12.611 -30.512 20.293 1.00 43.41 H new ATOM 0 HD21 ASN A 589 -13.590 -28.699 17.319 1.00 55.23 H new ATOM 0 HD22 ASN A 589 -12.467 -28.652 18.683 1.00 55.23 H new ATOM 733 N VAL A 590 -9.846 -33.131 18.647 1.00 33.43 N ATOM 734 CA VAL A 590 -9.456 -34.288 17.860 1.00 60.43 C ATOM 735 C VAL A 590 -10.658 -35.221 17.701 1.00 32.35 C ATOM 736 O VAL A 590 -11.361 -35.505 18.671 1.00 44.53 O ATOM 737 CB VAL A 590 -8.247 -34.974 18.500 1.00 35.04 C ATOM 738 CG1 VAL A 590 -8.100 -36.410 17.995 1.00 73.52 C ATOM 739 CG2 VAL A 590 -6.968 -34.172 18.254 1.00 21.12 C ATOM 0 H VAL A 590 -9.517 -33.142 19.613 1.00 33.43 H new ATOM 0 HA VAL A 590 -9.148 -33.982 16.860 1.00 60.43 H new ATOM 0 HB VAL A 590 -8.415 -35.014 19.576 1.00 35.04 H new ATOM 0 HG11 VAL A 590 -7.233 -36.874 18.466 1.00 73.52 H new ATOM 0 HG12 VAL A 590 -8.996 -36.977 18.246 1.00 73.52 H new ATOM 0 HG13 VAL A 590 -7.965 -36.403 16.913 1.00 73.52 H new ATOM 0 HG21 VAL A 590 -6.124 -34.681 18.719 1.00 21.12 H new ATOM 0 HG22 VAL A 590 -6.793 -34.086 17.182 1.00 21.12 H new ATOM 0 HG23 VAL A 590 -7.074 -33.177 18.686 1.00 21.12 H new ATOM 749 N SER A 591 -10.858 -35.673 16.472 1.00 33.22 N ATOM 750 CA SER A 591 -11.963 -36.568 16.174 1.00 35.45 C ATOM 751 C SER A 591 -11.881 -37.814 17.060 1.00 52.35 C ATOM 752 O SER A 591 -10.799 -38.359 17.271 1.00 10.23 O ATOM 753 CB SER A 591 -11.967 -36.966 14.697 1.00 33.42 C ATOM 754 OG SER A 591 -12.494 -35.934 13.868 1.00 64.24 O ATOM 0 H SER A 591 -10.273 -35.436 15.671 1.00 33.22 H new ATOM 0 HA SER A 591 -12.895 -36.042 16.383 1.00 35.45 H new ATOM 0 HB2 SER A 591 -10.950 -37.201 14.382 1.00 33.42 H new ATOM 0 HB3 SER A 591 -12.558 -37.873 14.567 1.00 33.42 H new ATOM 0 HG SER A 591 -12.567 -36.260 12.947 1.00 64.24 H new ATOM 760 N ARG A 592 -13.039 -38.228 17.553 1.00 51.43 N ATOM 761 CA ARG A 592 -13.112 -39.399 18.410 1.00 2.50 C ATOM 762 C ARG A 592 -12.116 -40.462 17.942 1.00 51.30 C ATOM 763 O ARG A 592 -11.213 -40.841 18.685 1.00 24.13 O ATOM 764 CB ARG A 592 -14.521 -39.994 18.410 1.00 30.33 C ATOM 765 CG ARG A 592 -15.282 -39.604 17.141 1.00 4.13 C ATOM 766 CD ARG A 592 -16.265 -40.702 16.732 1.00 71.11 C ATOM 767 NE ARG A 592 -16.753 -40.458 15.356 1.00 3.41 N ATOM 768 CZ ARG A 592 -17.295 -41.408 14.565 1.00 11.23 C ATOM 769 NH1 ARG A 592 -17.424 -42.676 15.008 1.00 21.54 N ATOM 770 NH2 ARG A 592 -17.697 -41.078 13.352 1.00 14.21 N ATOM 0 H ARG A 592 -13.935 -37.773 17.375 1.00 51.43 H new ATOM 0 HA ARG A 592 -12.863 -39.085 19.424 1.00 2.50 H new ATOM 0 HB2 ARG A 592 -14.461 -41.080 18.483 1.00 30.33 H new ATOM 0 HB3 ARG A 592 -15.067 -39.645 19.287 1.00 30.33 H new ATOM 0 HG2 ARG A 592 -15.822 -38.672 17.308 1.00 4.13 H new ATOM 0 HG3 ARG A 592 -14.576 -39.423 16.331 1.00 4.13 H new ATOM 0 HD2 ARG A 592 -15.778 -41.676 16.787 1.00 71.11 H new ATOM 0 HD3 ARG A 592 -17.105 -40.726 17.426 1.00 71.11 H new ATOM 0 HE ARG A 592 -16.675 -39.512 14.982 1.00 3.41 H new ATOM 0 HH11 ARG A 592 -17.111 -42.923 15.947 1.00 21.54 H new ATOM 0 HH12 ARG A 592 -17.835 -43.388 14.404 1.00 21.54 H new ATOM 0 HH21 ARG A 592 -17.596 -40.117 13.025 1.00 14.21 H new ATOM 0 HH22 ARG A 592 -18.109 -41.784 12.742 1.00 14.21 H new ATOM 783 N ASP A 593 -12.315 -40.912 16.712 1.00 31.51 N ATOM 784 CA ASP A 593 -11.446 -41.925 16.136 1.00 1.51 C ATOM 785 C ASP A 593 -9.986 -41.536 16.380 1.00 34.04 C ATOM 786 O ASP A 593 -9.682 -40.367 16.611 1.00 3.05 O ATOM 787 CB ASP A 593 -11.658 -42.038 14.625 1.00 14.13 C ATOM 788 CG ASP A 593 -13.113 -41.919 14.166 1.00 10.21 C ATOM 789 OD1 ASP A 593 -13.834 -42.922 14.061 1.00 63.44 O ATOM 790 OD2 ASP A 593 -13.506 -40.718 13.908 1.00 55.24 O ATOM 0 H ASP A 593 -13.065 -40.594 16.098 1.00 31.51 H new ATOM 0 HA ASP A 593 -11.683 -42.880 16.606 1.00 1.51 H new ATOM 0 HB2 ASP A 593 -11.073 -41.262 14.132 1.00 14.13 H new ATOM 0 HB3 ASP A 593 -11.264 -42.997 14.289 1.00 14.13 H new ATOM 796 N PRO A 594 -9.100 -42.565 16.319 1.00 23.44 N ATOM 797 CA PRO A 594 -7.679 -42.343 16.531 1.00 35.43 C ATOM 798 C PRO A 594 -7.041 -41.676 15.312 1.00 41.52 C ATOM 799 O PRO A 594 -6.987 -40.450 15.228 1.00 0.52 O ATOM 800 CB PRO A 594 -7.105 -43.720 16.823 1.00 34.22 C ATOM 801 CG PRO A 594 -8.131 -44.717 16.308 1.00 21.25 C ATOM 802 CD PRO A 594 -9.424 -43.963 16.048 1.00 14.31 C ATOM 0 HA PRO A 594 -7.478 -41.659 17.356 1.00 35.43 H new ATOM 0 HB2 PRO A 594 -6.144 -43.856 16.326 1.00 34.22 H new ATOM 0 HB3 PRO A 594 -6.933 -43.853 17.891 1.00 34.22 H new ATOM 0 HG2 PRO A 594 -7.776 -45.192 15.394 1.00 21.25 H new ATOM 0 HG3 PRO A 594 -8.292 -45.510 17.038 1.00 21.25 H new ATOM 0 HD2 PRO A 594 -9.762 -44.099 15.021 1.00 14.31 H new ATOM 0 HD3 PRO A 594 -10.226 -44.316 16.697 1.00 14.31 H new ATOM 810 N VAL A 595 -6.573 -42.511 14.396 1.00 33.44 N ATOM 811 CA VAL A 595 -5.941 -42.017 13.185 1.00 23.32 C ATOM 812 C VAL A 595 -6.861 -42.279 11.991 1.00 1.02 C ATOM 813 O VAL A 595 -7.367 -43.387 11.824 1.00 34.45 O ATOM 814 CB VAL A 595 -4.556 -42.649 13.023 1.00 55.42 C ATOM 815 CG1 VAL A 595 -4.071 -42.541 11.576 1.00 72.02 C ATOM 816 CG2 VAL A 595 -3.550 -42.018 13.987 1.00 22.11 C ATOM 0 H VAL A 595 -6.619 -43.527 14.469 1.00 33.44 H new ATOM 0 HA VAL A 595 -5.787 -40.940 13.246 1.00 23.32 H new ATOM 0 HB VAL A 595 -4.639 -43.707 13.271 1.00 55.42 H new ATOM 0 HG11 VAL A 595 -3.085 -42.997 11.488 1.00 72.02 H new ATOM 0 HG12 VAL A 595 -4.770 -43.058 10.918 1.00 72.02 H new ATOM 0 HG13 VAL A 595 -4.012 -41.491 11.290 1.00 72.02 H new ATOM 0 HG21 VAL A 595 -2.574 -42.485 13.852 1.00 22.11 H new ATOM 0 HG22 VAL A 595 -3.473 -40.950 13.784 1.00 22.11 H new ATOM 0 HG23 VAL A 595 -3.885 -42.169 15.013 1.00 22.11 H new ATOM 826 N VAL A 596 -7.049 -41.240 11.191 1.00 13.21 N ATOM 827 CA VAL A 596 -7.900 -41.343 10.017 1.00 24.44 C ATOM 828 C VAL A 596 -7.206 -40.673 8.830 1.00 54.41 C ATOM 829 O VAL A 596 -7.476 -39.512 8.524 1.00 72.35 O ATOM 830 CB VAL A 596 -9.279 -40.752 10.317 1.00 63.14 C ATOM 831 CG1 VAL A 596 -10.340 -41.338 9.384 1.00 55.24 C ATOM 832 CG2 VAL A 596 -9.660 -40.964 11.783 1.00 21.41 C ATOM 0 H VAL A 596 -6.627 -40.322 11.332 1.00 13.21 H new ATOM 0 HA VAL A 596 -8.061 -42.388 9.751 1.00 24.44 H new ATOM 0 HB VAL A 596 -9.230 -39.678 10.137 1.00 63.14 H new ATOM 0 HG11 VAL A 596 -11.311 -40.902 9.618 1.00 55.24 H new ATOM 0 HG12 VAL A 596 -10.080 -41.112 8.350 1.00 55.24 H new ATOM 0 HG13 VAL A 596 -10.386 -42.419 9.519 1.00 55.24 H new ATOM 0 HG21 VAL A 596 -10.644 -40.534 11.969 1.00 21.41 H new ATOM 0 HG22 VAL A 596 -9.683 -42.031 12.002 1.00 21.41 H new ATOM 0 HG23 VAL A 596 -8.925 -40.477 12.424 1.00 21.41 H new ATOM 842 N ILE A 597 -6.326 -41.432 8.193 1.00 15.44 N ATOM 843 CA ILE A 597 -5.592 -40.925 7.046 1.00 35.03 C ATOM 844 C ILE A 597 -5.610 -41.973 5.932 1.00 61.22 C ATOM 845 O ILE A 597 -5.848 -43.153 6.188 1.00 41.54 O ATOM 846 CB ILE A 597 -4.185 -40.491 7.460 1.00 41.30 C ATOM 847 CG1 ILE A 597 -4.241 -39.398 8.529 1.00 5.32 C ATOM 848 CG2 ILE A 597 -3.364 -40.061 6.243 1.00 41.53 C ATOM 849 CD1 ILE A 597 -4.269 -38.007 7.891 1.00 31.41 C ATOM 0 H ILE A 597 -6.105 -42.394 8.450 1.00 15.44 H new ATOM 0 HA ILE A 597 -6.073 -40.030 6.650 1.00 35.03 H new ATOM 0 HB ILE A 597 -3.679 -41.349 7.903 1.00 41.30 H new ATOM 0 HG12 ILE A 597 -5.127 -39.536 9.149 1.00 5.32 H new ATOM 0 HG13 ILE A 597 -3.376 -39.483 9.187 1.00 5.32 H new ATOM 0 HG21 ILE A 597 -2.368 -39.757 6.565 1.00 41.53 H new ATOM 0 HG22 ILE A 597 -3.282 -40.895 5.547 1.00 41.53 H new ATOM 0 HG23 ILE A 597 -3.857 -39.224 5.749 1.00 41.53 H new ATOM 0 HD11 ILE A 597 -4.309 -37.249 8.673 1.00 31.41 H new ATOM 0 HD12 ILE A 597 -3.370 -37.863 7.292 1.00 31.41 H new ATOM 0 HD13 ILE A 597 -5.148 -37.917 7.253 1.00 31.41 H new ATOM 861 N ASN A 598 -5.355 -41.505 4.719 1.00 62.11 N ATOM 862 CA ASN A 598 -5.338 -42.387 3.564 1.00 32.34 C ATOM 863 C ASN A 598 -3.980 -43.086 3.481 1.00 4.04 C ATOM 864 O ASN A 598 -3.912 -44.300 3.294 1.00 12.21 O ATOM 865 CB ASN A 598 -5.546 -41.602 2.268 1.00 1.20 C ATOM 866 CG ASN A 598 -6.008 -42.523 1.137 1.00 42.21 C ATOM 867 OD1 ASN A 598 -5.221 -43.186 0.481 1.00 53.42 O ATOM 868 ND2 ASN A 598 -7.324 -42.527 0.946 1.00 30.02 N ATOM 0 H ASN A 598 -5.158 -40.526 4.511 1.00 62.11 H new ATOM 0 HA ASN A 598 -6.145 -43.110 3.681 1.00 32.34 H new ATOM 0 HB2 ASN A 598 -6.286 -40.818 2.428 1.00 1.20 H new ATOM 0 HB3 ASN A 598 -4.616 -41.109 1.984 1.00 1.20 H new ATOM 0 HD21 ASN A 598 -7.731 -43.109 0.214 1.00 30.02 H new ATOM 0 HD22 ASN A 598 -7.926 -41.948 1.531 1.00 30.02 H new ATOM 875 N LYS A 599 -2.931 -42.289 3.625 1.00 63.42 N ATOM 876 CA LYS A 599 -1.578 -42.816 3.568 1.00 23.24 C ATOM 877 C LYS A 599 -0.827 -42.420 4.842 1.00 73.14 C ATOM 878 O LYS A 599 -0.904 -41.274 5.280 1.00 3.52 O ATOM 879 CB LYS A 599 -0.882 -42.370 2.281 1.00 52.13 C ATOM 880 CG LYS A 599 0.638 -42.354 2.456 1.00 53.13 C ATOM 881 CD LYS A 599 1.117 -40.993 2.966 1.00 74.24 C ATOM 882 CE LYS A 599 1.396 -40.039 1.803 1.00 73.15 C ATOM 883 NZ LYS A 599 1.385 -38.635 2.270 1.00 5.12 N ATOM 0 H LYS A 599 -2.991 -41.283 3.781 1.00 63.42 H new ATOM 0 HA LYS A 599 -1.595 -43.905 3.532 1.00 23.24 H new ATOM 0 HB2 LYS A 599 -1.151 -43.043 1.466 1.00 52.13 H new ATOM 0 HB3 LYS A 599 -1.230 -41.376 2.001 1.00 52.13 H new ATOM 0 HG2 LYS A 599 0.935 -43.134 3.157 1.00 53.13 H new ATOM 0 HG3 LYS A 599 1.120 -42.580 1.505 1.00 53.13 H new ATOM 0 HD2 LYS A 599 0.362 -40.561 3.623 1.00 74.24 H new ATOM 0 HD3 LYS A 599 2.021 -41.121 3.561 1.00 74.24 H new ATOM 0 HE2 LYS A 599 2.363 -40.273 1.357 1.00 73.15 H new ATOM 0 HE3 LYS A 599 0.645 -40.175 1.025 1.00 73.15 H new ATOM 0 HZ1 LYS A 599 2.138 -38.103 1.788 1.00 5.12 H new ATOM 0 HZ2 LYS A 599 0.463 -38.204 2.053 1.00 5.12 H new ATOM 0 HZ3 LYS A 599 1.546 -38.610 3.297 1.00 5.12 H new ATOM 896 N VAL A 600 -0.119 -43.391 5.399 1.00 32.22 N ATOM 897 CA VAL A 600 0.644 -43.158 6.613 1.00 24.43 C ATOM 898 C VAL A 600 2.026 -42.614 6.245 1.00 11.52 C ATOM 899 O VAL A 600 2.429 -42.667 5.084 1.00 21.34 O ATOM 900 CB VAL A 600 0.710 -44.441 7.445 1.00 73.34 C ATOM 901 CG1 VAL A 600 1.333 -44.175 8.816 1.00 1.31 C ATOM 902 CG2 VAL A 600 -0.676 -45.074 7.586 1.00 70.33 C ATOM 0 H VAL A 600 -0.058 -44.341 5.032 1.00 32.22 H new ATOM 0 HA VAL A 600 0.153 -42.408 7.234 1.00 24.43 H new ATOM 0 HB VAL A 600 1.350 -45.149 6.919 1.00 73.34 H new ATOM 0 HG11 VAL A 600 1.368 -45.103 9.386 1.00 1.31 H new ATOM 0 HG12 VAL A 600 2.345 -43.790 8.687 1.00 1.31 H new ATOM 0 HG13 VAL A 600 0.731 -43.442 9.353 1.00 1.31 H new ATOM 0 HG21 VAL A 600 -0.602 -45.984 8.181 1.00 70.33 H