USER MOD reduce.3.24.130724 H: found=0, std=0, add=1088, rem=0, adj=21 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= -0.26 USER MOD Set 1.2: A 622 GLN : amide:sc= -2.99 K(o=-3.3,f=-9.7!) USER MOD Set 2.1: A 581 ASN : amide:sc= -5.81! C(o=-8.1!,f=-1.8!) USER MOD Set 2.2: A 583 ASN : amide:sc= -2.33 K(o=-8.1,f=-4.3!) USER MOD Set 3.1: A 553 GLN : amide:sc= -2.09! C(o=-2.3!,f=-1.5!) USER MOD Set 3.2: A 565 HIS : no HD1:sc= -0.2 K(o=-2.3,f=-3.7) USER MOD Single : A 544 HIS : no HD1:sc= -0.341 X(o=-0.34,f=-0.034) USER MOD Single : A 545 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 546 GLN : amide:sc= -0.279 X(o=-0.28,f=0) USER MOD Single : A 551 HIS : no HD1:sc= -1.53 K(o=-1.5,f=-2.9!) USER MOD Single : A 558 ASN : amide:sc=-0.00134 K(o=-0.0013,f=-1.3) USER MOD Single : A 560 MET CE :methyl 153:sc= -0.195 (180deg=-1.36) 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 175:sc= 0.0219 USER MOD Single : A 576 HIS : no HD1:sc= -1.56 K(o=-1.6,f=-0.55) USER MOD Single : A 577 HIS : no HD1:sc= -18.4! C(o=-18!,f=-24!) USER MOD Single : A 579 ASN : amide:sc= -4.43! K(o=-4.4!,f=-1.1) USER MOD Single : A 585 SER OG : rot 180:sc= 0 USER MOD Single : A 586 ASN : amide:sc= 0 X(o=0,f=-0.0073) USER MOD Single : A 587 TYR OH : rot -80:sc= 1.07 USER MOD Single : A 589 ASN : amide:sc= -1.21 K(o=-1.2,f=-0.093) USER MOD Single : A 591 SER OG : rot 180:sc= 0 USER MOD Single : A 598 ASN : amide:sc= -2.09 K(o=-2.1,f=-3!) USER MOD Single : A 599 LYS NZ :NH3+ -157:sc= -0.115 (180deg=-1.11) 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 611 SER OG : rot 180:sc= 0 USER MOD Single : A 614 ASN : amide:sc= -3.71! K(o=-3.7!,f=-2.3) USER MOD Single : A 623 MET CE :methyl 180:sc= -0.115 (180deg=-0.115) USER MOD Single : A 625 TYR OH : rot 165:sc= 0 USER MOD Single : A 626 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 627 SER OG : rot -53:sc= 0.597 USER MOD Single : A 629 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 634 LYS NZ :NH3+ 157:sc= -8.64! (180deg=-10.1!) USER MOD Single : A 637 SER OG : rot 150:sc= -0.286 USER MOD Single : A 638 MET CE :methyl -161:sc= -11.2! (180deg=-12!) USER MOD Single : A 642 THR OG1 : rot -91:sc= 1.02 USER MOD Single : A 644 GLN : amide:sc= -1.41! X(o=-1.4!,f=-1.1) USER MOD Single : A 648 GLN : amide:sc= -4.31! C(o=-4.3!,f=-8!) 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=-0.00183 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= -11.2! C(o=-11!,f=-13!) USER MOD Single : A 668 CYS SG : rot 180:sc= -0.481 USER MOD Single : A 671 ASN : amide:sc= 0.23 X(o=0.23,f=0) USER MOD Single : A 673 SER OG : rot 13:sc= 0.00259 USER MOD Single : A 676 SER OG : rot -13:sc= 0.988 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 542 6.094 3.433 -3.072 1.00 4.01 N ATOM 2 CA GLY A 542 7.089 2.460 -2.652 1.00 50.35 C ATOM 3 C GLY A 542 6.518 1.514 -1.594 1.00 62.24 C ATOM 4 O GLY A 542 6.664 1.755 -0.397 1.00 60.02 O ATOM 0 HA2 GLY A 542 7.427 1.885 -3.514 1.00 50.35 H new ATOM 0 HA3 GLY A 542 7.961 2.976 -2.251 1.00 50.35 H new ATOM 8 N PRO A 543 5.863 0.429 -2.087 1.00 62.43 N ATOM 9 CA PRO A 543 5.270 -0.555 -1.198 1.00 32.11 C ATOM 10 C PRO A 543 6.344 -1.445 -0.570 1.00 61.51 C ATOM 11 O PRO A 543 7.264 -1.890 -1.254 1.00 63.43 O ATOM 12 CB PRO A 543 4.289 -1.328 -2.065 1.00 23.44 C ATOM 13 CG PRO A 543 4.705 -1.063 -3.502 1.00 54.44 C ATOM 14 CD PRO A 543 5.671 0.111 -3.499 1.00 71.42 C ATOM 0 HA PRO A 543 4.758 -0.101 -0.349 1.00 32.11 H new ATOM 0 HB2 PRO A 543 4.323 -2.394 -1.839 1.00 23.44 H new ATOM 0 HB3 PRO A 543 3.266 -0.997 -1.887 1.00 23.44 H new ATOM 0 HG2 PRO A 543 5.179 -1.946 -3.931 1.00 54.44 H new ATOM 0 HG3 PRO A 543 3.833 -0.838 -4.117 1.00 54.44 H new ATOM 0 HD2 PRO A 543 6.614 -0.151 -3.978 1.00 71.42 H new ATOM 0 HD3 PRO A 543 5.262 0.962 -4.045 1.00 71.42 H new ATOM 22 N HIS A 544 6.191 -1.679 0.725 1.00 2.01 N ATOM 23 CA HIS A 544 7.137 -2.508 1.453 1.00 73.32 C ATOM 24 C HIS A 544 6.663 -3.963 1.434 1.00 24.22 C ATOM 25 O HIS A 544 7.476 -4.885 1.482 1.00 5.03 O ATOM 26 CB HIS A 544 7.351 -1.973 2.870 1.00 51.43 C ATOM 27 CG HIS A 544 7.916 -0.573 2.918 1.00 21.02 C ATOM 28 ND1 HIS A 544 8.349 0.021 4.091 1.00 34.42 N ATOM 29 CD2 HIS A 544 8.116 0.342 1.927 1.00 52.31 C ATOM 30 CE1 HIS A 544 8.786 1.239 3.807 1.00 71.50 C ATOM 31 NE2 HIS A 544 8.640 1.436 2.465 1.00 3.23 N ATOM 0 H HIS A 544 5.426 -1.309 1.289 1.00 2.01 H new ATOM 0 HA HIS A 544 8.110 -2.472 0.963 1.00 73.32 H new ATOM 0 HB2 HIS A 544 6.399 -1.988 3.401 1.00 51.43 H new ATOM 0 HB3 HIS A 544 8.024 -2.644 3.403 1.00 51.43 H new ATOM 0 HD2 HIS A 544 7.887 0.200 0.881 1.00 52.31 H new ATOM 0 HE1 HIS A 544 9.187 1.951 4.513 1.00 71.50 H new ATOM 0 HE2 HIS A 544 8.892 2.285 1.958 1.00 3.23 H new ATOM 39 N MET A 545 5.350 -4.124 1.364 1.00 2.23 N ATOM 40 CA MET A 545 4.759 -5.451 1.339 1.00 52.22 C ATOM 41 C MET A 545 5.479 -6.391 2.308 1.00 54.30 C ATOM 42 O MET A 545 5.912 -7.475 1.920 1.00 11.35 O ATOM 43 CB MET A 545 4.841 -6.019 -0.079 1.00 74.14 C ATOM 44 CG MET A 545 3.754 -5.419 -0.974 1.00 41.01 C ATOM 45 SD MET A 545 2.297 -6.450 -0.941 1.00 25.13 S ATOM 46 CE MET A 545 2.674 -7.561 -2.286 1.00 34.51 C ATOM 0 H MET A 545 4.679 -3.357 1.324 1.00 2.23 H new ATOM 0 HA MET A 545 3.717 -5.370 1.648 1.00 52.22 H new ATOM 0 HB2 MET A 545 5.823 -5.809 -0.503 1.00 74.14 H new ATOM 0 HB3 MET A 545 4.733 -7.103 -0.047 1.00 74.14 H new ATOM 0 HG2 MET A 545 3.506 -4.414 -0.634 1.00 41.01 H new ATOM 0 HG3 MET A 545 4.122 -5.328 -1.996 1.00 41.01 H new ATOM 0 HE1 MET A 545 1.861 -8.278 -2.405 1.00 34.51 H new ATOM 0 HE2 MET A 545 2.792 -6.990 -3.207 1.00 34.51 H new ATOM 0 HE3 MET A 545 3.599 -8.095 -2.069 1.00 34.51 H new ATOM 56 N GLN A 546 5.584 -5.941 3.550 1.00 40.03 N ATOM 57 CA GLN A 546 6.244 -6.728 4.577 1.00 31.34 C ATOM 58 C GLN A 546 5.243 -7.133 5.661 1.00 14.42 C ATOM 59 O GLN A 546 4.401 -6.331 6.064 1.00 41.10 O ATOM 60 CB GLN A 546 7.425 -5.964 5.179 1.00 31.45 C ATOM 61 CG GLN A 546 6.943 -4.904 6.172 1.00 44.24 C ATOM 62 CD GLN A 546 8.127 -4.207 6.847 1.00 73.32 C ATOM 63 OE1 GLN A 546 8.220 -4.122 8.060 1.00 11.13 O ATOM 64 NE2 GLN A 546 9.023 -3.716 5.996 1.00 52.04 N ATOM 0 H GLN A 546 5.223 -5.042 3.868 1.00 40.03 H new ATOM 0 HA GLN A 546 6.637 -7.634 4.116 1.00 31.34 H new ATOM 0 HB2 GLN A 546 8.095 -6.661 5.682 1.00 31.45 H new ATOM 0 HB3 GLN A 546 7.999 -5.488 4.384 1.00 31.45 H new ATOM 0 HG2 GLN A 546 6.330 -4.167 5.654 1.00 44.24 H new ATOM 0 HG3 GLN A 546 6.311 -5.369 6.928 1.00 44.24 H new ATOM 0 HE21 GLN A 546 8.884 -3.822 4.991 1.00 52.04 H new ATOM 0 HE22 GLN A 546 9.850 -3.233 6.348 1.00 52.04 H new ATOM 73 N PHE A 547 5.367 -8.376 6.103 1.00 54.44 N ATOM 74 CA PHE A 547 4.483 -8.896 7.132 1.00 52.00 C ATOM 75 C PHE A 547 5.223 -9.874 8.046 1.00 34.55 C ATOM 76 O PHE A 547 5.460 -11.022 7.672 1.00 53.33 O ATOM 77 CB PHE A 547 3.353 -9.639 6.417 1.00 33.42 C ATOM 78 CG PHE A 547 2.839 -8.932 5.162 1.00 41.14 C ATOM 79 CD1 PHE A 547 3.638 -8.826 4.066 1.00 11.41 C ATOM 80 CD2 PHE A 547 1.584 -8.409 5.141 1.00 74.30 C ATOM 81 CE1 PHE A 547 3.161 -8.169 2.901 1.00 61.03 C ATOM 82 CE2 PHE A 547 1.107 -7.753 3.976 1.00 51.23 C ATOM 83 CZ PHE A 547 1.906 -7.646 2.880 1.00 34.51 C ATOM 0 H PHE A 547 6.066 -9.038 5.767 1.00 54.44 H new ATOM 0 HA PHE A 547 4.106 -8.079 7.748 1.00 52.00 H new ATOM 0 HB2 PHE A 547 3.703 -10.634 6.143 1.00 33.42 H new ATOM 0 HB3 PHE A 547 2.524 -9.773 7.112 1.00 33.42 H new ATOM 0 HD1 PHE A 547 4.635 -9.241 4.082 1.00 11.41 H new ATOM 0 HD2 PHE A 547 0.950 -8.493 6.011 1.00 74.30 H new ATOM 0 HE1 PHE A 547 3.795 -8.085 2.031 1.00 61.03 H new ATOM 0 HE2 PHE A 547 0.110 -7.339 3.960 1.00 51.23 H new ATOM 0 HZ PHE A 547 1.544 -7.146 1.994 1.00 34.51 H new ATOM 93 N PRO A 548 5.576 -9.372 9.260 1.00 72.01 N ATOM 94 CA PRO A 548 6.284 -10.189 10.231 1.00 52.11 C ATOM 95 C PRO A 548 5.342 -11.202 10.886 1.00 44.14 C ATOM 96 O PRO A 548 4.189 -10.886 11.175 1.00 25.15 O ATOM 97 CB PRO A 548 6.874 -9.199 11.222 1.00 33.11 C ATOM 98 CG PRO A 548 6.093 -7.908 11.037 1.00 35.34 C ATOM 99 CD PRO A 548 5.312 -8.018 9.738 1.00 74.10 C ATOM 0 HA PRO A 548 7.069 -10.795 9.779 1.00 52.11 H new ATOM 0 HB2 PRO A 548 6.783 -9.568 12.244 1.00 33.11 H new ATOM 0 HB3 PRO A 548 7.936 -9.043 11.033 1.00 33.11 H new ATOM 0 HG2 PRO A 548 5.417 -7.747 11.877 1.00 35.34 H new ATOM 0 HG3 PRO A 548 6.769 -7.054 11.005 1.00 35.34 H new ATOM 0 HD2 PRO A 548 4.247 -7.857 9.902 1.00 74.10 H new ATOM 0 HD3 PRO A 548 5.640 -7.272 9.014 1.00 74.10 H new ATOM 107 N VAL A 549 5.869 -12.399 11.100 1.00 40.43 N ATOM 108 CA VAL A 549 5.090 -13.460 11.715 1.00 2.20 C ATOM 109 C VAL A 549 4.414 -12.924 12.978 1.00 3.55 C ATOM 110 O VAL A 549 3.245 -13.210 13.231 1.00 71.14 O ATOM 111 CB VAL A 549 5.981 -14.675 11.983 1.00 10.43 C ATOM 112 CG1 VAL A 549 6.478 -15.290 10.674 1.00 74.14 C ATOM 113 CG2 VAL A 549 7.153 -14.304 12.894 1.00 20.44 C ATOM 0 H VAL A 549 6.826 -12.657 10.858 1.00 40.43 H new ATOM 0 HA VAL A 549 4.301 -13.794 11.041 1.00 2.20 H new ATOM 0 HB VAL A 549 5.380 -15.424 12.498 1.00 10.43 H new ATOM 0 HG11 VAL A 549 7.109 -16.151 10.893 1.00 74.14 H new ATOM 0 HG12 VAL A 549 5.625 -15.608 10.074 1.00 74.14 H new ATOM 0 HG13 VAL A 549 7.055 -14.549 10.120 1.00 74.14 H new ATOM 0 HG21 VAL A 549 7.771 -15.185 13.069 1.00 20.44 H new ATOM 0 HG22 VAL A 549 7.753 -13.529 12.417 1.00 20.44 H new ATOM 0 HG23 VAL A 549 6.771 -13.934 13.845 1.00 20.44 H new ATOM 123 N GLU A 550 5.179 -12.155 13.739 1.00 2.44 N ATOM 124 CA GLU A 550 4.669 -11.576 14.971 1.00 51.45 C ATOM 125 C GLU A 550 3.385 -10.791 14.696 1.00 54.14 C ATOM 126 O GLU A 550 2.485 -10.752 15.534 1.00 60.34 O ATOM 127 CB GLU A 550 5.722 -10.688 15.637 1.00 51.24 C ATOM 128 CG GLU A 550 6.383 -9.760 14.615 1.00 74.00 C ATOM 129 CD GLU A 550 7.005 -8.542 15.302 1.00 74.52 C ATOM 130 OE1 GLU A 550 6.276 -7.658 15.774 1.00 14.43 O ATOM 131 OE2 GLU A 550 8.294 -8.535 15.336 1.00 21.52 O ATOM 0 H GLU A 550 6.148 -11.919 13.526 1.00 2.44 H new ATOM 0 HA GLU A 550 4.436 -12.387 15.661 1.00 51.45 H new ATOM 0 HB2 GLU A 550 5.257 -10.095 16.425 1.00 51.24 H new ATOM 0 HB3 GLU A 550 6.480 -11.311 16.112 1.00 51.24 H new ATOM 0 HG2 GLU A 550 7.152 -10.305 14.067 1.00 74.00 H new ATOM 0 HG3 GLU A 550 5.643 -9.432 13.885 1.00 74.00 H new ATOM 139 N HIS A 551 3.340 -10.185 13.518 1.00 10.44 N ATOM 140 CA HIS A 551 2.181 -9.403 13.122 1.00 33.05 C ATOM 141 C HIS A 551 1.099 -10.333 12.569 1.00 23.21 C ATOM 142 O HIS A 551 -0.088 -10.016 12.629 1.00 24.22 O ATOM 143 CB HIS A 551 2.578 -8.303 12.136 1.00 23.12 C ATOM 144 CG HIS A 551 2.967 -7.000 12.793 1.00 24.33 C ATOM 145 ND1 HIS A 551 3.268 -5.858 12.073 1.00 45.33 N ATOM 146 CD2 HIS A 551 3.100 -6.671 14.110 1.00 24.23 C ATOM 147 CE1 HIS A 551 3.569 -4.891 12.928 1.00 74.14 C ATOM 148 NE2 HIS A 551 3.464 -5.397 14.190 1.00 64.41 N ATOM 0 H HIS A 551 4.088 -10.220 12.825 1.00 10.44 H new ATOM 0 HA HIS A 551 1.765 -8.896 13.993 1.00 33.05 H new ATOM 0 HB2 HIS A 551 3.413 -8.656 11.530 1.00 23.12 H new ATOM 0 HB3 HIS A 551 1.746 -8.121 11.456 1.00 23.12 H new ATOM 0 HD2 HIS A 551 2.937 -7.335 14.946 1.00 24.23 H new ATOM 0 HE1 HIS A 551 3.848 -3.880 12.671 1.00 74.14 H new ATOM 0 HE2 HIS A 551 3.637 -4.882 15.053 1.00 64.41 H new ATOM 156 N VAL A 552 1.549 -11.463 12.043 1.00 54.15 N ATOM 157 CA VAL A 552 0.634 -12.441 11.479 1.00 63.52 C ATOM 158 C VAL A 552 0.158 -13.385 12.585 1.00 11.33 C ATOM 159 O VAL A 552 0.968 -14.046 13.234 1.00 53.33 O ATOM 160 CB VAL A 552 1.305 -13.175 10.316 1.00 60.05 C ATOM 161 CG1 VAL A 552 0.490 -14.401 9.898 1.00 44.22 C ATOM 162 CG2 VAL A 552 1.528 -12.234 9.130 1.00 73.33 C ATOM 0 H VAL A 552 2.534 -11.723 11.996 1.00 54.15 H new ATOM 0 HA VAL A 552 -0.248 -11.948 11.070 1.00 63.52 H new ATOM 0 HB VAL A 552 2.281 -13.522 10.657 1.00 60.05 H new ATOM 0 HG11 VAL A 552 0.989 -14.904 9.070 1.00 44.22 H new ATOM 0 HG12 VAL A 552 0.405 -15.086 10.741 1.00 44.22 H new ATOM 0 HG13 VAL A 552 -0.506 -14.087 9.585 1.00 44.22 H new ATOM 0 HG21 VAL A 552 2.006 -12.780 8.317 1.00 73.33 H new ATOM 0 HG22 VAL A 552 0.569 -11.844 8.790 1.00 73.33 H new ATOM 0 HG23 VAL A 552 2.168 -11.407 9.437 1.00 73.33 H new ATOM 172 N GLN A 553 -1.154 -13.417 12.767 1.00 30.10 N ATOM 173 CA GLN A 553 -1.748 -14.268 13.784 1.00 61.41 C ATOM 174 C GLN A 553 -2.529 -15.410 13.130 1.00 14.13 C ATOM 175 O GLN A 553 -3.135 -15.228 12.075 1.00 65.11 O ATOM 176 CB GLN A 553 -2.644 -13.458 14.723 1.00 44.13 C ATOM 177 CG GLN A 553 -3.098 -14.304 15.914 1.00 62.33 C ATOM 178 CD GLN A 553 -3.553 -13.418 17.075 1.00 41.34 C ATOM 179 OE1 GLN A 553 -3.011 -13.454 18.167 1.00 21.41 O ATOM 180 NE2 GLN A 553 -4.576 -12.621 16.778 1.00 20.23 N ATOM 0 H GLN A 553 -1.822 -12.867 12.227 1.00 30.10 H new ATOM 0 HA GLN A 553 -0.946 -14.699 14.383 1.00 61.41 H new ATOM 0 HB2 GLN A 553 -2.104 -12.581 15.080 1.00 44.13 H new ATOM 0 HB3 GLN A 553 -3.515 -13.095 14.177 1.00 44.13 H new ATOM 0 HG2 GLN A 553 -3.915 -14.958 15.609 1.00 62.33 H new ATOM 0 HG3 GLN A 553 -2.280 -14.946 16.241 1.00 62.33 H new ATOM 0 HE21 GLN A 553 -4.983 -12.641 15.843 1.00 20.23 H new ATOM 0 HE22 GLN A 553 -4.953 -11.990 17.485 1.00 20.23 H new ATOM 189 N LEU A 554 -2.491 -16.561 13.785 1.00 71.34 N ATOM 190 CA LEU A 554 -3.188 -17.732 13.280 1.00 32.33 C ATOM 191 C LEU A 554 -4.639 -17.705 13.766 1.00 60.14 C ATOM 192 O LEU A 554 -4.900 -17.833 14.961 1.00 40.12 O ATOM 193 CB LEU A 554 -2.436 -19.009 13.661 1.00 11.03 C ATOM 194 CG LEU A 554 -1.171 -19.309 12.854 1.00 13.40 C ATOM 195 CD1 LEU A 554 -0.995 -20.815 12.650 1.00 1.44 C ATOM 196 CD2 LEU A 554 -1.175 -18.547 11.527 1.00 62.31 C ATOM 0 H LEU A 554 -1.989 -16.708 14.661 1.00 71.34 H new ATOM 0 HA LEU A 554 -3.215 -17.719 12.190 1.00 32.33 H new ATOM 0 HB2 LEU A 554 -2.164 -18.946 14.715 1.00 11.03 H new ATOM 0 HB3 LEU A 554 -3.118 -19.853 13.557 1.00 11.03 H new ATOM 0 HG LEU A 554 -0.310 -18.959 13.424 1.00 13.40 H new ATOM 0 HD11 LEU A 554 -0.089 -21.001 12.074 1.00 1.44 H new ATOM 0 HD12 LEU A 554 -0.916 -21.307 13.620 1.00 1.44 H new ATOM 0 HD13 LEU A 554 -1.855 -21.212 12.111 1.00 1.44 H new ATOM 0 HD21 LEU A 554 -0.265 -18.777 10.972 1.00 62.31 H new ATOM 0 HD22 LEU A 554 -2.043 -18.844 10.939 1.00 62.31 H new ATOM 0 HD23 LEU A 554 -1.219 -17.476 11.723 1.00 62.31 H new ATOM 208 N LEU A 555 -5.545 -17.538 12.813 1.00 2.34 N ATOM 209 CA LEU A 555 -6.963 -17.492 13.129 1.00 65.22 C ATOM 210 C LEU A 555 -7.728 -18.381 12.147 1.00 61.52 C ATOM 211 O LEU A 555 -7.159 -19.010 11.255 1.00 32.40 O ATOM 212 CB LEU A 555 -7.458 -16.045 13.162 1.00 3.12 C ATOM 213 CG LEU A 555 -6.426 -14.992 13.574 1.00 34.53 C ATOM 214 CD1 LEU A 555 -5.989 -14.153 12.372 1.00 20.32 C ATOM 215 CD2 LEU A 555 -6.956 -14.124 14.717 1.00 22.13 C ATOM 0 H LEU A 555 -5.325 -17.433 11.823 1.00 2.34 H new ATOM 0 HA LEU A 555 -7.144 -17.889 14.128 1.00 65.22 H new ATOM 0 HB2 LEU A 555 -7.835 -15.788 12.172 1.00 3.12 H new ATOM 0 HB3 LEU A 555 -8.302 -15.986 13.849 1.00 3.12 H new ATOM 0 HG LEU A 555 -5.540 -15.508 13.945 1.00 34.53 H new ATOM 0 HD11 LEU A 555 -5.256 -13.413 12.692 1.00 20.32 H new ATOM 0 HD12 LEU A 555 -5.544 -14.802 11.618 1.00 20.32 H new ATOM 0 HD13 LEU A 555 -6.856 -13.646 11.948 1.00 20.32 H new ATOM 0 HD21 LEU A 555 -6.204 -13.384 14.991 1.00 22.13 H new ATOM 0 HD22 LEU A 555 -7.865 -13.616 14.396 1.00 22.13 H new ATOM 0 HD23 LEU A 555 -7.177 -14.753 15.579 1.00 22.13 H new ATOM 227 N CYS A 556 -9.044 -18.420 12.332 1.00 22.10 N ATOM 228 CA CYS A 556 -9.913 -19.222 11.480 1.00 52.23 C ATOM 229 C CYS A 556 -10.724 -18.334 10.540 1.00 32.12 C ATOM 230 O CYS A 556 -11.704 -17.732 10.977 1.00 21.31 O ATOM 231 CB CYS A 556 -10.855 -20.074 12.333 1.00 44.21 C ATOM 232 SG CYS A 556 -11.521 -21.535 11.472 1.00 42.45 S ATOM 0 H CYS A 556 -9.531 -17.905 13.065 1.00 22.10 H new ATOM 0 HA CYS A 556 -9.284 -19.879 10.879 1.00 52.23 H new ATOM 0 HB2 CYS A 556 -10.322 -20.403 13.225 1.00 44.21 H new ATOM 0 HB3 CYS A 556 -11.686 -19.453 12.668 1.00 44.21 H new ATOM 237 N ILE A 557 -10.304 -18.272 9.285 1.00 25.04 N ATOM 238 CA ILE A 557 -10.998 -17.457 8.303 1.00 61.43 C ATOM 239 C ILE A 