USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 806 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 81 HIS : no HD1:sc= -4.84! C(o=-5.3!,f=-7.3!) USER MOD Set 1.2: B 617 HIS : no HD1:sc= -0.444 K(o=-5.3,f=-8.2) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 39:sc= 0.129 USER MOD Single : B 542 GLN : amide:sc= -0.0373 X(o=-0.037,f=-0.037) USER MOD Single : B 546 THR OG1 : rot 180:sc= 0 USER MOD Single : B 548 SER OG : rot 180:sc= 0 USER MOD Single : B 549 MET CE :methyl -157:sc= -0.427 (180deg=-1.37) USER MOD Single : B 552 SER OG : rot 180:sc= 0 USER MOD Single : B 556 GLN : amide:sc= -0.0564 K(o=-0.056,f=-1.8!) USER MOD Single : B 558 GLN : amide:sc= -2.48! C(o=-2.5!,f=-6.9!) USER MOD Single : B 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 560 GLN : amide:sc= -1.19 K(o=-1.2,f=-2.2) USER MOD Single : B 561 MET CE :methyl -154:sc= -2.59 (180deg=-4.87!) USER MOD Single : B 571 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : B 573 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 574 HIS : no HD1:sc= -3.39! C(o=-3.4!,f=-2.5!) USER MOD Single : B 576 THR OG1 : rot 180:sc= 0 USER MOD Single : B 580 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.235) USER MOD Single : B 582 THR OG1 : rot 90:sc= 1.23 USER MOD Single : B 584 MET CE :methyl 147:sc= -1.55 (180deg=-3.14) USER MOD Single : B 590 ASN : amide:sc= -0.172 K(o=-0.17,f=-2.7!) USER MOD Single : B 591 SER OG : rot 180:sc= 0 USER MOD Single : B 595 HIS : no HE2:sc= 0.246 K(o=0.25,f=-1) USER MOD Single : B 596 MET CE :methyl 168:sc= -0.332 (180deg=-0.761) USER MOD Single : B 599 SER OG : rot 180:sc= 0 USER MOD Single : B 602 SER OG : rot 180:sc= 0 USER MOD Single : B 605 SER OG : rot -170:sc= -0.147 USER MOD Single : B 606 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0234) USER MOD Single : B 615 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 618 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 620 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 73 -0.478 -1.586 -3.449 1.00 0.00 N ATOM 2 CA ALA A 73 0.589 -1.451 -4.433 1.00 0.00 C ATOM 3 C ALA A 73 1.674 -0.499 -3.939 1.00 0.00 C ATOM 4 O ALA A 73 1.429 0.693 -3.751 1.00 0.00 O ATOM 5 CB ALA A 73 0.025 -0.968 -5.761 1.00 0.00 C ATOM 0 HA ALA A 73 1.041 -2.432 -4.579 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.833 -0.872 -6.486 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -0.708 -1.686 -6.128 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.455 0.001 -5.622 1.00 0.00 H new ATOM 11 N LYS A 74 2.872 -1.032 -3.730 1.00 0.00 N ATOM 12 CA LYS A 74 3.995 -0.231 -3.259 1.00 0.00 C ATOM 13 C LYS A 74 4.655 0.514 -4.414 1.00 0.00 C ATOM 14 O LYS A 74 4.499 0.160 -5.583 1.00 0.00 O ATOM 15 CB LYS A 74 5.025 -1.120 -2.557 1.00 0.00 C ATOM 16 CG LYS A 74 4.745 -1.325 -1.079 1.00 0.00 C ATOM 17 CD LYS A 74 3.680 -2.386 -0.854 1.00 0.00 C ATOM 18 CE LYS A 74 3.559 -2.751 0.617 1.00 0.00 C ATOM 19 NZ LYS A 74 2.260 -3.413 0.919 1.00 0.00 N ATOM 0 H LYS A 74 3.091 -2.017 -3.880 1.00 0.00 H new ATOM 0 HA LYS A 74 3.612 0.502 -2.549 1.00 0.00 H new ATOM 0 HB2 LYS A 74 5.051 -2.091 -3.051 1.00 0.00 H new ATOM 0 HB3 LYS A 74 6.014 -0.677 -2.673 1.00 0.00 H new ATOM 0 HG2 LYS A 74 5.664 -1.617 -0.571 1.00 0.00 H new ATOM 0 HG3 LYS A 74 4.421 -0.384 -0.635 1.00 0.00 H new ATOM 0 HD2 LYS A 74 2.720 -2.022 -1.220 1.00 0.00 H new ATOM 0 HD3 LYS A 74 3.925 -3.277 -1.432 1.00 0.00 H new ATOM 0 HE2 LYS A 74 4.378 -3.414 0.895 1.00 0.00 H new ATOM 0 HE3 LYS A 74 3.658 -1.851 1.