new ATOM 0 HG22 VAL A 600 -1.348 -44.372 8.079 1.00 70.33 H new ATOM 0 HG23 VAL A 600 -1.067 -45.318 6.598 1.00 70.33 H new ATOM 912 N PHE A 601 2.713 -42.101 7.255 1.00 22.45 N ATOM 913 CA PHE A 601 4.041 -41.547 7.053 1.00 60.23 C ATOM 914 C PHE A 601 5.054 -42.188 8.004 1.00 72.23 C ATOM 915 O PHE A 601 4.674 -42.886 8.943 1.00 53.51 O ATOM 916 CB PHE A 601 3.952 -40.050 7.355 1.00 32.11 C ATOM 917 CG PHE A 601 2.914 -39.306 6.513 1.00 53.13 C ATOM 918 CD1 PHE A 601 1.588 -39.464 6.772 1.00 40.41 C ATOM 919 CD2 PHE A 601 3.317 -38.487 5.505 1.00 51.42 C ATOM 920 CE1 PHE A 601 0.625 -38.773 5.990 1.00 13.21 C ATOM 921 CE2 PHE A 601 2.354 -37.796 4.723 1.00 15.21 C ATOM 922 CZ PHE A 601 1.028 -37.953 4.982 1.00 32.52 C ATOM 0 H PHE A 601 2.375 -42.057 8.216 1.00 22.45 H new ATOM 0 HA PHE A 601 4.372 -41.737 6.032 1.00 60.23 H new ATOM 0 HB2 PHE A 601 3.712 -39.916 8.410 1.00 32.11 H new ATOM 0 HB3 PHE A 601 4.930 -39.598 7.190 1.00 32.11 H new ATOM 0 HD1 PHE A 601 1.268 -40.115 7.572 1.00 40.41 H new ATOM 0 HD2 PHE A 601 4.370 -38.362 5.299 1.00 51.42 H new ATOM 0 HE1 PHE A 601 -0.428 -38.898 6.196 1.00 13.21 H new ATOM 0 HE2 PHE A 601 2.674 -37.146 3.922 1.00 15.21 H new ATOM 0 HZ PHE A 601 0.295 -37.427 4.388 1.00 32.52 H new ATOM 932 N LYS A 602 6.323 -41.929 7.727 1.00 4.12 N ATOM 933 CA LYS A 602 7.394 -42.472 8.546 1.00 13.24 C ATOM 934 C LYS A 602 8.060 -41.336 9.326 1.00 73.02 C ATOM 935 O LYS A 602 8.178 -41.403 10.548 1.00 24.42 O ATOM 936 CB LYS A 602 8.367 -43.282 7.688 1.00 20.11 C ATOM 937 CG LYS A 602 7.641 -44.412 6.954 1.00 4.23 C ATOM 938 CD LYS A 602 7.079 -45.435 7.943 1.00 54.11 C ATOM 939 CE LYS A 602 6.566 -46.678 7.213 1.00 63.20 C ATOM 940 NZ LYS A 602 6.611 -47.858 8.105 1.00 22.22 N ATOM 0 H LYS A 602 6.634 -41.350 6.947 1.00 4.12 H new ATOM 0 HA LYS A 602 6.995 -43.172 9.280 1.00 13.24 H new ATOM 0 HB2 LYS A 602 8.852 -42.627 6.965 1.00 20.11 H new ATOM 0 HB3 LYS A 602 9.153 -43.699 8.318 1.00 20.11 H new ATOM 0 HG2 LYS A 602 6.831 -43.999 6.353 1.00 4.23 H new ATOM 0 HG3 LYS A 602 8.329 -44.905 6.267 1.00 4.23 H new ATOM 0 HD2 LYS A 602 7.853 -45.721 8.655 1.00 54.11 H new ATOM 0 HD3 LYS A 602 6.268 -44.985 8.516 1.00 54.11 H new ATOM 0 HE2 LYS A 602 5.544 -46.511 6.872 1.00 63.20 H new ATOM 0 HE3 LYS A 602 7.172 -46.862 6.326 1.00 63.20 H new ATOM 0 HZ1 LYS A 602 6.260 -48.693 7.594 1.00 22.22 H new ATOM 0 HZ2 LYS A 602 7.591 -48.026 8.410 1.00 22.22 H new ATOM 0 HZ3 LYS A 602 6.014 -47.686 8.939 1.00 22.22 H new ATOM 953 N ASP A 603 8.477 -40.319 8.586 1.00 20.02 N ATOM 954 CA ASP A 603 9.128 -39.170 9.193 1.00 61.24 C ATOM 955 C ASP A 603 8.411 -38.812 10.496 1.00 61.30 C ATOM 956 O ASP A 603 9.031 -38.309 11.431 1.00 11.44 O ATOM 957 CB ASP A 603 9.067 -37.952 8.269 1.00 0.34 C ATOM 958 CG ASP A 603 9.848 -38.092 6.961 1.00 14.00 C ATOM 959 OD1 ASP A 603 9.866 -37.174 6.127 1.00 25.41 O ATOM 960 OD2 ASP A 603 10.463 -39.216 6.811 1.00 2.33 O ATOM 0 H ASP A 603 8.377 -40.267 7.572 1.00 20.02 H new ATOM 0 HA ASP A 603 10.170 -39.431 9.378 1.00 61.24 H new ATOM 0 HB2 ASP A 603 8.023 -37.747 8.031 1.00 0.34 H new ATOM 0 HB3 ASP A 603 9.446 -37.085 8.810 1.00 0.34 H new ATOM 966 N TRP A 604 7.115 -39.087 10.516 1.00 41.54 N ATOM 967 CA TRP A 604 6.307 -38.800 11.689 1.00 41.32 C ATOM 968 C TRP A 604 5.085 -39.720 11.658 1.00 51.45 C ATOM 969 O TRP A 604 4.802 -40.347 10.638 1.00 32.23 O ATOM 970 CB TRP A 604 5.937 -37.316 11.751 1.00 65.44 C ATOM 971 CG TRP A 604 5.071 -36.842 10.583 1.00 54.14 C ATOM 972 CD1 TRP A 604 4.686 -37.538 9.504 1.00 24.21 C ATOM 973 CD2 TRP A 604 4.492 -35.530 10.419 1.00 51.11 C ATOM 974 NE1 TRP A 604 3.906 -36.774 8.661 1.00 73.35 N ATOM 975 CE2 TRP A 604 3.784 -35.514 9.235 1.00 74.23 C ATOM 976 CE3 TRP A 604 4.564 -34.394 11.244 1.00 24.03 C ATOM 977 CZ2 TRP A 604 3.094 -34.388 8.769 1.00 60.53 C ATOM 978 CZ3 TRP A 604 3.870 -33.277 10.764 1.00 31.15 C ATOM 979 CH2 TRP A 604 3.152 -33.245 9.574 1.00 24.25 C ATOM 0 H TRP A 604 6.604 -39.506 9.738 1.00 41.54 H new ATOM 0 HA TRP A 604 6.869 -38.998 12.602 1.00 41.32 H new ATOM 0 HB2 TRP A 604 5.408 -37.123 12.684 1.00 65.44 H new ATOM 0 HB3 TRP A 604 6.852 -36.724 11.775 1.00 65.44 H new ATOM 0 HD1 TRP A 604 4.953 -38.568 9.318 1.00 24.21 H new ATOM 0 HE1 TRP A 604 3.494 -37.078 7.779 1.00 73.35 H new ATOM 0 HE3 TRP A 604 5.112 -34.384 12.175 1.00 24.03 H new ATOM 0 HZ2 TRP A 604 2.546 -34.401 7.838 1.00 60.53 H new ATOM 0 HZ3 TRP A 604 3.894 -32.377 11.360 1.00 31.15 H new ATOM 0 HH2 TRP A 604 2.641 -32.342 9.272 1.00 24.25 H new ATOM 990 N LYS A 605 4.393 -39.770 12.787 1.00 64.45 N ATOM 991 CA LYS A 605 3.208 -40.603 12.901 1.00 21.13 C ATOM 992 C LYS A 605 1.967 -39.711 12.956 1.00 54.30 C ATOM 993 O LYS A 605 2.046 -38.555 13.369 1.00 42.33 O ATOM 994 CB LYS A 605 3.335 -41.554 14.093 1.00 31.12 C ATOM 995 CG LYS A 605 3.395 -40.778 15.410 1.00 4.42 C ATOM 996 CD LYS A 605 3.055 -41.682 16.596 1.00 32.22 C ATOM 997 CE LYS A 605 1.551 -41.675 16.877 1.00 72.33 C ATOM 998 NZ LYS A 605 1.181 -42.811 17.751 1.00 64.12 N ATOM 0 H LYS A 605 4.630 -39.247 13.630 1.00 64.45 H new ATOM 0 HA LYS A 605 3.104 -41.241 12.023 1.00 21.13 H new ATOM 0 HB2 LYS A 605 2.487 -42.239 14.109 1.00 31.12 H new ATOM 0 HB3 LYS A 605 4.233 -42.162 13.984 1.00 31.12 H new ATOM 0 HG2 LYS A 605 4.392 -40.357 15.543 1.00 4.42 H new ATOM 0 HG3 LYS A 605 2.698 -39.941 15.375 1.00 4.42 H new ATOM 0 HD2 LYS A 605 3.385 -42.700 16.388 1.00 32.22 H new ATOM 0 HD3 LYS A 605 3.596 -41.346 17.481 1.00 32.22 H new ATOM 0 HE2 LYS A 605 1.268 -40.736 17.352 1.00 72.33 H new ATOM 0 HE3 LYS A 605 1.000 -41.736 15.939 1.00 72.33 H new ATOM 0 HZ1 LYS A 605 0.157 -42.791 17.932 1.00 64.12 H new ATOM 0 HZ2 LYS A 605 1.433 -43.705 17.283 1.00 64.12 H new ATOM 0 HZ3 LYS A 605 1.693 -42.736 18.653 1.00 64.12 H new ATOM 1011 N PRO A 606 0.818 -40.296 12.522 1.00 23.33 N ATOM 1012 CA PRO A 606 -0.438 -39.567 12.518 1.00 54.01 C ATOM 1013 C PRO A 606 -1.000 -39.434 13.935 1.00 73.22 C ATOM 1014 O PRO A 606 -0.485 -40.044 14.871 1.00 41.15 O ATOM 1015 CB PRO A 606 -1.348 -40.356 11.590 1.00 43.43 C ATOM 1016 CG PRO A 606 -0.728 -41.739 11.476 1.00 73.12 C ATOM 1017 CD PRO A 606 0.686 -41.663 12.027 1.00 63.24 C ATOM 0 HA PRO A 606 -0.327 -38.541 12.168 1.00 54.01 H new ATOM 0 HB2 PRO A 606 -2.360 -40.413 11.991 1.00 43.43 H new ATOM 0 HB3 PRO A 606 -1.419 -39.878 10.613 1.00 43.43 H new ATOM 0 HG2 PRO A 606 -1.316 -42.468 12.033 1.00 73.12 H new ATOM 0 HG3 PRO A 606 -0.715 -42.067 10.437 1.00 73.12 H new ATOM 0 HD2 PRO A 606 0.840 -42.390 12.825 1.00 63.24 H new ATOM 0 HD3 PRO A 606 1.424 -41.877 11.254 1.00 63.24 H new ATOM 1025 N GLY A 607 -2.050 -38.634 14.048 1.00 2.51 N ATOM 1026 CA GLY A 607 -2.687 -38.413 15.335 1.00 35.10 C ATOM 1027 C GLY A 607 -4.208 -38.542 15.223 1.00 40.32 C ATOM 1028 O GLY A 607 -4.733 -39.646 15.093 1.00 72.40 O ATOM 0 H GLY A 607 -2.476 -38.131 13.269 1.00 2.51 H new ATOM 0 HA2 GLY A 607 -2.310 -39.134 16.060 1.00 35.10 H new ATOM 0 HA3 GLY A 607 -2.429 -37.422 15.707 1.00 35.10 H new ATOM 1032 N GLY A 608 -4.872 -37.397 15.277 1.00 53.41 N ATOM 1033 CA GLY A 608 -6.322 -37.367 15.183 1.00 60.30 C ATOM 1034 C GLY A 608 -6.794 -36.160 14.370 1.00 35.21 C ATOM 1035 O GLY A 608 -6.179 -35.096 14.418 1.00 75.03 O ATOM 0 H GLY A 608 -4.433 -36.483 15.385 1.00 53.41 H new ATOM 0 HA2 GLY A 608 -6.679 -38.286 14.717 1.00 60.30 H new ATOM 0 HA3 GLY A 608 -6.754 -37.328 16.183 1.00 60.30 H new ATOM 1039 N VAL A 609 -7.883 -36.366 13.643 1.00 65.23 N ATOM 1040 CA VAL A 609 -8.445 -35.308 12.821 1.00 64.24 C ATOM 1041 C VAL A 609 -8.685 -34.069 13.686 1.00 73.43 C ATOM 1042 O VAL A 609 -9.386 -34.139 14.694 1.00 55.31 O ATOM 1043 CB VAL A 609 -9.712 -35.805 12.122 1.00 20.33 C ATOM 1044 CG1 VAL A 609 -10.233 -34.766 11.128 1.00 74.23 C ATOM 1045 CG2 VAL A 609 -9.467 -37.149 11.434 1.00 71.35 C ATOM 0 H VAL A 609 -8.391 -37.250 13.606 1.00 65.23 H new ATOM 0 HA VAL A 609 -7.747 -35.024 12.034 1.00 64.24 H new ATOM 0 HB VAL A 609 -10.478 -35.954 12.883 1.00 20.33 H new ATOM 0 HG11 VAL A 609 -11.134 -35.144 10.645 1.00 74.23 H new ATOM 0 HG12 VAL A 609 -10.465 -33.841 11.656 1.00 74.23 H new ATOM 0 HG13 VAL A 609 -9.471 -34.571 10.373 1.00 74.23 H new ATOM 0 HG21 VAL A 609 -10.383 -37.480 10.945 1.00 71.35 H new ATOM 0 HG22 VAL A 609 -8.678 -37.038 10.690 1.00 71.35 H new ATOM 0 HG23 VAL A 609 -9.165 -37.888 12.176 1.00 71.35 H new ATOM 1055 N ILE A 610 -8.090 -32.965 13.260 1.00 54.22 N ATOM 1056 CA ILE A 610 -8.231 -31.712 13.983 1.00 74.40 C ATOM 1057 C ILE A 610 -9.412 -30.927 13.409 1.00 75.21 C ATOM 1058 O ILE A 610 -9.760 -31.089 12.240 1.00 15.42 O ATOM 1059 CB ILE A 610 -6.913 -30.936 13.972 1.00 51.12 C ATOM 1060 CG1 ILE A 610 -5.717 -31.887 13.900 1.00 20.44 C ATOM 1061 CG2 ILE A 610 -6.823 -29.991 15.172 1.00 72.12 C ATOM 1062 CD1 ILE A 610 -4.434 -31.191 14.359 1.00 13.05 C ATOM 0 H ILE A 610 -7.509 -32.912 12.423 1.00 54.22 H new ATOM 0 HA ILE A 610 -8.454 -31.901 15.033 1.00 74.40 H new ATOM 0 HB ILE A 610 -6.888 -30.319 13.074 1.00 51.12 H new ATOM 0 HG12 ILE A 610 -5.904 -32.760 14.525 1.00 20.44 H new ATOM 0 HG13 ILE A 610 -5.594 -32.246 12.878 1.00 20.44 H new ATOM 0 HG21 ILE A 610 -5.876 -29.452 15.140 1.00 72.12 H new ATOM 0 HG22 ILE A 610 -7.648 -29.279 15.137 1.00 72.12 H new ATOM 0 HG23 ILE A 610 -6.881 -30.568 16.095 1.00 72.12 H new ATOM 0 HD11 ILE A 610 -3.599 -31.889 14.298 1.00 13.05 H new ATOM 0 HD12 ILE A 610 -4.236 -30.332 13.717 1.00 13.05 H new ATOM 0 HD13 ILE A 610 -4.551 -30.855 15.389 1.00 13.05 H new ATOM 1074 N SER A 611 -9.996 -30.094 14.258 1.00 75.24 N ATOM 1075 CA SER A 611 -11.131 -29.284 13.849 1.00 12.54 C ATOM 1076 C SER A 611 -11.251 -28.057 14.756 1.00 50.20 C ATOM 1077 O SER A 611 -11.366 -28.189 15.973 1.00 21.05 O ATOM 1078 CB SER A 611 -12.428 -30.095 13.881 1.00 64.32 C ATOM 1079 OG SER A 611 -12.365 -31.166 14.820 1.00 42.44 O ATOM 0 H SER A 611 -9.705 -29.963 15.227 1.00 75.24 H new ATOM 0 HA SER A 611 -10.965 -28.956 12.823 1.00 12.54 H new ATOM 0 HB2 SER A 611 -13.260 -29.438 14.135 1.00 64.32 H new ATOM 0 HB3 SER A 611 -12.630 -30.495 12.887 1.00 64.32 H new ATOM 0 HG SER A 611 -11.893 -30.868 15.625 1.00 42.44 H new ATOM 1085 N CYS A 612 -11.220 -26.891 14.127 1.00 11.03 N ATOM 1086 CA CYS A 612 -11.324 -25.642 14.862 1.00 42.40 C ATOM 1087 C CYS A 612 -12.507 -25.748 15.826 1.00 54.24 C ATOM 1088 O CYS A 612 -13.651 -25.893 15.396 1.00 22.23 O ATOM 1089 CB CYS A 612 -11.459 -24.442 13.922 1.00 71.12 C ATOM 1090 SG CYS A 612 -11.295 -22.810 14.732 1.00 0.41 S