557 -12.501 -17.496 8.585 1.00 11.12 C ATOM 240 O ILE A 557 -13.204 -16.513 8.358 1.00 14.30 O ATOM 241 CB ILE A 557 -10.627 -17.896 6.885 1.00 72.44 C ATOM 242 CG1 ILE A 557 -11.595 -18.965 6.371 1.00 44.42 C ATOM 243 CG2 ILE A 557 -9.171 -18.362 6.818 1.00 52.22 C ATOM 244 CD1 ILE A 557 -11.313 -19.300 4.905 1.00 50.22 C ATOM 0 H ILE A 557 -9.491 -18.773 8.926 1.00 25.04 H new ATOM 0 HA ILE A 557 -10.685 -16.416 8.382 1.00 61.43 H new ATOM 0 HB ILE A 557 -10.720 -17.033 6.225 1.00 72.44 H new ATOM 0 HG12 ILE A 557 -11.503 -19.866 6.978 1.00 44.42 H new ATOM 0 HG13 ILE A 557 -12.621 -18.613 6.476 1.00 44.42 H new ATOM 0 HG21 ILE A 557 -8.934 -18.668 5.799 1.00 52.22 H new ATOM 0 HG22 ILE A 557 -8.513 -17.545 7.114 1.00 52.22 H new ATOM 0 HG23 ILE A 557 -9.027 -19.205 7.493 1.00 52.22 H new ATOM 0 HD11 ILE A 557 -12.014 -20.062 4.564 1.00 50.22 H new ATOM 0 HD12 ILE A 557 -11.429 -18.402 4.298 1.00 50.22 H new ATOM 0 HD13 ILE A 557 -10.294 -19.675 4.807 1.00 50.22 H new ATOM 256 N ASN A 558 -12.949 -18.642 9.077 1.00 52.24 N ATOM 257 CA ASN A 558 -14.356 -18.821 9.393 1.00 71.44 C ATOM 258 C ASN A 558 -14.677 -18.098 10.702 1.00 25.54 C ATOM 259 O ASN A 558 -15.480 -17.167 10.721 1.00 31.42 O ATOM 260 CB ASN A 558 -14.695 -20.302 9.575 1.00 70.13 C ATOM 261 CG ASN A 558 -14.974 -20.970 8.227 1.00 34.51 C ATOM 262 OD1 ASN A 558 -14.267 -20.779 7.251 1.00 13.04 O ATOM 263 ND2 ASN A 558 -16.042 -21.763 8.227 1.00 32.35 N ATOM 0 H ASN A 558 -12.363 -19.455 9.264 1.00 52.24 H new ATOM 0 HA ASN A 558 -14.941 -18.416 8.568 1.00 71.44 H new ATOM 0 HB2 ASN A 558 -13.868 -20.810 10.072 1.00 70.13 H new ATOM 0 HB3 ASN A 558 -15.566 -20.403 10.222 1.00 70.13 H new ATOM 0 HD21 ASN A 558 -16.312 -22.255 7.375 1.00 32.35 H new ATOM 0 HD22 ASN A 558 -16.591 -21.879 9.079 1.00 32.35 H new ATOM 270 N CYS A 559 -14.031 -18.555 11.766 1.00 55.41 N ATOM 271 CA CYS A 559 -14.238 -17.963 13.077 1.00 44.00 C ATOM 272 C CYS A 559 -13.487 -16.631 13.126 1.00 14.51 C ATOM 273 O CYS A 559 -14.105 -15.568 13.185 1.00 22.32 O ATOM 274 CB CYS A 559 -13.799 -18.907 14.199 1.00 50.43 C ATOM 275 SG CYS A 559 -14.356 -20.639 14.006 1.00 64.15 S ATOM 0 H CYS A 559 -13.365 -19.327 11.747 1.00 55.41 H new ATOM 0 HA CYS A 559 -15.302 -17.786 13.235 1.00 44.00 H new ATOM 0 HB2 CYS A 559 -12.711 -18.895 14.260 1.00 50.43 H new ATOM 0 HB3 CYS A 559 -14.176 -18.522 15.147 1.00 50.43 H new ATOM 280 N MET A 560 -12.167 -16.730 13.100 1.00 64.32 N ATOM 281 CA MET A 560 -11.326 -15.546 13.141 1.00 44.04 C ATOM 282 C MET A 560 -11.256 -14.971 14.557 1.00 61.51 C ATOM 283 O MET A 560 -11.437 -13.771 14.753 1.00 15.13 O ATOM 284 CB MET A 560 -11.886 -14.489 12.188 1.00 53.55 C ATOM 285 CG MET A 560 -12.240 -15.104 10.832 1.00 20.33 C ATOM 286 SD MET A 560 -13.006 -13.878 9.786 1.00 42.13 S ATOM 287 CE MET A 560 -14.726 -14.267 10.060 1.00 12.20 C ATOM 0 H MET A 560 -11.658 -17.613 13.051 1.00 64.32 H new ATOM 0 HA MET A 560 -10.319 -15.828 12.834 1.00 44.04 H new ATOM 0 HB2 MET A 560 -12.773 -14.032 12.627 1.00 53.55 H new ATOM 0 HB3 MET A 560 -11.153 -13.694 12.050 1.00 53.55 H new ATOM 0 HG2 MET A 560 -11.341 -15.491 10.353 1.00 20.33 H new ATOM 0 HG3 MET A 560 -12.916 -15.948 10.972 1.00 20.33 H new ATOM 0 HE1 MET A 560 -15.330 -13.373 9.904 1.00 12.20 H new ATOM 0 HE2 MET A 560 -15.039 -15.043 9.362 1.00 12.20 H new ATOM 0 HE3 MET A 560 -14.860 -14.622 11.082 1.00 12.20 H new ATOM 297 N VAL A 561 -10.992 -15.856 15.508 1.00 55.14 N ATOM 298 CA VAL A 561 -10.897 -15.452 16.900 1.00 4.20 C ATOM 299 C VAL A 561 -9.456 -15.636 17.382 1.00 51.42 C ATOM 300 O VAL A 561 -9.133 -15.308 18.522 1.00 4.43 O ATOM 301 CB VAL A 561 -11.912 -16.228 17.741 1.00 0.23 C ATOM 302 CG1 VAL A 561 -13.175 -16.532 16.933 1.00 21.32 C ATOM 303 CG2 VAL A 561 -11.295 -17.512 18.299 1.00 43.11 C ATOM 0 H VAL A 561 -10.841 -16.851 15.341 1.00 55.14 H new ATOM 0 HA VAL A 561 -11.145 -14.396 17.009 1.00 4.20 H new ATOM 0 HB VAL A 561 -12.198 -15.600 18.585 1.00 0.23 H new ATOM 0 HG11 VAL A 561 -13.880 -17.084 17.554 1.00 21.32 H new ATOM 0 HG12 VAL A 561 -13.632 -15.598 16.608 1.00 21.32 H new ATOM 0 HG13 VAL A 561 -12.913 -17.131 16.061 1.00 21.32 H new ATOM 0 HG21 VAL A 561 -12.038 -18.044 18.893 1.00 43.11 H new ATOM 0 HG22 VAL A 561 -10.967 -18.146 17.475 1.00 43.11 H new ATOM 0 HG23 VAL A 561 -10.440 -17.262 18.927 1.00 43.11 H new ATOM 313 N ALA A 562 -8.630 -16.160 16.489 1.00 45.43 N ATOM 314 CA ALA A 562 -7.231 -16.391 16.808 1.00 31.05 C ATOM 315 C ALA A 562 -7.095 -17.726 17.543 1.00 64.31 C ATOM 316 O ALA A 562 -7.488 -17.844 18.702 1.00 33.32 O ATOM 317 CB ALA A 562 -6.694 -15.217 17.629 1.00 42.30 C ATOM 0 H ALA A 562 -8.902 -16.431 15.544 1.00 45.43 H new ATOM 0 HA ALA A 562 -6.634 -16.452 15.898 1.00 31.05 H new ATOM 0 HB1 ALA A 562 -5.645 -15.390 17.868 1.00 42.30 H new ATOM 0 HB2 ALA A 562 -6.788 -14.297 17.052 1.00 42.30 H new ATOM 0 HB3 ALA A 562 -7.267 -15.127 18.552 1.00 42.30 H new ATOM 323 N VAL A 563 -6.535 -18.699 16.838 1.00 54.54 N ATOM 324 CA VAL A 563 -6.342 -20.021 17.408 1.00 51.10 C ATOM 325 C VAL A 563 -4.860 -20.220 17.732 1.00 31.01 C ATOM 326 O VAL A 563 -4.486 -21.208 18.362 1.00 71.21 O ATOM 327 CB VAL A 563 -6.895 -21.086 16.459 1.00 62.21 C ATOM 328 CG1 VAL A 563 -8.408 -21.236 16.624 1.00 14.52 C ATOM 329 CG2 VAL A 563 -6.530 -20.769 15.007 1.00 32.21 C ATOM 0 H VAL A 563 -6.209 -18.597 15.877 1.00 54.54 H new ATOM 0 HA VAL A 563 -6.895 -20.119 18.342 1.00 51.10 H new ATOM 0 HB VAL A 563 -6.434 -22.039 16.720 1.00 62.21 H new ATOM 0 HG11 VAL A 563 -8.775 -21.999 15.938 1.00 14.52 H new ATOM 0 HG12 VAL A 563 -8.635 -21.530 17.649 1.00 14.52 H new ATOM 0 HG13 VAL A 563 -8.894 -20.286 16.403 1.00 14.52 H new ATOM 0 HG21 VAL A 563 -6.935 -21.541 14.353 1.00 32.21 H new ATOM 0 HG22 VAL A 563 -6.949 -19.802 14.729 1.00 32.21 H new ATOM 0 HG23 VAL A 563 -5.445 -20.738 14.903 1.00 32.21 H new ATOM 339 N GLY A 564 -4.056 -19.265 17.287 1.00 34.31 N ATOM 340 CA GLY A 564 -2.624 -19.323 17.522 1.00 63.40 C ATOM 341 C GLY A 564 -1.924 -18.089 16.949 1.00 23.40 C ATOM 342 O GLY A 564 -2.560 -17.063 16.716 1.00 4.43 O ATOM 0 H GLY A 564 -4.370 -18.447 16.765 1.00 34.31 H new ATOM 0 HA2 GLY A 564 -2.430 -19.391 18.592 1.00 63.40 H new ATOM 0 HA3 GLY A 564 -2.213 -20.223 17.065 1.00 63.40 H new ATOM 346 N HIS A 565 -0.623 -18.231 16.738 1.00 13.31 N ATOM 347 CA HIS A 565 0.170 -17.140 16.197 1.00 71.22 C ATOM 348 C HIS A 565 0.944 -17.628 14.971 1.00 61.23 C ATOM 349 O HIS A 565 1.375 -18.779 14.922 1.00 60.34 O ATOM 350 CB HIS A 565 1.079 -16.543 17.273 1.00 31.41 C ATOM 351 CG HIS A 565 0.342 -15.761 18.334 1.00 44.51 C ATOM 352 ND1 HIS A 565 -0.065 -16.321 19.532 1.00 73.23 N ATOM 353 CD2 HIS A 565 -0.054 -14.456 18.365 1.00 40.24 C ATOM 354 CE1 HIS A 565 -0.679 -15.387 20.243 1.00 33.21 C ATOM 355 NE2 HIS A 565 -0.672 -14.232 19.518 1.00 43.02 N ATOM 0 H HIS A 565 -0.099 -19.084 16.932 1.00 13.31 H new ATOM 0 HA HIS A 565 -0.488 -16.334 15.872 1.00 71.22 H new ATOM 0 HB2 HIS A 565 1.636 -17.348 17.751 1.00 31.41 H new ATOM 0 HB3 HIS A 565 1.809 -15.889 16.796 1.00 31.41 H new ATOM 0 HD2 HIS A 565 0.108 -13.728 17.584 1.00 40.24 H new ATOM 0 HE1 HIS A 565 -1.110 -15.517 21.225 1.00 33.21 H new ATOM 0 HE2 HIS A 565 -1.075 -13.343 19.813 1.00 43.02 H new ATOM 363 N GLY A 566 1.097 -16.728 14.011 1.00 62.14 N ATOM 364 CA GLY A 566 1.812 -17.052 12.788 1.00 71.42 C ATOM 365 C GLY A 566 3.323 -17.080 13.027 1.00 71.42 C ATOM 366 O GLY A 566 4.097 -17.328 12.103 1.00 34.42 O ATOM 0 H GLY A 566 0.738 -15.774 14.055 1.00 62.14 H new ATOM 0 HA2 GLY A 566 1.481 -18.021 12.415 1.00 71.42 H new ATOM 0 HA3 GLY A 566 1.575 -16.317 12.019 1.00 71.42 H new ATOM 370 N SER A 567 3.698 -16.823 14.271 1.00 12.41 N ATOM 371 CA SER A 567 5.102 -16.815 14.643 1.00 24.12 C ATOM 372 C SER A 567 5.369 -17.886 15.703 1.00 72.44 C ATOM 373 O SER A 567 6.461 -17.950 16.266 1.00 55.13 O ATOM 374 CB SER A 567 5.528 -15.440 15.161 1.00 52.43 C ATOM 375 OG SER A 567 5.120 -15.227 16.509 1.00 14.04 O ATOM 0 H SER A 567 3.053 -16.619 15.035 1.00 12.41 H new ATOM 0 HA SER A 567 5.692 -17.037 13.753 1.00 24.12 H new ATOM 0 HB2 SER A 567 6.612 -15.346 15.091 1.00 52.43 H new ATOM 0 HB3 SER A 567 5.099 -14.665 14.526 1.00 52.43 H new ATOM 0 HG SER A 567 5.412 -14.339 16.803 1.00 14.04 H new ATOM 381 N ASP A 568 4.352 -18.702 15.942 1.00 3.21 N ATOM 382 CA ASP A 568 4.463 -19.767 16.924 1.00 31.20 C ATOM 383 C ASP A 568 4.437 -21.119 16.208 1.00 20.22 C ATOM 384 O ASP A 568 4.823 -22.137 16.781 1.00 5.45 O ATOM 385 CB ASP A 568 3.293 -19.732 17.909 1.00 1.44 C ATOM 386 CG ASP A 568 3.516 -20.512 19.207 1.00 43.34 C ATOM 387 OD1 ASP A 568 2.596 -21.158 19.729 1.00 25.52 O ATOM 388 OD2 ASP A 568 4.710 -20.436 19.689 1.00 22.35 O ATOM 0 H ASP A 568 3.448 -18.647 15.473 1.00 3.21 H new ATOM 0 HA ASP A 568 5.397 -19.628 17.468 1.00 31.20 H new ATOM 0 HB2 ASP A 568 3.080 -18.693 18.159 1.00 1.44 H new ATOM 0 HB3 ASP A 568 2.408 -20.128 17.412 1.00 1.44 H new ATOM 394 N LEU A 569 3.978 -21.086 14.966 1.00 71.31 N ATOM 395 CA LEU A 569 3.897 -22.297 14.166 1.00 55.52 C ATOM 396 C LEU A 569 5.229 -22.518 13.448 1.00 62.53 C ATOM 397 O LEU A 569 6.046 -21.604 13.351 1.00 23.12 O ATOM 398 CB LEU A 569 2.693 -22.236 13.223 1.00 12.23 C ATOM 399 CG LEU A 569 2.595 -20.991 12.340 1.00 40.45 C ATOM 400 CD1 LEU A 569 3.982 -20.525 11.893 1.00 42.01 C ATOM 401 CD2 LEU A 569 1.662 -21.233 11.152 1.00 71.34 C ATOM 0 H LEU A 569 3.658 -20.240 14.494 1.00 71.31 H new ATOM 0 HA LEU A 569 3.730 -23.165 14.804 1.00 55.52 H new ATOM 0 HB2 LEU A 569 2.717 -23.114 12.577 1.00 12.23 H new ATOM 0 HB3 LEU A 569 1.784 -22.305 13.821 1.00 12.23 H new ATOM 0 HG LEU A 569 2.160 -20.186 12.932 1.00 40.45 H new ATOM 0 HD11 LEU A 569 3.884 -19.638 11.267 1.00 42.01 H new ATOM 0 HD12 LEU A 569 4.585 -20.285 12.769 1.00 42.01 H new ATOM 0 HD13 LEU A 569 4.467 -21.319 11.325 1.00 42.01 H new ATOM 0 HD21 LEU A 569 1.610 -20.332 10.541 1.00 71.34 H new ATOM 0 HD22 LEU A 569 2.045 -22.058 10.551 1.00 71.34 H new ATOM 0 HD23 LEU A 569 0.665 -21.482 11.517 1.00 71.34 H new ATOM 413 N ARG A 570 5.407 -23.738 12.962 1.00 24.34 N ATOM 414 CA ARG A 570 6.627 -24.092 12.256 1.00 31.10 C ATOM 415 C ARG A 570 6.328 -25.120 11.163 1.00 40.34 C ATOM 416 O ARG A 570 5.189 -25.559 11.014 1.00 70.43 O ATOM 417 CB ARG A 570 7.672 -24.667 13.215 1.00 54.13 C ATOM 418 CG ARG A 570 8.383 -23.551 13.984 1.00 72.55 C ATOM 419 CD ARG A 570 9.315 -24.129 15.050 1.00 25.10 C ATOM 420 NE ARG A 570 9.456 -23.173 16.171 1.00 62.11 N ATOM 421 CZ ARG A 570 10.297 -22.117 16.164 1.00 52.22 C ATOM 422 NH1 ARG A 570 11.080 -21.872 15.092 1.00 25.01 N ATOM 423 NH2 ARG A 570 10.341 -21.327 17.221 1.00 63.05 N ATOM 0 H ARG A 570 4.727 -24.494 13.043 1.00 24.34 H new ATOM 0 HA ARG A 570 7.025 -23.183 11.806 1.00 31.10 H new ATOM 0 HB2 ARG A 570 7.191 -25.348 13.917 1.00 54.13 H new ATOM 0 HB3 ARG A 570 8.403 -25.250 12.655 1.00 54.13 H new ATOM 0 HG2 ARG A 570 8.955 -22.934 13.291 1.00 72.55 H new ATOM 0 HG3 ARG A 570 7.645 -22.901 14.454 1.00 72.55 H new ATOM 0 HD2 ARG A 570 8.919 -25.076 15.416 1.00 25.10 H new ATOM 0 HD3 ARG A 570 10.292 -24.339 14.615 1.00 25.10 H new ATOM 0 HE ARG A 570 8.882 -23.321 17.001 1.00 62.11 H new ATOM 0 HH11 ARG A 570 11.039 -22.487 14.279 1.00 25.01 H new ATOM 0 HH12 ARG A 570 11.713 -21.072 15.095 1.00 25.01 H new ATOM 0 HH21 ARG A 570 9.745 -21.519 18.026 1.00 63.05 H new ATOM 0 HH22 ARG A 570 10.971 -20.525 17.232 1.00 63.05 H new ATOM 436 N LYS A 571 7.371 -25.473 10.426 1.00 50.44 N ATOM 437 CA LYS A 571 7.234 -26.440 9.350 1.00 24.33 C ATOM 438 C LYS A 571 7.901 -27.754 9.764 1.00 5.50 C ATOM 439 O LYS A 571 9.101 -27.786 10.035 1.00 32.22 O ATOM 440 CB LYS A 571 7.772 -25.864 8.039 1.00 2.41 C ATOM 441 CG LYS A 571 6.655 -25.197 7.234 1.00 73.51 C ATOM 442 CD LYS A 571 6.991 -25.179 5.741 1.00 14.23 C ATOM 443 CE LYS A 571 8.378 -24.580 5.499 1.00 55.00 C ATOM 444 NZ LYS A 571 8.620 -24.404 4.050 1.00 51.24 N ATOM 0 H LYS A 571 8.314 -25.107 10.553 1.00 50.44 H new ATOM 0 HA LYS A 571 6.182 -26.659 9.166 1.00 24.33 H new ATOM 0 HB2 LYS A 571 8.556 -25.137 8.252 1.00 2.41 H new ATOM 0 HB3 LYS A 571 8.226 -26.659 7.448 1.00 2.41 H new ATOM 0 HG2 LYS A 571 5.718 -25.731 7.393 1.00 73.51 H new ATOM 0 HG3 LYS A 571 6.505 -24.177 7.589 1.00 73.51 H new ATOM 0 HD2 LYS A 571 6.955 -26.193 5.344 1.00 14.23 H new ATOM 0 HD3 LYS A 571 6.241 -24.599 5.203 1.00 14.23 H new ATOM 0 HE2 LYS A 571 8.459 -23.619 6.007 1.00 55.00 H new ATOM 0 HE3 LYS A 571 9.141 -25.231 5.925 1.00 55.00 H new ATOM 0 HZ1 LYS A 571 9.566 -23.997 3.903 1.00 51.24 H new ATOM 0 HZ2 LYS A 571 8.563 -25.327 3.574 1.00 51.24 H new ATOM 0 HZ3 LYS A 571 7.902 -23.765 3.653 1.00 51.24 H new ATOM 457 N VAL A 572 7.095 -28.804 9.799 1.00 22.25 N ATOM 458 CA VAL A 572 7.592 -30.117 10.176 1.00 44.24 C ATOM 459 C VAL A 572 8.340 -30.733 8.991 1.00 13.12 C ATOM 460 O VAL A 572 7.741 -31.018 7.955 1.00 11.12 O ATOM 461 CB VAL A 572 6.439 -30.990 10.674 1.00 2.15 C ATOM 462 CG1 VAL A 572 6.736 -32.473 10.446 1.00 24.33 C ATOM 463 CG2 VAL A 572 6.139 -30.711 12.149 1.00 75.25 C ATOM 0 H VAL A 572 6.101 -28.773 9.573 1.00 22.25 H new ATOM 0 HA VAL A 572 8.300 -30.035 11.001 1.00 44.24 H new ATOM 0 HB VAL A 572 5.551 -30.734 10.097 1.00 2.15 H new ATOM 0 HG11 VAL A 572 5.900 -33.071 10.809 1.00 24.33 H new ATOM 0 HG12 VAL A 572 6.878 -32.656 9.381 1.00 24.33 H new ATOM 0 HG13 VAL A 572 7.642 -32.750 10.985 1.00 24.33 H new ATOM 0 HG21 VAL A 572 5.315 -31.344 12.479 1.00 75.25 H new ATOM 0 HG22 VAL A 572 7.024 -30.926 12.747 1.00 75.25 H new ATOM 0 HG23 VAL A 572 5.863 -29.664 12.272 1.00 75.25 H new ATOM 473 N GLU A 573 9.637 -30.920 9.184 1.00 60.21 N ATOM 474 CA GLU A 573 10.472 -31.497 8.144 1.00 24.45 C ATOM 475 C GLU A 573 10.169 -30.843 6.795 1.00 0.12 C ATOM 476 O GLU A 573 10.223 -31.500 5.757 1.00 53.33 O ATOM 477 CB GLU A 573 10.288 -33.014 8.072 1.00 73.42 C ATOM 478 CG GLU A 573 8.895 -33.373 7.551 1.00 54.24 C ATOM 479 CD GLU A 573 8.859 -34.809 7.024 1.00 41.35 C ATOM 480 OE1 GLU A 573 9.849 -35.543 7.157 1.00 4.14 O ATOM 481 OE2 GLU A 573 7.752 -35.155 6.458 1.00 3.14 O ATOM 0 H GLU A 573 10.130 -30.682 10.045 1.00 60.21 H new ATOM 0 HA GLU A 573 11.515 -31.302 8.393 1.00 24.45 H new ATOM 0 HB2 GLU A 573 11.047 -33.445 7.419 1.00 73.42 H new ATOM 0 HB3 GLU A 573 10.434 -33.449 9.061 1.00 73.42 H new ATOM 0 HG2 GLU A 573 8.163 -33.257 8.350 1.00 54.24 H new ATOM 0 HG3 GLU A 573 8.611 -32.683 6.756 1.00 54.24 H new ATOM 489 N GLY A 574 9.857 -29.557 6.854 1.00 12.44 N ATOM 490 CA GLY A 574 9.545 -28.806 5.650 1.00 72.11 C ATOM 491 C GLY A 574 8.579 -29.584 4.754 1.00 63.24 C ATOM 492 O GLY A 574 8.738 -29.605 3.534 1.00 4.51 O ATOM 0 H GLY A 574 9.814 -29.016 7.717 1.00 12.44 H new ATOM 0 HA2 GLY A 574 9.104 -27.846 5.920 1.00 72.11 H new ATOM 0 HA3 GLY A 574 10.463 -28.592 5.102 1.00 72.11 H new ATOM 496 N THR A 575 7.599 -30.206 5.393 1.00 3.30 N ATOM 497 CA THR A 575 6.608 -30.983 4.669 1.00 61.21 C ATOM 498 C THR A 575 5.257 -30.266 4.679 1.00 73.13 C ATOM 499 O THR A 575 4.667 -30.032 3.625 1.00 14.22 O ATOM 500 CB THR A 575 6.559 -32.381 5.289 1.00 72.12 C ATOM 501 OG1 THR A 575 7.658 -33.064 4.693 1.00 63.11 O ATOM 502 CG2 THR A 575 5.335 -33.180 4.836 1.00 14.40 C ATOM 0 H THR A 575 7.470 -30.187 6.405 1.00 3.30 H new ATOM 0 HA THR A 575 6.877 -31.087 3.618 1.00 61.21 H new ATOM 0 HB THR A 575 6.555 -32.296 6.376 1.00 72.12 H new ATOM 0 HG1 THR A 575 7.754 -33.949 5.103 1.00 63.11 H new ATOM 0 HG21 THR A 575 5.349 -34.164 5.305 1.00 14.40 H new ATOM 0 HG22 THR A 575 4.427 -32.652 5.128 1.00 14.40 H new ATOM 0 HG23 THR A 575 5.356 -33.294 3.752 1.00 14.40 H new ATOM 510 N HIS A 576 4.806 -29.938 5.880 1.00 11.45 N ATOM 511 CA HIS A 576 3.535 -29.252 6.041 1.00 0.14 C ATOM 512 C HIS A 576 3.604 -28.321 7.254 1.00 41.03 C ATOM 513 O HIS A 576 4.244 -28.644 8.253 1.00 3.32 O ATOM 514 CB HIS A 576 2.384 -30.256 6.129 1.00 14.53 C ATOM 515 CG HIS A 576 1.984 -30.850 4.800 1.00 51.43 C ATOM 516 ND1 HIS A 576 1.570 -32.163 4.659 1.00 4.23 N ATOM 517 CD2 HIS A 576 1.938 -30.296 3.554 