ATOM 0 H CYS A 612 -11.124 -26.785 13.117 1.00 11.03 H new ATOM 0 HA CYS A 612 -10.409 -25.474 15.430 1.00 42.40 H new ATOM 0 HB2 CYS A 612 -10.702 -24.522 13.142 1.00 71.12 H new ATOM 0 HB3 CYS A 612 -12.430 -24.492 13.430 1.00 71.12 H new ATOM 1095 N ARG A 613 -12.192 -25.671 17.110 1.00 13.02 N ATOM 1096 CA ARG A 613 -13.216 -25.757 18.138 1.00 4.32 C ATOM 1097 C ARG A 613 -14.060 -24.481 18.154 1.00 74.11 C ATOM 1098 O ARG A 613 -15.214 -24.502 18.580 1.00 1.44 O ATOM 1099 CB ARG A 613 -12.592 -25.964 19.520 1.00 71.21 C ATOM 1100 CG ARG A 613 -13.638 -25.797 20.624 1.00 1.31 C ATOM 1101 CD ARG A 613 -12.992 -25.878 22.008 1.00 25.45 C ATOM 1102 NE ARG A 613 -13.881 -26.608 22.940 1.00 2.40 N ATOM 1103 CZ ARG A 613 -13.536 -26.959 24.197 1.00 2.51 C ATOM 1104 NH1 ARG A 613 -12.315 -26.649 24.684 1.00 33.23 N ATOM 1105 NH2 ARG A 613 -14.410 -27.609 24.943 1.00 44.22 N ATOM 0 H ARG A 613 -11.243 -25.550 17.463 1.00 13.02 H new ATOM 0 HA ARG A 613 -13.849 -26.613 17.905 1.00 4.32 H new ATOM 0 HB2 ARG A 613 -12.152 -26.959 19.579 1.00 71.21 H new ATOM 0 HB3 ARG A 613 -11.783 -25.248 19.669 1.00 71.21 H new ATOM 0 HG2 ARG A 613 -14.142 -24.838 20.510 1.00 1.31 H new ATOM 0 HG3 ARG A 613 -14.400 -26.571 20.528 1.00 1.31 H new ATOM 0 HD2 ARG A 613 -12.029 -26.384 21.940 1.00 25.45 H new ATOM 0 HD3 ARG A 613 -12.799 -24.875 22.387 1.00 25.45 H new ATOM 0 HE ARG A 613 -14.813 -26.862 22.612 1.00 2.40 H new ATOM 0 HH11 ARG A 613 -11.646 -26.146 24.101 1.00 33.23 H new ATOM 0 HH12 ARG A 613 -12.062 -26.918 25.635 1.00 33.23 H new ATOM 0 HH21 ARG A 613 -15.330 -27.839 24.567 1.00 44.22 H new ATOM 0 HH22 ARG A 613 -14.165 -27.882 25.895 1.00 44.22 H new ATOM 1118 N ASN A 614 -13.453 -23.402 17.684 1.00 52.54 N ATOM 1119 CA ASN A 614 -14.135 -22.119 17.638 1.00 32.32 C ATOM 1120 C ASN A 614 -15.294 -22.198 16.642 1.00 43.32 C ATOM 1121 O ASN A 614 -16.344 -21.595 16.857 1.00 33.53 O ATOM 1122 CB ASN A 614 -13.190 -21.009 17.177 1.00 4.52 C ATOM 1123 CG ASN A 614 -12.049 -20.809 18.177 1.00 30.23 C ATOM 1124 OD1 ASN A 614 -12.136 -21.175 19.338 1.00 4.10 O ATOM 1125 ND2 ASN A 614 -10.978 -20.210 17.664 1.00 31.22 N ATOM 0 H ASN A 614 -12.496 -23.389 17.331 1.00 52.54 H new ATOM 0 HA ASN A 614 -14.494 -21.892 18.642 1.00 32.32 H new ATOM 0 HB2 ASN A 614 -12.781 -21.258 16.198 1.00 4.52 H new ATOM 0 HB3 ASN A 614 -13.745 -20.078 17.063 1.00 4.52 H new ATOM 0 HD21 ASN A 614 -10.163 -20.031 18.251 1.00 31.22 H new ATOM 0 HD22 ASN A 614 -10.971 -19.929 16.683 1.00 31.22 H new ATOM 1132 N CYS A 615 -15.063 -22.945 15.572 1.00 22.15 N ATOM 1133 CA CYS A 615 -16.074 -23.110 14.542 1.00 31.12 C ATOM 1134 C CYS A 615 -16.274 -24.608 14.301 1.00 13.41 C ATOM 1135 O CYS A 615 -17.289 -25.175 14.704 1.00 3.31 O ATOM 1136 CB CYS A 615 -15.698 -22.370 13.257 1.00 72.21 C ATOM 1137 SG CYS A 615 -14.654 -20.888 13.502 1.00 2.33 S ATOM 0 H CYS A 615 -14.190 -23.443 15.396 1.00 22.15 H new ATOM 0 HA CYS A 615 -17.013 -22.668 14.876 1.00 31.12 H new ATOM 0 HB2 CYS A 615 -15.174 -23.061 12.597 1.00 72.21 H new ATOM 0 HB3 CYS A 615 -16.613 -22.072 12.745 1.00 72.21 H new ATOM 1142 N GLY A 616 -15.291 -25.205 13.645 1.00 61.52 N ATOM 1143 CA GLY A 616 -15.346 -26.626 13.345 1.00 33.21 C ATOM 1144 C GLY A 616 -14.573 -26.947 12.064 1.00 32.14 C ATOM 1145 O GLY A 616 -14.210 -28.098 11.826 1.00 3.23 O ATOM 0 H GLY A 616 -14.451 -24.731 13.312 1.00 61.52 H new ATOM 0 HA2 GLY A 616 -14.929 -27.193 14.177 1.00 33.21 H new ATOM 0 HA3 GLY A 616 -16.385 -26.938 13.235 1.00 33.21 H new ATOM 1149 N GLU A 617 -14.345 -25.909 11.273 1.00 23.14 N ATOM 1150 CA GLU A 617 -13.621 -26.066 10.023 1.00 54.11 C ATOM 1151 C GLU A 617 -12.423 -26.998 10.216 1.00 12.40 C ATOM 1152 O GLU A 617 -11.399 -26.592 10.763 1.00 61.01 O ATOM 1153 CB GLU A 617 -13.178 -24.709 9.472 1.00 22.22 C ATOM 1154 CG GLU A 617 -12.715 -24.832 8.019 1.00 55.11 C ATOM 1155 CD GLU A 617 -12.422 -23.455 7.419 1.00 71.42 C ATOM 1156 OE1 GLU A 617 -12.064 -22.523 8.153 1.00 2.40 O ATOM 1157 OE2 GLU A 617 -12.577 -23.374 6.141 1.00 52.53 O ATOM 0 H GLU A 617 -14.649 -24.956 11.473 1.00 23.14 H new ATOM 0 HA GLU A 617 -14.292 -26.517 9.291 1.00 54.11 H new ATOM 0 HB2 GLU A 617 -14.003 -24.000 9.536 1.00 22.22 H new ATOM 0 HB3 GLU A 617 -12.368 -24.311 10.083 1.00 22.22 H new ATOM 0 HG2 GLU A 617 -11.820 -25.452 7.970 1.00 55.11 H new ATOM 0 HG3 GLU A 617 -13.483 -25.334 7.430 1.00 55.11 H new ATOM 1165 N VAL A 618 -12.591 -28.229 9.756 1.00 15.24 N ATOM 1166 CA VAL A 618 -11.537 -29.221 9.872 1.00 65.33 C ATOM 1167 C VAL A 618 -10.222 -28.623 9.366 1.00 71.40 C ATOM 1168 O VAL A 618 -10.174 -28.052 8.278 1.00 60.13 O ATOM 1169 CB VAL A 618 -11.937 -30.499 9.130 1.00 5.34 C ATOM 1170 CG1 VAL A 618 -10.708 -31.348 8.798 1.00 3.55 C ATOM 1171 CG2 VAL A 618 -12.958 -31.304 9.937 1.00 44.41 C ATOM 0 H VAL A 618 -13.442 -28.562 9.302 1.00 15.24 H new ATOM 0 HA VAL A 618 -11.388 -29.500 10.915 1.00 65.33 H new ATOM 0 HB VAL A 618 -12.407 -30.208 8.190 1.00 5.34 H new ATOM 0 HG11 VAL A 618 -11.020 -32.250 8.271 1.00 3.55 H new ATOM 0 HG12 VAL A 618 -10.030 -30.775 8.166 1.00 3.55 H new ATOM 0 HG13 VAL A 618 -10.197 -31.625 9.720 1.00 3.55 H new ATOM 0 HG21 VAL A 618 -13.226 -32.207 9.388 1.00 44.41 H new ATOM 0 HG22 VAL A 618 -12.526 -31.579 10.899 1.00 44.41 H new ATOM 0 HG23 VAL A 618 -13.851 -30.700 10.100 1.00 44.41 H new ATOM 1181 N TRP A 619 -9.188 -28.775 10.180 1.00 30.32 N ATOM 1182 CA TRP A 619 -7.877 -28.257 9.829 1.00 64.50 C ATOM 1183 C TRP A 619 -7.087 -29.384 9.160 1.00 22.53 C ATOM 1184 O TRP A 619 -6.316 -29.142 8.233 1.00 1.40 O ATOM 1185 CB TRP A 619 -7.169 -27.678 11.056 1.00 74.23 C ATOM 1186 CG TRP A 619 -7.740 -26.340 11.529 1.00 15.01 C ATOM 1187 CD1 TRP A 619 -8.498 -25.476 10.840 1.00 71.14 C ATOM 1188 CD2 TRP A 619 -7.568 -25.744 12.832 1.00 21.33 C ATOM 1189 NE1 TRP A 619 -8.825 -24.372 11.600 1.00 51.42 N ATOM 1190 CE2 TRP A 619 -8.241 -24.540 12.850 1.00 34.01 C ATOM 1191 CE3 TRP A 619 -6.866 -26.208 13.959 1.00 41.22 C ATOM 1192 CZ2 TRP A 619 -8.279 -23.699 13.969 1.00 73.21 C ATOM 1193 CZ3 TRP A 619 -6.913 -25.356 15.069 1.00 54.11 C ATOM 1194 CH2 TRP A 619 -7.587 -24.140 15.103 1.00 62.53 C ATOM 0 H TRP A 619 -9.232 -29.250 11.082 1.00 30.32 H new ATOM 0 HA TRP A 619 -7.966 -27.428 9.126 1.00 64.50 H new ATOM 0 HB2 TRP A 619 -7.232 -28.397 11.872 1.00 74.23 H new ATOM 0 HB3 TRP A 619 -6.111 -27.549 10.826 1.00 74.23 H new ATOM 0 HD1 TRP A 619 -8.813 -25.625 9.818 1.00 71.14 H new ATOM 0 HE1 TRP A 619 -9.391 -23.578 11.300 1.00 51.42 H new ATOM 0 HE3 TRP A 619 -6.333 -27.147 13.967 1.00 41.22 H new ATOM 0 HZ2 TRP A 619 -8.813 -22.761 13.958 1.00 73.21 H new ATOM 0 HZ3 TRP A 619 -6.389 -25.665 15.961 1.00 54.11 H new ATOM 0 HH2 TRP A 619 -7.577 -23.539 16.000 1.00 62.53 H new ATOM 1205 N GLY A 620 -7.306 -30.593 9.657 1.00 0.01 N ATOM 1206 CA GLY A 620 -6.624 -31.758 9.119 1.00 33.14 C ATOM 1207 C GLY A 620 -6.514 -32.863 10.172 1.00 73.32 C ATOM 1208 O GLY A 620 -7.523 -33.432 10.587 1.00 24.24 O ATOM 0 H GLY A 620 -7.946 -30.791 10.426 1.00 0.01 H new ATOM 0 HA2 GLY A 620 -7.165 -32.132 8.250 1.00 33.14 H new ATOM 0 HA3 GLY A 620 -5.628 -31.476 8.777 1.00 33.14 H new ATOM 1212 N LEU A 621 -5.281 -33.134 10.573 1.00 61.15 N ATOM 1213 CA LEU A 621 -5.026 -34.161 11.568 1.00 10.05 C ATOM 1214 C LEU A 621 -3.804 -33.766 12.401 1.00 74.23 C ATOM 1215 O LEU A 621 -2.957 -33.002 11.942 1.00 51.30 O ATOM 1216 CB LEU A 621 -4.900 -35.533 10.903 1.00 3.02 C ATOM 1217 CG LEU A 621 -3.494 -35.932 10.450 1.00 3.31 C ATOM 1218 CD1 LEU A 621 -2.913 -34.894 9.488 1.00 42.12 C ATOM 1219 CD2 LEU A 621 -2.579 -36.174 11.652 1.00 25.40 C ATOM 0 H LEU A 621 -4.447 -32.660 10.227 1.00 61.15 H new ATOM 0 HA LEU A 621 -5.868 -34.243 12.255 1.00 10.05 H new ATOM 0 HB2 LEU A 621 -5.263 -36.288 11.601 1.00 3.02 H new ATOM 0 HB3 LEU A 621 -5.560 -35.556 10.036 1.00 3.02 H new ATOM 0 HG LEU A 621 -3.565 -36.873 9.904 1.00 3.31 H new ATOM 0 HD11 LEU A 621 -1.913 -35.202 9.181 1.00 42.12 H new ATOM 0 HD12 LEU A 621 -3.553 -34.813 8.610 1.00 42.12 H new ATOM 0 HD13 LEU A 621 -2.858 -33.926 9.987 1.00 42.12 H new ATOM 0 HD21 LEU A 621 -1.586 -36.456 11.302 1.00 25.40 H new ATOM 0 HD22 LEU A 621 -2.509 -35.262 12.246 1.00 25.40 H new ATOM 0 HD23 LEU A 621 -2.989 -36.976 12.266 1.00 25.40 H new ATOM 1231 N GLN A 622 -3.753 -34.305 13.610 1.00 64.42 N ATOM 1232 CA GLN A 622 -2.649 -34.019 14.510 1.00 22.04 C ATOM 1233 C GLN A 622 -1.474 -34.957 14.225 1.00 0.30 C ATOM 1234 O GLN A 622 -1.660 -36.164 14.081 1.00 63.03 O ATOM 1235 CB GLN A 622 -3.092 -34.124 15.971 1.00 4.31 C ATOM 1236 CG GLN A 622 -2.397 -33.066 16.832 1.00 74.04 C ATOM 1237 CD GLN A 622 -2.207 -33.565 18.266 1.00 41.45 C ATOM 1238 OE1 GLN A 622 -1.126 -33.953 18.677 1.00 61.24 O ATOM 1239 NE2 GLN A 622 -3.314 -33.532 19.001 1.00 13.13 N ATOM 0 H GLN A 622 -4.458 -34.938 13.987 1.00 64.42 H new ATOM 0 HA GLN A 622 -2.321 -32.994 14.336 1.00 22.04 H new ATOM 0 HB2 GLN A 622 -4.173 -33.999 16.037 1.00 4.31 H new ATOM 0 HB3 GLN A 622 -2.862 -35.118 16.354 1.00 4.31 H new ATOM 0 HG2 GLN A 622 -1.428 -32.818 16.398 1.00 74.04 H new ATOM 0 HG3 GLN A 622 -2.988 -32.150 16.837 1.00 74.04 H new ATOM 0 HE21 GLN A 622 -4.187 -33.195 18.594 1.00 13.13 H new ATOM 0 HE22 GLN A 622 -3.291 -33.844 19.972 1.00 13.13 H new ATOM 1248 N MET A 623 -0.291 -34.366 14.152 1.00 5.52 N ATOM 1249 CA MET A 623 0.914 -35.133 13.887 1.00 64.03 C ATOM 1250 C MET A 623 1.860 -35.102 15.089 1.00 44.11 C ATOM 1251 O MET A 623 1.990 -34.076 15.755 1.00 44.25 O ATOM 1252 CB MET A 623 1.627 -34.557 12.661 1.00 32.43 C ATOM 1253 CG MET A 623 1.033 -35.119 11.368 1.00 51.12 C ATOM 1254 SD MET A 623 1.447 -36.847 11.206 1.00 65.44 S ATOM 1255 CE MET A 623 0.596 -37.229 9.684 1.00 44.24 C ATOM 0 H MET A 623 -0.141 -33.364 14.272 1.00 5.52 H new ATOM 0 HA MET A 623 0.629 -36.168 13.700 1.00 64.03 H new ATOM 0 HB2 MET A 623 1.541 -33.470 12.663 1.00 32.43 H new ATOM 0 HB3 MET A 623 2.690 -34.793 12.710 1.00 32.43 H new ATOM 0 HG2 MET A 623 -0.050 -34.995 11.372 1.00 51.12 H new ATOM 0 HG3 MET A 623 1.415 -34.563 10.511 1.00 51.12 H new ATOM 0 HE1 MET A 623 -0.142 -38.010 9.866 1.00 44.24 H new ATOM 0 HE2 MET A 623 0.094 -36.335 9.314 1.00 44.24 H new ATOM 0 HE3 MET A 623 1.315 -37.575 8.942 1.00 44.24 H new ATOM 1265 N ILE A 624 2.496 -36.239 15.330 1.00 4.24 N ATOM 1266 CA ILE A 624 3.427 -36.355 16.441 1.00 54.32 C ATOM 1267 C ILE A 624 4.835 -36.604 15.897 1.00 52.41 C ATOM 1268 O ILE A 624 5.007 -37.332 14.921 1.00 63.20 O ATOM 1269 CB ILE A 624 2.951 -37.422 