1.00 12.00 C ATOM 518 CE1 HIS A 576 1.292 -32.379 3.382 1.00 34.33 C ATOM 519 NE2 HIS A 576 1.520 -31.221 2.699 1.00 65.32 N ATOM 0 H HIS A 576 5.298 -30.134 6.752 1.00 11.45 H new ATOM 0 HA HIS A 576 3.337 -28.635 5.164 1.00 0.14 H new ATOM 0 HB2 HIS A 576 2.670 -31.062 6.804 1.00 14.53 H new ATOM 0 HB3 HIS A 576 1.518 -29.763 6.570 1.00 14.53 H new ATOM 0 HD2 HIS A 576 2.198 -29.278 3.306 1.00 12.00 H new ATOM 0 HE1 HIS A 576 0.946 -33.309 2.956 1.00 34.33 H new ATOM 0 HE2 HIS A 576 1.391 -31.088 1.696 1.00 65.32 H new ATOM 527 N HIS A 577 2.936 -27.184 7.125 1.00 32.22 N ATOM 528 CA HIS A 577 2.913 -26.204 8.198 1.00 61.13 C ATOM 529 C HIS A 577 2.068 -26.733 9.358 1.00 10.14 C ATOM 530 O HIS A 577 0.930 -27.155 9.160 1.00 14.35 O ATOM 531 CB HIS A 577 2.430 -24.847 7.683 1.00 43.30 C ATOM 532 CG HIS A 577 3.202 -24.332 6.491 1.00 74.31 C ATOM 533 ND1 HIS A 577 3.980 -23.189 6.538 1.00 12.22 N ATOM 534 CD2 HIS A 577 3.307 -24.817 5.220 1.00 33.45 C ATOM 535 CE1 HIS A 577 4.523 -23.003 5.344 1.00 22.12 C ATOM 536 NE2 HIS A 577 4.104 -24.013 4.529 1.00 64.22 N ATOM 0 H HIS A 577 2.407 -26.919 6.294 1.00 32.22 H new ATOM 0 HA HIS A 577 3.924 -26.046 8.573 1.00 61.13 H new ATOM 0 HB2 HIS A 577 1.377 -24.926 7.414 1.00 43.30 H new ATOM 0 HB3 HIS A 577 2.499 -24.118 8.490 1.00 43.30 H new ATOM 0 HD2 HIS A 577 2.823 -25.705 4.841 1.00 33.45 H new ATOM 0 HE1 HIS A 577 5.182 -22.194 5.065 1.00 22.12 H new ATOM 0 HE2 HIS A 577 4.361 -24.131 3.549 1.00 64.22 H new ATOM 544 N VAL A 578 2.658 -26.693 10.544 1.00 11.20 N ATOM 545 CA VAL A 578 1.974 -27.163 11.737 1.00 54.33 C ATOM 546 C VAL A 578 2.225 -26.181 12.883 1.00 34.33 C ATOM 547 O VAL A 578 3.370 -25.842 13.175 1.00 3.21 O ATOM 548 CB VAL A 578 2.414 -28.591 12.065 1.00 44.34 C ATOM 549 CG1 VAL A 578 1.870 -29.583 11.035 1.00 51.41 C ATOM 550 CG2 VAL A 578 3.938 -28.685 12.164 1.00 2.24 C ATOM 0 H VAL A 578 3.602 -26.342 10.704 1.00 11.20 H new ATOM 0 HA VAL A 578 0.897 -27.200 11.571 1.00 54.33 H new ATOM 0 HB VAL A 578 1.997 -28.855 13.037 1.00 44.34 H new ATOM 0 HG11 VAL A 578 2.198 -30.590 11.292 1.00 51.41 H new ATOM 0 HG12 VAL A 578 0.781 -29.545 11.033 1.00 51.41 H new ATOM 0 HG13 VAL A 578 2.244 -29.321 10.045 1.00 51.41 H new ATOM 0 HG21 VAL A 578 4.225 -29.710 12.398 1.00 2.24 H new ATOM 0 HG22 VAL A 578 4.383 -28.392 11.213 1.00 2.24 H new ATOM 0 HG23 VAL A 578 4.293 -28.020 12.951 1.00 2.24 H new ATOM 560 N ASN A 579 1.134 -25.753 13.503 1.00 64.14 N ATOM 561 CA ASN A 579 1.222 -24.818 14.611 1.00 52.51 C ATOM 562 C ASN A 579 1.299 -25.597 15.925 1.00 13.54 C ATOM 563 O ASN A 579 0.439 -26.429 16.209 1.00 61.53 O ATOM 564 CB ASN A 579 -0.012 -23.914 14.668 1.00 62.41 C ATOM 565 CG ASN A 579 -0.073 -23.153 15.994 1.00 73.32 C ATOM 566 OD1 ASN A 579 -1.130 -22.923 16.559 1.00 62.51 O ATOM 567 ND2 ASN A 579 1.115 -22.776 16.457 1.00 61.43 N ATOM 0 H ASN A 579 0.185 -26.037 13.259 1.00 64.14 H new ATOM 0 HA ASN A 579 2.112 -24.205 14.466 1.00 52.51 H new ATOM 0 HB2 ASN A 579 0.012 -23.206 13.839 1.00 62.41 H new ATOM 0 HB3 ASN A 579 -0.913 -24.515 14.548 1.00 62.41 H new ATOM 0 HD21 ASN A 579 1.180 -22.262 17.335 1.00 61.43 H new ATOM 0 HD22 ASN A 579 1.961 -23.001 15.934 1.00 61.43 H new ATOM 574 N VAL A 580 2.336 -25.298 16.693 1.00 23.03 N ATOM 575 CA VAL A 580 2.537 -25.960 17.971 1.00 14.02 C ATOM 576 C VAL A 580 2.049 -25.045 19.097 1.00 62.15 C ATOM 577 O VAL A 580 2.418 -23.873 19.152 1.00 23.03 O ATOM 578 CB VAL A 580 4.003 -26.368 18.125 1.00 2.22 C ATOM 579 CG1 VAL A 580 4.158 -27.473 19.172 1.00 41.03 C ATOM 580 CG2 VAL A 580 4.597 -26.797 16.782 1.00 73.41 C ATOM 0 H VAL A 580 3.046 -24.606 16.455 1.00 23.03 H new ATOM 0 HA VAL A 580 1.952 -26.878 18.021 1.00 14.02 H new ATOM 0 HB VAL A 580 4.558 -25.497 18.473 1.00 2.22 H new ATOM 0 HG11 VAL A 580 5.210 -27.744 19.262 1.00 41.03 H new ATOM 0 HG12 VAL A 580 3.792 -27.116 20.135 1.00 41.03 H new ATOM 0 HG13 VAL A 580 3.583 -28.347 18.867 1.00 41.03 H new ATOM 0 HG21 VAL A 580 5.640 -27.082 16.920 1.00 73.41 H new ATOM 0 HG22 VAL A 580 4.037 -27.647 16.391 1.00 73.41 H new ATOM 0 HG23 VAL A 580 4.538 -25.968 16.076 1.00 73.41 H new ATOM 590 N ASN A 581 1.227 -25.615 19.965 1.00 24.24 N ATOM 591 CA ASN A 581 0.686 -24.866 21.086 1.00 13.41 C ATOM 592 C ASN A 581 -0.297 -25.749 21.857 1.00 13.33 C ATOM 593 O ASN A 581 -1.046 -26.519 21.259 1.00 74.12 O ATOM 594 CB ASN A 581 -0.070 -23.625 20.605 1.00 21.33 C ATOM 595 CG ASN A 581 -0.051 -22.525 21.668 1.00 22.14 C ATOM 596 OD1 ASN A 581 0.878 -21.740 21.770 1.00 54.03 O ATOM 597 ND2 ASN A 581 -1.125 -22.512 22.453 1.00 64.21 N ATOM 0 H ASN A 581 0.922 -26.587 19.915 1.00 24.24 H new ATOM 0 HA ASN A 581 1.518 -24.559 21.720 1.00 13.41 H new ATOM 0 HB2 ASN A 581 0.381 -23.254 19.685 1.00 21.33 H new ATOM 0 HB3 ASN A 581 -1.101 -23.891 20.370 1.00 21.33 H new ATOM 0 HD21 ASN A 581 -1.207 -21.816 23.194 1.00 64.21 H new ATOM 0 HD22 ASN A 581 -1.867 -23.198 22.314 1.00 64.21 H new ATOM 604 N PRO A 582 -0.262 -25.604 23.209 1.00 1.50 N ATOM 605 CA PRO A 582 -1.140 -26.379 24.068 1.00 14.33 C ATOM 606 C PRO A 582 -2.573 -25.844 24.014 1.00 41.23 C ATOM 607 O PRO A 582 -3.527 -26.618 23.951 1.00 25.14 O ATOM 608 CB PRO A 582 -0.522 -26.281 25.453 1.00 33.25 C ATOM 609 CG PRO A 582 0.411 -25.082 25.410 1.00 60.20 C ATOM 610 CD PRO A 582 0.612 -24.701 23.953 1.00 42.25 C ATOM 0 HA PRO A 582 -1.222 -27.420 23.755 1.00 14.33 H new ATOM 0 HB2 PRO A 582 -1.290 -26.151 26.215 1.00 33.25 H new ATOM 0 HB3 PRO A 582 0.023 -27.191 25.703 1.00 33.25 H new ATOM 0 HG2 PRO A 582 -0.014 -24.247 25.968 1.00 60.20 H new ATOM 0 HG3 PRO A 582 1.366 -25.324 25.877 1.00 60.20 H new ATOM 0 HD2 PRO A 582 0.347 -23.659 23.776 1.00 42.25 H new ATOM 0 HD3 PRO A 582 1.653 -24.821 23.652 1.00 42.25 H new ATOM 618 N ASN A 583 -2.679 -24.523 24.039 1.00 63.31 N ATOM 619 CA ASN A 583 -3.979 -23.876 23.993 1.00 43.31 C ATOM 620 C ASN A 583 -4.705 -24.291 22.712 1.00 52.41 C ATOM 621 O ASN A 583 -5.918 -24.121 22.599 1.00 12.22 O ATOM 622 CB ASN A 583 -3.835 -22.353 23.983 1.00 51.42 C ATOM 623 CG ASN A 583 -2.737 -21.899 24.947 1.00 52.10 C ATOM 624 OD1 ASN A 583 -2.261 -22.649 25.783 1.00 4.31 O ATOM 625 ND2 ASN A 583 -2.364 -20.633 24.785 1.00 40.25 N ATOM 0 H ASN A 583 -1.886 -23.884 24.091 1.00 63.31 H new ATOM 0 HA ASN A 583 -4.539 -24.180 24.877 1.00 43.31 H new ATOM 0 HB2 ASN A 583 -3.601 -22.013 22.974 1.00 51.42 H new ATOM 0 HB3 ASN A 583 -4.783 -21.893 24.263 1.00 51.42 H new ATOM 0 HD21 ASN A 583 -1.638 -20.235 25.381 1.00 40.25 H new ATOM 0 HD22 ASN A 583 -2.804 -20.060 24.065 1.00 40.25 H new ATOM 632 N PHE A 584 -3.933 -24.827 21.779 1.00 44.35 N ATOM 633 CA PHE A 584 -4.487 -25.267 20.510 1.00 75.11 C ATOM 634 C PHE A 584 -5.485 -26.409 20.715 1.00 54.24 C ATOM 635 O PHE A 584 -6.466 -26.520 19.981 1.00 53.32 O ATOM 636 CB PHE A 584 -3.319 -25.773 19.662 1.00 23.22 C ATOM 637 CG PHE A 584 -3.454 -25.466 18.169 1.00 21.14 C ATOM 638 CD1 PHE A 584 -3.518 -24.176 17.744 1.00 61.15 C ATOM 639 CD2 PHE A 584 -3.510 -26.483 17.268 1.00 31.33 C ATOM 640 CE1 PHE A 584 -3.643 -23.891 16.358 1.00 33.21 C ATOM 641 CE2 PHE A 584 -3.636 -26.198 15.883 1.00 65.31 C ATOM 642 CZ PHE A 584 -3.699 -24.908 15.457 1.00 75.30 C ATOM 0 H PHE A 584 -2.927 -24.967 21.876 1.00 44.35 H new ATOM 0 HA PHE A 584 -5.012 -24.442 20.028 1.00 75.11 H new ATOM 0 HB2 PHE A 584 -2.395 -25.328 20.032 1.00 23.22 H new ATOM 0 HB3 PHE A 584 -3.228 -26.851 19.794 1.00 23.22 H new ATOM 0 HD1 PHE A 584 -3.474 -23.368 18.460 1.00 61.15 H new ATOM 0 HD2 PHE A 584 -3.459 -27.507 17.606 1.00 31.33 H new ATOM 0 HE1 PHE A 584 -3.694 -22.867 16.020 1.00 33.21 H new ATOM 0 HE2 PHE A 584 -3.682 -27.006 15.168 1.00 65.31 H new ATOM 0 HZ PHE A 584 -3.793 -24.691 14.403 1.00 75.30 H new ATOM 652 N SER A 585 -5.201 -27.229 21.716 1.00 45.43 N ATOM 653 CA SER A 585 -6.061 -28.358 22.026 1.00 2.32 C ATOM 654 C SER A 585 -7.467 -27.864 22.373 1.00 60.41 C ATOM 655 O SER A 585 -8.448 -28.575 22.159 1.00 12.24 O ATOM 656 CB SER A 585 -5.489 -29.185 23.179 1.00 11.25 C ATOM 657 OG SER A 585 -6.326 -30.290 23.510 1.00 13.54 O ATOM 0 H SER A 585 -4.387 -27.134 22.323 1.00 45.43 H new ATOM 0 HA SER A 585 -6.115 -29.000 21.146 1.00 2.32 H new ATOM 0 HB2 SER A 585 -4.498 -29.549 22.907 1.00 11.25 H new ATOM 0 HB3 SER A 585 -5.365 -28.549 24.055 1.00 11.25 H new ATOM 0 HG SER A 585 -5.926 -30.794 24.249 1.00 13.54 H new ATOM 663 N ASN A 586 -7.520 -26.651 22.902 1.00 40.21 N ATOM 664 CA ASN A 586 -8.790 -26.054 23.280 1.00 23.12 C ATOM 665 C ASN A 586 -9.392 -25.338 22.070 1.00 13.20 C ATOM 666 O ASN A 586 -10.532 -24.878 22.120 1.00 32.33 O ATOM 667 CB ASN A 586 -8.603 -25.023 24.395 1.00 33.33 C ATOM 668 CG ASN A 586 -8.683 -25.685 25.773 1.00 52.25 C ATOM 669 OD1 ASN A 586 -9.749 -25.899 26.326 1.00 11.53 O ATOM 670 ND2 ASN A 586 -7.499 -25.996 26.293 1.00 54.13 N ATOM 0 H ASN A 586 -6.704 -26.065 23.078 1.00 40.21 H new ATOM 0 HA ASN A 586 -9.446 -26.850 23.631 1.00 23.12 H new ATOM 0 HB2 ASN A 586 -7.638 -24.529 24.280 1.00 33.33 H new ATOM 0 HB3 ASN A 586 -9.368 -24.251 24.313 1.00 33.33 H new ATOM 0 HD21 ASN A 586 -7.445 -26.442 27.209 1.00 54.13 H new ATOM 0 HD22 ASN A 586 -6.645 -25.789 25.776 1.00 54.13 H new ATOM 677 N TYR A 587 -8.600 -25.265 21.011 1.00 41.03 N ATOM 678 CA TYR A 587 -9.041 -24.612 19.790 1.00 60.44 C ATOM 679 C TYR A 587 -9.456 -25.642 18.737 1.00 51.03 C ATOM 680 O TYR A 587 -9.852 -25.279 17.630 1.00 14.45 O ATOM 681 CB TYR A 587 -7.834 -23.828 19.271 1.00 61.41 C ATOM 682 CG TYR A 587 -7.742 -22.400 19.810 1.00 45.41 C ATOM 683 CD1 TYR A 587 -8.872 -21.610 19.868 1.00 2.51 C ATOM 684 CD2 TYR A 587 -6.528 -21.901 20.238 1.00 12.40 C ATOM 685 CE1 TYR A 587 -8.785 -20.265 20.376 1.00 41.35 C ATOM 686 CE2 TYR A 587 -6.441 -20.556 20.745 1.00 13.34 C ATOM 687 CZ TYR A 587 -7.574 -19.804 20.789 1.00 21.21 C ATOM 688 OH TYR A 587 -7.492 -18.534 21.268 1.00 21.03 O ATOM 0 H TYR A 587 -7.655 -25.647 20.973 1.00 41.03 H new ATOM 0 HA TYR A 587 -9.902 -23.973 19.986 1.00 60.44 H new ATOM 0 HB2 TYR A 587 -6.923 -24.365 19.536 1.00 61.41 H new ATOM 0 HB3 TYR A 587 -7.877 -23.793 18.182 1.00 61.41 H new ATOM 0 HD1 TYR A 587 -9.822 -22.000 19.533 1.00 2.51 H new ATOM 0 HD2 TYR A 587 -5.644 -22.519 20.193 1.00 12.40 H new ATOM 0 HE1 TYR A 587 -9.662 -19.637 20.428 1.00 41.35 H new ATOM 0 HE2 TYR A 587 -5.498 -20.153 21.083 1.00 13.34 H new ATOM 0 HH TYR A 587 -7.465 -17.903 20.519 1.00 21.03 H new ATOM 698 N TYR A 588 -9.351 -26.906 19.118 1.00 20.41 N ATOM 699 CA TYR A 588 -9.711 -27.991 18.221 1.00 65.23 C ATOM 700 C TYR A 588 -9.931 -29.293 18.994 1.00 12.44 C ATOM 701 O TYR A 588 -9.440 -29.446 20.111 1.00 3.25 O ATOM 702 CB TYR A 588 -8.520 -28.169 17.276 1.00 53.00 C ATOM 703 CG TYR A 588 -7.390 -29.024 17.853 1.00 11.51 C ATOM 704 CD1 TYR A 588 -7.581 -30.375 18.056 1.00 73.23 C ATOM 705 CD2 TYR A 588 -6.179 -28.443 18.171 1.00 11.31 C ATOM 706 CE1 TYR A 588 -6.518 -31.179 18.599 1.00 64.52 C ATOM 707 CE2 TYR A 588 -5.115 -29.247 18.714 1.00 13.03 C ATOM 708 CZ TYR A 588 -5.337 -30.576 18.901 1.00 11.34 C ATOM 709 OH TYR A 588 -4.332 -31.335 19.414 1.00 34.34 O ATOM 0 H TYR A 588 -9.022 -27.204 20.036 1.00 20.41 H new ATOM 0 HA TYR A 588 -10.635 -27.760 17.692 1.00 65.23 H new ATOM 0 HB2 TYR A 588 -8.869 -28.624 16.349 1.00 53.00 H new ATOM 0 HB3 TYR A 588 -8.124 -27.187 17.019 1.00 53.00 H new ATOM 0 HD1 TYR A 588 -8.529 -30.830 17.807 1.00 73.23 H new ATOM 0 HD2 TYR A 588 -6.029 -27.385 18.013 1.00 11.31 H new ATOM 0 HE1 TYR A 588 -6.655 -32.238 18.763 1.00 64.52 H new ATOM 0 HE2 TYR A 588 -4.163 -28.805 18.967 1.00 13.03 H new ATOM 0 HH TYR A 588 -3.548 -30.771 19.580 1.00 34.34 H new ATOM 719 N ASN A 589 -10.671 -30.197 18.369 1.00 22.05 N ATOM 720 CA ASN A 589 -10.963 -31.480 18.985 1.00 25.43 C ATOM 721 C ASN A 589 -10.712 -32.597 17.970 1.00 71.11 C ATOM 722 O ASN A 589 -11.368 -32.655 16.931 1.00 35.12 O ATOM 723 CB ASN A 589 -12.426 -31.560 19.425 1.00 62.41 C ATOM 724 CG ASN A 589 -12.871 -30.255 20.088 1.00 74.34 C ATOM 725 OD1 ASN A 589 -12.835 -30.099 21.297 1.00 44.10 O ATOM 726 ND2 ASN A 589 -13.293 -29.330 19.231 1.00 74.05 N ATOM 0 H ASN A 589 -11.077 -30.066 17.442 1.00 22.05 H new ATOM 0 HA ASN A 589 -10.318 -31.590 19.857 1.00 25.43 H new ATOM 0 HB2 ASN A 589 -13.058 -31.768 18.562 1.00 62.41 H new ATOM 0 HB3 ASN A 589 -12.555 -32.388 20.121 1.00 62.41 H new ATOM 0 HD21 ASN A 589 -13.613 -28.424 19.575 1.00 74.05 H new ATOM 0 HD22 ASN A 589 -13.297 -29.526 18.230 1.00 74.05 H new ATOM 733 N VAL A 590 -9.761 -33.456 18.306 1.00 72.33 N ATOM 734 CA VAL A 590 -9.416 -34.568 17.436 1.00 21.11 C ATOM 735 C VAL A 590 -10.532 -35.614 17.485 1.00 40.53 C ATOM 736 O VAL A 590 -11.107 -35.864 18.543 1.00 52.13 O ATOM 737 CB VAL A 590 -8.049 -35.134 17.828 1.00 53.14 C ATOM 738 CG1 VAL A 590 -7.863 -36.548 17.275 1.00 21.31 C ATOM 739 CG2 VAL A 590 -6.921 -34.211 17.364 1.00 4.21 C ATOM 0 H VAL A 590 -9.219 -33.405 19.168 1.00 72.33 H new ATOM 0 HA VAL A 590 -9.330 -34.232 16.403 1.00 21.11 H new ATOM 0 HB VAL A 590 -8.009 -35.192 18.916 1.00 53.14 H new ATOM 0 HG11 VAL A 590 -6.884 -36.927 17.568 1.00 21.31 H new ATOM 0 HG12 VAL A 590 -8.639 -37.200 17.675 1.00 21.31 H new ATOM 0 HG13 VAL A 590 -7.933 -36.526 16.187 1.00 21.31 H new ATOM 0 HG21 VAL A 590 -5.960 -34.636 17.655 1.00 4.21 H new ATOM 0 HG22 VAL A 590 -6.959 -34.107 16.280 1.00 4.21 H new ATOM 0 HG23 VAL A 590 -7.039 -33.231 17.826 1.00 4.21 H new ATOM 749 N SER A 591 -10.805 -36.196 16.326 1.00 4.32 N ATOM 750 CA SER A 591 -11.842 -37.208 16.223 1.00 25.43 C ATOM 751 C SER A 591 -11.640 -38.275 17.302 1.00 53.12 C ATOM 752 O SER A 591 -10.526 -38.473 17.784 1.00 71.24 O ATOM 753 CB SER A 591 -11.847 -37.852 14.835 1.00 12.22 C ATOM 754 OG SER A 591 -13.028 -38.616 14.606 1.00 63.40 O ATOM 0 H SER A 591 -10.326 -35.986 15.450 1.00 4.32 H new ATOM 0 HA SER A 591 -12.808 -36.725 16.374 1.00 25.43 H new ATOM 0 HB2 SER A 591 -11.764 -37.075 14.075 1.00 12.22 H new ATOM 0 HB3 SER A 591 -10.973 -38.495 14.730 1.00 12.22 H new ATOM 0 HG SER A 591 -12.994 -39.009 13.709 1.00 63.40 H new ATOM 760 N ARG A 592 -12.736 -38.934 17.649 1.00 11.41 N ATOM 761 CA ARG A 592 -12.694 -39.975 18.662 1.00 51.13 C ATOM 762 C ARG A 592 -11.613 -41.003 18.321 1.00 13.04 C ATOM 763 O ARG A 592 -10.635 -41.145 19.053 1.00 65.14 O ATOM 764 CB ARG A 592 -14.045 -40.684 18.778 1.00 24.44 C ATOM 765 CG ARG A 592 -15.164 -39.686 19.083 1.00 23.51 C ATOM 766 CD ARG A 592 -16.471 -40.411 19.409 1.00 21.54 C ATOM 767 NE ARG A 592 -17.152 -40.814 18.159 1.00 54.22 N ATOM 768 CZ ARG A 592 -17.778 -39.954 17.328 1.00 54.35 C ATOM 769 NH1 ARG A 592 -17.814 -38.634 17.608 1.00 54.42 N ATOM 770 NH2 ARG A 592 -18.355 -40.423 16.237 1.00 42.13 N ATOM 0 H ARG A 592 -13.658 -38.767 17.247 1.00 11.41 H new ATOM 0 HA ARG A 592 -12.462 -39.502 19.616 1.00 51.13 H new ATOM 0 HB2 ARG A 592 -14.265 -41.209 17.849 1.00 24.44 H new ATOM 0 HB3 ARG A 592 -13.999 -41.436 19.566 1.00 24.44 H new ATOM 0 HG2 ARG A 592 -14.874 -39.055 19.923 1.00 23.51 H new ATOM 0 HG3 ARG A 592 -15.313 -39.028 18.227 1.00 23.51 H new ATOM 0 HD2 ARG A 592 -16.266 -41.290 20.021 1.00 21.54 H new ATOM 0 HD3 ARG A 592 -17.121 -39.760 19.994 1.00 21.54 H new ATOM 0 HE ARG A 592 -17.148 -41.803 17.910 1.00 54.22 H new ATOM 0 HH11 ARG A 592 -17.366 -38.279 18.453 1.00 54.42 H new ATOM 0 HH12 ARG A 592 -18.289 -37.991 16.975 1.00 54.42 H new ATOM 0 HH21 ARG A 592 -18.324 -41.422 16.033 1.00 42.13 H new ATOM 0 HH22 ARG A 592 -18.832 -39.787 15.599 1.00 42.13 H new ATOM 783 N ASP A 593 -11.827 -41.693 17.211 1.00 31.50 N ATOM 784 CA ASP A 593 -10.883 -42.704 16.765 1.00 74.31 C ATOM 785 C ASP A 593 -9.457 -42.189 16.968 1.00 31.21 C ATOM 786 O ASP A 593 -9.215 -40.985 16.913 1.00 5.44 O ATOM 787 CB ASP A 593 -11.068 -43.012 15.278 1.00 44.55 C ATOM 788 CG ASP A 593 -12.520 -43.041 14.798 1.00 34.14 C ATOM 789 OD1 ASP A 593 -13.459 -43.068 15.608 1.00 54.12 O ATOM 790 OD2 ASP A 593 -12.672 -43.036 13.517 1.00 11.14 O ATOM 0 H ASP A 593 -12.640 -41.572 16.607 1.00 31.50 H new ATOM 0 HA ASP A 593 -11.059 -43.610 17.345 1.00 74.31 H new ATOM 0 HB2 ASP A 593 -10.525 -42.266 14.698 1.00 44.55 H new ATOM 0 HB3 ASP A 593 -10.611 -43.978 15.063 1.00 44.55 H new ATOM 796 N PRO A 594 -8.526 -43.152 17.204 1.00 34.45 N ATOM 797 CA PRO A 594 -7.131 -42.809 17.416 1.00 3.51 C ATOM 798 C PRO A 594 -6.453 -42.429 16.098 1.00 54.03 C ATOM 799 O PRO A 594 -6.156 -41.259 15.863 1.00 54.33 O ATOM 800 CB PRO A 594 -6.517 -44.037 18.067 1.00 71.51 C ATOM 801 CG PRO A 594 -7.470 -45.185 17.773 1.00 51.42 C ATOM 802 CD PRO A 594 -8.777 -44.589 17.276 1.00 13.22 C ATOM 0 HA PRO A 594 -7.006 -41.933 18.053 1.00 3.51 H new ATOM 0 HB2 PRO A 594 -5.525 -44.239 17.662 1.00 71.51 H new ATOM 0 HB3 PRO A 594 -6.399 -43.892 19.141 1.00 71.51 H new ATOM 0 HG2 PRO A 594 -7.045 -45.852 17.023 1.00 51.42 H new ATOM 0 HG3 PRO A 594 -7.639 -45.781 18.670 1.00 51.42 H new ATOM 0 HD2 PRO A 594 -9.051 -44.992 16.301 1.00 13.22 H new ATOM 0 HD3 PRO A 594 -9.599 -44.814 17.956 1.00 13.22 H new ATOM 810 N VAL A 595 -6.229 -43.440 15.272 1.00 71.50 N ATOM 811 CA VAL A 595 -5.593 -43.228 13.983 1.00 4.52 C ATOM 812 C VAL A 595 -6.466 -43.832 12.882 1.00 40.32 C ATOM 813 O VAL A 595 -6.746 -45.029 12.894 1.00 70.43 O ATOM 814 CB VAL A 595 -4.173 -43.797 14.000 1.00 23.43 C ATOM 815 CG1 VAL A 595 -3.573 -43.816 12.593 1.00 25.22 C ATOM 816 CG2 VAL A 595 -3.280 -43.016 14.967 1.00 72.41 C ATOM 0 H VAL A 595 -6.477 -44.409 15.471 1.00 71.50 H new ATOM 0 HA VAL A 595 -5.499 -42.162 13.775 1.00 4.52 H new ATOM 0 HB VAL A 595 -4.229 -44.826 14.354 1.00 23.43 H new ATOM 0 HG11 VAL A 595 -2.563 -44.225 12.633 1.00 25.22 H new ATOM 0 HG12 VAL A 595 -4.190 -44.436 11.943 1.00 25.22 H new ATOM 0 HG13 VAL A 595 -3.537 -42.800 12.199 1.00 25.22 H new ATOM 0 HG21 VAL A 595 -2.276 -43.441 14.960 1.00 72.41 H new ATOM 0 HG22 VAL A 595 -3.234 -41.972 14.657 1.00 72.41 H new ATOM 0 HG23 VAL A 595 -3.693 -43.078 15.974 1.00 72.41 H new ATOM 826 N VAL A 596 -6.872 -42.975 11.956 1.00 31.22 N ATOM 827 CA VAL A 596 -7.708 -43.409 10.850 1.00 61.52 C ATOM 828 C VAL A 596 -7.188 -42.791 9.550 1.00 33.14 C ATOM 829 O VAL A 596 -7.589 -41.689 9.180 1.00 44.32 O ATOM 830 CB VAL A 596 -9.171 -43.064 11.133 1.00 74.33 C ATOM 831 CG1 VAL A 596 -10.112 -43.961 10.325 1.00 11.21 C ATOM 832 CG2 VAL A 596 -9.477 -43.156 12.629 1.00 1.21 C ATOM 0 H VAL A 596 -6.637 -41.982 11.949 1.00 31.22 H new ATOM 0 HA VAL A 596 -7.660 -44.492 10.737 1.00 61.52 H new ATOM 0 HB VAL A 596 -9.339 -42.034 10.820 1.00 74.33 H new ATOM 0 HG11 VAL A 596 -11.146 -43.695 10.545 1.00 11.21 H new ATOM 0 HG12 VAL A 596 -9.920 -43.824 9.261 1.00 11.21 H new ATOM 0 HG13 VAL A 596 -9.941 -45.003 10.593 1.00 11.21 H new ATOM 0 HG21 VAL A 596 -10.524 -42.906 12.802 1.00 1.21 H new ATOM 0 HG22 VAL A 596 -9.284 -44.170 12.978 1.00 1.21 H new ATOM 0 HG23 VAL A 596 -8.842 -42.457 13.174 1.00 1.21 H new ATOM 842 N ILE A 597 -6.304 -43.528 8.894 1.00 73.10 N ATOM 843 CA ILE A 597 -5.726 -43.066 7.644 1.00 43.12 C ATOM 844 C ILE A 597 -5.668 -44.230 6.653 1.00 43.04 C ATOM 845 O ILE A 597 -5.814 -45.388 7.040 1.00 30.14 O ATOM 846 CB ILE A 597 -4.370 -42.403 7.894 1.00 44.13 C ATOM 847 CG1 ILE A 597 -4.527 -41.130 8.728 1.00 31.23 C ATOM 848 CG2 ILE A 597 -3.638 -42.138 6.576 1.00 1.25 C ATOM 849 CD1 ILE A 597 -4.759 -39.912 7.832 1.00 64.01 C ATOM 0 H ILE A 597 -5.974 -44.442 9.205 1.00 73.10 H new ATOM 0 HA ILE A 597 -6.354 -42.296 7.195 1.00 43.12 H new ATOM 0 HB ILE A 597 -3.754 -43.092 8.472 1.00 44.13 H new ATOM 0 HG12 ILE A 597 -5.364 -41.244 9.417 1.00 31.23 H new ATOM 0 HG13 ILE A 597 -3.634 -40.975 9.334 1.00 31.23 H new ATOM 0 HG21 ILE A 597 -2.677 -41.666 6.782 1.00 1.25 H new ATOM 0 HG22 ILE A 597 -3.475 -43.081 6.054 1.00 1.25 H new ATOM 0 HG23 ILE A 597 -4.240 -41.478 5.952 1.00 1.25 H new ATOM 0 HD11 ILE A 597 -4.867 -39.021 8.450 1.00 64.01 H new ATOM 0 HD12 ILE A 597 -3.909 -39.787 7.161 1.00 64.01 H new ATOM 0 HD13 ILE A 597 -5.666 -40.059 7.246 1.00 64.01 H new ATOM 861 N ASN A 598 -5.454 -43.882 5.392 1.00 21.02 N ATOM 862 CA ASN A 598 -5.375 -44.884 4.342 1.00 2.44 C ATOM 863 C ASN A 598 -3.907 -45.230 4.084 1.00 72.23 C ATOM 864 O ASN A 598 -3.542 -46.404 4.037 1.00 2.31 O ATOM 865 CB ASN A 598 -5.974 -44.360 3.036 1.00 74.32 C ATOM 866 CG ASN A 598 -5.453 -42.958 2.716 1.00 15.33 C ATOM 867 OD1 ASN A 598 -4.434 -42.778 2.071 1.00 62.11 O ATOM 868 ND2 ASN A 598 -6.208 -41.977 3.203 1.00 51.42 N ATOM 0 H ASN A 598 -5.333 -42.920 5.074 1.00 21.02 H new ATOM 0 HA ASN A 598 -5.934 -45.761 4.669 1.00 2.44 H new ATOM 0 HB2 ASN A 598 -5.726 -45.039 2.220 1.00 74.32 H new ATOM 0 HB3 ASN A 598 -7.061 -44.339 3.113 1.00 74.32 H new ATOM 0 HD21 ASN A 598 -5.945 -41.004 3.044 1.00 51.42 H new ATOM 0 HD22 ASN A 598 -7.050 -42.197 3.735 1.00 51.42 H new ATOM 875 N LYS A 599 -3.106 -44.188 3.922 1.00 2.44 N ATOM 876 CA LYS A 599 -1.686 -44.367 3.670 1.00 71.04 C ATOM 877 C LYS A 599 -0.897 -43.986 4.924 1.00 71.31 C ATOM 878 O LYS A 599 -1.241 -43.025 5.610 1.00 32.21 O ATOM 879 CB LYS A 599 -1.263 -43.594 2.419 1.00 62.43 C ATOM 880 CG LYS A 599 0.261 -43.539 2.298 1.00 65.20 C ATOM 881 CD LYS A 599 0.833 -42.370 3.103 1.00 61.05 C ATOM 882 CE LYS A 599 2.152 -41.883 2.500 1.00 43.12 C ATOM 883 NZ LYS A 599 2.888 -43.010 1.884 1.00 2.31 N ATOM 0 H LYS A 599 -3.413 -43.216 3.960 1.00 2.44 H new ATOM 0 HA LYS A 599 -1.465 -45.414 3.461 1.00 71.04 H new ATOM 0 HB2 LYS A 599 -1.685 -44.069 1.533 1.00 62.43 H new ATOM 0 HB3 LYS A 599 -1.665 -42.582 2.459 1.00 62.43 H new ATOM 0 HG2 LYS A 599 0.692 -44.475 2.653 1.00 65.20 H new ATOM 0 HG3 LYS A 599 0.543 -43.436 1.250 1.00 65.20 H new ATOM 0 HD2 LYS A 599 0.114 -41.551 3.123 1.00 61.05 H new ATOM 0 HD3 LYS A 599 0.993 -42.679 4.136 1.00 61.05 H new ATOM 0 HE2 LYS A 599 1.955 -41.117 1.750 1.00 43.12 H new ATOM 0 HE3 LYS A 599 2.764 -41.421 3.275 1.00 43.12 H new ATOM 0 HZ1 LYS A 599 3.900 -42.777 1.834 1.00 2.31 H new ATOM 0 HZ2 LYS A 599 2.758 -43.866 2.460 1.00 2.31 H new ATOM 0 HZ3 LYS A 599 2.524 -43.180 0.925 1.00 2.31 H new ATOM 896 N VAL A 600 0.146 -44.760 5.185 1.00 3.24 N ATOM 897 CA VAL A 600 0.987 -44.516 6.345 1.00 10.31 C ATOM 898 C VAL A 600 2.300 -43.875 5.892 1.00 64.13 C ATOM 899 O VAL A 600 2.738 -44.082 4.761 1.00 40.41 O ATOM 900 CB VAL A 600 1.194 -45.816 7.124 1.00 32.05 C ATOM 901 CG1 VAL A 600 1.866 -45.546 8.472 1.00 20.41 C ATOM 902 CG2 VAL A 600 -0.130 -46.560 7.311 1.00 51.10 C ATOM 0 H VAL A 600 0.428 -45.556 4.613 1.00 3.24 H new ATOM 0 HA VAL A 600 0.503 -43.817 7.027 1.00 10.31 H new ATOM 0 HB VAL A 600 1.857 -46.454 6.540 1.00 32.05 H new ATOM 0 HG11 VAL A 600 2.002 -46.487 9.006 1.00 20.41 H new ATOM 0 HG12 VAL A 600 2.837 -45.079 8.307 1.00 20.41 H new ATOM 0 HG13 VAL A 600 1.239 -44.880 9.064 1.00 20.41 H new ATOM 0 HG21 VAL A 600 0.045 -47.481 7.868 1.00 51.10 H new ATOM 0 HG22 VAL A 600 -0.827 -45.929 7.863 1.00 51.10 H new ATOM 0 HG23 VAL A 600 -0.553 -46.801 6.336 1.00 51.10 H new ATOM 912 N PHE A 601 2.892 -43.110 6.797 1.00 23.54 N ATOM 913 CA PHE A 601 4.147 -42.438 6.505 1.00 71.32 C ATOM 914 C PHE A 601 5.247 -42.885 7.470 1.00 34.22 C ATOM 915 O PHE A 601 4.966 -43.524 8.483 1.00 2.24 O ATOM 916 CB PHE A 601 3.904 -40.939 6.686 1.00 12.23 C ATOM 917 CG PHE A 601 2.798 -40.375 5.792 1.00 51.12 C ATOM 918 CD1 PHE A 601 1.495 -40.653 6.064 1.00 71.50 C ATOM 919 CD2 PHE A 601 3.118 -39.595 4.725 1.00 60.05 C ATOM 920 CE1 PHE A 601 0.469 -40.130 5.234 1.00 74.12 C ATOM 921 CE2 PHE A 601 2.092 -39.072 3.894 1.00 13.34 C ATOM 922 CZ PHE A 601 0.789 -39.350 4.167 1.00 73.24 C ATOM 0 H PHE A 601 2.526 -42.940 7.734 1.00 23.54 H new ATOM 0 HA PHE A 601 4.471 -42.679 5.492 1.00 71.32 H new ATOM 0 HB2 PHE A 601 3.648 -40.746 7.728 1.00 12.23 H new ATOM 0 HB3 PHE A 601 4.831 -40.404 6.481 1.00 12.23 H new ATOM 0 HD1 PHE A 601 1.241 -41.272 6.912 1.00 71.50 H new ATOM 0 HD2 PHE A 601 4.153 -39.373 4.509 1.00 60.05 H new ATOM 0 HE1 PHE A 601 -0.566 -40.352 5.450 1.00 74.12 H new ATOM 0 HE2 PHE A 601 2.346 -38.454 3.046 1.00 13.34 H new ATOM 0 HZ PHE A 601 0.008 -38.951 3.536 1.00 73.24 H new ATOM 932 N LYS A 602 6.475 -42.532 7.122 1.00 41.12 N ATOM 933 CA LYS A 602 7.618 -42.889 7.945 1.00 42.42 C ATOM 934 C LYS A 602 8.133 -41.640 8.664 1.00 35.13 C ATOM 935 O LYS A 602 8.289 -41.642 9.884 1.00 32.54 O ATOM 936 CB LYS A 602 8.683 -43.597 7.105 1.00 50.22 C ATOM 937 CG LYS A 602 8.154 -44.922 6.553 1.00 71.12 C ATOM 938 CD LYS A 602 7.354 -44.700 5.268 1.00 75.32 C ATOM 939 CE LYS A 602 8.054 -45.341 4.068 1.00 20.42 C ATOM 940 NZ LYS A 602 7.087 -45.593 2.977 1.00 75.12 N ATOM 0 H LYS A 602 6.704 -42.002 6.281 1.00 41.12 H new ATOM 0 HA LYS A 602 7.325 -43.603 8.715 1.00 42.42 H new ATOM 0 HB2 LYS A 602 8.990 -42.952 6.281 1.00 50.22 H new ATOM 0 HB3 LYS A 602 9.569 -43.780 7.713 1.00 50.22 H new ATOM 0 HG2 LYS A 602 8.987 -45.596 6.355 1.00 71.12 H new ATOM 0 HG3 LYS A 602 7.523 -45.405 7.299 1.00 71.12 H new ATOM 0 HD2 LYS A 602 6.356 -45.123 5.379 1.00 75.32 H new ATOM 0 HD3 LYS A 602 7.230 -43.631 5.093 1.00 75.32 H new ATOM 0 HE2 LYS A 602 8.850 -44.687 3.712 1.00 20.42 H new ATOM 0 HE3 LYS A 602 8.522 -46.278 4.370 1.00 20.42 H new ATOM 0 HZ1 LYS A 602 7.579 -46.028 2.171 1.00 75.12 H new ATOM 0 HZ2 LYS A 602 6.342 -46.235 3.315 1.00 75.12 H new ATOM 0 HZ3 LYS A 602 6.660 -44.693 2.677 1.00 75.12 H new ATOM 953 N ASP A 603 8.381 -40.603 7.878 1.00 65.31 N ATOM 954 CA ASP A 603 8.875 -39.351 8.425 1.00 51.34 C ATOM 955 C ASP A 603 8.153 -39.054 9.741 1.00 70.14 C ATOM 956 O ASP A 603 8.774 -38.618 10.709 1.00 72.32 O ATOM 957 CB ASP A 603 8.608 -38.188 7.466 1.00 31.34 C ATOM 958 CG ASP A 603 9.551 -38.112 6.264 1.00 1.42 C ATOM 959 OD1 ASP A 603 10.779 -38.200 6.409 1.00 4.04 O ATOM 960 OD2 ASP A 603 8.969 -37.952 5.124 1.00 2.31 O ATOM 0 H ASP A 603 8.249 -40.604 6.867 1.00 65.31 H new ATOM 0 HA ASP A 603 9.949 -39.451 8.581 1.00 51.34 H new ATOM 0 HB2 ASP A 603 7.584 -38.266 7.101 1.00 31.34 H new ATOM 0 HB3 ASP A 603 8.678 -37.254 8.023 1.00 31.34 H new ATOM 966 N TRP A 604 6.851 -39.302 9.733 1.00 25.14 N ATOM 967 CA TRP A 604 6.038 -39.067 10.914 1.00 23.05 C ATOM 968 C TRP A 604 4.787 -39.941 10.809 1.00 62.42 C ATOM 969 O TRP A 604 4.482 -40.468 9.740 1.00 62.20 O ATOM 970 CB TRP A 604 5.717 -37.580 11.071 1.00 14.44 C ATOM 971 CG TRP A 604 4.875 -37.001 9.932 1.00 62.32 C ATOM 972 CD1 TRP A 604 4.498 -37.605 8.797 1.00 54.14 C ATOM 973 CD2 TRP A 604 4.319 -35.671 9.863 1.00 33.41 C ATOM 974 NE1 TRP A 604 3.742 -36.765 8.004 1.00 14.14 N ATOM 975 CE2 TRP A 604 3.629 -35.552 8.674 1.00 43.23 C ATOM 976 CE3 TRP A 604 4.395 -34.605 10.776 1.00 2.11 C ATOM 977 CZ2 TRP A 604 2.964 -34.382 8.288 1.00 71.24 C ATOM 978 CZ3 TRP A 604 3.725 -33.443 10.375 1.00 11.23 C ATOM 979 CH2 TRP A 604 3.027 -33.306 9.181 1.00 34.43 C ATOM 0 H TRP A 604 6.340 -39.663 8.928 1.00 25.14 H new ATOM 0 HA TRP A 604 6.581 -39.344 11.817 1.00 23.05 H new ATOM 0 HB2 TRP A 604 5.188 -37.430 12.012 1.00 14.44 H new ATOM 0 HB3 TRP A 604 6.651 -37.022 11.138 1.00 14.44 H new ATOM 0 HD1 TRP A 604 4.753 -38.621 8.535 1.00 54.14 H new ATOM 0 HE1 TRP A 604 3.340 -36.992 7.094 1.00 14.14 H new ATOM 0 HE3 TRP A 604 4.928 -34.677 11.713 1.00 2.11 H new ATOM 0 HZ2 TRP A 604 2.431 -34.313 7.351 1.00 71.24 H new ATOM 0 HZ3 TRP A 604 3.752 -32.593 11.041 1.00 11.23 H new ATOM 0 HH2 TRP A 604 2.536 -32.374 8.943 1.00 34.43 H new ATOM 990 N LYS A 605 4.097 -40.069 11.932 1.00 13.33 N ATOM 991 CA LYS A 605 2.886 -40.870 11.980 1.00 74.24 C ATOM 992 C LYS A 605 1.668 -39.945 12.034 1.00 45.31 C ATOM 993 O LYS A 605 1.775 -38.797 12.463 1.00 25.13 O ATOM 994 CB LYS A 605 2.950 -41.870 13.136 1.00 73.33 C ATOM 995 CG LYS A 605 3.059 -41.148 14.480 1.00 4.11 C ATOM 996 CD LYS A 605 2.775 -42.103 15.641 1.00 61.53 C ATOM 997 CE LYS A 605 1.283 -42.125 15.980 1.00 24.12 C ATOM 998 NZ LYS A 605 1.014 -43.088 17.071 1.00 20.21 N ATOM 0 H LYS A 605 4.354 -39.631 12.817 1.00 13.33 H new ATOM 0 HA LYS A 605 2.791 -41.470 11.075 1.00 74.24 H new ATOM 0 HB2 LYS A 605 2.059 -42.498 13.128 1.00 73.33 H new ATOM 0 HB3 LYS A 605 3.807 -42.530 13.003 1.00 73.33 H new ATOM 0 HG2 LYS A 605 4.057 -40.724 14.589 1.00 4.11 H new ATOM 0 HG3 LYS A 605 2.355 -40.316 14.508 1.00 4.11 H new ATOM 0 HD2 LYS A 605 3.107 -43.108 15.380 1.00 61.53 H new ATOM 0 HD3 LYS A 605 3.346 -41.796 16.517 1.00 61.53 H new ATOM 0 HE2 LYS A 605 0.957 -41.128 16.278 1.00 24.12 H new ATOM 0 HE3 LYS A 605 0.707 -42.398 15.096 1.00 24.12 H new ATOM 0 HZ1 LYS A 605 -0.003 -43.091 17.289 1.00 20.21 H new ATOM 0 HZ2 LYS A 605 1.307 -44.040 16.773 1.00 20.21 H new ATOM 0 HZ3 LYS A 605 1.549 -42.811 17.919 1.00 20.21 H new ATOM 1011 N PRO A 606 0.509 -40.492 11.581 1.00 61.54 N ATOM 1012 CA PRO A 606 -0.727 -39.729 11.573 1.00 1.24 C ATOM 1013 C PRO A 606 -1.300 -39.600 12.986 1.00 1.42 C ATOM 1014 O PRO A 606 -0.771 -40.184 13.930 1.00 21.43 O ATOM 1015 CB PRO A 606 -1.648 -40.479 10.625 1.00 23.43 C ATOM 1016 CG PRO A 606 -1.065 -41.878 10.499 1.00 54.23 C ATOM 1017 CD PRO A 606 0.345 -41.848 11.065 1.00 71.43 C ATOM 0 HA PRO A 606 -0.585 -38.702 11.238 1.00 1.24 H new ATOM 0 HB2 PRO A 606 -2.666 -40.513 11.014 1.00 23.43 H new ATOM 0 HB3 PRO A 606 -1.695 -39.986 9.654 1.00 23.43 H new ATOM 0 HG2 PRO A 606 -1.679 -42.598 11.041 1.00 54.23 H new ATOM 0 HG3 PRO A 606 -1.051 -42.193 9.456 1.00 54.23 H new ATOM 0 HD2 PRO A 606 0.471 -42.590 11.854 1.00 71.43 H new ATOM 0 HD3 PRO A 606 1.085 -42.071 10.296 1.00 71.43 H new ATOM 1025 N GLY A 607 -2.374 -38.830 13.087 1.00 62.33 N ATOM 1026 CA GLY A 607 -3.024 -38.617 14.368 1.00 35.13 C ATOM 1027 C GLY A 607 -4.546 -38.695 14.230 1.00 33.24 C ATOM 1028 O GLY A 607 -5.121 -39.782 14.259 1.00 22.41 O ATOM 0 H GLY A 607 -2.810 -38.346 12.302 1.00 62.33 H new ATOM 0 HA2 GLY A 607 -2.681 -39.365 15.083 1.00 35.13 H new ATOM 0 HA3 GLY A 607 -2.741 -37.643 14.766 1.00 35.13 H new ATOM 1032 N GLY A 608 -5.156 -37.528 14.084 1.00 42.02 N ATOM 1033 CA GLY A 608 -6.600 -37.450 13.941 1.00 22.44 C ATOM 1034 C GLY A 608 -7.015 -36.139 13.272 1.00 51.21 C ATOM 1035 O GLY A 608 -6.362 -35.112 13.451 1.00 65.31 O ATOM 0 H GLY A 608 -4.676 -36.628 14.062 1.00 42.02 H new ATOM 0 HA2 GLY A 608 -6.956 -38.293 13.349 1.00 22.44 H new ATOM 0 HA3 GLY A 608 -7.071 -37.527 14.921 1.00 22.44 H new ATOM 1039 N VAL A 609 -8.100 -36.215 12.515 1.00 64.53 N ATOM 1040 CA VAL A 609 -8.610 -35.047 11.818 1.00 62.14 C ATOM 1041 C VAL A 609 -8.888 -33.935 12.831 1.00 34.21 C ATOM 1042 O VAL A 609 -9.646 -34.131 13.780 1.00 24.13 O ATOM 1043 CB VAL A 609 -9.841 -35.426 10.993 1.00 74.34 C ATOM 1044 CG1 VAL A 609 -10.353 -34.229 10.189 1.00 65.23 C ATOM 1045 CG2 VAL A 609 -9.543 -36.615 10.077 1.00 41.13 C ATOM 0 H VAL A 609 -8.640 -37.068 12.369 1.00 64.53 H new ATOM 0 HA VAL A 609 -7.869 -34.668 11.115 1.00 62.14 H new ATOM 0 HB VAL A 609 -10.628 -35.726 11.685 1.00 74.34 H new ATOM 0 HG11 VAL A 609 -11.228 -34.526 9.612 1.00 65.23 H new ATOM 0 HG12 VAL A 609 -10.624 -33.422 10.870 1.00 65.23 H new ATOM 0 HG13 VAL A 609 -9.572 -33.885 9.512 1.00 65.23 H new ATOM 0 HG21 VAL A 609 -10.435 -36.864 9.502 1.00 41.13 H new ATOM 0 HG22 VAL A 609 -8.733 -36.355 9.396 1.00 41.13 H new ATOM 0 HG23 VAL A 609 -9.249 -37.474 10.680 1.00 41.13 H new ATOM 1055 N ILE A 610 -8.261 -32.792 12.595 1.00 70.41 N ATOM 1056 CA ILE A 610 -8.432 -31.649 13.475 1.00 22.13 C ATOM 1057 C ILE A 610 -9.589 -30.787 12.966 1.00 23.10 C ATOM 1058 O ILE A 610 -9.790 -30.662 11.759 1.00 30.30 O ATOM 1059 CB ILE A 610 -7.114 -30.885 13.623 1.00 34.22 C ATOM 1060 CG1 ILE A 610 -5.916 -31.827 13.485 1.00 52.45 C ATOM 1061 CG2 ILE A 610 -7.079 -30.102 14.937 1.00 32.32 C ATOM 1062 CD1 ILE A 610 -4.631 -31.154 13.971 1.00 12.15 C ATOM 0 H ILE A 610 -7.634 -32.633 11.807 1.00 70.41 H new ATOM 0 HA ILE A 610 -8.698 -31.978 14.480 1.00 22.13 H new ATOM 0 HB ILE A 610 -7.047 -30.158 12.813 1.00 34.22 H new ATOM 0 HG12 ILE A 610 -6.095 -32.735 14.060 1.00 52.45 H new ATOM 0 HG13 ILE A 610 -5.802 -32.127 12.443 1.00 52.45 H new ATOM 0 HG21 ILE A 610 -6.132 -29.568 15.017 1.00 32.32 H new ATOM 0 HG22 ILE A 610 -7.901 -29.387 14.956 1.00 32.32 H new ATOM 0 HG23 ILE A 610 -7.179 -30.792 15.775 1.00 32.32 H