17.429 1.00 43.13 C ATOM 1270 CG1 ILE A 624 1.510 -37.159 17.869 1.00 54.25 C ATOM 1271 CG2 ILE A 624 3.904 -37.528 18.621 1.00 20.32 C ATOM 1272 CD1 ILE A 624 0.517 -37.619 16.799 1.00 44.45 C ATOM 0 H ILE A 624 2.385 -37.088 14.776 1.00 4.24 H new ATOM 0 HA ILE A 624 3.464 -35.424 17.006 1.00 54.32 H new ATOM 0 HB ILE A 624 2.961 -38.386 16.921 1.00 43.13 H new ATOM 0 HG12 ILE A 624 1.310 -37.682 18.804 1.00 54.25 H new ATOM 0 HG13 ILE A 624 1.374 -36.095 18.063 1.00 54.25 H new ATOM 0 HG21 ILE A 624 3.543 -38.293 19.308 1.00 20.32 H new ATOM 0 HG22 ILE A 624 4.899 -37.797 18.268 1.00 20.32 H new ATOM 0 HG23 ILE A 624 3.949 -36.569 19.137 1.00 20.32 H new ATOM 0 HD11 ILE A 624 -0.500 -37.421 17.137 1.00 44.45 H new ATOM 0 HD12 ILE A 624 0.704 -37.077 15.872 1.00 44.45 H new ATOM 0 HD13 ILE A 624 0.639 -38.688 16.625 1.00 44.45 H new ATOM 1284 N TYR A 625 5.806 -35.984 16.552 1.00 34.31 N ATOM 1285 CA TYR A 625 7.193 -36.130 16.146 1.00 4.44 C ATOM 1286 C TYR A 625 8.131 -36.022 17.351 1.00 72.11 C ATOM 1287 O TYR A 625 8.287 -34.946 17.926 1.00 30.34 O ATOM 1288 CB TYR A 625 7.477 -34.970 15.190 1.00 54.23 C ATOM 1289 CG TYR A 625 8.965 -34.679 14.988 1.00 0.43 C ATOM 1290 CD1 TYR A 625 9.685 -35.384 14.045 1.00 13.32 C ATOM 1291 CD2 TYR A 625 9.588 -33.711 15.750 1.00 41.21 C ATOM 1292 CE1 TYR A 625 11.086 -35.110 13.856 1.00 54.34 C ATOM 1293 CE2 TYR A 625 10.989 -33.437 15.560 1.00 1.34 C ATOM 1294 CZ TYR A 625 11.669 -34.150 14.623 1.00 53.24 C ATOM 1295 OH TYR A 625 12.992 -33.891 14.444 1.00 53.14 O ATOM 0 H TYR A 625 5.659 -35.380 17.361 1.00 34.31 H new ATOM 0 HA TYR A 625 7.357 -37.103 15.683 1.00 4.44 H new ATOM 0 HB2 TYR A 625 7.026 -35.192 14.223 1.00 54.23 H new ATOM 0 HB3 TYR A 625 6.990 -34.072 15.570 1.00 54.23 H new ATOM 0 HD1 TYR A 625 9.198 -36.141 13.449 1.00 13.32 H new ATOM 0 HD2 TYR A 625 9.025 -33.159 16.488 1.00 41.21 H new ATOM 0 HE1 TYR A 625 11.661 -35.655 13.122 1.00 54.34 H new ATOM 0 HE2 TYR A 625 11.488 -32.682 16.149 1.00 1.34 H new ATOM 0 HH TYR A 625 13.347 -33.437 15.237 1.00 53.14 H new ATOM 1305 N LYS A 626 8.730 -37.152 17.696 1.00 23.03 N ATOM 1306 CA LYS A 626 9.648 -37.198 18.822 1.00 62.42 C ATOM 1307 C LYS A 626 8.867 -36.988 20.120 1.00 30.04 C ATOM 1308 O LYS A 626 9.448 -36.651 21.151 1.00 60.40 O ATOM 1309 CB LYS A 626 10.791 -36.200 18.623 1.00 72.51 C ATOM 1310 CG LYS A 626 11.358 -36.292 17.205 1.00 53.33 C ATOM 1311 CD LYS A 626 12.401 -37.406 17.102 1.00 74.43 C ATOM 1312 CE LYS A 626 11.745 -38.783 17.222 1.00 73.52 C ATOM 1313 NZ LYS A 626 12.441 -39.766 16.361 1.00 54.23 N ATOM 0 H LYS A 626 8.598 -38.042 17.216 1.00 23.03 H new ATOM 0 HA LYS A 626 10.120 -38.178 18.889 1.00 62.42 H new ATOM 0 HB2 LYS A 626 10.432 -35.188 18.810 1.00 72.51 H new ATOM 0 HB3 LYS A 626 11.581 -36.397 19.348 1.00 72.51 H new ATOM 0 HG2 LYS A 626 10.550 -36.479 16.498 1.00 53.33 H new ATOM 0 HG3 LYS A 626 11.810 -35.340 16.928 1.00 53.33 H new ATOM 0 HD2 LYS A 626 12.926 -37.331 16.150 1.00 74.43 H new ATOM 0 HD3 LYS A 626 13.147 -37.285 17.888 1.00 74.43 H new ATOM 0 HE2 LYS A 626 11.772 -39.116 18.260 1.00 73.52 H new ATOM 0 HE3 LYS A 626 10.695 -38.719 16.935 1.00 73.52 H new ATOM 0 HZ1 LYS A 626 11.983 -40.695 16.454 1.00 54.23 H new ATOM 0 HZ2 LYS A 626 12.393 -39.455 15.370 1.00 54.23 H new ATOM 0 HZ3 LYS A 626 13.436 -39.840 16.653 1.00 54.23 H new ATOM 1326 N SER A 627 7.562 -37.195 20.028 1.00 34.24 N ATOM 1327 CA SER A 627 6.695 -37.032 21.183 1.00 32.41 C ATOM 1328 C SER A 627 6.280 -35.566 21.323 1.00 32.45 C ATOM 1329 O SER A 627 6.207 -35.042 22.434 1.00 51.34 O ATOM 1330 CB SER A 627 7.384 -37.514 22.461 1.00 1.44 C ATOM 1331 OG SER A 627 8.102 -36.466 23.108 1.00 42.15 O ATOM 0 H SER A 627 7.084 -37.474 19.172 1.00 34.24 H new ATOM 0 HA SER A 627 5.804 -37.642 21.031 1.00 32.41 H new ATOM 0 HB2 SER A 627 6.638 -37.918 23.145 1.00 1.44 H new ATOM 0 HB3 SER A 627 8.069 -38.327 22.219 1.00 1.44 H new ATOM 0 HG SER A 627 8.717 -36.048 22.470 1.00 42.15 H new ATOM 1337 N VAL A 628 6.019 -34.947 20.182 1.00 52.21 N ATOM 1338 CA VAL A 628 5.613 -33.552 20.163 1.00 1.44 C ATOM 1339 C VAL A 628 4.287 -33.421 19.412 1.00 51.43 C ATOM 1340 O VAL A 628 4.229 -33.646 18.204 1.00 41.52 O ATOM 1341 CB VAL A 628 6.727 -32.690 19.565 1.00 62.51 C ATOM 1342 CG1 VAL A 628 6.227 -31.275 19.269 1.00 61.33 C ATOM 1343 CG2 VAL A 628 7.950 -32.659 20.484 1.00 33.03 C ATOM 0 H VAL A 628 6.081 -35.386 19.263 1.00 52.21 H new ATOM 0 HA VAL A 628 5.449 -33.189 21.177 1.00 1.44 H new ATOM 0 HB VAL A 628 7.030 -33.142 18.620 1.00 62.51 H new ATOM 0 HG11 VAL A 628 7.038 -30.684 18.845 1.00 61.33 H new ATOM 0 HG12 VAL A 628 5.402 -31.322 18.558 1.00 61.33 H new ATOM 0 HG13 VAL A 628 5.884 -30.810 20.193 1.00 61.33 H new ATOM 0 HG21 VAL A 628 8.727 -32.040 20.035 1.00 33.03 H new ATOM 0 HG22 VAL A 628 7.668 -32.243 21.451 1.00 33.03 H new ATOM 0 HG23 VAL A 628 8.328 -33.672 20.621 1.00 33.03 H new ATOM 1353 N LYS A 629 3.254 -33.057 20.158 1.00 60.14 N ATOM 1354 CA LYS A 629 1.932 -32.893 19.577 1.00 62.52 C ATOM 1355 C LYS A 629 1.915 -31.637 18.704 1.00 4.21 C ATOM 1356 O LYS A 629 1.783 -30.525 19.213 1.00 15.02 O ATOM 1357 CB LYS A 629 0.862 -32.897 20.670 1.00 22.15 C ATOM 1358 CG LYS A 629 0.883 -34.211 21.454 1.00 60.44 C ATOM 1359 CD LYS A 629 0.195 -35.329 20.667 1.00 31.03 C ATOM 1360 CE LYS A 629 -1.319 -35.302 20.888 1.00 61.35 C ATOM 1361 NZ LYS A 629 -1.678 -36.056 22.110 1.00 52.14 N ATOM 0 H LYS A 629 3.306 -32.871 21.160 1.00 60.14 H new ATOM 0 HA LYS A 629 1.694 -33.736 18.928 1.00 62.52 H new ATOM 0 HB2 LYS A 629 1.028 -32.061 21.350 1.00 22.15 H new ATOM 0 HB3 LYS A 629 -0.121 -32.753 20.222 1.00 22.15 H new ATOM 0 HG2 LYS A 629 1.913 -34.494 21.670 1.00 60.44 H new ATOM 0 HG3 LYS A 629 0.383 -34.075 22.413 1.00 60.44 H new ATOM 0 HD2 LYS A 629 0.413 -35.219 19.605 1.00 31.03 H new ATOM 0 HD3 LYS A 629 0.594 -36.295 20.976 1.00 31.03 H new ATOM 0 HE2 LYS A 629 -1.661 -34.271 20.976 1.00 61.35 H new ATOM 0 HE3 LYS A 629 -1.826 -35.734 20.025 1.00 61.35 H new ATOM 0 HZ1 LYS A 629 -2.709 -36.028 22.245 1.00 52.14 H new ATOM 0 HZ2 LYS A 629 -1.369 -37.044 22.012 1.00 52.14 H new ATOM 0 HZ3 LYS A 629 -1.209 -35.627 22.933 1.00 52.14 H new ATOM 1374 N LEU A 630 2.052 -31.856 17.405 1.00 41.24 N ATOM 1375 CA LEU A 630 2.054 -30.755 16.456 1.00 3.24 C ATOM 1376 C LEU A 630 0.836 -30.876 15.538 1.00 2.55 C ATOM 1377 O LEU A 630 0.756 -31.794 14.724 1.00 25.14 O ATOM 1378 CB LEU A 630 3.386 -30.697 15.706 1.00 4.40 C ATOM 1379 CG LEU A 630 4.645 -30.675 16.575 1.00 4.32 C ATOM 1380 CD1 LEU A 630 5.907 -30.637 15.711 1.00 4.43 C ATOM 1381 CD2 LEU A 630 4.601 -29.518 17.576 1.00 73.11 C ATOM 0 H LEU A 630 2.162 -32.780 16.987 1.00 41.24 H new ATOM 0 HA LEU A 630 1.967 -29.802 16.978 1.00 3.24 H new ATOM 0 HB2 LEU A 630 3.443 -31.558 15.040 1.00 4.40 H new ATOM 0 HB3 LEU A 630 3.387 -29.807 15.077 1.00 4.40 H new ATOM 0 HG LEU A 630 4.677 -31.599 17.152 1.00 4.32 H new ATOM 0 HD11 LEU A 630 6.787 -30.622 16.353 1.00 4.43 H new ATOM 0 HD12 LEU A 630 5.938 -31.520 15.073 1.00 4.43 H new ATOM 0 HD13 LEU A 630 5.896 -29.741 15.090 1.00 4.43 H new ATOM 0 HD21 LEU A 630 5.508 -29.526 18.181 1.00 73.11 H new ATOM 0 HD22 LEU A 630 4.532 -28.573 17.037 1.00 73.11 H new ATOM 0 HD23 LEU A 630 3.732 -29.630 18.224 1.00 73.11 H new ATOM 1393 N PRO A 631 -0.107 -29.910 15.705 1.00 42.22 N ATOM 1394 CA PRO A 631 -1.317 -29.899 14.901 1.00 71.20 C ATOM 1395 C PRO A 631 -1.026 -29.418 13.478 1.00 70.41 C ATOM 1396 O PRO A 631 -0.401 -28.376 13.287 1.00 72.35 O ATOM 1397 CB PRO A 631 -2.279 -28.991 15.650 1.00 62.02 C ATOM 1398 CG PRO A 631 -1.421 -28.162 16.592 1.00 32.32 C ATOM 1399 CD PRO A 631 -0.046 -28.806 16.659 1.00 31.51 C ATOM 0 HA PRO A 631 -1.746 -30.893 14.773 1.00 71.20 H new ATOM 0 HB2 PRO A 631 -2.831 -28.352 14.960 1.00 62.02 H new ATOM 0 HB3 PRO A 631 -3.016 -29.574 16.203 1.00 62.02 H new ATOM 0 HG2 PRO A 631 -1.344 -27.135 16.235 1.00 32.32 H new ATOM 0 HG3 PRO A 631 -1.872 -28.122 17.583 1.00 32.32 H new ATOM 0 HD2 PRO A 631 0.737 -28.096 16.393 1.00 31.51 H new ATOM 0 HD3 PRO A 631 0.175 -29.163 17.665 1.00 31.51 H new ATOM 1407 N VAL A 632 -1.493 -30.201 12.516 1.00 0.20 N ATOM 1408 CA VAL A 632 -1.291 -29.868 11.116 1.00 3.12 C ATOM 1409 C VAL A 632 -2.555 -29.204 10.567 1.00 43.43 C ATOM 1410 O VAL A 632 -3.578 -29.862 10.387 1.00 13.34 O ATOM 1411 CB VAL A 632 -0.885 -31.119 10.334 1.00 5.32 C ATOM 1412 CG1 VAL A 632 -0.431 -30.757 8.919 1.00 44.13 C ATOM 1413 CG2 VAL A 632 0.202 -31.900 11.076 1.00 70.03 C ATOM 0 H VAL A 632 -2.010 -31.065 12.679 1.00 0.20 H new ATOM 0 HA VAL A 632 -0.475 -29.154 11.007 1.00 3.12 H new ATOM 0 HB VAL A 632 -1.761 -31.762 10.250 1.00 5.32 H new ATOM 0 HG11 VAL A 632 -0.148 -31.664 8.385 1.00 44.13 H new ATOM 0 HG12 VAL A 632 -1.247 -30.264 8.390 1.00 44.13 H new ATOM 0 HG13 VAL A 632 0.426 -30.085 8.972 1.00 44.13 H new ATOM 0 HG21 VAL A 632 0.473 -32.784 10.499 1.00 70.03 H new ATOM 0 HG22 VAL A 632 1.081 -31.268 11.205 1.00 70.03 H new ATOM 0 HG23 VAL A 632 -0.172 -32.205 12.053 1.00 70.03 H new ATOM 1423 N LEU A 633 -2.442 -27.908 10.315 1.00 41.23 N ATOM 1424 CA LEU A 633 -3.563 -27.147 9.789 1.00 21.13 C ATOM 1425 C LEU A 633 -3.262 -26.733 8.348 1.00 44.04 C ATOM 1426 O LEU A 633 -2.145 -26.917 7.865 1.00 32.44 O ATOM 1427 CB LEU A 633 -3.891 -25.971 10.711 1.00 35.11 C ATOM 1428 CG LEU A 633 -3.678 -26.211 12.207 1.00 31.40 C ATOM 1429 CD1 LEU A 633 -3.905 -27.682 12.564 1.00 52.41 C ATOM 1430 CD2 LEU A 633 -2.298 -25.721 12.650 1.00 53.41 C ATOM 0 H LEU A 633 -1.591 -27.366 10.465 1.00 41.23 H new ATOM 0 HA LEU A 633 -4.462 -27.762 9.762 1.00 21.13 H new ATOM 0 HB2 LEU A 633 -3.282 -25.118 10.410 1.00 35.11 H new ATOM 0 HB3 LEU A 633 -4.932 -25.691 10.553 1.00 35.11 H new ATOM 0 HG LEU A 633 -4.418 -25.628 12.755 1.00 31.40 H new ATOM 0 HD11 LEU A 633 -3.747 -27.826 13.633 1.00 52.41 H new ATOM 0 HD12 LEU A 633 -4.925 -27.966 12.306 1.00 52.41 H new ATOM 0 HD13 LEU A 633 -3.204 -28.304 12.007 1.00 52.41 H new ATOM 0 HD21 LEU A 633 -2.172 -25.903 13.717 1.00 53.41 H new ATOM 0 HD22 LEU A 633 -1.527 -26.257 12.097 1.00 53.41 H new ATOM 0 HD23 LEU A 633 -2.210 -24.653 12.452 1.00 53.41 H new ATOM 1442 N LYS A 634 -4.277 -26.181 7.700 1.00 40.13 N ATOM 1443 CA LYS A 634 -4.135 -25.739 6.323 1.00 62.12 C ATOM 1444 C LYS A 634 -3.915 -24.225 6.298 1.00 73.13 C ATOM 1445 O LYS A 634 -3.849 -23.586 7.347 1.00 64.52 O ATOM 1446 CB LYS A 634 -5.329 -26.201 5.486 1.00 72.32 C ATOM 1447 CG LYS A 634 -5.956 -27.466 6.077 1.00 54.34 C ATOM 1448 CD LYS A 634 -7.145 -27.933 5.235 1.00 53.14 C ATOM 1449 CE LYS A 634 -8.104 -26.775 4.950 1.00 35.35 C ATOM 1450 NZ LYS A 634 -9.501 -27.262 4.893 1.00 12.43 N ATOM 0 H LYS A 634 -5.202 -26.030 8.103 1.00 40.13 H new ATOM 0 HA LYS A 634 -3.258 -26.196 5.865 1.00 62.12 H new ATOM 0 HB2 LYS A 634 -6.075 -25.408 5.441 1.00 72.32 H new ATOM 0 HB3 LYS A 634 -5.007 -26.394 4.463 1.00 72.32 H new ATOM 0 HG2 LYS A 634 -5.208 -28.257 6.127 1.00 54.34 H new ATOM 0 HG3 LYS A 634 -6.283 -27.271 7.098 1.00 54.34 H new ATOM 0 HD2 LYS A 634 -6.787 -28.353 4.295 1.00 53.14 H new ATOM 0 HD3 LYS A 634 -7.675 -28.729 5.758 1.00 53.14 H new ATOM 0 HE2 LYS A 634 -8.008 -26.016 5.727 1.00 35.35 H new ATOM 0 HE3 LYS A 634 -7.839 -26.300 4.005 1.00 35.35 H new ATOM 0 HZ1 LYS A 634 -10.139 -26.464 4.699 1.00 12.43 H new ATOM 0 HZ2 LYS A 634 -9.591 -27.970 4.136 1.00 12.43 H new ATOM 0 HZ3 LYS A 634 -9.755 -27.695 5.804 1.00 12.43 H new ATOM 1463 N VAL A 635 -3.809 -23.695 5.088 1.00 0.22 N ATOM 1464 CA VAL A 635 -3.598 -22.268 4.913 1.00 53.14 C ATOM 1465 C VAL A 635 -4.917 -21.608 4.505 1.00 73.40 C ATOM 1466 O VAL A 635 -5.147 -20.437 4.801 1.00 14.13 O ATOM 1467 CB VAL A 635 -2.472 -22.025 3.906 1.00 73.15 C ATOM 1468 CG1 VAL A 635 -2.845 -22.569 2.525 1.00 61.11 C ATOM 1469 CG2 VAL A 635 -2.114 -20.540 3.831 1.00 10.52 C ATOM 0 H VAL A 635 -3.865 -24.228 4.220 1.00 0.22 H new ATOM 0 HA VAL A 635 -3.282 -21.811 5.851 1.00 53.14 H new ATOM 0 HB VAL A 635 -1.591 -22.565 4.253 1.00 73.15 H new ATOM 0 HG11 VAL A 635 -2.028 -22.383 1.828 1.00 61.11 H new ATOM 0 HG12 VAL A 635 -3.027 -23.641 2.593 1.00 61.11 H new ATOM 0 HG13 VAL A 635 -3.746 -22.070 2.169 1.00 61.11 H new ATOM 0 HG21 VAL A 635 -1.311 -20.395 3.108 1.00 10.52 H new ATOM 0 HG22 VAL A 635 -2.989 -19.970 3.520 1.00 10.52 H new ATOM 0 HG23 VAL A 635 -1.786 -20.195 4.811 1.00 10.52 H new ATOM 1479 N ARG A 636 -5.749 -22.389 3.832 1.00 72.43 N ATOM 1480 CA ARG A 636 -7.039 -21.896 3.380 1.00 12.14 C ATOM 1481 C ARG A 636 -8.025 -21.842 4.549 1.00 53.00 C ATOM 1482 O ARG A 636 -9.051 -21.168 4.469 1.00 33.15 O ATOM 1483 CB ARG A 636 -7.614 -22.786 2.277 1.00 34.53 C ATOM 1484 CG ARG A 636 -7.901 -24.194 2.803 1.00 30.51 C ATOM 1485 CD ARG A 636 -7.759 -25.235 1.690 1.00 5.13 C ATOM 1486 NE ARG A 636 -9.084 -25.534 1.104 1.00 12.13 N ATOM 1487 CZ ARG A 636 -9.271 -25.989 -0.153 1.00 23.32 C ATOM 1488 NH1 ARG A 636 -8.216 -26.202 -0.968 1.00 22.30 N ATOM 1489 NH2 ARG A 636 -10.500 -26.223 -0.573 1.00 61.11 N ATOM 0 H ARG A 636 -5.555 -23.360 3.589 1.00 72.43 H new ATOM 0 HA ARG A 636 -6.889 -20.893 2.980 1.00 12.14 H new ATOM 0 HB2 ARG A 636 -8.532 -22.344 1.890 1.00 34.53 H new ATOM 0 HB3 ARG A 636 -6.911 -22.841 1.445 1.00 34.53 H new ATOM 0 HG2 ARG A 636 -7.214 -24.429 3.616 1.00 30.51 H new ATOM 0 HG3 ARG A 636 -8.909 -24.233 3.216 1.00 30.51 H new ATOM 0 HD2 ARG A 636 -7.086 -24.864 0.917 1.00 5.13 H new ATOM 0 HD3 ARG A 636 -7.314 -26.147 2.088 1.00 5.13 H new ATOM 0 HE ARG A 636 -9.908 -25.387 1.687 1.00 12.13 H new ATOM 0 HH11 ARG A 636 -7.269 -26.019 -0.635 1.00 22.30 H new ATOM 0 HH12 ARG A 636 -8.366 -26.546 -1.917 1.00 22.30 H new ATOM 0 HH21 ARG A 636 -11.291 -26.060 0.049 1.00 61.11 H new ATOM 0 HH22 ARG A 636 -10.658 -26.567 -1.520 1.00 61.11 H new ATOM 1502 N SER A 637 -7.680 -22.561 5.607 1.00 43.21 N ATOM 1503 CA SER A 637 -8.522 -22.603 6.790 1.00 22.33 C ATOM 1504 C SER A 637 -7.978 -21.647 7.854 1.00 54.12 C ATOM 1505 O SER A 637 -8.652 -21.366 8.844 1.00 71.40 O ATOM 1506 CB SER A 637 -8.613 -24.024 7.351 1.00 64.02 C ATOM 1507 OG SER A 637 -7.347 -24.679 7.352 1.00 72.40 O ATOM 0 H SER A 637 -6.829 -23.119 5.669 1.00 43.21 H new ATOM 0 HA SER A 637 -9.526 -22.288 6.506 1.00 22.33 H new ATOM 0 HB2 SER A 637 -9.004 -23.988 8.368 1.00 64.02 H new ATOM 0 HB3 SER A 637 -9.321 -24.603 6.758 1.00 64.02 H new ATOM 0 HG SER A 637 -7.411 -25.514 7.860 1.00 72.40 H new ATOM 1513 N MET A 638 -6.765 -21.173 7.613 1.00 50.43 N ATOM 1514 CA MET A 638 -6.123 -20.254 8.537 1.00 14.54 C ATOM 1515 C MET A 638 -6.045 -18.845 7.945 1.00 73.01 C ATOM 1516 O MET A 638 -5.586 -18.666 6.818 1.00 24.31 O ATOM 1517 CB MET A 638 -4.713 -20.752 8.857 1.00 64.25 C ATOM 1518 CG MET A 638 -4.760 -22.019 9.714 1.00 43.41 C ATOM 1519 SD MET A 638 -5.334 -21.622 11.357 1.00 61.51 S ATOM 1520 CE MET A 638 -6.884 -22.508 11.366 1.00 64.34 C ATOM 0 H MET A 638 -6.209 -21.408 6.791 1.00 50.43 H new ATOM 0 HA MET A 638 -6.718 -20.212 9.449 1.00 14.54 H new ATOM 0 HB2 MET A 638 -4.176 -20.955 7.930 1.00 64.25 H new ATOM 0 HB3 MET A 638 -4.159 -19.974 9.382 1.00 64.25 H new ATOM 0 HG2 MET A 638 -5.422 -22.754 9.256 1.00 43.41 H new ATOM 0 HG3 MET A 638 -3.769 -22.471 9.765 1.00 43.41 H new ATOM 0 HE1 MET A 638 -7.644 -21.907 11.866 1.00 64.34 H new ATOM 0 HE2 MET A 638 -7.196 -22.707 10.341 1.00 64.34 H new ATOM 0 HE3 MET A 638 -6.760 -23.452 11.897 1.00 64.34 H new ATOM 1530 N LEU A 639 -6.502 -17.881 8.731 1.00 44.12 N ATOM 1531 CA LEU A 639 -6.489 -16.494 8.298 1.00 12.21 C ATOM 1532 C LEU A 639 -5.199 -15.826 8.778 1.00 13.24 C ATOM 1533 O LEU A 639 -4.738 -16.084 9.889 1.00 34.51 O ATOM 1534 CB LEU A 639 -7.761 -15.778 8.758 1.00 43.21 C ATOM 1535 CG LEU A 639 -7.733 -14.250 8.687 1.00 3.43 C ATOM 1536 CD1 LEU A 639 -7.204 -13.773 7.333 1.00 5.14 C ATOM 1537 CD2 LEU A 639 -9.109 -13.661 9.004 1.00 2.24 C ATOM 0 H LEU A 639 -6.883 -18.033 9.665 1.00 44.12 H new ATOM 0 HA LEU A 639 -6.493 -16.434 7.210 1.00 12.21 H new ATOM 0 HB2 LEU A 639 -8.594 -16.135 8.153 1.00 43.21 H new ATOM 0 HB3 LEU A 639 -7.967 -16.070 9.788 1.00 43.21 H new ATOM 0 HG LEU A 639 -7.043 -13.886 9.448 1.00 3.43 H new ATOM 0 HD11 LEU A 639 -7.195 -12.683 7.309 1.00 5.14 H new ATOM 0 HD12 LEU A 639 -6.191 -14.148 7.186 1.00 5.14 H new ATOM 0 HD13 LEU A 639 -7.849 -14.148 6.538 1.00 5.14 H new ATOM 0 HD21 LEU A 639 -9.061 -12.574 8.947 1.00 2.24 H new ATOM 0 HD22 LEU A 639 -9.838 -14.031 8.283 1.00 2.24 H new ATOM 0 HD23 LEU A 639 -9.409 -13.958 10.009 1.00 2.24 H new ATOM 1549 N LEU A 640 -4.653 -14.979 7.918 1.00 71.32 N ATOM 1550 CA LEU A 640 -3.425 -14.272 8.240 1.00 34.24 C ATOM 1551 C LEU A 640 -3.740 -12.793 8.470 1.00 4.45 C ATOM 1552 O LEU A 640 -3.787 -12.010 7.523 1.00 41.30 O ATOM 1553 CB LEU A 640 -2.368 -14.516 7.162 1.00 3.20 C ATOM 1554 CG LEU A 640 -1.874 -15.957 7.021 1.00 45.04 C ATOM 1555 CD1 LEU A 640 -1.984 -16.707 8.349 1.00 22.24 C ATOM 1556 CD2 LEU A 640 -2.609 -16.680 5.891 1.00 34.50 C ATOM 0 H LEU A 640 -5.039 -14.766 6.998 1.00 71.32 H new ATOM 0 HA LEU A 640 -2.996 -14.655 9.166 1.00 34.24 H new ATOM 0 HB2 LEU A 640 -2.776 -14.197 6.203 1.00 3.20 H new ATOM 0 HB3 LEU A 640 -1.510 -13.878 7.372 1.00 3.20 H new ATOM 0 HG LEU A 640 -0.818 -15.931 6.753 1.00 45.04 H new ATOM 0 HD11 LEU A 640 -1.626 -17.729 8.221 1.00 22.24 H new ATOM 0 HD12 LEU A 640 -1.379 -16.203 9.103 1.00 22.24 H new ATOM 0 HD13 LEU A 640 -3.025 -16.725 8.672 1.00 22.24 H new ATOM 0 HD21 LEU A 640 -2.239 -17.702 5.812 1.00 34.50 H new ATOM 0 HD22 LEU A 640 -3.678 -16.696 6.104 1.00 34.50 H new ATOM 0 HD23 LEU A 640 -2.435 -16.157 4.951 1.00 34.50 H new ATOM 1568 N GLU A 641 -3.946 -12.454 9.735 1.00 72.13 N ATOM 1569 CA GLU A 641 -4.255 -11.082 10.101 1.00 24.33 C ATOM 1570 C GLU A 641 -2.993 -10.219 10.037 1.00 61.30 C ATOM 1571 O GLU A 641 -1.970 -10.563 10.628 1.00 74.32 O ATOM 1572 CB GLU A 641 -4.894 -11.016 11.490 1.00 62.32 C ATOM 1573 CG GLU A 641 -6.403 -10.789 11.388 1.00 14.22 C ATOM 1574 CD GLU A 641 -7.059 -10.834 12.770 1.00 2.21 C ATOM 1575 OE1 GLU A 641 -8.263 -11.111 12.876 1.00 24.24 O ATOM 1576 OE2 GLU A 641 -6.271 -10.569 13.756 1.00 5.22 O ATOM 0 H GLU A 641 -3.905 -13.106 10.519 1.00 72.13 H new ATOM 0 HA GLU A 641 -4.977 -10.689 9.385 1.00 24.33 H new ATOM 0 HB2 GLU A 641 -4.698 -11.943 12.029 1.00 62.32 H new ATOM 0 HB3 GLU A 641 -4.439 -10.210 12.066 1.00 62.32 H new ATOM 0 HG2 GLU A 641 -6.598 -9.824 10.920 1.00 14.22 H new ATOM 0 HG3 GLU A 641 -6.846 -11.550 10.746 1.00 14.22 H new ATOM 1584 N THR A 642 -3.106 -9.115 9.314 1.00 13.43 N ATOM 1585 CA THR A 642 -1.987 -8.200 9.165 1.00 13.31 C ATOM 1586 C THR A 642 -2.459 -6.752 9.315 1.00 4.14 C ATOM 1587 O THR A 642 -3.646 -6.463 9.171 1.00 25.51 O ATOM 1588 CB THR A 642 -1.320 -8.485 7.818 1.00 1.23 C ATOM 1589 OG1 THR A 642 -1.850 -7.487 6.950 1.00 4.31 O ATOM 1590 CG2 THR A 642 -1.789 -9.803 7.200 1.00 63.41 C ATOM 0 H THR A 642 -3.955 -8.833 8.825 1.00 13.43 H new ATOM 0 HA THR A 642 -1.246 -8.350 9.950 1.00 13.31 H new ATOM 0 HB THR A 642 -0.238 -8.509 7.947 1.00 1.23 H new ATOM 0 HG1 THR A 642 -2.668 -7.822 6.528 1.00 4.31 H new ATOM 0 HG21 THR A 642 -1.285 -9.957 6.246 1.00 63.41 H new ATOM 0 HG22 THR A 642 -1.550 -10.626 7.873 1.00 63.41 H new ATOM 0 HG23 THR A 642 -2.867 -9.767 7.040 1.00 63.41 H new ATOM 1598 N PRO A 643 -1.479 -5.856 9.611 1.00 23.41 N ATOM 1599 CA PRO A 643 -1.781 -4.446 9.783 1.00 51.44 C ATOM 1600 C PRO A 643 -2.038 -3.772 8.433 1.00 4.21 C ATOM 1601 O PRO A 643 -2.275 -2.566 8.372 1.00 24.41 O ATOM 1602 CB PRO A 643 -0.579 -3.872 10.514 1.00 2.41 C ATOM 1603 CG PRO A 643 0.548 -4.872 10.314 1.00 73.40 C ATOM 1604 CD PRO A 643 -0.062 -6.162 9.789 1.00 12.04 C ATOM 0 HA PRO A 643 -2.694 -4.278 10.354 1.00 51.44 H new ATOM 0 HB2 PRO A 643 -0.309 -2.895 10.114 1.00 2.41 H new ATOM 0 HB3 PRO A 643 -0.795 -3.734 11.573 1.00 2.41 H new ATOM 0 HG2 PRO A 643 1.283 -4.483 9.610 1.00 73.40 H new ATOM 0 HG3 PRO A 643 1.071 -5.051 11.254 1.00 73.40 H new ATOM 0 HD2 PRO A 643 0.399 -6.464 8.849 1.00 12.04 H new ATOM 0 HD3 PRO A 643 0.081 -6.983 10.492 1.00 12.04 H new ATOM 1612 N GLN A 644 -1.982 -4.580 7.384 1.00 4.53 N ATOM 1613 CA GLN A 644 -2.205 -4.077 6.040 1.00 51.45 C ATOM 1614 C GLN A 644 -3.548 -4.576 5.502 1.00 22.13 C ATOM 1615 O GLN A 644 -4.003 -4.132 4.449 1.00 22.32 O ATOM 1616 CB GLN A 644 -1.059 -4.475 5.108 1.00 71.34 C ATOM 1617 CG GLN A 644 0.259 -4.586 5.876 1.00 44.31 C ATOM 1618 CD GLN A 644 1.456 -4.419 4.938 1.00 44.33 C ATOM 1619 OE1 GLN A 644 1.977 -3.333 4.741 1.00 24.14 O ATOM 1620 NE2 GLN A 644 1.862 -5.552 4.371 1.00 53.51 N ATOM 0 H GLN A 644 -1.785 -5.579 7.438 1.00 4.53 H new ATOM 0 HA GLN A 644 -2.234 -2.988 6.081 1.00 51.45 H new ATOM 0 HB2 GLN A 644 -1.288 -5.428 4.631 1.00 71.34 H new ATOM 0 HB3 GLN A 644 -0.959 -3.737 4.312 1.00 71.34 H new ATOM 0 HG2 GLN A 644 0.295 -3.825 6.656 1.00 44.31 H new ATOM 0 HG3 GLN A 644 0.314 -5.555 6.373 1.00 44.31 H new ATOM 0 HE21 GLN A 644 1.381 -6.427 4.579 1.00 53.51 H new ATOM 0 HE22 GLN A 644 2.654 -5.545 3.728 1.00 53.51 H new