new ATOM 0 HD11 ILE A 610 -3.795 -31.845 13.862 1.00 12.15 H new ATOM 0 HD12 ILE A 610 -4.442 -30.259 13.378 1.00 12.15 H new ATOM 0 HD13 ILE A 610 -4.739 -30.878 15.020 1.00 12.15 H new ATOM 1074 N SER A 611 -10.319 -30.214 13.912 1.00 62.52 N ATOM 1075 CA SER A 611 -11.450 -29.368 13.574 1.00 14.20 C ATOM 1076 C SER A 611 -11.469 -28.134 14.479 1.00 73.12 C ATOM 1077 O SER A 611 -11.311 -28.248 15.693 1.00 24.03 O ATOM 1078 CB SER A 611 -12.768 -30.135 13.695 1.00 32.35 C ATOM 1079 OG SER A 611 -12.651 -31.263 14.558 1.00 34.53 O ATOM 0 H SER A 611 -10.149 -30.319 14.912 1.00 62.52 H new ATOM 0 HA SER A 611 -11.341 -29.049 12.537 1.00 14.20 H new ATOM 0 HB2 SER A 611 -13.543 -29.468 14.073 1.00 32.35 H new ATOM 0 HB3 SER A 611 -13.087 -30.466 12.707 1.00 32.35 H new ATOM 0 HG SER A 611 -13.513 -31.725 14.611 1.00 34.53 H new ATOM 1085 N CYS A 612 -11.665 -26.983 13.852 1.00 23.23 N ATOM 1086 CA CYS A 612 -11.706 -25.729 14.586 1.00 75.53 C ATOM 1087 C CYS A 612 -12.856 -25.800 15.593 1.00 61.21 C ATOM 1088 O CYS A 612 -14.019 -25.902 15.207 1.00 52.35 O ATOM 1089 CB CYS A 612 -11.843 -24.529 13.647 1.00 75.33 C ATOM 1090 SG CYS A 612 -11.582 -22.901 14.440 1.00 42.14 S ATOM 0 H CYS A 612 -11.797 -26.892 12.845 1.00 23.23 H new ATOM 0 HA CYS A 612 -10.766 -25.585 15.119 1.00 75.53 H new ATOM 0 HB2 CYS A 612 -11.127 -24.639 12.832 1.00 75.33 H new ATOM 0 HB3 CYS A 612 -12.838 -24.545 13.202 1.00 75.33 H new ATOM 1095 N ARG A 613 -12.490 -25.744 16.865 1.00 1.20 N ATOM 1096 CA ARG A 613 -13.476 -25.800 17.931 1.00 70.23 C ATOM 1097 C ARG A 613 -14.281 -24.500 17.979 1.00 43.23 C ATOM 1098 O ARG A 613 -15.417 -24.486 18.450 1.00 41.33 O ATOM 1099 CB ARG A 613 -12.808 -26.029 19.288 1.00 42.21 C ATOM 1100 CG ARG A 613 -13.831 -25.950 20.423 1.00 62.20 C ATOM 1101 CD ARG A 613 -13.140 -25.993 21.788 1.00 71.34 C ATOM 1102 NE ARG A 613 -13.949 -26.787 22.740 1.00 53.55 N ATOM 1103 CZ ARG A 613 -13.760 -26.788 24.076 1.00 3.12 C ATOM 1104 NH1 ARG A 613 -12.785 -26.037 24.631 1.00 42.53 N ATOM 1105 NH2 ARG A 613 -14.542 -27.535 24.833 1.00 62.23 N ATOM 0 H ARG A 613 -11.524 -25.660 17.182 1.00 1.20 H new ATOM 0 HA ARG A 613 -14.143 -26.636 17.722 1.00 70.23 H new ATOM 0 HB2 ARG A 613 -12.323 -27.005 19.298 1.00 42.21 H new ATOM 0 HB3 ARG A 613 -12.028 -25.284 19.444 1.00 42.21 H new ATOM 0 HG2 ARG A 613 -14.409 -25.030 20.333 1.00 62.20 H new ATOM 0 HG3 ARG A 613 -14.535 -26.778 20.341 1.00 62.20 H new ATOM 0 HD2 ARG A 613 -12.147 -26.431 21.688 1.00 71.34 H new ATOM 0 HD3 ARG A 613 -13.005 -24.981 22.169 1.00 71.34 H new ATOM 0 HE ARG A 613 -14.696 -27.370 22.362 1.00 53.55 H new ATOM 0 HH11 ARG A 613 -12.184 -25.463 24.039 1.00 42.53 H new ATOM 0 HH12 ARG A 613 -12.649 -26.044 25.642 1.00 42.53 H new ATOM 0 HH21 ARG A 613 -15.276 -28.100 24.406 1.00 62.23 H new ATOM 0 HH22 ARG A 613 -14.412 -27.547 25.845 1.00 62.23 H new ATOM 1118 N ASN A 614 -13.660 -23.439 17.485 1.00 42.41 N ATOM 1119 CA ASN A 614 -14.304 -22.136 17.466 1.00 71.34 C ATOM 1120 C ASN A 614 -15.483 -22.170 16.491 1.00 41.32 C ATOM 1121 O ASN A 614 -16.486 -21.489 16.700 1.00 22.25 O ATOM 1122 CB ASN A 614 -13.335 -21.049 16.998 1.00 64.12 C ATOM 1123 CG ASN A 614 -12.223 -20.827 18.025 1.00 0.33 C ATOM 1124 OD1 ASN A 614 -12.386 -21.051 19.213 1.00 33.24 O ATOM 1125 ND2 ASN A 614 -11.087 -20.374 17.503 1.00 25.13 N ATOM 0 H ASN A 614 -12.718 -23.455 17.095 1.00 42.41 H new ATOM 0 HA ASN A 614 -14.637 -21.910 18.479 1.00 71.34 H new ATOM 0 HB2 ASN A 614 -12.899 -21.333 16.040 1.00 64.12 H new ATOM 0 HB3 ASN A 614 -13.878 -20.118 16.837 1.00 64.12 H new ATOM 0 HD21 ASN A 614 -10.285 -20.193 18.107 1.00 25.13 H new ATOM 0 HD22 ASN A 614 -11.018 -20.208 16.499 1.00 25.13 H new ATOM 1132 N CYS A 615 -15.323 -22.969 15.446 1.00 50.50 N ATOM 1133 CA CYS A 615 -16.362 -23.100 14.438 1.00 4.43 C ATOM 1134 C CYS A 615 -16.553 -24.587 14.137 1.00 72.34 C ATOM 1135 O CYS A 615 -17.546 -25.185 14.549 1.00 52.05 O ATOM 1136 CB CYS A 615 -16.030 -22.300 13.177 1.00 52.50 C ATOM 1137 SG CYS A 615 -14.960 -20.841 13.453 1.00 64.25 S ATOM 0 H CYS A 615 -14.490 -23.532 15.275 1.00 50.50 H new ATOM 0 HA CYS A 615 -17.296 -22.684 14.817 1.00 4.43 H new ATOM 0 HB2 CYS A 615 -15.541 -22.962 12.462 1.00 52.50 H new ATOM 0 HB3 CYS A 615 -16.962 -21.968 12.718 1.00 52.50 H new ATOM 1142 N GLY A 616 -15.587 -25.142 13.420 1.00 61.21 N ATOM 1143 CA GLY A 616 -15.637 -26.549 13.058 1.00 3.33 C ATOM 1144 C GLY A 616 -14.852 -26.812 11.771 1.00 35.02 C ATOM 1145 O GLY A 616 -14.454 -27.944 11.504 1.00 65.42 O ATOM 0 H GLY A 616 -14.765 -24.643 13.080 1.00 61.21 H new ATOM 0 HA2 GLY A 616 -15.226 -27.152 13.868 1.00 3.33 H new ATOM 0 HA3 GLY A 616 -16.674 -26.857 12.925 1.00 3.33 H new ATOM 1149 N GLU A 617 -14.655 -25.747 11.008 1.00 21.11 N ATOM 1150 CA GLU A 617 -13.926 -25.849 9.755 1.00 4.15 C ATOM 1151 C GLU A 617 -12.698 -26.746 9.927 1.00 2.45 C ATOM 1152 O GLU A 617 -11.696 -26.328 10.506 1.00 41.00 O ATOM 1153 CB GLU A 617 -13.526 -24.465 9.240 1.00 61.13 C ATOM 1154 CG GLU A 617 -13.107 -24.528 7.769 1.00 0.25 C ATOM 1155 CD GLU A 617 -14.330 -24.613 6.854 1.00 11.51 C ATOM 1156 OE1 GLU A 617 -14.601 -23.672 6.092 1.00 23.24 O ATOM 1157 OE2 GLU A 617 -15.010 -25.704 6.952 1.00 31.35 O ATOM 0 H GLU A 617 -14.987 -24.809 11.233 1.00 21.11 H new ATOM 0 HA GLU A 617 -14.581 -26.302 9.011 1.00 4.15 H new ATOM 0 HB2 GLU A 617 -14.362 -23.775 9.355 1.00 61.13 H new ATOM 0 HB3 GLU A 617 -12.704 -24.073 9.840 1.00 61.13 H new ATOM 0 HG2 GLU A 617 -12.520 -23.645 7.516 1.00 0.25 H new ATOM 0 HG3 GLU A 617 -12.466 -25.394 7.607 1.00 0.25 H new ATOM 1165 N VAL A 618 -12.816 -27.961 9.414 1.00 31.45 N ATOM 1166 CA VAL A 618 -11.728 -28.921 9.504 1.00 13.41 C ATOM 1167 C VAL A 618 -10.456 -28.298 8.925 1.00 32.11 C ATOM 1168 O VAL A 618 -10.478 -27.737 7.831 1.00 60.24 O ATOM 1169 CB VAL A 618 -12.124 -30.226 8.811 1.00 24.45 C ATOM 1170 CG1 VAL A 618 -10.979 -31.240 8.858 1.00 23.23 C ATOM 1171 CG2 VAL A 618 -13.398 -30.809 9.426 1.00 23.12 C ATOM 0 H VAL A 618 -13.648 -28.304 8.934 1.00 31.45 H new ATOM 0 HA VAL A 618 -11.523 -29.171 10.545 1.00 13.41 H new ATOM 0 HB VAL A 618 -12.330 -30.001 7.765 1.00 24.45 H new ATOM 0 HG11 VAL A 618 -11.286 -32.159 8.359 1.00 23.23 H new ATOM 0 HG12 VAL A 618 -10.106 -30.827 8.353 1.00 23.23 H new ATOM 0 HG13 VAL A 618 -10.728 -31.458 9.896 1.00 23.23 H new ATOM 0 HG21 VAL A 618 -13.657 -31.736 8.915 1.00 23.12 H new ATOM 0 HG22 VAL A 618 -13.231 -31.012 10.484 1.00 23.12 H new ATOM 0 HG23 VAL A 618 -14.214 -30.095 9.318 1.00 23.12 H new ATOM 1181 N TRP A 619 -9.378 -28.418 9.686 1.00 40.04 N ATOM 1182 CA TRP A 619 -8.099 -27.874 9.262 1.00 40.02 C ATOM 1183 C TRP A 619 -7.355 -28.964 8.487 1.00 52.41 C ATOM 1184 O TRP A 619 -6.920 -28.740 7.358 1.00 23.44 O ATOM 1185 CB TRP A 619 -7.306 -27.343 10.457 1.00 24.34 C ATOM 1186 CG TRP A 619 -7.923 -26.107 11.115 1.00 71.50 C ATOM 1187 CD1 TRP A 619 -8.800 -25.243 10.586 1.00 3.33 C ATOM 1188 CD2 TRP A 619 -7.674 -25.631 12.454 1.00 4.12 C ATOM 1189 NE1 TRP A 619 -9.132 -24.248 11.483 1.00 41.51 N ATOM 1190 CE2 TRP A 619 -8.425 -24.491 12.655 1.00 74.31 C ATOM 1191 CE3 TRP A 619 -6.840 -26.146 13.463 1.00 52.23 C ATOM 1192 CZ2 TRP A 619 -8.419 -23.770 13.855 1.00 71.12 C ATOM 1193 CZ3 TRP A 619 -6.845 -25.414 14.656 1.00 40.51 C ATOM 1194 CH2 TRP A 619 -7.596 -24.264 14.874 1.00 70.43 C ATOM 0 H TRP A 619 -9.364 -28.884 10.593 1.00 40.04 H new ATOM 0 HA TRP A 619 -8.243 -27.017 8.605 1.00 40.02 H new ATOM 0 HB2 TRP A 619 -7.219 -28.134 11.202 1.00 24.34 H new ATOM 0 HB3 TRP A 619 -6.295 -27.101 10.130 1.00 24.34 H new ATOM 0 HD1 TRP A 619 -9.197 -25.316 9.584 1.00 3.33 H new ATOM 0 HE1 TRP A 619 -9.778 -23.476 11.317 1.00 41.51 H new ATOM 0 HE3 TRP A 619 -6.243 -27.036 13.328 1.00 52.23 H new ATOM 0 HZ2 TRP A 619 -9.017 -22.881 13.987 1.00 71.12 H new ATOM 0 HZ3 TRP A 619 -6.222 -25.767 15.464 1.00 40.51 H new ATOM 0 HH2 TRP A 619 -7.545 -23.754 15.825 1.00 70.43 H new ATOM 1205 N GLY A 620 -7.232 -30.119 9.124 1.00 55.13 N ATOM 1206 CA GLY A 620 -6.549 -31.244 8.508 1.00 1.23 C ATOM 1207 C GLY A 620 -6.530 -32.453 9.445 1.00 23.14 C ATOM 1208 O GLY A 620 -7.557 -33.097 9.655 1.00 3.32 O ATOM 0 H GLY A 620 -7.594 -30.300 10.060 1.00 55.13 H new ATOM 0 HA2 GLY A 620 -7.047 -31.510 7.575 1.00 1.23 H new ATOM 0 HA3 GLY A 620 -5.528 -30.960 8.255 1.00 1.23 H new ATOM 1212 N LEU A 621 -5.350 -32.725 9.984 1.00 72.51 N ATOM 1213 CA LEU A 621 -5.184 -33.846 10.894 1.00 62.12 C ATOM 1214 C LEU A 621 -3.954 -33.606 11.772 1.00 32.01 C ATOM 1215 O LEU A 621 -3.098 -32.789 11.438 1.00 51.33 O ATOM 1216 CB LEU A 621 -5.137 -35.164 10.118 1.00 53.02 C ATOM 1217 CG LEU A 621 -3.911 -36.045 10.365 1.00 32.11 C ATOM 1218 CD1 LEU A 621 -4.017 -37.362 9.593 1.00 54.41 C ATOM 1219 CD2 LEU A 621 -2.620 -35.292 10.039 1.00 40.11 C ATOM 0 H LEU A 621 -4.500 -32.189 9.808 1.00 72.51 H new ATOM 0 HA LEU A 621 -6.043 -33.926 11.561 1.00 62.12 H new ATOM 0 HB2 LEU A 621 -6.029 -35.740 10.365 1.00 53.02 H new ATOM 0 HB3 LEU A 621 -5.188 -34.938 9.053 1.00 53.02 H new ATOM 0 HG LEU A 621 -3.879 -36.295 11.425 1.00 32.11 H new ATOM 0 HD11 LEU A 621 -3.133 -37.969 9.786 1.00 54.41 H new ATOM 0 HD12 LEU A 621 -4.906 -37.903 9.916 1.00 54.41 H new ATOM 0 HD13 LEU A 621 -4.088 -37.153 8.525 1.00 54.41 H new ATOM 0 HD21 LEU A 621 -1.764 -35.941 10.223 1.00 40.11 H new ATOM 0 HD22 LEU A 621 -2.629 -34.992 8.991 1.00 40.11 H new ATOM 0 HD23 LEU A 621 -2.546 -34.406 10.670 1.00 40.11 H new ATOM 1231 N GLN A 622 -3.906 -34.333 12.879 1.00 61.35 N ATOM 1232 CA GLN A 622 -2.795 -34.210 13.807 1.00 14.45 C ATOM 1233 C GLN A 622 -1.679 -35.187 13.433 1.00 10.33 C ATOM 1234 O GLN A 622 -1.945 -36.339 13.095 1.00 53.23 O ATOM 1235 CB GLN A 622 -3.259 -34.432 15.248 1.00 24.35 C ATOM 1236 CG GLN A 622 -2.630 -33.405 16.192 1.00 40.54 C ATOM 1237 CD GLN A 622 -2.401 -34.003 17.581 1.00 62.32 C ATOM 1238 OE1 GLN A 622 -1.429 -34.696 17.834 1.00 43.11 O ATOM 1239 NE2 GLN A 622 -3.347 -33.699 18.464 1.00 13.21 N ATOM 0 H GLN A 622 -4.619 -35.009 13.154 1.00 61.35 H new ATOM 0 HA GLN A 622 -2.400 -33.196 13.739 1.00 14.45 H new ATOM 0 HB2 GLN A 622 -4.345 -34.360 15.299 1.00 24.35 H new ATOM 0 HB3 GLN A 622 -2.991 -35.438 15.569 1.00 24.35 H new ATOM 0 HG2 GLN A 622 -1.682 -33.060 15.780 1.00 40.54 H new ATOM 0 HG3 GLN A 622 -3.279 -32.533 16.270 1.00 40.54 H new ATOM 0 HE21 GLN A 622 -4.135 -33.114 18.186 1.00 13.21 H new ATOM 0 HE22 GLN A 622 -3.285 -34.051 19.419 1.00 13.21 H new ATOM 1248 N MET A 623 -0.453 -34.691 13.507 1.00 43.41 N ATOM 1249 CA MET A 623 0.705 -35.505 13.180 1.00 21.41 C ATOM 1250 C MET A 623 1.704 -35.528 14.339 1.00 44.15 C ATOM 1251 O MET A 623 2.040 -34.483 14.894 1.00 41.02 O ATOM 1252 CB MET A 623 1.386 -34.947 11.929 1.00 0.31 C ATOM 1253 CG MET A 623 0.777 -35.546 10.660 1.00 42.24 C ATOM 1254 SD MET A 623 1.590 -37.083 10.259 1.00 25.54 S ATOM 1255 CE MET A 623 0.760 -37.485 8.731 1.00 44.40 C ATOM 0 H MET A 623 -0.236 -33.735 13.789 1.00 43.41 H new ATOM 0 HA MET A 623 0.368 -36.525 12.995 1.00 21.41 H new ATOM 0 HB2 MET A 623 1.284 -33.862 11.908 1.00 0.31 H new ATOM 0 HB3 MET A 623 2.453 -35.166 11.963 1.00 0.31 H new ATOM 0 HG2 MET A 623 -0.290 -35.716 10.804 1.00 42.24 H new ATOM 0 HG3 MET A 623 0.879 -34.845 9.832 1.00 42.24 H new ATOM 0 HE1 MET A 623 1.151 -38.425 8.341 1.00 44.40 H new ATOM 0 HE2 MET A 623 -0.310 -37.585 8.914 1.00 44.40 H new ATOM 0 HE3 MET A 623 0.931 -36.691 8.004 1.00 44.40 H new ATOM 1265 N ILE A 624 2.152 -36.730 14.669 1.00 73.52 N ATOM 1266 CA ILE A 624 3.106 -36.903 15.751 1.00 12.11 C ATOM 1267 C ILE A 624 4.498 -37.142 15.164 1.00 23.52 C ATOM 1268 O ILE A 624 4.634 -37.770 14.115 1.00 21.11 O ATOM 1269 CB ILE A 624 2.642 -38.006 16.704 1.00 73.42 C ATOM 1270 CG1 ILE A 624 1.263 -37.686 17.284 1.00 53.21 C ATOM 1271 CG2 ILE A 624 3.680 -38.258 17.799 1.00 1.41 C ATOM 1272 CD1 ILE A 624 0.150 -38.209 16.374 1.00 52.04 C ATOM 0 H ILE A 624 1.872 -37.594 14.206 1.00 73.52 H new ATOM 0 HA ILE A 624 3.166 -35.997 16.355 1.00 12.11 H new ATOM 0 HB ILE A 624 2.545 -38.930 16.134 1.00 73.42 H new ATOM 0 HG12 ILE A 624 1.168 -38.133 18.274 1.00 53.21 H new ATOM 0 HG13 ILE A 624 1.159 -36.608 17.409 1.00 53.21 H new ATOM 0 HG21 ILE A 624 3.325 -39.047 18.462 1.00 1.41 H new ATOM 0 HG22 ILE A 624 4.622 -38.564 17.344 1.00 1.41 H new ATOM 0 HG23 ILE A 624 3.834 -37.344 18.372 1.00 1.41 H new ATOM 0 HD11 ILE A 624 -0.820 -37.968 16.810 1.00 52.04 H new ATOM 0 HD12 ILE A 624 0.233 -37.742 15.393 1.00 52.04 H new ATOM 0 HD13 ILE A 624 0.243 -39.290 16.270 1.00 52.04 H new ATOM 1284 N TYR A 625 5.498 -36.630 15.867 1.00 52.12 N ATOM 1285 CA TYR A 625 6.875 -36.780 15.429 1.00 60.24 C ATOM 1286 C TYR A 625 7.838 -36.717 16.616 1.00 62.52 C ATOM 1287 O TYR A 625 8.053 -35.651 17.189 1.00 3.15 O ATOM 1288 CB TYR A 625 7.153 -35.598 14.499 1.00 41.45 C ATOM 1289 CG TYR A 625 8.636 -35.248 14.363 1.00 3.45 C ATOM 1290 CD1 TYR A 625 9.447 -35.989 13.529 1.00 62.24 C ATOM 1291 CD2 TYR A 625 9.164 -34.190 15.077 1.00 75.03 C ATOM 1292 CE1 TYR A 625 10.843 -35.660 13.402 1.00 42.25 C ATOM 1293 CE2 TYR A 625 10.560 -33.861 14.950 1.00 55.54 C ATOM 1294 CZ TYR A 625 11.330 -34.612 14.118 1.00 5.33 C ATOM 1295 OH TYR A 625 12.649 -34.301 13.998 1.00 11.53 O ATOM 0 H TYR A 625 5.382 -36.111 16.737 1.00 52.12 H new ATOM 0 HA TYR A 625 7.018 -37.742 14.937 1.00 60.24 H new ATOM 0 HB2 TYR A 625 6.752 -35.824 13.511 1.00 41.45 H new ATOM 0 HB3 TYR A 625 6.617 -34.724 14.869 1.00 41.45 H new ATOM 0 HD1 TYR A 625 9.035 -36.817 12.971 1.00 62.24 H new ATOM 0 HD2 TYR A 625 8.530 -33.610 15.731 1.00 75.03 H new ATOM 0 HE1 TYR A 625 11.489 -36.233 12.753 1.00 42.25 H new ATOM 0 HE2 TYR A 625 10.986 -33.037 15.503 1.00 55.54 H new ATOM 0 HH TYR A 625 12.809 -33.407 14.366 1.00 11.53 H new ATOM 1305 N LYS A 626 8.392 -37.874 16.949 1.00 2.11 N ATOM 1306 CA LYS A 626 9.327 -37.964 18.058 1.00 43.15 C ATOM 1307 C LYS A 626 8.574 -37.753 19.373 1.00 64.23 C ATOM 1308 O LYS A 626 9.181 -37.444 20.397 1.00 64.30 O ATOM 1309 CB LYS A 626 10.494 -36.995 17.855 1.00 53.34 C ATOM 1310 CG LYS A 626 11.037 -37.082 16.427 1.00 53.32 C ATOM 1311 CD LYS A 626 12.047 -38.223 16.293 1.00 1.10 C ATOM 1312 CE LYS A 626 11.355 -39.583 16.403 1.00 64.24 C ATOM 1313 NZ LYS A 626 12.015 -40.573 15.521 1.00 0.45 N ATOM 0 H LYS A 626 8.211 -38.757 16.471 1.00 2.11 H new ATOM 0 HA LYS A 626 9.772 -38.958 18.101 1.00 43.15 H new ATOM 0 HB2 LYS A 626 10.166 -35.976 18.062 1.00 53.34 H new ATOM 0 HB3 LYS A 626 11.289 -37.224 18.565 1.00 53.34 H new ATOM 0 HG2 LYS A 626 10.214 -37.237 15.730 1.00 53.32 H new ATOM 0 HG3 LYS A 626 11.511 -36.138 16.156 1.00 53.32 H new ATOM 0 HD2 LYS A 626 12.560 -38.149 15.334 1.00 1.10 H new ATOM 0 HD3 LYS A 626 12.807 -38.134 17.069 1.00 1.10 H new ATOM 0 HE2 LYS A 626 11.385 -39.930 17.436 1.00 64.24 H new ATOM 0 HE3 LYS A 626 10.304 -39.486 16.129 1.00 64.24 H new ATOM 0 HZ1 LYS A 626 11.533 -41.491 15.608 1.00 0.45 H new ATOM 0 HZ2 LYS A 626 11.965 -40.247 14.535 1.00 0.45 H new ATOM 0 HZ3 LYS A 626 13.011 -40.677 15.801 1.00 0.45 H new ATOM 1326 N SER A 627 7.263 -37.929 19.301 1.00 1.35 N ATOM 1327 CA SER A 627 6.421 -37.762 20.474 1.00 51.33 C ATOM 1328 C SER A 627 6.037 -36.290 20.637 1.00 43.51 C ATOM 1329 O SER A 627 6.022 -35.768 21.751 1.00 74.21 O ATOM 1330 CB SER A 627 7.124 -38.270 21.734 1.00 41.21 C ATOM 1331 OG SER A 627 7.874 -37.243 22.377 1.00 24.23 O ATOM 0 H SER A 627 6.763 -38.185 18.450 1.00 1.35 H new ATOM 0 HA SER A 627 5.516 -38.353 20.332 1.00 51.33 H new ATOM 0 HB2 SER A 627 6.383 -38.666 22.428 1.00 41.21 H new ATOM 0 HB3 SER A 627 7.788 -39.094 21.472 1.00 41.21 H new ATOM 0 HG SER A 627 8.476 -36.823 21.728 1.00 24.23 H new ATOM 1337 N VAL A 628 5.737 -35.661 19.510 1.00 42.01 N ATOM 1338 CA VAL A 628 5.355 -34.259 19.514 1.00 74.22 C ATOM 1339 C VAL A 628 4.058 -34.087 18.720 1.00 42.42 C ATOM 1340 O VAL A 628 4.039 -34.281 17.505 1.00 22.14 O ATOM 1341 CB VAL A 628 6.503 -33.402 18.977 1.00 12.14 C ATOM 1342 CG1 VAL A 628 6.035 -31.973 18.696 1.00 13.30 C ATOM 1343 CG2 VAL A 628 7.690 -33.410 19.942 1.00 22.22 C ATOM 0 H VAL A 628 5.751 -36.097 18.588 1.00 42.01 H new ATOM 0 HA VAL A 628 5.162 -33.918 20.531 1.00 74.22 H new ATOM 0 HB VAL A 628 6.834 -33.838 18.034 1.00 12.14 H new ATOM 0 HG11 VAL A 628 6.870 -31.385 18.315 1.00 13.30 H new ATOM 0 HG12 VAL A 628 5.236 -31.991 17.955 1.00 13.30 H new ATOM 0 HG13 VAL A 628 5.665 -31.524 19.617 1.00 13.30 H new ATOM 0 HG21 VAL A 628 8.492 -32.793 19.537 1.00 22.22 H new ATOM 0 HG22 VAL A 628 7.377 -33.011 20.907 1.00 22.22 H new ATOM 0 HG23 VAL A 628 8.047 -34.432 20.071 1.00 22.22 H new ATOM 1353 N LYS A 629 3.006 -33.723 19.438 1.00 32.31 N ATOM 1354 CA LYS A 629 1.708 -33.522 18.816 1.00 62.31 C ATOM 1355 C LYS A 629 1.736 -32.233 17.993 1.00 2.42 C ATOM 1356 O LYS A 629 1.596 -31.140 18.540 1.00 13.04 O ATOM 1357 CB LYS A 629 0.598 -33.557 19.868 1.00 2.53 C ATOM 1358 CG LYS A 629 0.710 -34.808 20.742 1.00 14.42 C ATOM 1359 CD LYS A 629 -0.009 -35.993 20.096 1.00 74.51 C ATOM 1360 CE LYS A 629 -1.510 -35.951 20.390 1.00 32.43 C ATOM 1361 NZ LYS A 629 -1.807 -36.637 21.668 1.00 51.10 N ATOM 0 H LYS A 629 3.026 -33.562 20.445 1.00 32.31 H new ATOM 0 HA LYS A 629 1.486 -34.336 18.126 1.00 62.31 H new ATOM 0 HB2 LYS A 629 0.656 -32.666 20.493 1.00 2.53 H new ATOM 0 HB3 LYS A 629 -0.375 -33.538 19.376 1.00 2.53 H new ATOM 0 HG2 LYS A 629 1.760 -35.055 20.896 1.00 14.42 H new ATOM 0 HG3 LYS A 629 0.281 -34.609 21.724 1.00 14.42 H new ATOM 0 HD2 LYS A 629 0.155 -35.979 19.018 1.00 74.51 H new ATOM 0 HD3 LYS A 629 0.412 -36.926 20.470 1.00 74.51 H new ATOM 0 HE2 LYS A 629 -1.848 -34.916 20.439 1.00 32.43 H new ATOM 0 HE3 LYS A 629 -2.059 -36.428 19.578 1.00 32.43 H new ATOM 0 HZ1 LYS A 629 -2.830 -36.599 21.853 1.00 51.10 H new ATOM 0 HZ2 LYS A 629 -1.502 -37.630 21.608 1.00 51.10 H new ATOM 0 HZ3 LYS A 629 -1.298 -36.165 22.442 1.00 51.10 H new ATOM 1374 N LEU A 630 1.919 -32.402 16.692 1.00 74.30 N ATOM 1375 CA LEU A 630 1.967 -31.265 15.788 1.00 32.45 C ATOM 1376 C LEU A 630 0.770 -31.324 14.837 1.00 32.24 C ATOM 1377 O LEU A 630 0.691 -32.209 13.987 1.00 32.51 O ATOM 1378 CB LEU A 630 3.318 -31.206 15.073 1.00 21.24 C ATOM 1379 CG LEU A 630 4.554 -31.175 15.976 1.00 74.45 C ATOM 1380 CD1 LEU A 630 5.806 -31.595 15.204 1.00 44.30 C ATOM 1381 CD2 LEU A 630 4.718 -29.804 16.634 1.00 71.04 C ATOM 0 H LEU A 630 2.036 -33.310 16.242 1.00 74.30 H new ATOM 0 HA LEU A 630 1.886 -30.332 16.345 1.00 32.45 H new ATOM 0 HB2 LEU A 630 3.396 -32.070 14.414 1.00 21.24 H new ATOM 0 HB3 LEU A 630 3.333 -30.319 14.439 1.00 21.24 H new ATOM 0 HG LEU A 630 4.411 -31.900 16.777 1.00 74.45 H new ATOM 0 HD11 LEU A 630 6.670 -31.565 15.868 1.00 44.30 H new ATOM 0 HD12 LEU A 630 5.676 -32.608 14.824 1.00 44.30 H new ATOM 0 HD13 LEU A 630 5.965 -30.912 14.370 1.00 44.30 H new ATOM 0 HD21 LEU A 630 5.603 -29.809 17.270 1.00 71.04 H new ATOM 0 HD22 LEU A 630 4.829 -29.041 15.863 1.00 71.04 H new ATOM 0 HD23 LEU A 630 3.838 -29.583 17.238 1.00 71.04 H new ATOM 1393 N PRO A 631 -0.156 -30.345 15.018 1.00 52.54 N ATOM 1394 CA PRO A 631 -1.345 -30.277 14.186 1.00 54.54 C ATOM 1395 C PRO A 631 -1.008 -29.749 12.789 1.00 35.24 C ATOM 1396 O PRO A 631 -0.241 -28.798 12.650 1.00 61.24 O ATOM 1397 CB PRO A 631 -2.306 -29.376 14.945 1.00 41.10 C ATOM 1398 CG PRO A 631 -1.455 -28.603 15.939 1.00 45.31 C ATOM 1399 CD PRO A 631 -0.096 -29.280 16.014 1.00 3.54 C ATOM 0 HA PRO A 631 -1.792 -31.256 14.011 1.00 54.54 H new ATOM 0 HB2 PRO A 631 -2.826 -28.699 14.266 1.00 41.10 H new ATOM 0 HB3 PRO A 631 -3.069 -29.962 15.457 1.00 41.10 H new ATOM 0 HG2 PRO A 631 -1.348 -27.565 15.624 1.00 45.31 H new ATOM 0 HG3 PRO A 631 -1.930 -28.591 16.920 1.00 45.31 H new ATOM 0 HD2 PRO A 631 0.709 -28.578 15.795 1.00 3.54 H new ATOM 0 HD3 PRO A 631 0.093 -29.680 17.010 1.00 3.54 H new ATOM 1407 N VAL A 632 -1.599 -30.390 11.791 1.00 11.33 N ATOM 1408 CA VAL A 632 -1.371 -29.997 10.411 1.00 74.00 C ATOM 1409 C VAL A 632 -2.545 -29.143 9.928 1.00 74.21 C ATOM 1410 O VAL A 632 -3.586 -29.674 9.541 1.00 2.44 O ATOM 1411 CB VAL A 632 -1.138 -31.237 9.546 1.00 72.23 C ATOM 1412 CG1 VAL A 632 -0.884 -30.849 8.088 1.00 4.40 C ATOM 1413 CG2 VAL A 632 0.012 -32.082 10.097 1.00 2.11 C ATOM 0 H VAL A 632 -2.235 -31.178 11.911 1.00 11.33 H new ATOM 0 HA VAL A 632 -0.471 -29.387 10.331 1.00 74.00 H new ATOM 0 HB VAL A 632 -2.044 -31.843 9.578 1.00 72.23 H new ATOM 0 HG11 VAL A 632 -0.721 -31.749 7.495 1.00 4.40 H new ATOM 0 HG12 VAL A 632 -1.748 -30.309 7.699 1.00 4.40 H new ATOM 0 HG13 VAL A 632 -0.002 -30.212 8.030 1.00 4.40 H new ATOM 0 HG21 VAL A 632 0.156 -32.957 9.464 1.00 2.11 H new ATOM 0 HG22 VAL A 632 0.926 -31.488 10.110 1.00 2.11 H new ATOM 0 HG23 VAL A 632 -0.226 -32.403 11.111 1.00 2.11 H new ATOM 1423 N LEU A 633 -2.339 -27.835 9.966 1.00 52.04 N ATOM 1424 CA LEU A 633 -3.368 -26.903 9.536 1.00 3.55 C ATOM 1425 C LEU A 633 -3.067 -26.440 8.109 1.00 35.32 C ATOM 1426 O LEU A 633 -2.004 -26.738 7.567 1.00 11.23 O ATOM 1427 CB LEU A 633 -3.502 -25.755 10.539 1.00 14.31 C ATOM 1428 CG LEU A 633 -3.479 -26.149 12.017 1.00 20.13 C ATOM 1429 CD1 LEU A 633 -3.907 -27.606 12.203 1.00 63.33 C ATOM 1430 CD2 LEU A 633 -2.108 -25.871 12.637 1.00 13.34 C ATOM 0 H LEU A 633 -1.475 -27.398 10.288 1.00 52.04 H new ATOM 0 HA LEU A 633 -4.341 -27.393 9.514 1.00 3.55 H new ATOM 0 HB2 LEU A 633 -2.693 -25.046 10.360 1.00 14.31 H new ATOM 0 HB3 LEU A 633 -4.436 -25.230 10.338 1.00 14.31 H new ATOM 0 HG LEU A 633 -4.204 -25.531 12.547 1.00 20.13 H new ATOM 0 HD11 LEU A 633 -3.882 -27.860 13.263 1.00 63.33 H new ATOM 0 HD12 LEU A 633 -4.919 -27.739 11.822 1.00 63.33 H new ATOM 0 HD13 LEU A 633 -3.225 -28.258 11.657 1.00 63.33 H new ATOM 0 HD21 LEU A 633 -2.119 -26.160 13.688 1.00 13.34 H new ATOM 0 HD22 LEU A 633 -1.347 -26.447 12.110 1.00 13.34 H new ATOM 0 HD23 LEU A 633 -1.880 -24.808 12.555 1.00 13.34 H new ATOM 1442 N LYS A 634 -4.024 -25.720 7.541 1.00 24.30 N ATOM 1443 CA LYS A 634 -3.875 -25.214 6.187 1.00 21.02 C ATOM 1444 C LYS A 634 -3.814 -23.686 6.223 1.00 43.33 C ATOM 1445 O LYS A 634 -3.720 -23.089 7.294 1.00 32.45 O ATOM 1446 CB LYS A 634 -4.981 -25.764 5.285 1.00 73.31 C ATOM 1447 CG LYS A 634 -6.154 -26.292 6.114 1.00 24.14 C ATOM 1448 CD LYS A 634 -7.122 -27.098 5.245 1.00 5.53 C ATOM 1449 CE LYS A 634 -7.625 -26.262 4.067 1.00 51.13 C ATOM 1450 NZ LYS A 634 -8.530 -27.063 3.213 1.00 73.13 N ATOM 0 H LYS A 634 -4.905 -25.475 7.994 1.00 24.30 H new ATOM 0 HA LYS A 634 -2.938 -25.561 5.751 1.00 21.02 H new ATOM 0 HB2 LYS A 634 -5.330 -24.980 4.613 1.00 73.31 H new ATOM 0 HB3 LYS A 634 -4.582 -26.564 4.662 1.00 73.31 H new ATOM 0 HG2 LYS A 634 -5.779 -26.918 6.923 1.00 24.14 H new ATOM 0 HG3 LYS A 634 -6.682 -25.458 6.575 1.00 24.14 H new ATOM 0 HD2 LYS A 634 -6.624 -27.994 4.874 1.00 5.53 H new ATOM 0 HD3 LYS A 634 -7.967 -27.430 5.848 1.00 5.53 H new ATOM 0 HE2 LYS A 634 -8.149 -25.381 4.436 1.00 51.13 H new ATOM 0 HE3 LYS A 634 -6.779 -25.907 3.478 1.00 51.13 H new ATOM 0 HZ1 LYS A 634 -9.152 -26.427 2.675 1.00 73.13 H new ATOM 0 HZ2 LYS A 634 -7.967 -27.637 2.553 1.00 73.13 H new ATOM 0 HZ3 LYS A 634 -9.107 -27.689 3.810 1.00 73.13 H new ATOM 1463 N VAL A 635 -3.869 -23.095 5.038 1.00 63.42 N ATOM 1464 CA VAL A 635 -3.821 -21.648 4.920 1.00 43.12 C ATOM 1465 C VAL A 635 -5.214 -21.123 4.568 1.00 10.34 C ATOM 1466 O VAL A 635 -5.670 -20.133 5.139 1.00 74.12 O ATOM 1467 CB VAL A 635 -2.754 -21.241 3.901 1.00 21.13 C ATOM 1468 CG1 VAL A 635 -1.386 -21.090 4.570 1.00 14.24 C ATOM 1469 CG2 VAL A 635 -2.691 -22.240 2.745 1.00 61.55 C ATOM 0 H VAL A 635 -3.946 -23.593 4.151 1.00 63.42 H new ATOM 0 HA VAL A 635 -3.534 -21.197 5.870 1.00 43.12 H new ATOM 0 HB VAL A 635 -3.035 -20.271 3.491 1.00 21.13 H new ATOM 0 HG11 VAL A 635 -0.646 -20.800 3.824 1.00 14.24 H new ATOM 0 HG12 VAL A 635 -1.442 -20.323 5.343 1.00 14.24 H new ATOM 0 HG13 VAL A 635 -1.095 -22.039 5.021 1.00 14.24 H new ATOM 0 HG21 VAL A 635 -1.925 -21.927 2.035 1.00 61.55 H new ATOM 0 HG22 VAL A 635 -2.445 -23.229 3.132 1.00 61.55 H new ATOM 0 HG23 VAL A 635 -3.658 -22.277 2.243 1.00 61.55 H new ATOM 1479 N ARG A 636 -5.851 -21.809 3.631 1.00 50.21 N ATOM 1480 CA ARG A 636 -7.183 -21.424 3.197 1.00 51.24 C ATOM 1481 C ARG A 636 -8.173 -21.535 4.358 1.00 1.11 C ATOM 1482 O ARG A 636 -9.297 -21.044 4.269 1.00 12.02 O ATOM 1483 CB ARG A 636 -7.662 -22.305 2.041 1.00 30.45 C ATOM 1484 CG ARG A 636 -7.291 -23.771 2.280 1.00 53.42 C ATOM 1485 CD ARG A 636 -8.303 -24.707 1.615 1.00 24.15 C ATOM 1486 NE ARG A 636 -7.611 -25.901 1.081 1.00 33.51 N ATOM 1487 CZ ARG A 636 -8.230 -26.899 0.415 1.00 60.25 C ATOM 1488 NH1 ARG A 636 -9.561 -26.854 0.195 1.00 52.13 N ATOM 1489 NH2 ARG A 636 -7.514 -27.920 -0.019 1.00 2.21 N ATOM 0 H ARG A 636 -5.469 -22.629 3.160 1.00 50.21 H new ATOM 0 HA ARG A 636 -7.134 -20.390 2.855 1.00 51.24 H new ATOM 0 HB2 ARG A 636 -8.743 -22.213 1.932 1.00 30.45 H new ATOM 0 HB3 ARG A 636 -7.217 -21.961 1.108 1.00 30.45 H new ATOM 0 HG2 ARG A 636 -6.294 -23.967 1.885 1.00 53.42 H new ATOM 0 HG3 ARG A 636 -7.254 -23.971 3.351 1.00 53.42 H new ATOM 0 HD2 ARG A 636 -9.062 -25.009 2.337 1.00 24.15 H new ATOM 0 HD3 ARG A 636 -8.819 -24.185 0.810 1.00 24.15 H new ATOM 0 HE ARG A 636 -6.604 -25.975 1.225 1.00 33.51 H new ATOM 0 HH11 ARG A 636 -10.107 -26.062 0.533 1.00 52.13 H new ATOM 0 HH12 ARG A 636 -10.021 -27.612 -0.309 1.00 52.13 H new ATOM 0 HH21 ARG A 636 -6.509 -27.947 0.151 1.00 2.21 H new ATOM 0 HH22 ARG A 636 -7.966 -28.682 -0.524 1.00 2.21 H new ATOM 1502 N SER A 637 -7.719 -22.183 5.421 1.00 42.13 N ATOM 1503 CA SER A 637 -8.550 -22.365 6.598 1.00 14.43 C ATOM 1504 C SER A 637 -8.064 -21.454 7.728 1.00 71.32 C ATOM 1505 O SER A 637 -8.793 -21.205 8.686 1.00 13.25 O ATOM 1506 CB SER A 637 -8.547 -23.825 7.055 1.00 52.22 C ATOM 1507 OG SER A 637 -9.729 -24.161 7.776 1.00 75.42 O ATOM 0 H SER A 637 -6.786 -22.588 5.491 1.00 42.13 H new ATOM 0 HA SER A 637 -9.574 -22.096 6.338 1.00 14.43 H new ATOM 0 HB2 SER A 637 -8.455 -24.477 6.186 1.00 52.22 H new ATOM 0 HB3 SER A 637 -7.675 -24.006 7.683 1.00 52.22 H new ATOM 0 HG SER A 637 -9.937 -25.109 7.640 1.00 75.42 H new ATOM 1513 N MET A 638 -6.835 -20.983 7.577 1.00 31.02 N ATOM 1514 CA MET A 638 -6.243 -20.106 8.573 1.00 43.34 C ATOM 1515 C MET A 638 -6.168 -18.666 8.060 1.00 64.24 C ATOM 1516 O MET A 638 -5.757 -18.428 6.925 1.00 62.41 O ATOM 1517 CB MET A 638 -4.836 -20.600 8.916 1.00 1.50 C ATOM 1518 CG MET A 638 -4.892 -21.907 9.709 1.00 51.10 C ATOM 1519 SD MET A 638 -5.527 -21.599 11.349 1.00 65.42 S ATOM 1520 CE MET A 638 -7.111 -22.412 11.226 1.00 61.43 C ATOM 0 H MET A 638 -6.233 -21.192 6.780 1.00 31.02 H new ATOM 0 HA MET A 638 -6.871 -20.122 9.464 1.00 43.34 H new ATOM 0 HB2 MET A 638 -4.266 -20.751 7.999 1.00 1.50 H new ATOM 0 HB3 MET A 638 -4.311 -19.841 9.496 1.00 1.50 H new ATOM 0 HG2 MET A 638 -5.527 -22.628 9.194 1.00 51.10 H new ATOM 0 HG3 MET A 638 -3.897 -22.347 9.772 1.00 51.10 H new ATOM 0 HE1 MET A 638 -7.771 -22.044 12.012 1.00 61.43 H new ATOM 0 HE2 MET A 638 -7.554 -22.201 10.252 1.00 61.43 H new ATOM 0 HE3 MET A 638 -6.977 -23.488 11.339 1.00 61.43 H new ATOM 1530 N LEU A 639 -6.571 -17.743 8.920 1.00 22.35 N ATOM 1531 CA LEU A 639 -6.554 -16.334 8.569 1.00 54.43 C ATOM 1532 C LEU A 639 -5.270 -15.694 9.101 1.00 72.50 C ATOM 1533 O LEU A 639 -4.847 -15.982 10.219 1.00 23.34 O ATOM 1534 CB LEU A 639 -7.831 -15.645 9.055 1.00 73.10 C ATOM 1535 CG LEU A 639 -7.863 -14.121 8.924 1.00 0.02 C ATOM 1536 CD1 LEU A 639 -7.392 -13.680 7.537 1.00 54.11 C ATOM 1537 CD2 LEU A 639 -9.250 -13.571 9.261 1.00 53.53 C ATOM 0 H LEU A 639 -6.912 -17.944 9.860 1.00 22.35 H new ATOM 0 HA LEU A 639 -6.546 -16.212 7.486 1.00 54.43 H new ATOM 0 HB2 LEU A 639 -8.675 -16.055 8.500 1.00 73.10 H new ATOM 0 HB3 LEU A 639 -7.983 -15.903 10.103 1.00 73.10 H new ATOM 0 HG LEU A 639 -7.166 -13.701 9.649 1.00 0.02 H new ATOM 0 HD11 LEU A 639 -7.424 -12.593 7.470 1.00 54.11 H new ATOM 0 HD12 LEU A 639 -6.370 -14.023 7.373 1.00 54.11 H new ATOM 0 HD13 LEU A 639 -8.045 -14.110 6.777 1.00 54.11 H new ATOM 0 HD21 LEU A 639 -9.245 -12.486 9.160 1.00 53.53 H new ATOM 0 HD22 LEU A 639 -9.986 -13.996 8.578 1.00 53.53 H new ATOM 0 HD23 LEU A 639 -9.509 -13.839 10.285 1.00 53.53 H new ATOM 1549 N LEU A 640 -4.686 -14.839 8.275 1.00 73.03 N ATOM 1550 CA LEU A 640 -3.459 -14.157 8.648 1.00 10.23 C ATOM 1551 C LEU A 640 -3.765 -12.685 8.935 1.00 75.42 C ATOM 1552 O LEU A 640 -3.742 -11.855 8.028 1.00 54.21 O ATOM 1553 CB LEU A 640 -2.384 -14.364 7.579 1.00 31.24 C ATOM 1554 CG LEU A 640 -2.174 -15.805 7.110 1.00 32.31 C ATOM 1555 CD1 LEU A 640 -1.285 -15.853 5.866 1.00 3.23 C ATOM 1556 CD2 LEU A 640 -1.624 -16.676 8.242 1.00 51.13 C ATOM 0 H LEU A 640 -5.040 -14.603 7.348 1.00 73.03 H new ATOM 0 HA LEU A 640 -3.051 -14.583 9.565 1.00 10.23 H new ATOM 0 HB2 LEU A 640 -2.639 -13.754 6.712 1.00 31.24 H new ATOM 0 HB3 LEU A 640 -1.437 -13.987 7.966 1.00 31.24 H new ATOM 0 HG LEU A 640 -3.143 -16.217 6.829 1.00 32.31 H new ATOM 0 HD11 LEU A 640 -1.152 -16.889 5.554 1.00 3.23 H new ATOM 0 HD12 LEU A 640 -1.755 -15.289 5.061 1.00 3.23 H new ATOM 0 HD13 LEU A 640 -0.313 -15.416 6.096 1.00 3.23 H new ATOM 0 HD21 LEU A 640 -1.484 -17.695 7.882 1.00 51.13 H new ATOM 0 HD22 LEU A 640 -0.668 -16.275 8.578 1.00 51.13 H new ATOM 0 HD23 LEU A 640 -2.328 -16.679 9.074 1.00 51.13 H new ATOM 1568 N GLU A 641 -4.045 -12.408 10.200 1.00 54.23 N ATOM 1569 CA GLU A 641 -4.356 -11.051 10.617 1.00 31.11 C ATOM 1570 C GLU A 641 -3.085 -10.200 10.644 1.00 51.23 C ATOM 1571 O GLU A 641 -2.123 -10.536 11.332 1.00 62.10 O ATOM 1572 CB GLU A 641 -5.051 -11.042 11.980 1.00 25.43 C ATOM 1573 CG GLU A 641 -6.551 -10.782 11.830 1.00 43.22 C ATOM 1574 CD GLU A 641 -7.238 -10.730 13.196 1.00 61.31 C ATOM 1575 OE1 GLU A 641 -8.395 -11.156 13.324 1.00 75.10 O ATOM 1576 OE2 GLU A 641 -6.525 -10.227 14.146 1.00 14.30 O ATOM 0 H GLU A 641 -4.063 -13.100 10.950 1.00 54.23 H new ATOM 0 HA GLU A 641 -5.045 -10.618 9.892 1.00 31.11 H new ATOM 0 HB2 GLU A 641 -4.892 -11.998 12.479 1.00 25.43 H new ATOM 0 HB3 GLU A 641 -4.607 -10.274 12.613 1.00 25.43 H new ATOM 0 HG2 GLU A 641 -6.710 -9.841 11.303 1.00 43.22 H new ATOM 0 HG3 GLU A 641 -7.001 -11.567 11.222 1.00 43.22 H new ATOM 1584 N THR A 642 -3.123 -9.114 9.886 1.00 3.40 N ATOM 1585 CA THR A 642 -1.986 -8.211 9.814 1.00 21.51 C ATOM 1586 C THR A 642 -2.448 -6.759 9.947 1.00 73.20 C ATOM 1587 O THR A 642 -3.618 -6.453 9.720 1.00 44.14 O ATOM 1588 CB THR A 642 -1.240 -8.495 8.509 1.00 44.41 C ATOM 1589 OG1 THR A 642 -1.674 -7.461 7.629 1.00 3.25 O ATOM 1590 CG2 THR A 642 -1.712 -9.783 7.832 1.00 50.33 C ATOM 0 H THR A 642 -3.923 -8.839 9.316 1.00 3.40 H new ATOM 0 HA THR A 642 -1.297 -8.376 10.642 1.00 21.51 H new ATOM 0 HB THR A 642 -0.171 -8.562 8.710 1.00 44.41 H new ATOM 0 HG1 THR A 642 -2.458 -7.766 7.127 1.00 3.25 H new ATOM 0 HG21 THR A 642 -1.150 -9.937 6.911 1.00 50.33 H new ATOM 0 HG22 THR A 642 -1.549 -10.627 8.502 1.00 50.33 H new ATOM 0 HG23 THR A 642 -2.774 -9.704 7.600 1.00 50.33 H new ATOM 1598 N PRO A 643 -1.481 -5.880 10.324 1.00 34.55 N ATOM 1599 CA PRO A 643 -1.777 -4.468 10.490 1.00 14.34 C ATOM 1600 C PRO A 643 -1.925 -3.775 9.134 1.00 75.51 C ATOM 1601 O PRO A 643 -2.157 -2.569 9.071 1.00 44.04 O ATOM 1602 CB PRO A 643 -0.625 -3.918 11.315 1.00 62.41 C ATOM 1603 CG PRO A 643 0.500 -4.932 11.186 1.00 65.23 C ATOM 1604 CD PRO A 643 -0.086 -6.207 10.602 1.00 22.43 C ATOM 0 HA PRO A 643 -2.728 -4.295 10.993 1.00 14.34 H new ATOM 0 HB2 PRO A 643 -0.314 -2.940 10.948 1.00 62.41 H new ATOM 0 HB3 PRO A 643 -0.917 -3.789 12.357 1.00 62.41 H new ATOM 0 HG2 PRO A 643 1.290 -4.545 10.542 1.00 65.23 H new ATOM 0 HG3 PRO A 643 0.949 -5.129 12.159 1.00 65.23 H new ATOM 0 HD2 PRO A 643 0.439 -6.505 9.695 1.00 22.43 H new ATOM 0 HD3 PRO A 643 -0.006 -7.037 11.304 1.00 22.43 H new ATOM 1612 N GLN A 644 -1.786 -4.569 8.082 1.00 35.12 N ATOM 1613 CA GLN A 644 -1.902 -4.048 6.731 1.00 51.22 C ATOM 1614 C GLN A 644 -3.172 -4.580 6.063 1.00 25.52 C ATOM 1615 O GLN A 644 -3.472 -4.228 4.924 1.00 73.44 O ATOM 1616 CB GLN A 644 -0.662 -4.391 5.903 1.00 50.21 C ATOM 1617 CG GLN A 644 0.615 -4.207 6.726 1.00 53.33 C