ATOM 1629 N GLY A 645 -4.144 -5.493 6.250 1.00 12.44 N ATOM 1630 CA GLY A 645 -5.426 -6.057 5.862 1.00 23.24 C ATOM 1631 C GLY A 645 -5.368 -7.586 5.844 1.00 33.02 C ATOM 1632 O GLY A 645 -4.420 -8.169 5.321 1.00 72.03 O ATOM 0 H GLY A 645 -3.763 -5.859 7.122 1.00 12.44 H new ATOM 0 HA2 GLY A 645 -6.198 -5.727 6.557 1.00 23.24 H new ATOM 0 HA3 GLY A 645 -5.706 -5.688 4.875 1.00 23.24 H new ATOM 1636 N ARG A 646 -6.395 -8.192 6.422 1.00 11.23 N ATOM 1637 CA ARG A 646 -6.474 -9.642 6.479 1.00 5.41 C ATOM 1638 C ARG A 646 -6.139 -10.245 5.113 1.00 34.15 C ATOM 1639 O ARG A 646 -6.349 -9.609 4.082 1.00 62.13 O ATOM 1640 CB ARG A 646 -7.869 -10.101 6.904 1.00 34.45 C ATOM 1641 CG ARG A 646 -7.981 -10.178 8.429 1.00 42.54 C ATOM 1642 CD ARG A 646 -9.432 -10.395 8.862 1.00 10.30 C ATOM 1643 NE ARG A 646 -10.259 -9.234 8.462 1.00 62.32 N ATOM 1644 CZ ARG A 646 -11.604 -9.192 8.565 1.00 12.02 C ATOM 1645 NH1 ARG A 646 -12.287 -10.247 9.058 1.00 71.21 N ATOM 1646 NH2 ARG A 646 -12.242 -8.103 8.177 1.00 20.33 N ATOM 0 H ARG A 646 -7.180 -7.705 6.855 1.00 11.23 H new ATOM 0 HA ARG A 646 -5.751 -9.985 7.219 1.00 5.41 H new ATOM 0 HB2 ARG A 646 -8.617 -9.410 6.515 1.00 34.45 H new ATOM 0 HB3 ARG A 646 -8.082 -11.078 6.470 1.00 34.45 H new ATOM 0 HG2 ARG A 646 -7.361 -10.993 8.802 1.00 42.54 H new ATOM 0 HG3 ARG A 646 -7.599 -9.258 8.872 1.00 42.54 H new ATOM 0 HD2 ARG A 646 -9.824 -11.305 8.407 1.00 10.30 H new ATOM 0 HD3 ARG A 646 -9.481 -10.532 9.942 1.00 10.30 H new ATOM 0 HE ARG A 646 -9.782 -8.415 8.085 1.00 62.32 H new ATOM 0 HH11 ARG A 646 -11.787 -11.084 9.356 1.00 71.21 H new ATOM 0 HH12 ARG A 646 -13.303 -10.207 9.132 1.00 71.21 H new ATOM 0 HH21 ARG A 646 -11.718 -7.310 7.806 1.00 20.33 H new ATOM 0 HH22 ARG A 646 -13.258 -8.055 8.248 1.00 20.33 H new ATOM 1659 N ILE A 647 -5.625 -11.466 5.151 1.00 13.33 N ATOM 1660 CA ILE A 647 -5.260 -12.162 3.929 1.00 31.15 C ATOM 1661 C ILE A 647 -5.659 -13.635 4.048 1.00 4.53 C ATOM 1662 O ILE A 647 -5.410 -14.268 5.073 1.00 14.33 O ATOM 1663 CB ILE A 647 -3.778 -11.950 3.614 1.00 11.31 C ATOM 1664 CG1 ILE A 647 -3.498 -10.489 3.253 1.00 73.42 C ATOM 1665 CG2 ILE A 647 -3.307 -12.911 2.521 1.00 22.01 C ATOM 1666 CD1 ILE A 647 -2.046 -10.118 3.558 1.00 0.44 C ATOM 0 H ILE A 647 -5.453 -11.991 6.009 1.00 13.33 H new ATOM 0 HA ILE A 647 -5.805 -11.751 3.079 1.00 31.15 H new ATOM 0 HB ILE A 647 -3.202 -12.176 4.511 1.00 11.31 H new ATOM 0 HG12 ILE A 647 -3.704 -10.326 2.195 1.00 73.42 H new ATOM 0 HG13 ILE A 647 -4.169 -9.837 3.813 1.00 73.42 H new ATOM 0 HG21 ILE A 647 -2.250 -12.739 2.316 1.00 22.01 H new ATOM 0 HG22 ILE A 647 -3.450 -13.939 2.854 1.00 22.01 H new ATOM 0 HG23 ILE A 647 -3.885 -12.740 1.613 1.00 22.01 H new ATOM 0 HD11 ILE A 647 -1.873 -9.075 3.292 1.00 0.44 H new ATOM 0 HD12 ILE A 647 -1.850 -10.259 4.621 1.00 0.44 H new ATOM 0 HD13 ILE A 647 -1.378 -10.755 2.978 1.00 0.44 H new ATOM 1678 N GLN A 648 -6.270 -14.137 2.986 1.00 41.34 N ATOM 1679 CA GLN A 648 -6.705 -15.523 2.958 1.00 51.22 C ATOM 1680 C GLN A 648 -6.307 -16.178 1.634 1.00 43.11 C ATOM 1681 O GLN A 648 -6.860 -15.852 0.585 1.00 70.13 O ATOM 1682 CB GLN A 648 -8.214 -15.628 3.190 1.00 63.44 C ATOM 1683 CG GLN A 648 -8.565 -16.916 3.937 1.00 23.42 C ATOM 1684 CD GLN A 648 -9.020 -18.007 2.966 1.00 72.41 C ATOM 1685 OE1 GLN A 648 -9.984 -17.859 2.233 1.00 50.13 O ATOM 1686 NE2 GLN A 648 -8.275 -19.109 3.001 1.00 13.34 N ATOM 0 H GLN A 648 -6.474 -13.609 2.138 1.00 41.34 H new ATOM 0 HA GLN A 648 -6.208 -16.056 3.768 1.00 51.22 H new ATOM 0 HB2 GLN A 648 -8.559 -14.766 3.762 1.00 63.44 H new ATOM 0 HB3 GLN A 648 -8.735 -15.605 2.233 1.00 63.44 H new ATOM 0 HG2 GLN A 648 -7.697 -17.263 4.498 1.00 23.42 H new ATOM 0 HG3 GLN A 648 -9.355 -16.717 4.661 1.00 23.42 H new ATOM 0 HE21 GLN A 648 -7.481 -19.168 3.639 1.00 13.34 H new ATOM 0 HE22 GLN A 648 -8.498 -19.895 2.390 1.00 13.34 H new ATOM 1695 N ALA A 649 -5.350 -17.090 1.726 1.00 42.41 N ATOM 1696 CA ALA A 649 -4.871 -17.793 0.548 1.00 22.43 C ATOM 1697 C ALA A 649 -5.501 -19.187 0.500 1.00 14.54 C ATOM 1698 O ALA A 649 -6.304 -19.538 1.363 1.00 32.44 O ATOM 1699 CB ALA A 649 -3.342 -17.846 0.571 1.00 1.14 C ATOM 0 H ALA A 649 -4.894 -17.358 2.598 1.00 42.41 H new ATOM 0 HA ALA A 649 -5.166 -17.266 -0.359 1.00 22.43 H new ATOM 0 HB1 ALA A 649 -2.983 -18.373 -0.313 1.00 1.14 H new ATOM 0 HB2 ALA A 649 -2.943 -16.832 0.575 1.00 1.14 H new ATOM 0 HB3 ALA A 649 -3.010 -18.371 1.467 1.00 1.14 H new ATOM 1705 N LYS A 650 -5.114 -19.942 -0.517 1.00 11.21 N ATOM 1706 CA LYS A 650 -5.632 -21.289 -0.689 1.00 5.34 C ATOM 1707 C LYS A 650 -4.493 -22.295 -0.507 1.00 51.32 C ATOM 1708 O LYS A 650 -4.735 -23.493 -0.367 1.00 1.51 O ATOM 1709 CB LYS A 650 -6.358 -21.417 -2.029 1.00 43.12 C ATOM 1710 CG LYS A 650 -7.440 -20.345 -2.171 1.00 52.20 C ATOM 1711 CD LYS A 650 -8.529 -20.791 -3.149 1.00 32.23 C ATOM 1712 CE LYS A 650 -9.313 -19.590 -3.681 1.00 74.44 C ATOM 1713 NZ LYS A 650 -10.091 -19.971 -4.882 1.00 12.42 N ATOM 0 H LYS A 650 -4.448 -19.647 -1.231 1.00 11.21 H new ATOM 0 HA LYS A 650 -6.379 -21.511 0.073 1.00 5.34 H new ATOM 0 HB2 LYS A 650 -5.641 -21.326 -2.845 1.00 43.12 H new ATOM 0 HB3 LYS A 650 -6.808 -22.406 -2.110 1.00 43.12 H new ATOM 0 HG2 LYS A 650 -7.883 -20.139 -1.197 1.00 52.20 H new ATOM 0 HG3 LYS A 650 -6.992 -19.415 -2.520 1.00 52.20 H new ATOM 0 HD2 LYS A 650 -8.077 -21.332 -3.980 1.00 32.23 H new ATOM 0 HD3 LYS A 650 -9.209 -21.482 -2.651 1.00 32.23 H new ATOM 0 HE2 LYS A 650 -9.985 -19.215 -2.909 1.00 74.44 H new ATOM 0 HE3 LYS A 650 -8.627 -18.780 -3.927 1.00 74.44 H new ATOM 0 HZ1 LYS A 650 -10.618 -19.145 -5.231 1.00 12.42 H new ATOM 0 HZ2 LYS A 650 -9.443 -20.307 -5.623 1.00 12.42 H new ATOM 0 HZ3 LYS A 650 -10.759 -20.729 -4.637 1.00 12.42 H new ATOM 1726 N LYS A 651 -3.276 -21.771 -0.516 1.00 52.30 N ATOM 1727 CA LYS A 651 -2.100 -22.608 -0.354 1.00 43.02 C ATOM 1728 C LYS A 651 -1.044 -21.847 0.451 1.00 53.03 C ATOM 1729 O LYS A 651 -1.091 -20.621 0.540 1.00 73.10 O ATOM 1730 CB LYS A 651 -1.600 -23.098 -1.715 1.00 30.54 C ATOM 1731 CG LYS A 651 -2.289 -24.405 -2.113 1.00 61.31 C ATOM 1732 CD LYS A 651 -1.621 -25.605 -1.438 1.00 34.03 C ATOM 1733 CE LYS A 651 -0.352 -26.019 -2.185 1.00 0.50 C ATOM 1734 NZ LYS A 651 0.073 -27.375 -1.773 1.00 60.23 N ATOM 0 H LYS A 651 -3.079 -20.777 -0.633 1.00 52.30 H new ATOM 0 HA LYS A 651 -2.347 -23.506 0.212 1.00 43.02 H new ATOM 0 HB2 LYS A 651 -1.790 -22.337 -2.472 1.00 30.54 H new ATOM 0 HB3 LYS A 651 -0.521 -23.248 -1.678 1.00 30.54 H new ATOM 0 HG2 LYS A 651 -3.342 -24.365 -1.833 1.00 61.31 H new ATOM 0 HG3 LYS A 651 -2.252 -24.525 -3.196 1.00 61.31 H new ATOM 0 HD2 LYS A 651 -1.374 -25.355 -0.406 1.00 34.03 H new ATOM 0 HD3 LYS A 651 -2.318 -26.443 -1.406 1.00 34.03 H new ATOM 0 HE2 LYS A 651 -0.533 -25.999 -3.260 1.00 0.50 H new ATOM 0 HE3 LYS A 651 0.446 -25.304 -1.983 1.00 0.50 H new ATOM 0 HZ1 LYS A 651 0.936 -27.640 -2.290 1.00 60.23 H new ATOM 0 HZ2 LYS A 651 0.265 -27.383 -0.751 1.00 60.23 H new ATOM 0 HZ3 LYS A 651 -0.683 -28.056 -1.988 1.00 60.23 H new ATOM 1747 N TRP A 652 -0.117 -22.606 1.016 1.00 10.44 N ATOM 1748 CA TRP A 652 0.948 -22.018 1.811 1.00 62.11 C ATOM 1749 C TRP A 652 1.943 -21.358 0.854 1.00 62.41 C ATOM 1750 O TRP A 652 2.881 -20.693 1.290 1.00 64.12 O ATOM 1751 CB TRP A 652 1.596 -23.065 2.719 1.00 64.23 C ATOM 1752 CG TRP A 652 0.631 -23.705 3.718 1.00 21.34 C ATOM 1753 CD1 TRP A 652 -0.260 -24.681 3.496 1.00 54.32 C ATOM 1754 CD2 TRP A 652 0.496 -23.373 5.116 1.00 20.35 C ATOM 1755 NE1 TRP A 652 -0.957 -25.000 4.643 1.00 35.32 N ATOM 1756 CE2 TRP A 652 -0.483 -24.180 5.660 1.00 23.11 C ATOM 1757 CE3 TRP A 652 1.179 -22.423 5.896 1.00 55.21 C ATOM 1758 CZ2 TRP A 652 -0.868 -24.118 7.005 1.00 64.43 C ATOM 1759 CZ3 TRP A 652 0.782 -22.374 7.238 1.00 41.52 C ATOM 1760 CH2 TRP A 652 -0.201 -23.179 7.800 1.00 15.43 C ATOM 0 H TRP A 652 -0.081 -23.622 0.939 1.00 10.44 H new ATOM 0 HA TRP A 652 0.553 -21.256 2.482 1.00 62.11 H new ATOM 0 HB2 TRP A 652 2.033 -23.848 2.099 1.00 64.23 H new ATOM 0 HB3 TRP A 652 2.414 -22.599 3.268 1.00 64.23 H new ATOM 0 HD1 TRP A 652 -0.413 -25.158 2.539 1.00 54.32 H new ATOM 0 HE1 TRP A 652 -1.686 -25.708 4.729 1.00 35.32 H new ATOM 0 HE3 TRP A 652 1.949 -21.782 5.492 1.00 55.21 H new ATOM 0 HZ2 TRP A 652 -1.638 -24.760 7.407 1.00 64.43 H new ATOM 0 HZ3 TRP A 652 1.275 -21.660 7.881 1.00 41.52 H new ATOM 0 HH2 TRP A 652 -0.449 -23.081 8.846 1.00 15.43 H new ATOM 1771 N SER A 653 1.704 -21.566 -0.433 1.00 2.14 N ATOM 1772 CA SER A 653 2.568 -21.000 -1.455 1.00 54.40 C ATOM 1773 C SER A 653 2.349 -19.488 -1.546 1.00 72.13 C ATOM 1774 O SER A 653 3.187 -18.767 -2.086 1.00 74.44 O ATOM 1775 CB SER A 653 2.315 -21.655 -2.814 1.00 63.50 C ATOM 1776 OG SER A 653 2.655 -20.791 -3.895 1.00 72.31 O ATOM 0 H SER A 653 0.925 -22.118 -0.791 1.00 2.14 H new ATOM 0 HA SER A 653 3.603 -21.195 -1.175 1.00 54.40 H new ATOM 0 HB2 SER A 653 2.897 -22.574 -2.887 1.00 63.50 H new ATOM 0 HB3 SER A 653 1.265 -21.936 -2.891 1.00 63.50 H new ATOM 0 HG SER A 653 2.481 -21.246 -4.745 1.00 72.31 H new ATOM 1782 N ARG A 654 1.218 -19.053 -1.010 1.00 2.31 N ATOM 1783 CA ARG A 654 0.879 -17.640 -1.024 1.00 54.10 C ATOM 1784 C ARG A 654 1.182 -17.008 0.336 1.00 52.52 C ATOM 1785 O ARG A 654 1.277 -15.786 0.449 1.00 64.50 O ATOM 1786 CB ARG A 654 -0.600 -17.432 -1.357 1.00 72.30 C ATOM 1787 CG ARG A 654 -0.995 -18.217 -2.610 1.00 15.22 C ATOM 1788 CD ARG A 654 -0.321 -17.638 -3.855 1.00 4.31 C ATOM 1789 NE ARG A 654 -1.285 -16.812 -4.615 1.00 42.42 N ATOM 1790 CZ ARG A 654 -2.409 -17.294 -5.187 1.00 44.32 C ATOM 1791 NH1 ARG A 654 -2.719 -18.604 -5.090 1.00 13.24 N ATOM 1792 NH2 ARG A 654 -3.199 -16.465 -5.844 1.00 1.14 N ATOM 0 H ARG A 654 0.525 -19.654 -0.564 1.00 2.31 H new ATOM 0 HA ARG A 654 1.484 -17.161 -1.794 1.00 54.10 H new ATOM 0 HB2 ARG A 654 -1.214 -17.751 -0.515 1.00 72.30 H new ATOM 0 HB3 ARG A 654 -0.796 -16.371 -1.511 1.00 72.30 H new ATOM 0 HG2 ARG A 654 -0.712 -19.263 -2.492 1.00 15.22 H new ATOM 0 HG3 ARG A 654 -2.078 -18.191 -2.733 1.00 15.22 H new ATOM 0 HD2 ARG A 654 0.539 -17.034 -3.565 1.00 4.31 H new ATOM 0 HD3 ARG A 654 0.054 -18.445 -4.484 1.00 4.31 H new ATOM 0 HE ARG A 654 -1.088 -15.816 -4.713 1.00 42.42 H new ATOM 0 HH11 ARG A 654 -2.102 -19.238 -4.582 1.00 13.24 H new ATOM 0 HH12 ARG A 654 -3.570 -18.960 -5.525 1.00 13.24 H new ATOM 0 HH21 ARG A 654 -2.956 -15.477 -5.914 1.00 1.14 H new ATOM 0 HH22 ARG A 654 -4.052 -16.813 -6.282 1.00 1.14 H new ATOM 1805 N VAL A 655 1.324 -17.867 1.334 1.00 65.22 N ATOM 1806 CA VAL A 655 1.615 -17.408 2.681 1.00 12.24 C ATOM 1807 C VAL A 655 2.624 -16.259 2.618 1.00 75.21 C ATOM 1808 O VAL A 655 3.743 -16.437 2.141 1.00 60.15 O ATOM 1809 CB VAL A 655 2.095 -18.579 3.541 1.00 4.32 C ATOM 1810 CG1 VAL A 655 2.963 -18.087 4.702 1.00 52.14 C ATOM 1811 CG2 VAL A 655 0.914 -19.405 4.052 1.00 74.32 C ATOM 0 H VAL A 655 1.243 -18.879 1.237 1.00 65.22 H new ATOM 0 HA VAL A 655 0.713 -17.022 3.156 1.00 12.24 H new ATOM 0 HB VAL A 655 2.709 -19.225 2.914 1.00 4.32 H new ATOM 0 HG11 VAL A 655 3.291 -18.939 5.298 1.00 52.14 H new ATOM 0 HG12 VAL A 655 3.834 -17.563 4.308 1.00 52.14 H new ATOM 0 HG13 VAL A 655 2.383 -17.409 5.328 1.00 52.14 H new ATOM 0 HG21 VAL A 655 1.284 -20.231 4.660 1.00 74.32 H new ATOM 0 HG22 VAL A 655 0.262 -18.773 4.655 1.00 74.32 H new ATOM 0 HG23 VAL A 655 0.353 -19.801 3.205 1.00 74.32 H new ATOM 1821 N PRO A 656 2.179 -15.076 3.119 1.00 1.40 N ATOM 1822 CA PRO A 656 3.030 -13.898 3.124 1.00 62.13 C ATOM 1823 C PRO A 656 4.099 -13.998 4.214 1.00 32.22 C ATOM 1824 O PRO A 656 5.259 -13.661 3.984 1.00 22.01 O ATOM 1825 CB PRO A 656 2.082 -12.728 3.327 1.00 12.10 C ATOM 1826 CG PRO A 656 0.802 -13.322 3.891 1.00 34.24 C ATOM 1827 CD PRO A 656 0.859 -14.828 3.692 1.00 4.13 C ATOM 0 HA PRO A 656 3.592 -13.781 2.197 1.00 62.13 H new ATOM 0 HB2 PRO A 656 2.507 -11.995 4.012 1.00 12.10 H new ATOM 0 HB3 PRO A 656 1.892 -12.212 2.386 1.00 12.10 H new ATOM 0 HG2 PRO A 656 0.703 -13.080 4.949 1.00 34.24 H new ATOM 0 HG3 PRO A 656 -0.068 -12.903 3.386 1.00 34.24 H new ATOM 0 HD2 PRO A 656 0.731 -15.357 4.636 1.00 4.13 H new ATOM 0 HD3 PRO A 656 0.067 -15.170 3.025 1.00 4.13 H new ATOM 1835 N PHE A 657 3.669 -14.463 5.378 1.00 22.20 N ATOM 1836 CA PHE A 657 4.575 -14.612 6.505 1.00 73.13 C ATOM 1837 C PHE A 657 5.526 -15.792 6.292 1.00 52.54 C ATOM 1838 O PHE A 657 5.253 -16.675 5.480 1.00 31.05 O ATOM 1839 CB PHE A 657 3.712 -14.884 7.739 1.00 62.44 C ATOM 1840 CG PHE A 657 2.994 -16.235 7.710 1.00 54.11 C ATOM 1841 CD1 PHE A 657 1.772 -16.343 7.122 1.00 41.14 C ATOM 1842 CD2 PHE A 657 3.576 -17.327 8.273 1.00 63.34 C ATOM 1843 CE1 PHE A 657 1.105 -17.596 7.095 1.00 23.20 C ATOM 1844 CE2 PHE A 657 2.909 -18.581 8.246 1.00 4.31 C ATOM 1845 CZ PHE A 657 1.688 -18.689 7.658 1.00 51.32 C ATOM 0 H PHE A 657 2.706 -14.741 5.565 1.00 22.20 H new ATOM 0 HA PHE A 657 5.177 -13.711 6.620 1.00 73.13 H new ATOM 0 HB2 PHE A 657 4.342 -14.838 8.628 1.00 62.44 H new ATOM 0 HB3 PHE A 657 2.970 -14.091 7.833 1.00 62.44 H new ATOM 0 HD1 PHE A 657 1.309 -15.475 6.676 1.00 41.14 H new ATOM 0 HD2 PHE A 657 4.546 -17.241 8.741 1.00 63.34 H new ATOM 0 HE1 PHE A 657 0.135 -17.682 6.628 1.00 23.20 H new ATOM 0 HE2 PHE A 657 3.372 -19.449 8.693 1.00 4.31 H new ATOM 0 HZ PHE A 657 1.181 -19.642 7.638 1.00 51.32 H new ATOM 1855 N SER A 658 6.623 -15.767 7.034 1.00 32.41 N ATOM 1856 CA SER A 658 7.616 -16.824 6.937 1.00 51.43 C ATOM 1857 C SER A 658 7.275 -17.954 7.910 1.00 2.33 C ATOM 1858 O SER A 658 6.691 -17.714 8.966 1.00 52.54 O ATOM 1859 CB SER A 658 9.021 -16.286 7.218 1.00 74.53 C ATOM 1860 OG SER A 658 9.371 -15.222 6.338 1.00 51.42 O ATOM 0 H SER A 658 6.846 -15.032 7.705 1.00 32.41 H new ATOM 0 HA SER A 658 7.602 -17.214 5.919 1.00 51.43 H new ATOM 0 HB2 SER A 658 9.076 -15.937 8.249 1.00 74.53 H new ATOM 0 HB3 SER A 658 9.746 -17.094 7.116 1.00 74.53 H new ATOM 0 HG SER A 658 10.274 -14.905 6.551 1.00 51.42 H new ATOM 1866 N VAL A 659 7.655 -19.162 7.521 1.00 40.32 N ATOM 1867 CA VAL A 659 7.397 -20.330 8.346 1.00 40.40 C ATOM 1868 C VAL A 659 8.664 -21.184 8.423 1.00 10.14 C ATOM 1869 O VAL A 659 8.920 -22.002 7.541 1.00 3.14 O ATOM 1870 CB VAL A 659 6.190 -21.098 7.803 1.00 43.20 C ATOM 1871 CG1 VAL A 659 5.557 -21.966 8.892 1.00 5.45 C ATOM 1872 CG2 VAL A 659 5.161 -20.143 7.195 1.00 12.14 C ATOM 0 H VAL A 659 8.140 -19.357 6.645 1.00 40.32 H new ATOM 0 HA VAL A 659 7.144 -20.031 9.363 1.00 40.40 H new ATOM 0 HB VAL A 659 6.542 -21.759 7.011 1.00 43.20 H new ATOM 0 HG11 VAL A 659 4.702 -22.501 8.479 1.00 5.45 H new ATOM 0 HG12 VAL A 659 6.291 -22.683 9.258 1.00 5.45 H new ATOM 0 HG13 VAL A 659 5.226 -21.333 9.715 1.00 5.45 H new ATOM 0 HG21 VAL A 659 4.313 -20.714 6.817 1.00 12.14 H new ATOM 0 HG22 VAL A 659 4.817 -19.445 7.958 1.00 12.14 H new ATOM 0 HG23 VAL A 659 5.619 -19.588 6.376 1.00 12.14 H new ATOM 1882 N PRO A 660 9.443 -20.959 9.515 1.00 1.22 N ATOM 1883 CA PRO A 660 10.677 -21.698 9.719 1.00 30.34 C ATOM 1884 C PRO A 660 10.389 -23.130 10.177 1.00 42.31 C ATOM 1885 O PRO A 660 9.394 -23.380 10.854 1.00 33.35 O ATOM 1886 CB PRO A 660 11.454 -20.891 10.747 1.00 71.24 C ATOM 1887 CG PRO A 660 10.436 -19.986 11.422 1.00 23.42 C ATOM 1888 CD PRO A 660 9.171 -19.998 10.580 1.00 11.12 C ATOM 0 HA PRO A 660 11.255 -21.812 8.802 1.00 30.34 H new ATOM 0 HB2 PRO A 660 11.937 -21.545 11.473 1.00 71.24 H new ATOM 0 HB3 PRO A 660 12.241 -20.307 10.271 1.00 71.24 H new ATOM 0 HG2 PRO A 660 10.225 -20.336 12.433 1.00 23.42 H new ATOM 0 HG3 PRO A 660 10.826 -18.972 11.510 1.00 23.42 H new ATOM 0 HD2 PRO A 660 8.305 -20.296 11.171 1.00 11.12 H new ATOM 0 HD3 PRO A 660 8.955 -19.009 10.175 1.00 11.12 H new ATOM 1896 N ASP A 661 11.279 -24.031 9.788 1.00 32.23 N ATOM 1897 CA ASP A 661 11.133 -25.431 10.150 1.00 0.11 C ATOM 1898 C ASP A 661 10.999 -25.549 11.670 1.00 72.03 C ATOM 1899 O ASP A 661 11.266 -24.593 12.396 1.00 23.22 O ATOM 1900 CB ASP A 661 12.357 -26.242 9.719 1.00 12.42 C ATOM 1901 CG ASP A 661 13.676 -25.816 10.368 1.00 75.10 C ATOM 1902 OD1 ASP A 661 13.702 -24.941 11.247 1.00 61.45 O ATOM 1903 OD2 ASP A 661 14.722 -26.431 9.931 1.00 73.34 O ATOM 0 H ASP A 661 12.103 -23.819 9.226 1.00 32.23 H new ATOM 0 HA ASP A 661 10.248 -25.819 9.646 1.00 0.11 H new ATOM 0 HB2 ASP A 661 12.178 -27.292 9.950 1.00 12.42 H new ATOM 0 HB3 ASP A 661 12.461 -26.167 8.637 1.00 12.42 H new ATOM 1909 N PHE A 662 10.585 -26.730 12.105 1.00 14.21 N ATOM 1910 CA PHE A 662 10.412 -26.985 13.525 1.00 74.30 C ATOM 1911 C PHE A 662 11.760 -27.229 14.206 1.00 34.34 C ATOM 1912 O PHE A 662 12.411 -28.242 13.956 1.00 4.02 O ATOM 1913 CB PHE A 662 9.554 -28.246 13.651 1.00 21.03 C ATOM 1914 CG PHE A 662 9.472 -28.803 15.074 1.00 3.21 C ATOM 1915 CD1 PHE A 662 8.503 -28.364 15.921 1.00 33.42 C ATOM 1916 CD2 PHE A 662 10.369 -29.736 15.492 1.00 60.12 C ATOM 1917 CE1 PHE A 662 8.427 -28.881 17.242 1.00 72.24 C ATOM 1918 CE2 PHE A 662 10.293 -30.253 16.812 1.00 1.23 C ATOM 1919 CZ PHE A 662 9.324 -29.814 17.659 1.00 34.43 C ATOM 0 H PHE A 662 10.364 -27.521 11.499 1.00 14.21 H new ATOM 0 HA PHE A 662 9.944 -26.125 14.004 1.00 74.30 H new ATOM 0 HB2 PHE A 662 8.546 -28.024 13.300 1.00 21.03 H new ATOM 0 HB3 PHE A 662 9.958 -29.015 12.993 1.00 21.03 H new ATOM 0 HD1 PHE A 662 7.791 -27.622 15.589 1.00 33.42 H new ATOM 0 HD2 PHE A 662 11.139 -30.084 14.820 1.00 60.12 H new ATOM 0 HE1 PHE A 662 7.657 -28.533 17.915 1.00 72.24 H new ATOM 0 HE2 PHE A 662 11.005 -30.995 17.143 1.00 1.23 H new ATOM 0 HZ PHE A 662 9.267 -30.207 18.663 1.00 34.43 H new ATOM 1929 N ASP A 663 12.138 -26.284 15.054 1.00 13.12 N ATOM 1930 CA ASP A 663 13.396 -26.383 15.774 1.00 63.55 C ATOM 1931 C ASP A 663 13.304 -27.515 16.799 1.00 25.11 C ATOM 1932 O ASP A 663 12.847 -27.305 17.921 1.00 34.12 O ATOM 1933 CB ASP A 663 13.705 -25.088 16.526 1.00 54.51 C ATOM 1934 CG ASP A 663 14.298 -23.968 15.669 1.00 41.32 C ATOM 1935 OD1 ASP A 663 15.266 -24.179 14.924 1.00 45.34 O ATOM 1936 OD2 ASP A 663 13.717 -22.822 15.790 1.00 71.45 O ATOM 0 H ASP A 663 11.595 -25.445 15.259 1.00 13.12 H new ATOM 0 HA ASP A 663 14.186 -26.574 15.047 1.00 63.55 H new ATOM 0 HB2 ASP A 663 12.786 -24.725 16.986 1.00 54.51 H new ATOM 0 HB3 ASP A 663 14.400 -25.312 17.335 1.00 54.51 H new ATOM 1942 N PHE A 664 13.747 -28.690 16.377 1.00 22.41 N ATOM 1943 CA PHE A 664 13.721 -29.856 17.245 1.00 53.41 C ATOM 1944 C PHE A 664 14.668 -29.676 18.433 1.00 15.13 C ATOM 1945 O PHE A 664 14.360 -30.100 19.546 1.00 11.43 O ATOM 1946 CB PHE A 664 14.192 -31.047 16.408 1.00 13.14 C ATOM 1947 CG PHE A 664 14.341 -32.346 17.204 1.00 54.42 C ATOM 1948 CD1 PHE A 664 13.292 -32.825 17.925 1.00 71.54 C ATOM 1949 CD2 PHE A 664 15.522 -33.020 17.190 1.00 55.11 C ATOM 1950 CE1 PHE A 664 13.430 -34.031 18.663 1.00 40.43 C ATOM 1951 CE2 PHE A 664 15.660 -34.225 17.928 1.00 33.01 C ATOM 1952 CZ PHE A 664 14.611 -34.705 18.649 1.00 50.01 C ATOM 0 H PHE A 664 14.126 -28.860 15.445 1.00 22.41 H new ATOM 0 HA PHE A 664 12.715 -30.006 17.636 1.00 53.41 H new ATOM 0 HB2 PHE A 664 13.484 -31.210 15.595 1.00 13.14 H new ATOM 0 HB3 PHE A 664 15.150 -30.801 15.951 1.00 13.14 H new ATOM 0 HD1 PHE A 664 12.355 -32.289 17.936 1.00 71.54 H new ATOM 0 HD2 PHE A 664 16.355 -32.639 16.618 1.00 55.11 H new ATOM 0 HE1 PHE A 664 12.597 -34.412 19.235 1.00 40.43 H new ATOM 0 HE2 PHE A 664 16.598 -34.761 17.917 1.00 33.01 H new ATOM 0 HZ PHE A 664 14.716 -35.622 19.210 1.00 50.01 H new ATOM 1962 N LEU A 665 15.800 -29.047 18.157 1.00 43.15 N ATOM 1963 CA LEU A 665 16.794 -28.806 19.189 1.00 40.21 C ATOM 1964 C LEU A 665 16.178 -27.944 20.293 1.00 73.13 C ATOM 1965 O LEU A 665 16.165 -28.337 21.458 1.00 21.41 O ATOM 1966 CB LEU A 665 18.065 -28.209 18.580 1.00 31.55 C ATOM 1967 CG LEU A 665 18.742 -29.043 17.490 1.00 14.13 C ATOM 1968 CD1 LEU A 665 19.971 -28.322 16.933 1.00 32.51 C ATOM 1969 CD2 LEU A 665 19.082 -30.444 18.003 1.00 53.21 C ATOM 0 H LEU A 665 16.052 -28.696 17.233 1.00 43.15 H new ATOM 0 HA LEU A 665 17.100 -29.745 19.650 1.00 40.21 H new ATOM 0 HB2 LEU A 665 17.820 -27.232 18.163 1.00 31.55 H new ATOM 0 HB3 LEU A 665 18.784 -28.042 19.382 1.00 31.55 H new ATOM 0 HG LEU A 665 18.039 -29.164 16.666 1.00 14.13 H new ATOM 0 HD11 LEU A 665 20.434 -28.936 16.160 1.00 32.51 H new ATOM 0 HD12 LEU A 665 19.669 -27.366 16.505 1.00 32.51 H new ATOM 0 HD13 LEU A 665 20.687 -28.150 17.737 1.00 32.51 H new ATOM 0 HD21 LEU A 665 19.562 -31.016 17.209 1.00 53.21 H new ATOM 0 HD22 LEU A 665 19.759 -30.366 18.854 1.00 53.21 H new ATOM 0 HD23 LEU A 665 18.168 -30.950 18.312 1.00 53.21 H new ATOM 1981 N GLN A 666 15.681 -26.785 19.887 1.00 44.34 N ATOM 1982 CA GLN A 666 15.065 -25.864 20.827 1.00 70.04 C ATOM 1983 C GLN A 666 13.869 -26.527 21.513 1.00 70.35 C ATOM 1984 O GLN A 666 13.849 -26.667 22.734 1.00 15.25 O ATOM 1985 CB GLN A 666 14.648 -24.567 20.130 1.00 32.23 C ATOM 1986 CG GLN A 666 13.872 -23.657 21.085 1.00 72.41 C ATOM 1987 CD GLN A 666 13.995 -22.191 20.666 1.00 3.14 C ATOM 1988 OE1 GLN A 666 13.175 -21.655 19.940 1.00 14.42 O ATOM 1989 NE2 GLN A 666 15.064 -21.575 21.164 1.00 51.55 N ATOM 0 H GLN A 