ATOM 1618 CD GLN A 644 1.847 -4.153 5.821 1.00 42.13 C ATOM 1619 OE1 GLN A 644 2.429 -3.107 5.582 1.00 73.32 O ATOM 1620 NE2 GLN A 644 2.212 -5.335 5.332 1.00 32.03 N ATOM 0 H GLN A 644 -1.594 -5.569 8.138 1.00 35.12 H new ATOM 0 HA GLN A 644 -1.973 -2.962 6.787 1.00 51.22 H new ATOM 0 HB2 GLN A 644 -0.728 -5.421 5.553 1.00 50.21 H new ATOM 0 HB3 GLN A 644 -0.624 -3.755 5.018 1.00 50.21 H new ATOM 0 HG2 GLN A 644 0.547 -3.289 7.309 1.00 53.33 H new ATOM 0 HG3 GLN A 644 0.716 -5.028 7.436 1.00 53.33 H new ATOM 0 HE21 GLN A 644 1.681 -6.172 5.572 1.00 32.03 H new ATOM 0 HE22 GLN A 644 3.023 -5.404 4.717 1.00 32.03 H new ATOM 1629 N GLY A 645 -3.882 -5.421 6.801 1.00 11.52 N ATOM 1630 CA GLY A 645 -5.112 -6.005 6.295 1.00 72.21 C ATOM 1631 C GLY A 645 -5.026 -7.533 6.275 1.00 43.42 C ATOM 1632 O GLY A 645 -4.009 -8.095 5.872 1.00 62.14 O ATOM 0 H GLY A 645 -3.629 -5.712 7.745 1.00 11.52 H new ATOM 0 HA2 GLY A 645 -5.950 -5.693 6.918 1.00 72.21 H new ATOM 0 HA3 GLY A 645 -5.307 -5.635 5.289 1.00 72.21 H new ATOM 1636 N ARG A 646 -6.106 -8.161 6.715 1.00 51.50 N ATOM 1637 CA ARG A 646 -6.165 -9.612 6.753 1.00 51.14 C ATOM 1638 C ARG A 646 -5.822 -10.193 5.380 1.00 44.15 C ATOM 1639 O ARG A 646 -6.110 -9.580 4.353 1.00 60.34 O ATOM 1640 CB ARG A 646 -7.555 -10.096 7.170 1.00 10.03 C ATOM 1641 CG ARG A 646 -7.616 -10.353 8.677 1.00 13.45 C ATOM 1642 CD ARG A 646 -9.058 -10.288 9.186 1.00 23.35 C ATOM 1643 NE ARG A 646 -9.987 -10.765 8.138 1.00 44.05 N ATOM 1644 CZ ARG A 646 -11.303 -10.468 8.100 1.00 20.04 C ATOM 1645 NH1 ARG A 646 -11.857 -9.692 9.056 1.00 54.44 N ATOM 1646 NH2 ARG A 646 -12.040 -10.948 7.116 1.00 21.32 N ATOM 0 H ARG A 646 -6.948 -7.691 7.048 1.00 51.50 H new ATOM 0 HA ARG A 646 -5.437 -9.954 7.489 1.00 51.14 H new ATOM 0 HB2 ARG A 646 -8.301 -9.351 6.894 1.00 10.03 H new ATOM 0 HB3 ARG A 646 -7.803 -11.011 6.631 1.00 10.03 H new ATOM 0 HG2 ARG A 646 -7.191 -11.332 8.900 1.00 13.45 H new ATOM 0 HG3 ARG A 646 -7.008 -9.615 9.200 1.00 13.45 H new ATOM 0 HD2 ARG A 646 -9.164 -10.899 10.083 1.00 23.35 H new ATOM 0 HD3 ARG A 646 -9.308 -9.265 9.466 1.00 23.35 H new ATOM 0 HE ARG A 646 -9.609 -11.356 7.397 1.00 44.05 H new ATOM 0 HH11 ARG A 646 -11.280 -9.326 9.813 1.00 54.44 H new ATOM 0 HH12 ARG A 646 -12.852 -9.472 9.021 1.00 54.44 H new ATOM 0 HH21 ARG A 646 -11.613 -11.534 6.399 1.00 21.32 H new ATOM 0 HH22 ARG A 646 -13.036 -10.733 7.073 1.00 21.32 H new ATOM 1659 N ILE A 647 -5.210 -11.368 5.406 1.00 73.03 N ATOM 1660 CA ILE A 647 -4.824 -12.039 4.176 1.00 54.53 C ATOM 1661 C ILE A 647 -5.175 -13.524 4.278 1.00 35.20 C ATOM 1662 O ILE A 647 -4.702 -14.217 5.177 1.00 20.03 O ATOM 1663 CB ILE A 647 -3.350 -11.775 3.862 1.00 73.14 C ATOM 1664 CG1 ILE A 647 -3.105 -10.290 3.586 1.00 74.24 C ATOM 1665 CG2 ILE A 647 -2.869 -12.659 2.710 1.00 63.43 C ATOM 1666 CD1 ILE A 647 -1.727 -9.859 4.090 1.00 43.04 C ATOM 0 H ILE A 647 -4.972 -11.873 6.260 1.00 73.03 H new ATOM 0 HA ILE A 647 -5.383 -11.637 3.331 1.00 54.53 H new ATOM 0 HB ILE A 647 -2.761 -12.040 4.740 1.00 73.14 H new ATOM 0 HG12 ILE A 647 -3.181 -10.098 2.516 1.00 74.24 H new ATOM 0 HG13 ILE A 647 -3.877 -9.694 4.073 1.00 74.24 H new ATOM 0 HG21 ILE A 647 -1.818 -12.452 2.507 1.00 63.43 H new ATOM 0 HG22 ILE A 647 -2.986 -13.708 2.983 1.00 63.43 H new ATOM 0 HG23 ILE A 647 -3.460 -12.448 1.818 1.00 63.43 H new ATOM 0 HD11 ILE A 647 -1.578 -8.800 3.881 1.00 43.04 H new ATOM 0 HD12 ILE A 647 -1.663 -10.030 5.165 1.00 43.04 H new ATOM 0 HD13 ILE A 647 -0.956 -10.440 3.584 1.00 43.04 H new ATOM 1678 N GLN A 648 -6.003 -13.970 3.344 1.00 43.41 N ATOM 1679 CA GLN A 648 -6.423 -15.360 3.318 1.00 63.44 C ATOM 1680 C GLN A 648 -5.893 -16.051 2.059 1.00 33.12 C ATOM 1681 O GLN A 648 -6.345 -15.763 0.952 1.00 32.11 O ATOM 1682 CB GLN A 648 -7.946 -15.475 3.406 1.00 23.03 C ATOM 1683 CG GLN A 648 -8.362 -16.843 3.951 1.00 41.02 C ATOM 1684 CD GLN A 648 -8.522 -17.858 2.818 1.00 75.45 C ATOM 1685 OE1 GLN A 648 -7.562 -18.345 2.245 1.00 65.50 O ATOM 1686 NE2 GLN A 648 -9.787 -18.149 2.527 1.00 73.30 N ATOM 0 H GLN A 648 -6.394 -13.392 2.600 1.00 43.41 H new ATOM 0 HA GLN A 648 -6.003 -15.862 4.189 1.00 63.44 H new ATOM 0 HB2 GLN A 648 -8.337 -14.688 4.051 1.00 23.03 H new ATOM 0 HB3 GLN A 648 -8.383 -15.324 2.419 1.00 23.03 H new ATOM 0 HG2 GLN A 648 -7.614 -17.199 4.660 1.00 41.02 H new ATOM 0 HG3 GLN A 648 -9.301 -16.751 4.497 1.00 41.02 H new ATOM 0 HE21 GLN A 648 -10.545 -17.705 3.046 1.00 73.30 H new ATOM 0 HE22 GLN A 648 -9.999 -18.816 1.785 1.00 73.30 H new ATOM 1695 N ALA A 649 -4.943 -16.949 2.271 1.00 22.43 N ATOM 1696 CA ALA A 649 -4.347 -17.683 1.168 1.00 70.42 C ATOM 1697 C ALA A 649 -4.690 -19.168 1.304 1.00 32.12 C ATOM 1698 O ALA A 649 -5.079 -19.623 2.379 1.00 54.22 O ATOM 1699 CB ALA A 649 -2.838 -17.434 1.144 1.00 3.41 C ATOM 0 H ALA A 649 -4.571 -17.185 3.191 1.00 22.43 H new ATOM 0 HA ALA A 649 -4.750 -17.337 0.216 1.00 70.42 H new ATOM 0 HB1 ALA A 649 -2.391 -17.985 0.316 1.00 3.41 H new ATOM 0 HB2 ALA A 649 -2.647 -16.369 1.016 1.00 3.41 H new ATOM 0 HB3 ALA A 649 -2.399 -17.771 2.083 1.00 3.41 H new ATOM 1705 N LYS A 650 -4.534 -19.883 0.200 1.00 44.24 N ATOM 1706 CA LYS A 650 -4.822 -21.307 0.182 1.00 11.24 C ATOM 1707 C LYS A 650 -3.515 -22.086 0.024 1.00 3.34 C ATOM 1708 O LYS A 650 -3.479 -23.296 0.240 1.00 31.21 O ATOM 1709 CB LYS A 650 -5.864 -21.630 -0.891 1.00 3.42 C ATOM 1710 CG LYS A 650 -6.981 -20.584 -0.903 1.00 3.12 C ATOM 1711 CD LYS A 650 -8.274 -21.170 -1.472 1.00 53.00 C ATOM 1712 CE LYS A 650 -9.350 -20.091 -1.611 1.00 34.34 C ATOM 1713 NZ LYS A 650 -9.154 -19.321 -2.859 1.00 53.00 N ATOM 0 H LYS A 650 -4.211 -19.502 -0.690 1.00 44.24 H new ATOM 0 HA LYS A 650 -5.266 -21.617 1.128 1.00 11.24 H new ATOM 0 HB2 LYS A 650 -5.385 -21.667 -1.869 1.00 3.42 H new ATOM 0 HB3 LYS A 650 -6.287 -22.617 -0.706 1.00 3.42 H new ATOM 0 HG2 LYS A 650 -7.156 -20.222 0.110 1.00 3.12 H new ATOM 0 HG3 LYS A 650 -6.673 -19.725 -1.499 1.00 3.12 H new ATOM 0 HD2 LYS A 650 -8.077 -21.619 -2.445 1.00 53.00 H new ATOM 0 HD3 LYS A 650 -8.634 -21.966 -0.821 1.00 53.00 H new ATOM 0 HE2 LYS A 650 -10.338 -20.552 -1.613 1.00 34.34 H new ATOM 0 HE3 LYS A 650 -9.313 -19.420 -0.753 1.00 34.34 H new ATOM 0 HZ1 LYS A 650 -9.893 -18.593 -2.937 1.00 53.00 H new ATOM 0 HZ2 LYS A 650 -8.219 -18.865 -2.843 1.00 53.00 H new ATOM 0 HZ3 LYS A 650 -9.212 -19.963 -3.675 1.00 53.00 H new ATOM 1726 N LYS A 651 -2.472 -21.359 -0.351 1.00 31.42 N ATOM 1727 CA LYS A 651 -1.166 -21.967 -0.540 1.00 62.12 C ATOM 1728 C LYS A 651 -0.152 -21.282 0.378 1.00 24.42 C ATOM 1729 O LYS A 651 -0.042 -20.057 0.383 1.00 24.34 O ATOM 1730 CB LYS A 651 -0.772 -21.942 -2.019 1.00 13.45 C ATOM 1731 CG LYS A 651 -1.413 -23.106 -2.777 1.00 15.52 C ATOM 1732 CD LYS A 651 -0.705 -24.424 -2.459 1.00 1.21 C ATOM 1733 CE LYS A 651 0.582 -24.565 -3.274 1.00 40.12 C ATOM 1734 NZ LYS A 651 1.089 -25.954 -3.206 1.00 51.21 N ATOM 0 H LYS A 651 -2.505 -20.355 -0.529 1.00 31.42 H new ATOM 0 HA LYS A 651 -1.191 -23.020 -0.259 1.00 62.12 H new ATOM 0 HB2 LYS A 651 -1.082 -20.997 -2.466 1.00 13.45 H new ATOM 0 HB3 LYS A 651 0.313 -21.997 -2.111 1.00 13.45 H new ATOM 0 HG2 LYS A 651 -2.467 -23.182 -2.510 1.00 15.52 H new ATOM 0 HG3 LYS A 651 -1.369 -22.915 -3.849 1.00 15.52 H new ATOM 0 HD2 LYS A 651 -0.473 -24.469 -1.395 1.00 1.21 H new ATOM 0 HD3 LYS A 651 -1.370 -25.260 -2.675 1.00 1.21 H new ATOM 0 HE2 LYS A 651 0.394 -24.291 -4.312 1.00 40.12 H new ATOM 0 HE3 LYS A 651 1.337 -23.877 -2.894 1.00 40.12 H new ATOM 0 HZ1 LYS A 651 1.963 -26.032 -3.764 1.00 51.21 H new ATOM 0 HZ2 LYS A 651 1.287 -26.203 -2.216 1.00 51.21 H new ATOM 0 HZ3 LYS A 651 0.374 -26.604 -3.590 1.00 51.21 H new ATOM 1747 N TRP A 652 0.564 -22.103 1.133 1.00 72.31 N ATOM 1748 CA TRP A 652 1.565 -21.592 2.053 1.00 23.13 C ATOM 1749 C TRP A 652 2.674 -20.935 1.229 1.00 52.05 C ATOM 1750 O TRP A 652 3.438 -20.122 1.746 1.00 40.54 O ATOM 1751 CB TRP A 652 2.081 -22.701 2.973 1.00 45.42 C ATOM 1752 CG TRP A 652 0.992 -23.369 3.814 1.00 2.11 C ATOM 1753 CD1 TRP A 652 0.088 -24.277 3.422 1.00 13.43 C ATOM 1754 CD2 TRP A 652 0.728 -23.144 5.215 1.00 4.40 C ATOM 1755 NE1 TRP A 652 -0.737 -24.651 4.464 1.00 63.41 N ATOM 1756 CE2 TRP A 652 -0.334 -23.941 5.589 1.00 54.54 C ATOM 1757 CE3 TRP A 652 1.367 -22.295 6.136 1.00 11.31 C ATOM 1758 CZ2 TRP A 652 -0.853 -23.967 6.889 1.00 64.31 C ATOM 1759 CZ3 TRP A 652 0.837 -22.333 7.431 1.00 21.05 C ATOM 1760 CH2 TRP A 652 -0.232 -23.130 7.824 1.00 54.45 C ATOM 0 H TRP A 652 0.470 -23.119 1.126 1.00 72.31 H new ATOM 0 HA TRP A 652 1.133 -20.842 2.715 1.00 23.13 H new ATOM 0 HB2 TRP A 652 2.575 -23.461 2.367 1.00 45.42 H new ATOM 0 HB3 TRP A 652 2.836 -22.284 3.640 1.00 45.42 H new ATOM 0 HD1 TRP A 652 0.014 -24.667 2.418 1.00 13.43 H new ATOM 0 HE1 TRP A 652 -1.502 -25.324 4.417 1.00 63.41 H new ATOM 0 HE3 TRP A 652 2.201 -21.664 5.866 1.00 11.31 H new ATOM 0 HZ2 TRP A 652 -1.687 -24.599 7.156 1.00 64.31 H new ATOM 0 HZ3 TRP A 652 1.291 -21.698 8.178 1.00 21.05 H new ATOM 0 HH2 TRP A 652 -0.582 -23.104 8.845 1.00 54.45 H new ATOM 1771 N SER A 653 2.726 -21.312 -0.040 1.00 62.34 N ATOM 1772 CA SER A 653 3.728 -20.770 -0.942 1.00 5.22 C ATOM 1773 C SER A 653 3.479 -19.277 -1.164 1.00 52.24 C ATOM 1774 O SER A 653 4.360 -18.560 -1.637 1.00 32.13 O ATOM 1775 CB SER A 653 3.727 -21.513 -2.279 1.00 32.31 C ATOM 1776 OG SER A 653 4.274 -20.722 -3.330 1.00 73.14 O ATOM 0 H SER A 653 2.090 -21.987 -0.465 1.00 62.34 H new ATOM 0 HA SER A 653 4.708 -20.905 -0.484 1.00 5.22 H new ATOM 0 HB2 SER A 653 4.301 -22.434 -2.182 1.00 32.31 H new ATOM 0 HB3 SER A 653 2.707 -21.799 -2.534 1.00 32.31 H new ATOM 0 HG SER A 653 4.257 -21.232 -4.166 1.00 73.14 H new ATOM 1782 N ARG A 654 2.274 -18.852 -0.813 1.00 72.35 N ATOM 1783 CA ARG A 654 1.897 -17.458 -0.969 1.00 0.41 C ATOM 1784 C ARG A 654 1.936 -16.743 0.384 1.00 73.34 C ATOM 1785 O ARG A 654 2.111 -15.527 0.443 1.00 70.34 O ATOM 1786 CB ARG A 654 0.494 -17.329 -1.566 1.00 21.33 C ATOM 1787 CG ARG A 654 0.204 -18.476 -2.536 1.00 42.14 C ATOM 1788 CD ARG A 654 1.113 -18.397 -3.765 1.00 32.21 C ATOM 1789 NE ARG A 654 0.428 -18.982 -4.939 1.00 53.34 N ATOM 1790 CZ ARG A 654 0.266 -20.307 -5.139 1.00 51.02 C ATOM 1791 NH1 ARG A 654 0.740 -21.198 -4.243 1.00 12.04 N ATOM 1792 NH2 ARG A 654 -0.362 -20.719 -6.225 1.00 14.53 N ATOM 0 H ARG A 654 1.546 -19.449 -0.421 1.00 72.35 H new ATOM 0 HA ARG A 654 2.612 -16.996 -1.649 1.00 0.41 H new ATOM 0 HB2 ARG A 654 -0.247 -17.328 -0.766 1.00 21.33 H new ATOM 0 HB3 ARG A 654 0.402 -16.376 -2.087 1.00 21.33 H new ATOM 0 HG2 ARG A 654 0.351 -19.431 -2.031 1.00 42.14 H new ATOM 0 HG3 ARG A 654 -0.840 -18.438 -2.848 1.00 42.14 H new ATOM 0 HD2 ARG A 654 1.376 -17.359 -3.967 1.00 32.21 H new ATOM 0 HD3 ARG A 654 2.044 -18.930 -3.574 1.00 32.21 H new ATOM 0 HE ARG A 654 0.055 -18.344 -5.641 1.00 53.34 H new ATOM 0 HH11 ARG A 654 1.225 -20.872 -3.407 1.00 12.04 H new ATOM 0 HH12 ARG A 654 0.613 -22.198 -4.402 1.00 12.04 H new ATOM 0 HH21 ARG A 654 -0.716 -20.039 -6.898 1.00 14.53 H new ATOM 0 HH22 ARG A 654 -0.493 -21.717 -6.391 1.00 14.53 H new ATOM 1805 N VAL A 655 1.769 -17.530 1.437 1.00 43.51 N ATOM 1806 CA VAL A 655 1.783 -16.987 2.785 1.00 30.40 C ATOM 1807 C VAL A 655 2.875 -15.921 2.890 1.00 11.21 C ATOM 1808 O VAL A 655 4.004 -16.138 2.453 1.00 52.14 O ATOM 1809 CB VAL A 655 1.952 -18.118 3.802 1.00 32.00 C ATOM 1810 CG1 VAL A 655 2.703 -17.632 5.043 1.00 41.42 C ATOM 1811 CG2 VAL A 655 0.598 -18.720 4.182 1.00 73.52 C ATOM 0 H VAL A 655 1.623 -18.538 1.384 1.00 43.51 H new ATOM 0 HA VAL A 655 0.833 -16.502 3.012 1.00 30.40 H new ATOM 0 HB VAL A 655 2.548 -18.902 3.335 1.00 32.00 H new ATOM 0 HG11 VAL A 655 2.809 -18.455 5.749 1.00 41.42 H new ATOM 0 HG12 VAL A 655 3.690 -17.273 4.753 1.00 41.42 H new ATOM 0 HG13 VAL A 655 2.145 -16.821 5.512 1.00 41.42 H new ATOM 0 HG21 VAL A 655 0.746 -19.521 4.906 1.00 73.52 H new ATOM 0 HG22 VAL A 655 -0.034 -17.947 4.620 1.00 73.52 H new ATOM 0 HG23 VAL A 655 0.115 -19.121 3.291 1.00 73.52 H new ATOM 1821 N PRO A 656 2.490 -14.762 3.488 1.00 3.42 N ATOM 1822 CA PRO A 656 3.424 -13.661 3.656 1.00 14.33 C ATOM 1823 C PRO A 656 4.418 -13.952 4.782 1.00 42.01 C ATOM 1824 O PRO A 656 5.629 -13.907 4.572 1.00 3.31 O ATOM 1825 CB PRO A 656 2.553 -12.446 3.932 1.00 1.34 C ATOM 1826 CG PRO A 656 1.203 -12.991 4.369 1.00 51.34 C ATOM 1827 CD PRO A 656 1.162 -14.469 4.018 1.00 32.13 C ATOM 0 HA PRO A 656 4.045 -13.498 2.775 1.00 14.33 H new ATOM 0 HB2 PRO A 656 2.991 -11.820 4.709 1.00 1.34 H new ATOM 0 HB3 PRO A 656 2.454 -11.826 3.041 1.00 1.34 H new ATOM 0 HG2 PRO A 656 1.063 -12.849 5.441 1.00 51.34 H new ATOM 0 HG3 PRO A 656 0.395 -12.457 3.868 1.00 51.34 H new ATOM 0 HD2 PRO A 656 0.943 -15.078 4.895 1.00 32.13 H new ATOM 0 HD3 PRO A 656 0.387 -14.680 3.281 1.00 32.13 H new ATOM 1835 N PHE A 657 3.870 -14.245 5.952 1.00 53.31 N ATOM 1836 CA PHE A 657 4.694 -14.544 7.111 1.00 55.41 C ATOM 1837 C PHE A 657 5.576 -15.767 6.855 1.00 3.14 C ATOM 1838 O PHE A 657 5.190 -16.672 6.118 1.00 62.32 O ATOM 1839 CB PHE A 657 3.742 -14.849 8.269 1.00 31.12 C ATOM 1840 CG PHE A 657 3.079 -16.226 8.184 1.00 45.32 C ATOM 1841 CD1 PHE A 657 3.734 -17.325 8.646 1.00 72.05 C ATOM 1842 CD2 PHE A 657 1.837 -16.350 7.646 1.00 15.01 C ATOM 1843 CE1 PHE A 657 3.119 -18.602 8.566 1.00 30.51 C ATOM 1844 CE2 PHE A 657 1.222 -17.628 7.567 1.00 52.43 C ATOM 1845 CZ PHE A 657 1.876 -18.727 8.028 1.00 0.14 C ATOM 0 H PHE A 657 2.865 -14.282 6.122 1.00 53.31 H new ATOM 0 HA PHE A 657 5.346 -13.699 7.332 1.00 55.41 H new ATOM 0 HB2 PHE A 657 4.293 -14.780 9.207 1.00 31.12 H new ATOM 0 HB3 PHE A 657 2.966 -14.085 8.299 1.00 31.12 H new ATOM 0 HD1 PHE A 657 4.721 -17.226 9.073 1.00 72.05 H new ATOM 0 HD2 PHE A 657 1.318 -15.477 7.279 1.00 15.01 H new ATOM 0 HE1 PHE A 657 3.639 -19.475 8.933 1.00 30.51 H new ATOM 0 HE2 PHE A 657 0.235 -17.727 7.141 1.00 52.43 H new ATOM 0 HZ PHE A 657 1.409 -19.699 7.967 1.00 0.14 H new ATOM 1855 N SER A 658 6.745 -15.754 7.479 1.00 31.25 N ATOM 1856 CA SER A 658 7.686 -16.851 7.329 1.00 73.40 C ATOM 1857 C SER A 658 7.337 -17.978 8.304 1.00 15.51 C ATOM 1858 O SER A 658 6.837 -17.723 9.399 1.00 53.12 O ATOM 1859 CB SER A 658 9.123 -16.379 7.556 1.00 61.40 C ATOM 1860 OG SER A 658 9.301 -15.014 7.189 1.00 12.22 O ATOM 0 H SER A 658 7.062 -15.001 8.090 1.00 31.25 H new ATOM 0 HA SER A 658 7.613 -17.227 6.308 1.00 73.40 H new ATOM 0 HB2 SER A 658 9.386 -16.509 8.606 1.00 61.40 H new ATOM 0 HB3 SER A 658 9.805 -17.002 6.977 1.00 61.40 H new ATOM 0 HG SER A 658 10.231 -14.750 7.350 1.00 12.22 H new ATOM 1866 N VAL A 659 7.614 -19.199 7.871 1.00 13.35 N ATOM 1867 CA VAL A 659 7.335 -20.365 8.693 1.00 42.25 C ATOM 1868 C VAL A 659 8.613 -21.193 8.845 1.00 52.31 C ATOM 1869 O VAL A 659 9.010 -21.903 7.923 1.00 44.34 O ATOM 1870 CB VAL A 659 6.174 -21.161 8.094 1.00 64.45 C ATOM 1871 CG1 VAL A 659 5.420 -21.932 9.179 1.00 2.32 C ATOM 1872 CG2 VAL A 659 5.228 -20.248 7.312 1.00 44.15 C ATOM 0 H VAL A 659 8.028 -19.407 6.962 1.00 13.35 H new ATOM 0 HA VAL A 659 7.023 -20.063 9.693 1.00 42.25 H new ATOM 0 HB VAL A 659 6.591 -21.887 7.396 1.00 64.45 H new ATOM 0 HG11 VAL A 659 4.600 -22.489 8.726 1.00 2.32 H new ATOM 0 HG12 VAL A 659 6.101 -22.625 9.672 1.00 2.32 H new ATOM 0 HG13 VAL A 659 5.021 -21.231 9.913 1.00 2.32 H new ATOM 0 HG21 VAL A 659 4.412 -20.839 6.897 1.00 44.15 H new ATOM 0 HG22 VAL A 659 4.822 -19.487 7.979 1.00 44.15 H new ATOM 0 HG23 VAL A 659 5.775 -19.766 6.502 1.00 44.15 H new ATOM 1882 N PRO A 660 9.237 -21.071 10.047 1.00 14.12 N ATOM 1883 CA PRO A 660 10.461 -21.800 10.332 1.00 10.53 C ATOM 1884 C PRO A 660 10.171 -23.279 10.594 1.00 55.21 C ATOM 1885 O PRO A 660 9.121 -23.623 11.135 1.00 54.24 O ATOM 1886 CB PRO A 660 11.069 -21.092 11.532 1.00 22.34 C ATOM 1887 CG PRO A 660 9.940 -20.291 12.160 1.00 24.14 C ATOM 1888 CD PRO A 660 8.795 -20.239 11.163 1.00 74.40 C ATOM 0 HA PRO A 660 11.156 -21.801 9.492 1.00 10.53 H new ATOM 0 HB2 PRO A 660 11.480 -21.810 12.242 1.00 22.34 H new ATOM 0 HB3 PRO A 660 11.888 -20.440 11.227 1.00 22.34 H new ATOM 0 HG2 PRO A 660 9.615 -20.755 13.091 1.00 24.14 H