666 15.692 -26.463 18.919 1.00 44.34 H new ATOM 0 HA GLN A 666 15.800 -25.608 21.590 1.00 70.04 H new ATOM 0 HB2 GLN A 666 15.533 -24.046 19.764 1.00 32.23 H new ATOM 0 HB3 GLN A 666 14.032 -24.799 19.261 1.00 32.23 H new ATOM 0 HG2 GLN A 666 12.822 -23.948 21.098 1.00 72.41 H new ATOM 0 HG3 GLN A 666 14.250 -23.782 22.100 1.00 72.41 H new ATOM 0 HE21 GLN A 666 15.711 -22.084 21.766 1.00 51.55 H new ATOM 0 HE22 GLN A 666 15.236 -20.594 20.944 1.00 51.55 H new ATOM 1998 N HIS A 667 12.902 -26.919 20.696 1.00 14.33 N ATOM 1999 CA HIS A 667 11.705 -27.564 21.209 1.00 31.02 C ATOM 2000 C HIS A 667 12.097 -28.638 22.226 1.00 72.21 C ATOM 2001 O HIS A 667 11.408 -28.831 23.227 1.00 64.43 O ATOM 2002 CB HIS A 667 10.851 -28.114 20.065 1.00 64.13 C ATOM 2003 CG HIS A 667 9.368 -28.106 20.347 1.00 72.45 C ATOM 2004 ND1 HIS A 667 8.560 -27.015 20.080 1.00 12.10 N ATOM 2005 CD2 HIS A 667 8.556 -29.068 20.873 1.00 54.44 C ATOM 2006 CE1 HIS A 667 7.319 -27.316 20.435 1.00 63.44 C ATOM 2007 NE2 HIS A 667 7.319 -28.589 20.926 1.00 11.20 N ATOM 0 H HIS A 667 12.923 -26.802 19.683 1.00 14.33 H new ATOM 0 HA HIS A 667 11.086 -26.831 21.727 1.00 31.02 H new ATOM 0 HB2 HIS A 667 11.043 -27.526 19.167 1.00 64.13 H new ATOM 0 HB3 HIS A 667 11.164 -29.136 19.850 1.00 64.13 H new ATOM 0 HD1 HIS A 667 8.867 -26.129 19.678 1.00 12.10 H new ATOM 0 HD2 HIS A 667 8.867 -30.052 21.192 1.00 54.44 H new ATOM 0 HE1 HIS A 667 6.459 -26.668 20.351 1.00 63.44 H new ATOM 2015 N CYS A 668 13.201 -29.309 21.934 1.00 44.12 N ATOM 2016 CA CYS A 668 13.693 -30.359 22.810 1.00 43.41 C ATOM 2017 C CYS A 668 14.166 -29.713 24.114 1.00 35.54 C ATOM 2018 O CYS A 668 13.897 -30.229 25.199 1.00 52.44 O ATOM 2019 CB CYS A 668 14.801 -31.178 22.145 1.00 41.34 C ATOM 2020 SG CYS A 668 14.069 -32.517 21.135 1.00 32.13 S ATOM 0 H CYS A 668 13.769 -29.146 21.103 1.00 44.12 H new ATOM 0 HA CYS A 668 12.890 -31.064 23.024 1.00 43.41 H new ATOM 0 HB2 CYS A 668 15.415 -30.532 21.517 1.00 41.34 H new ATOM 0 HB3 CYS A 668 15.457 -31.602 22.905 1.00 41.34 H new ATOM 0 HG CYS A 668 13.949 -32.116 19.904 1.00 32.13 H new ATOM 2026 N ALA A 669 14.861 -28.596 23.967 1.00 41.44 N ATOM 2027 CA ALA A 669 15.373 -27.875 25.120 1.00 42.24 C ATOM 2028 C ALA A 669 14.206 -27.241 25.879 1.00 31.33 C ATOM 2029 O ALA A 669 14.377 -26.762 26.999 1.00 35.02 O ATOM 2030 CB ALA A 669 16.400 -26.838 24.659 1.00 22.41 C ATOM 0 H ALA A 669 15.082 -28.172 23.066 1.00 41.44 H new ATOM 0 HA ALA A 669 15.880 -28.556 25.804 1.00 42.24 H new ATOM 0 HB1 ALA A 669 16.784 -26.297 25.524 1.00 22.41 H new ATOM 0 HB2 ALA A 669 17.223 -27.341 24.151 1.00 22.41 H new ATOM 0 HB3 ALA A 669 15.926 -26.136 23.973 1.00 22.41 H new ATOM 2036 N GLU A 670 13.046 -27.260 25.240 1.00 52.44 N ATOM 2037 CA GLU A 670 11.851 -26.693 25.841 1.00 14.10 C ATOM 2038 C GLU A 670 11.160 -27.731 26.728 1.00 14.41 C ATOM 2039 O GLU A 670 10.564 -27.383 27.746 1.00 35.55 O ATOM 2040 CB GLU A 670 10.895 -26.165 24.769 1.00 2.42 C ATOM 2041 CG GLU A 670 11.188 -24.697 24.449 1.00 73.40 C ATOM 2042 CD GLU A 670 9.942 -23.996 23.903 1.00 31.44 C ATOM 2043 OE1 GLU A 670 9.110 -23.512 24.686 1.00 64.24 O ATOM 2044 OE2 GLU A 670 9.854 -23.963 22.617 1.00 62.52 O ATOM 0 H GLU A 670 12.908 -27.659 24.312 1.00 52.44 H new ATOM 0 HA GLU A 670 12.147 -25.849 26.464 1.00 14.10 H new ATOM 0 HB2 GLU A 670 10.991 -26.765 23.864 1.00 2.42 H new ATOM 0 HB3 GLU A 670 9.865 -26.268 25.112 1.00 2.42 H new ATOM 0 HG2 GLU A 670 11.532 -24.187 25.349 1.00 73.40 H new ATOM 0 HG3 GLU A 670 11.995 -24.634 23.719 1.00 73.40 H new ATOM 2052 N ASN A 671 11.263 -28.983 26.309 1.00 73.21 N ATOM 2053 CA ASN A 671 10.655 -30.074 27.053 1.00 41.44 C ATOM 2054 C ASN A 671 11.699 -30.694 27.983 1.00 31.33 C ATOM 2055 O ASN A 671 11.530 -30.691 29.202 1.00 51.43 O ATOM 2056 CB ASN A 671 10.151 -31.169 26.111 1.00 53.31 C ATOM 2057 CG ASN A 671 8.873 -30.729 25.393 1.00 44.23 C ATOM 2058 OD1 ASN A 671 7.843 -31.381 25.448 1.00 44.53 O ATOM 2059 ND2 ASN A 671 8.997 -29.590 24.718 1.00 43.43 N ATOM 0 H ASN A 671 11.758 -29.267 25.464 1.00 73.21 H new ATOM 0 HA ASN A 671 9.815 -29.670 27.619 1.00 41.44 H new ATOM 0 HB2 ASN A 671 10.922 -31.406 25.377 1.00 53.31 H new ATOM 0 HB3 ASN A 671 9.959 -32.081 26.677 1.00 53.31 H new ATOM 0 HD21 ASN A 671 8.201 -29.212 24.205 1.00 43.43 H new ATOM 0 HD22 ASN A 671 9.888 -29.094 24.714 1.00 43.43 H new ATOM 2066 N LEU A 672 12.755 -31.213 27.374 1.00 51.42 N ATOM 2067 CA LEU A 672 13.826 -31.836 28.133 1.00 41.35 C ATOM 2068 C LEU A 672 14.134 -30.984 29.366 1.00 73.11 C ATOM 2069 O LEU A 672 14.054 -31.468 30.494 1.00 1.31 O ATOM 2070 CB LEU A 672 15.042 -32.084 27.238 1.00 62.11 C ATOM 2071 CG LEU A 672 14.811 -32.995 26.030 1.00 5.41 C ATOM 2072 CD1 LEU A 672 16.069 -33.802 25.704 1.00 24.12 C ATOM 2073 CD2 LEU A 672 13.593 -33.894 26.246 1.00 31.24 C ATOM 0 H LEU A 672 12.892 -31.215 26.363 1.00 51.42 H new ATOM 0 HA LEU A 672 13.517 -32.818 28.492 1.00 41.35 H new ATOM 0 HB2 LEU A 672 15.406 -31.122 26.878 1.00 62.11 H new ATOM 0 HB3 LEU A 672 15.835 -32.517 27.848 1.00 62.11 H new ATOM 0 HG LEU A 672 14.598 -32.367 25.165 1.00 5.41 H new ATOM 0 HD11 LEU A 672 15.878 -34.441 24.842 1.00 24.12 H new ATOM 0 HD12 LEU A 672 16.889 -33.121 25.476 1.00 24.12 H new ATOM 0 HD13 LEU A 672 16.337 -34.420 26.561 1.00 24.12 H new ATOM 0 HD21 LEU A 672 13.451 -34.531 25.373 1.00 31.24 H new ATOM 0 HD22 LEU A 672 13.751 -34.516 27.127 1.00 31.24 H new ATOM 0 HD23 LEU A 672 12.707 -33.277 26.392 1.00 31.24 H new ATOM 2085 N SER A 673 14.479 -29.731 29.109 1.00 15.13 N ATOM 2086 CA SER A 673 14.798 -28.808 30.185 1.00 44.54 C ATOM 2087 C SER A 673 16.068 -29.265 30.907 1.00 54.54 C ATOM 2088 O SER A 673 16.303 -28.889 32.054 1.00 35.42 O ATOM 2089 CB SER A 673 13.637 -28.691 31.174 1.00 25.22 C ATOM 2090 OG SER A 673 12.757 -27.621 30.841 1.00 23.12 O ATOM 0 H SER A 673 14.545 -29.333 28.172 1.00 15.13 H new ATOM 0 HA SER A 673 14.969 -27.823 29.751 1.00 44.54 H new ATOM 0 HB2 SER A 673 13.079 -29.627 31.190 1.00 25.22 H new ATOM 0 HB3 SER A 673 14.031 -28.537 32.179 1.00 25.22 H new ATOM 0 HG SER A 673 12.028 -27.581 31.495 1.00 23.12 H new ATOM 2096 N ASP A 674 16.853 -30.068 30.204 1.00 34.23 N ATOM 2097 CA ASP A 674 18.092 -30.580 30.764 1.00 71.42 C ATOM 2098 C ASP A 674 19.119 -29.449 30.837 1.00 2.04 C ATOM 2099 O ASP A 674 20.131 -29.569 31.526 1.00 44.40 O ATOM 2100 CB ASP A 674 18.674 -31.691 29.888 1.00 61.33 C ATOM 2101 CG ASP A 674 19.754 -32.544 30.557 1.00 33.11 C ATOM 2102 OD1 ASP A 674 19.466 -33.609 31.123 1.00 24.15 O ATOM 2103 OD2 ASP A 674 20.950 -32.068 30.480 1.00 42.10 O ATOM 0 H ASP A 674 16.655 -30.376 29.252 1.00 34.23 H new ATOM 0 HA ASP A 674 17.875 -30.978 31.755 1.00 71.42 H new ATOM 0 HB2 ASP A 674 17.862 -32.344 29.569 1.00 61.33 H new ATOM 0 HB3 ASP A 674 19.093 -31.241 28.988 1.00 61.33 H new ATOM 2109 N LEU A 675 18.823 -28.376 30.118 1.00 23.42 N ATOM 2110 CA LEU A 675 19.709 -27.224 30.093 1.00 34.43 C ATOM 2111 C LEU A 675 19.550 -26.436 31.395 1.00 74.20 C ATOM 2112 O LEU A 675 20.503 -26.295 32.160 1.00 53.35 O ATOM 2113 CB LEU A 675 19.465 -26.389 28.835 1.00 44.12 C ATOM 2114 CG LEU A 675 19.516 -27.147 27.507 1.00 55.34 C ATOM 2115 CD1 LEU A 675 20.651 -28.172 27.503 1.00 33.30 C ATOM 2116 CD2 LEU A 675 18.163 -27.788 27.190 1.00 51.23 C ATOM 0 H LEU A 675 17.982 -28.280 29.548 1.00 23.42 H new ATOM 0 HA LEU A 675 20.750 -27.544 30.039 1.00 34.43 H new ATOM 0 HB2 LEU A 675 18.488 -25.914 28.922 1.00 44.12 H new ATOM 0 HB3 LEU A 675 20.206 -25.590 28.804 1.00 44.12 H new ATOM 0 HG LEU A 675 19.727 -26.431 26.713 1.00 55.34 H new ATOM 0 HD11 LEU A 675 20.664 -28.696 26.548 1.00 33.30 H new ATOM 0 HD12 LEU A 675 21.603 -27.662 27.650 1.00 33.30 H new ATOM 0 HD13 LEU A 675 20.496 -28.890 28.309 1.00 33.30 H new ATOM 0 HD21 LEU A 675 18.226 -28.321 26.241 1.00 51.23 H new ATOM 0 HD22 LEU A 675 17.898 -28.488 27.982 1.00 51.23 H new ATOM 0 HD23 LEU A 675 17.400 -27.012 27.121 1.00 51.23 H new ATOM 2128 N SER A 676 18.338 -25.944 31.607 1.00 40.31 N ATOM 2129 CA SER A 676 18.042 -25.173 32.803 1.00 71.42 C ATOM 2130 C SER A 676 16.543 -24.876 32.876 1.00 32.41 C ATOM 2131 O SER A 676 15.877 -24.769 31.848 1.00 54.33 O ATOM 2132 CB SER A 676 18.843 -23.870 32.831 1.00 22.41 C ATOM 2133 OG SER A 676 18.159 -22.808 32.172 1.00 33.41 O ATOM 0 H SER A 676 17.550 -26.064 30.971 1.00 40.31 H new ATOM 0 HA SER A 676 18.332 -25.764 33.672 1.00 71.42 H new ATOM 0 HB2 SER A 676 19.040 -23.588 33.865 1.00 22.41 H new ATOM 0 HB3 SER A 676 19.810 -24.029 32.354 1.00 22.41 H new ATOM 0 HG SER A 676 18.702 -21.994 32.213 1.00 33.41 H new ATOM 2139 N LEU A 677 16.056 -24.752 34.102 1.00 31.40 N ATOM 2140 CA LEU A 677 14.648 -24.470 34.323 1.00 12.10 C ATOM 2141 C LEU A 677 14.423 -22.957 34.283 1.00 3.04 C ATOM 2142 O LEU A 677 13.557 -22.473 33.557 1.00 73.23 O ATOM 2143 CB LEU A 677 14.166 -25.129 35.617 1.00 74.54 C ATOM 2144 CG LEU A 677 14.221 -26.658 35.651 1.00 23.12 C ATOM 2145 CD1 LEU A 677 15.599 -27.166 35.223 1.00 62.35 C ATOM 2146 CD2 LEU A 677 13.817 -27.190 37.027 1.00 33.54 C ATOM 0 H LEU A 677 16.612 -24.842 34.953 1.00 31.40 H new ATOM 0 HA LEU A 677 14.043 -24.904 33.527 1.00 12.10 H new ATOM 0 HB2 LEU A 677 14.766 -24.745 36.442 1.00 74.54 H new ATOM 0 HB3 LEU A 677 13.137 -24.818 35.799 1.00 74.54 H new ATOM 0 HG LEU A 677 13.498 -27.042 34.932 1.00 23.12 H new ATOM 0 HD11 LEU A 677 15.612 -28.255 35.256 1.00 62.35 H new ATOM 0 HD12 LEU A 677 15.811 -26.831 34.208 1.00 62.35 H new ATOM 0 HD13 LEU A 677 16.358 -26.774 35.900 1.00 62.35 H new ATOM 0 HD21 LEU A 677 13.864 -28.279 37.024 1.00 33.54 H new ATOM 0 HD22 LEU A 677 14.498 -26.799 37.783 1.00 33.54 H new ATOM 0 HD23 LEU A 677 12.800 -26.872 37.256 1.00 33.54 H new ATOM 2158 N ASP A 678 15.219 -22.252 35.074 1.00 41.11 N ATOM 2159 CA ASP A 678 15.118 -20.804 35.138 1.00 1.24 C ATOM 2160 C ASP A 678 15.169 -20.230 33.721 1.00 3.20 C ATOM 2161 O ASP A 678 16.085 -19.481 33.384 1.00 54.54 O ATOM 2162 CB ASP A 678 16.281 -20.205 35.933 1.00 35.50 C ATOM 2163 CG ASP A 678 15.963 -18.895 36.657 1.00 74.53 C ATOM 2164 OD1 ASP A 678 15.919 -17.820 36.041 1.00 74.10 O ATOM 2165 OD2 ASP A 678 15.752 -19.010 37.924 1.00 32.22 O ATOM 0 H ASP A 678 15.936 -22.657 35.676 1.00 41.11 H new ATOM 0 HA ASP A 678 14.178 -20.553 35.630 1.00 1.24 H new ATOM 0 HB2 ASP A 678 16.614 -20.937 36.668 1.00 35.50 H new ATOM 0 HB3 ASP A 678 17.116 -20.034 35.253 1.00 35.50 H new TER 2171 ASP A 678 HETATM 2172 ZN ZN A 679 -13.123 -22.643 13.285 1.00 72.01 ZN