new ATOM 0 HG3 PRO A 660 10.277 -19.284 12.407 1.00 24.14 H new ATOM 0 HD2 PRO A 660 7.872 -20.620 11.600 1.00 74.40 H new ATOM 0 HD3 PRO A 660 8.597 -19.217 10.841 1.00 74.40 H new ATOM 1896 N ASP A 661 11.120 -24.114 10.198 1.00 34.20 N ATOM 1897 CA ASP A 661 10.979 -25.549 10.383 1.00 11.40 C ATOM 1898 C ASP A 661 11.064 -25.877 11.875 1.00 41.20 C ATOM 1899 O ASP A 661 11.863 -25.285 12.600 1.00 74.13 O ATOM 1900 CB ASP A 661 12.097 -26.309 9.667 1.00 1.51 C ATOM 1901 CG ASP A 661 12.126 -26.136 8.147 1.00 2.22 C ATOM 1902 OD1 ASP A 661 11.435 -25.270 7.589 1.00 23.25 O ATOM 1903 OD2 ASP A 661 12.910 -26.947 7.521 1.00 32.12 O ATOM 0 H ASP A 661 11.990 -23.825 9.750 1.00 34.20 H new ATOM 0 HA ASP A 661 10.016 -25.850 9.969 1.00 11.40 H new ATOM 0 HB2 ASP A 661 13.055 -25.984 10.073 1.00 1.51 H new ATOM 0 HB3 ASP A 661 11.998 -27.370 9.895 1.00 1.51 H new ATOM 1909 N PHE A 662 10.230 -26.819 12.290 1.00 61.15 N ATOM 1910 CA PHE A 662 10.201 -27.233 13.682 1.00 22.11 C ATOM 1911 C PHE A 662 11.523 -27.888 14.087 1.00 64.11 C ATOM 1912 O PHE A 662 11.949 -28.866 13.474 1.00 31.23 O ATOM 1913 CB PHE A 662 9.074 -28.259 13.820 1.00 3.34 C ATOM 1914 CG PHE A 662 9.011 -28.932 15.193 1.00 71.22 C ATOM 1915 CD1 PHE A 662 9.952 -29.849 15.545 1.00 43.43 C ATOM 1916 CD2 PHE A 662 8.013 -28.615 16.061 1.00 43.53 C ATOM 1917 CE1 PHE A 662 9.893 -30.474 16.818 1.00 4.33 C ATOM 1918 CE2 PHE A 662 7.954 -29.240 17.334 1.00 4.44 C ATOM 1919 CZ PHE A 662 8.896 -30.156 17.686 1.00 33.12 C ATOM 0 H PHE A 662 9.569 -27.308 11.686 1.00 61.15 H new ATOM 0 HA PHE A 662 10.044 -26.367 14.325 1.00 22.11 H new ATOM 0 HB2 PHE A 662 8.122 -27.766 13.624 1.00 3.34 H new ATOM 0 HB3 PHE A 662 9.199 -29.026 13.056 1.00 3.34 H new ATOM 0 HD1 PHE A 662 10.744 -30.102 14.856 1.00 43.43 H new ATOM 0 HD2 PHE A 662 7.265 -27.888 15.782 1.00 43.53 H new ATOM 0 HE1 PHE A 662 10.640 -31.202 17.097 1.00 4.33 H new ATOM 0 HE2 PHE A 662 7.161 -28.988 18.023 1.00 4.44 H new ATOM 0 HZ PHE A 662 8.852 -30.631 18.655 1.00 33.12 H new ATOM 1929 N ASP A 663 12.136 -27.322 15.116 1.00 23.44 N ATOM 1930 CA ASP A 663 13.401 -27.839 15.610 1.00 24.13 C ATOM 1931 C ASP A 663 13.147 -28.699 16.850 1.00 70.11 C ATOM 1932 O ASP A 663 12.669 -28.201 17.868 1.00 72.12 O ATOM 1933 CB ASP A 663 14.343 -26.701 16.009 1.00 31.25 C ATOM 1934 CG ASP A 663 15.821 -27.085 16.096 1.00 23.53 C ATOM 1935 OD1 ASP A 663 16.628 -26.383 16.723 1.00 0.22 O ATOM 1936 OD2 ASP A 663 16.139 -28.172 15.477 1.00 5.34 O ATOM 0 H ASP A 663 11.780 -26.510 15.621 1.00 23.44 H new ATOM 0 HA ASP A 663 13.860 -28.425 14.813 1.00 24.13 H new ATOM 0 HB2 ASP A 663 14.236 -25.891 15.288 1.00 31.25 H new ATOM 0 HB3 ASP A 663 14.027 -26.310 16.976 1.00 31.25 H new ATOM 1942 N PHE A 664 13.478 -29.976 16.723 1.00 1.32 N ATOM 1943 CA PHE A 664 13.291 -30.910 17.821 1.00 44.34 C ATOM 1944 C PHE A 664 14.337 -30.686 18.915 1.00 12.41 C ATOM 1945 O PHE A 664 14.192 -31.187 20.029 1.00 53.10 O ATOM 1946 CB PHE A 664 13.466 -32.317 17.245 1.00 4.52 C ATOM 1947 CG PHE A 664 13.068 -33.437 18.208 1.00 1.33 C ATOM 1948 CD1 PHE A 664 11.778 -33.550 18.624 1.00 51.44 C ATOM 1949 CD2 PHE A 664 14.004 -34.319 18.649 1.00 21.41 C ATOM 1950 CE1 PHE A 664 11.408 -34.589 19.517 1.00 23.24 C ATOM 1951 CE2 PHE A 664 13.634 -35.359 19.543 1.00 4.10 C ATOM 1952 CZ PHE A 664 12.344 -35.472 19.958 1.00 2.13 C ATOM 0 H PHE A 664 13.874 -30.386 15.877 1.00 1.32 H new ATOM 0 HA PHE A 664 12.305 -30.771 18.264 1.00 44.34 H new ATOM 0 HB2 PHE A 664 12.870 -32.404 16.337 1.00 4.52 H new ATOM 0 HB3 PHE A 664 14.508 -32.453 16.956 1.00 4.52 H new ATOM 0 HD1 PHE A 664 11.035 -32.849 18.275 1.00 51.44 H new ATOM 0 HD2 PHE A 664 15.029 -34.229 18.320 1.00 21.41 H new ATOM 0 HE1 PHE A 664 10.383 -34.679 19.846 1.00 23.24 H new ATOM 0 HE2 PHE A 664 14.377 -36.060 19.893 1.00 4.10 H new ATOM 0 HZ PHE A 664 12.063 -36.263 20.638 1.00 2.13 H new ATOM 1962 N LEU A 665 15.367 -29.932 18.560 1.00 71.03 N ATOM 1963 CA LEU A 665 16.436 -29.635 19.498 1.00 61.41 C ATOM 1964 C LEU A 665 16.037 -28.433 20.356 1.00 71.11 C ATOM 1965 O LEU A 665 16.268 -28.424 21.564 1.00 34.21 O ATOM 1966 CB LEU A 665 17.762 -29.449 18.758 1.00 62.53 C ATOM 1967 CG LEU A 665 18.050 -30.449 17.635 1.00 14.23 C ATOM 1968 CD1 LEU A 665 19.500 -30.338 17.161 1.00 72.13 C ATOM 1969 CD2 LEU A 665 17.694 -31.874 18.065 1.00 5.54 C ATOM 0 H LEU A 665 15.484 -29.518 17.635 1.00 71.03 H new ATOM 0 HA LEU A 665 16.591 -30.474 20.176 1.00 61.41 H new ATOM 0 HB2 LEU A 665 17.782 -28.444 18.337 1.00 62.53 H new ATOM 0 HB3 LEU A 665 18.572 -29.506 19.485 1.00 62.53 H new ATOM 0 HG LEU A 665 17.414 -30.201 16.785 1.00 14.23 H new ATOM 0 HD11 LEU A 665 19.678 -31.059 16.363 1.00 72.13 H new ATOM 0 HD12 LEU A 665 19.685 -29.331 16.788 1.00 72.13 H new ATOM 0 HD13 LEU A 665 20.172 -30.545 17.994 1.00 72.13 H new ATOM 0 HD21 LEU A 665 17.908 -32.564 17.249 1.00 5.54 H new ATOM 0 HD22 LEU A 665 18.286 -32.149 18.938 1.00 5.54 H new ATOM 0 HD23 LEU A 665 16.634 -31.925 18.314 1.00 5.54 H new ATOM 1981 N GLN A 666 15.445 -27.447 19.698 1.00 60.44 N ATOM 1982 CA GLN A 666 15.012 -26.243 20.385 1.00 54.20 C ATOM 1983 C GLN A 666 13.645 -26.466 21.037 1.00 43.25 C ATOM 1984 O GLN A 666 13.488 -26.269 22.240 1.00 3.25 O ATOM 1985 CB GLN A 666 14.975 -25.049 19.429 1.00 74.13 C ATOM 1986 CG GLN A 666 14.934 -23.729 20.201 1.00 54.10 C ATOM 1987 CD GLN A 666 15.607 -22.608 19.407 1.00 51.24 C ATOM 1988 OE1 GLN A 666 15.069 -22.084 18.445 1.00 40.10 O ATOM 1989 NE2 GLN A 666 16.810 -22.270 19.861 1.00 65.42 N ATOM 0 H GLN A 666 15.255 -27.458 18.696 1.00 60.44 H new ATOM 0 HA GLN A 666 15.734 -26.016 21.169 1.00 54.20 H new ATOM 0 HB2 GLN A 666 15.852 -25.069 18.782 1.00 74.13 H new ATOM 0 HB3 GLN A 666 14.101 -25.123 18.782 1.00 74.13 H new ATOM 0 HG2 GLN A 666 13.899 -23.459 20.412 1.00 54.10 H new ATOM 0 HG3 GLN A 666 15.434 -23.850 21.162 1.00 54.10 H new ATOM 0 HE21 GLN A 666 17.202 -22.749 20.672 1.00 65.42 H new ATOM 0 HE22 GLN A 666 17.341 -21.532 19.399 1.00 65.42 H new ATOM 1998 N HIS A 667 12.692 -26.874 20.212 1.00 13.31 N ATOM 1999 CA HIS A 667 11.344 -27.126 20.693 1.00 11.31 C ATOM 2000 C HIS A 667 11.403 -27.983 21.959 1.00 13.42 C ATOM 2001 O HIS A 667 10.607 -27.794 22.878 1.00 23.14 O ATOM 2002 CB HIS A 667 10.483 -27.750 19.594 1.00 73.53 C ATOM 2003 CG HIS A 667 9.001 -27.519 19.768 1.00 13.14 C ATOM 2004 ND1 HIS A 667 8.114 -28.536 20.075 1.00 20.30 N ATOM 2005 CD2 HIS A 667 8.260 -26.377 19.677 1.00 22.12 C ATOM 2006 CE1 HIS A 667 6.897 -28.019 20.161 1.00 4.02 C ATOM 2007 NE2 HIS A 667 6.990 -26.681 19.914 1.00 50.22 N ATOM 0 H HIS A 667 12.826 -27.036 19.214 1.00 13.31 H new ATOM 0 HA HIS A 667 10.866 -26.183 20.957 1.00 11.31 H new ATOM 0 HB2 HIS A 667 10.793 -27.345 18.631 1.00 73.53 H new ATOM 0 HB3 HIS A 667 10.672 -28.823 19.564 1.00 73.53 H new ATOM 0 HD1 HIS A 667 8.356 -29.517 20.212 1.00 20.30 H new ATOM 0 HD2 HIS A 667 8.642 -25.393 19.451 1.00 22.12 H new ATOM 0 HE1 HIS A 667 5.991 -28.562 20.387 1.00 4.02 H new ATOM 2015 N CYS A 668 12.353 -28.906 21.966 1.00 34.15 N ATOM 2016 CA CYS A 668 12.526 -29.793 23.105 1.00 52.24 C ATOM 2017 C CYS A 668 13.111 -28.981 24.262 1.00 53.43 C ATOM 2018 O CYS A 668 12.642 -29.081 25.395 1.00 60.15 O ATOM 2019 CB CYS A 668 13.400 -30.999 22.754 1.00 1.53 C ATOM 2020 SG CYS A 668 13.641 -32.048 24.234 1.00 13.11 S ATOM 0 H CYS A 668 13.011 -29.059 21.202 1.00 34.15 H new ATOM 0 HA CYS A 668 11.560 -30.201 23.402 1.00 52.24 H new ATOM 0 HB2 CYS A 668 12.931 -31.579 21.959 1.00 1.53 H new ATOM 0 HB3 CYS A 668 14.365 -30.662 22.376 1.00 1.53 H new ATOM 0 HG CYS A 668 14.383 -33.070 23.925 1.00 13.11 H new ATOM 2026 N ALA A 669 14.126 -28.194 23.937 1.00 40.13 N ATOM 2027 CA ALA A 669 14.780 -27.365 24.935 1.00 52.20 C ATOM 2028 C ALA A 669 13.822 -26.258 25.379 1.00 35.04 C ATOM 2029 O ALA A 669 14.079 -25.567 26.364 1.00 63.11 O ATOM 2030 CB ALA A 669 16.086 -26.810 24.362 1.00 33.34 C ATOM 0 H ALA A 669 14.512 -28.113 22.996 1.00 40.13 H new ATOM 0 HA ALA A 669 15.035 -27.954 25.816 1.00 52.20 H new ATOM 0 HB1 ALA A 669 16.577 -26.188 25.111 1.00 33.34 H new ATOM 0 HB2 ALA A 669 16.743 -27.635 24.089 1.00 33.34 H new ATOM 0 HB3 ALA A 669 15.870 -26.211 23.478 1.00 33.34 H new ATOM 2036 N GLU A 670 12.736 -26.124 24.632 1.00 52.00 N ATOM 2037 CA GLU A 670 11.738 -25.113 24.937 1.00 53.14 C ATOM 2038 C GLU A 670 10.759 -25.634 25.991 1.00 54.04 C ATOM 2039 O GLU A 670 10.274 -24.870 26.824 1.00 32.20 O ATOM 2040 CB GLU A 670 10.998 -24.674 23.671 1.00 4.52 C ATOM 2041 CG GLU A 670 11.703 -23.488 23.008 1.00 31.31 C ATOM 2042 CD GLU A 670 10.741 -22.715 22.103 1.00 64.51 C ATOM 2043 OE1 GLU A 670 10.598 -23.054 20.919 1.00 51.34 O ATOM 2044 OE2 GLU A 670 10.130 -21.732 22.671 1.00 40.43 O ATOM 0 H GLU A 670 12.525 -26.699 23.816 1.00 52.00 H new ATOM 0 HA GLU A 670 12.247 -24.239 25.343 1.00 53.14 H new ATOM 0 HB2 GLU A 670 10.943 -25.507 22.970 1.00 4.52 H new ATOM 0 HB3 GLU A 670 9.973 -24.399 23.921 1.00 4.52 H new ATOM 0 HG2 GLU A 670 12.101 -22.823 23.774 1.00 31.31 H new ATOM 0 HG3 GLU A 670 12.551 -23.845 22.423 1.00 31.31 H new ATOM 2052 N ASN A 671 10.497 -26.931 25.919 1.00 1.23 N ATOM 2053 CA ASN A 671 9.585 -27.563 26.857 1.00 13.10 C ATOM 2054 C ASN A 671 10.377 -28.093 28.054 1.00 14.42 C ATOM 2055 O ASN A 671 9.838 -28.216 29.153 1.00 25.24 O ATOM 2056 CB ASN A 671 8.860 -28.745 26.209 1.00 4.42 C ATOM 2057 CG ASN A 671 7.704 -28.264 25.330 1.00 10.22 C ATOM 2058 OD1 ASN A 671 6.540 -28.503 25.606 1.00 53.22 O ATOM 2059 ND2 ASN A 671 8.088 -27.575 24.260 1.00 44.43 N ATOM 0 H ASN A 671 10.900 -27.561 25.226 1.00 1.23 H new ATOM 0 HA ASN A 671 8.853 -26.818 27.169 1.00 13.10 H new ATOM 0 HB2 ASN A 671 9.563 -29.322 25.608 1.00 4.42 H new ATOM 0 HB3 ASN A 671 8.480 -29.412 26.983 1.00 4.42 H new ATOM 0 HD21 ASN A 671 7.391 -27.211 23.611 1.00 44.43 H new ATOM 0 HD22 ASN A 671 9.080 -27.411 24.088 1.00 44.43 H new ATOM 2066 N LEU A 672 11.642 -28.391 27.800 1.00 22.34 N ATOM 2067 CA LEU A 672 12.514 -28.905 28.844 1.00 54.24 C ATOM 2068 C LEU A 672 13.240 -27.738 29.515 1.00 3.03 C ATOM 2069 O LEU A 672 13.159 -27.569 30.731 1.00 4.10 O ATOM 2070 CB LEU A 672 13.454 -29.972 28.279 1.00 12.22 C ATOM 2071 CG LEU A 672 12.782 -31.215 27.692 1.00 42.33 C ATOM 2072 CD1 LEU A 672 13.650 -32.457 27.900 1.00 21.24 C ATOM 2073 CD2 LEU A 672 11.374 -31.397 28.261 1.00 73.44 C ATOM 0 H LEU A 672 12.085 -28.287 26.887 1.00 22.34 H new ATOM 0 HA LEU A 672 11.931 -29.405 29.617 1.00 54.24 H new ATOM 0 HB2 LEU A 672 14.067 -29.514 27.503 1.00 12.22 H new ATOM 0 HB3 LEU A 672 14.130 -30.289 29.073 1.00 12.22 H new ATOM 0 HG LEU A 672 12.678 -31.072 26.616 1.00 42.33 H new ATOM 0 HD11 LEU A 672 13.149 -33.326 27.474 1.00 21.24 H new ATOM 0 HD12 LEU A 672 14.612 -32.315 27.408 1.00 21.24 H new ATOM 0 HD13 LEU A 672 13.808 -32.616 28.967 1.00 21.24 H new ATOM 0 HD21 LEU A 672 10.919 -32.287 27.827 1.00 73.44 H new ATOM 0 HD22 LEU A 672 11.431 -31.509 29.344 1.00 73.44 H new ATOM 0 HD23 LEU A 672 10.768 -30.524 28.018 1.00 73.44 H new ATOM 2085 N SER A 673 13.934 -26.963 28.694 1.00 32.14 N ATOM 2086 CA SER A 673 14.674 -25.817 29.194 1.00 42.11 C ATOM 2087 C SER A 673 15.802 -26.284 30.116 1.00 65.23 C ATOM 2088 O SER A 673 16.337 -25.498 30.897 1.00 73.14 O ATOM 2089 CB SER A 673 13.752 -24.846 29.934 1.00 43.54 C ATOM 2090 OG SER A 673 13.174 -23.884 29.055 1.00 62.12 O ATOM 0 H SER A 673 13.999 -27.106 27.686 1.00 32.14 H new ATOM 0 HA SER A 673 15.104 -25.290 28.342 1.00 42.11 H new ATOM 0 HB2 SER A 673 12.959 -25.406 30.431 1.00 43.54 H new ATOM 0 HB3 SER A 673 14.316 -24.333 30.713 1.00 43.54 H new ATOM 0 HG SER A 673 13.314 -24.164 28.126 1.00 62.12 H new ATOM 2096 N ASP A 674 16.132 -27.562 29.994 1.00 13.24 N ATOM 2097 CA ASP A 674 17.187 -28.143 30.807 1.00 33.10 C ATOM 2098 C ASP A 674 18.498 -27.401 30.540 1.00 14.34 C ATOM 2099 O ASP A 674 19.391 -27.388 31.386 1.00 50.12 O ATOM 2100 CB ASP A 674 17.400 -29.618 30.460 1.00 14.13 C ATOM 2101 CG ASP A 674 18.363 -30.367 31.383 1.00 12.25 C ATOM 2102 OD1 ASP A 674 19.219 -31.137 30.924 1.00 73.41 O ATOM 2103 OD2 ASP A 674 18.207 -30.130 32.642 1.00 52.21 O ATOM 0 H ASP A 674 15.687 -28.211 29.345 1.00 13.24 H new ATOM 0 HA ASP A 674 16.893 -28.057 31.853 1.00 33.10 H new ATOM 0 HB2 ASP A 674 16.434 -30.123 30.480 1.00 14.13 H new ATOM 0 HB3 ASP A 674 17.774 -29.685 29.438 1.00 14.13 H new ATOM 2109 N LEU A 675 18.571 -26.800 29.362 1.00 63.34 N ATOM 2110 CA LEU A 675 19.758 -26.058 28.973 1.00 41.50 C ATOM 2111 C LEU A 675 19.915 -24.841 29.888 1.00 65.24 C ATOM 2112 O LEU A 675 20.800 -24.813 30.742 1.00 35.04 O ATOM 2113 CB LEU A 675 19.706 -25.705 27.485 1.00 65.51 C ATOM 2114 CG LEU A 675 20.299 -26.743 26.529 1.00 1.02 C ATOM 2115 CD1 LEU A 675 20.391 -28.115 27.199 1.00 64.52 C ATOM 2116 CD2 LEU A 675 19.510 -26.796 25.220 1.00 50.04 C ATOM 0 H LEU A 675 17.827 -26.812 28.664 1.00 63.34 H new ATOM 0 HA LEU A 675 20.650 -26.672 29.100 1.00 41.50 H new ATOM 0 HB2 LEU A 675 18.665 -25.537 27.208 1.00 65.51 H new ATOM 0 HB3 LEU A 675 20.231 -24.762 27.337 1.00 65.51 H new ATOM 0 HG LEU A 675 21.315 -26.437 26.280 1.00 1.02 H new ATOM 0 HD11 LEU A 675 20.815 -28.834 26.499 1.00 64.52 H new ATOM 0 HD12 LEU A 675 21.028 -28.047 28.081 1.00 64.52 H new ATOM 0 HD13 LEU A 675 19.395 -28.442 27.496 1.00 64.52 H new ATOM 0 HD21 LEU A 675 19.952 -27.541 24.559 1.00 50.04 H new ATOM 0 HD22 LEU A 675 18.475 -27.065 25.430 1.00 50.04 H new ATOM 0 HD23 LEU A 675 19.540 -25.819 24.737 1.00 50.04 H new ATOM 2128 N SER A 676 19.044 -23.866 29.677 1.00 42.43 N ATOM 2129 CA SER A 676 19.075 -22.650 30.472 1.00 43.44 C ATOM 2130 C SER A 676 17.788 -21.851 30.257 1.00 41.14 C ATOM 2131 O SER A 676 17.152 -21.962 29.210 1.00 50.23 O ATOM 2132 CB SER A 676 20.295 -21.795 30.123 1.00 41.44 C ATOM 2133 OG SER A 676 21.518 -22.470 30.404 1.00 42.44 O ATOM 0 H SER A 676 18.312 -23.893 28.967 1.00 42.43 H new ATOM 0 HA SER A 676 19.150 -22.930 31.523 1.00 43.44 H new ATOM 0 HB2 SER A 676 20.262 -21.530 29.066 1.00 41.44 H new ATOM 0 HB3 SER A 676 20.258 -20.863 30.687 1.00 41.44 H new ATOM 0 HG SER A 676 21.337 -23.259 30.957 1.00 42.44 H new ATOM 2139 N LEU A 677 17.443 -21.064 31.265 1.00 52.43 N ATOM 2140 CA LEU A 677 16.243 -20.247 31.199 1.00 10.42 C ATOM 2141 C LEU A 677 16.576 -18.913 30.528 1.00 54.33 C ATOM 2142 O LEU A 677 16.096 -18.629 29.431 1.00 63.20 O ATOM 2143 CB LEU A 677 15.620 -20.097 32.589 1.00 70.23 C ATOM 2144 CG LEU A 677 15.119 -21.387 33.241 1.00 32.23 C ATOM 2145 CD1 LEU A 677 16.195 -22.474 33.205 1.00 71.04 C ATOM 2146 CD2 LEU A 677 14.618 -21.124 34.663 1.00 43.11 C ATOM 0 H LEU A 677 17.973 -20.975 32.132 1.00 52.43 H new ATOM 0 HA LEU A 677 15.485 -20.733 30.585 1.00 10.42 H new ATOM 0 HB2 LEU A 677 16.358 -19.642 33.249 1.00 70.23 H new ATOM 0 HB3 LEU A 677 14.784 -19.401 32.518 1.00 70.23 H new ATOM 0 HG LEU A 677 14.271 -21.754 32.663 1.00 32.23 H new ATOM 0 HD11 LEU A 677 15.813 -23.380 33.675 1.00 71.04 H new ATOM 0 HD12 LEU A 677 16.462 -22.687 32.170 1.00 71.04 H new ATOM 0 HD13 LEU A 677 17.078 -22.130 33.744 1.00 71.04 H new ATOM 0 HD21 LEU A 677 14.268 -22.057 35.104 1.00 43.11 H new ATOM 0 HD22 LEU A 677 15.431 -20.721 35.266 1.00 43.11 H new ATOM 0 HD23 LEU A 677 13.798 -20.407 34.633 1.00 43.11 H new ATOM 2158 N ASP A 678 17.394 -18.129 31.214 1.00 1.02 N ATOM 2159 CA ASP A 678 17.796 -16.832 30.698 1.00 44.31 C ATOM 2160 C ASP A 678 18.135 -16.962 29.212 1.00 51.15 C ATOM 2161 O ASP A 678 17.387 -16.488 28.357 1.00 24.22 O ATOM 2162 CB ASP A 678 19.040 -16.312 31.422 1.00 32.22 C ATOM 2163 CG ASP A 678 19.311 -14.816 31.250 1.00 71.33 C ATOM 2164 OD1 ASP A 678 18.554 -13.969 31.746 1.00 2.42 O ATOM 2165 OD2 ASP A 678 20.364 -14.529 30.563 1.00 44.12 O ATOM 0 H ASP A 678 17.790 -18.367 32.123 1.00 1.02 H new ATOM 0 HA ASP A 678 16.971 -16.137 30.854 1.00 44.31 H new ATOM 0 HB2 ASP A 678 18.939 -16.528 32.486 1.00 32.22 H new ATOM 0 HB3 ASP A 678 19.908 -16.866 31.065 1.00 32.22 H new TER 2171 ASP A 678 HETATM 2172 ZN ZN A 679 -13.459 -22.587 13.085 1.00 53.44 ZN