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 2.216 -3.646 1.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 1.479 -2.771 0.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 2.177 -4.285 0.359 1.00 0.00 H new ATOM 33 N PRO A 75 5.412 1.571 -4.083 1.00 0.00 N ATOM 34 CA PRO A 75 6.113 2.386 -5.080 1.00 0.00 C ATOM 35 C PRO A 75 7.270 1.637 -5.732 1.00 0.00 C ATOM 36 O PRO A 75 7.745 2.018 -6.802 1.00 0.00 O ATOM 37 CB PRO A 75 6.635 3.572 -4.265 1.00 0.00 C ATOM 38 CG PRO A 75 6.753 3.052 -2.873 1.00 0.00 C ATOM 39 CD PRO A 75 5.644 2.050 -2.710 1.00 0.00 C ATOM 0 HA PRO A 75 5.460 2.672 -5.904 1.00 0.00 H new ATOM 0 HB2 PRO A 75 7.598 3.918 -4.641 1.00 0.00 H new ATOM 0 HB3 PRO A 75 5.950 4.419 -4.315 1.00 0.00 H new ATOM 0 HG2 PRO A 75 7.726 2.587 -2.711 1.00 0.00 H new ATOM 0 HG3 PRO A 75 6.660 3.859 -2.146 1.00 0.00 H new ATOM 0 HD2 PRO A 75 5.932 1.237 -2.044 1.00 0.00 H new ATOM 0 HD3 PRO A 75 4.749 2.506 -2.287 1.00 0.00 H new ATOM 47 N PHE A 76 7.719 0.569 -5.081 1.00 0.00 N ATOM 48 CA PHE A 76 8.822 -0.233 -5.598 1.00 0.00 C ATOM 49 C PHE A 76 8.640 -1.704 -5.235 1.00 0.00 C ATOM 50 O PHE A 76 8.156 -2.033 -4.152 1.00 0.00 O ATOM 51 CB PHE A 76 10.155 0.279 -5.048 1.00 0.00 C ATOM 52 CG PHE A 76 11.344 -0.491 -5.546 1.00 0.00 C ATOM 53 CD1 PHE A 76 11.529 -0.704 -6.902 1.00 0.00 C ATOM 54 CD2 PHE A 76 12.277 -1.003 -4.658 1.00 0.00 C ATOM 55 CE1 PHE A 76 12.623 -1.412 -7.365 1.00 0.00 C ATOM 56 CE2 PHE A 76 13.373 -1.711 -5.114 1.00 0.00 C ATOM 57 CZ PHE A 76 13.545 -1.917 -6.469 1.00 0.00 C ATOM 0 H PHE A 76 7.336 0.239 -4.195 1.00 0.00 H new ATOM 0 HA PHE A 76 8.827 -0.142 -6.684 1.00 0.00 H new ATOM 0 HB2 PHE A 76 10.272 1.328 -5.319 1.00 0.00 H new ATOM 0 HB3 PHE A 76 10.132 0.232 -3.959 1.00 0.00 H new ATOM 0 HD1 PHE A 76 10.810 -0.312 -7.606 1.00 0.00 H new ATOM 0 HD2 PHE A 76 12.146 -0.847 -3.597 1.00 0.00 H new ATOM 0 HE1 PHE A 76 12.756 -1.570 -8.425 1.00 0.00 H new ATOM 0 HE2 PHE A 76 14.094 -2.103 -4.412 1.00 0.00 H new ATOM 0 HZ PHE A 76 14.399 -2.472 -6.827 1.00 0.00 H new ATOM 67 N VAL A 77 9.032 -2.586 -6.150 1.00 0.00 N ATOM 68 CA VAL A 77 8.914 -4.022 -5.928 1.00 0.00 C ATOM 69 C VAL A 77 10.286 -4.674 -5.809 1.00 0.00 C ATOM 70 O VAL A 77 10.769 -5.336 -6.729 1.00 0.00 O ATOM 71 CB VAL A 77 8.130 -4.703 -7.066 1.00 0.00 C ATOM 72 CG1 VAL A 77 6.645 -4.397 -6.949 1.00 0.00 C ATOM 73 CG2 VAL A 77 8.669 -4.265 -8.419 1.00 0.00 C ATOM 0 H VAL A 77 9.434 -2.331 -7.052 1.00 0.00 H new ATOM 0 HA VAL A 77 8.370 -4.154 -4.993 1.00 0.00 H new ATOM 0 HB VAL A 77 8.261 -5.782 -6.980 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.108 -4.886 -7.761 1.00 0.00 H new ATOM 0 HG12 VAL A 77 6.272 -4.765 -5.993 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.490 -3.320 -7.008 1.00 0.00 H new ATOM 0 HG21 VAL A 77 8.104 -4.755 -9.212 1.00 0.00 H new ATOM 0 HG22 VAL A 77 8.569 -3.184 -8.518 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.720 -4.541 -8.499 1.00 0.00 H new ATOM 83 N PRO A 78 10.932 -4.486 -4.649 1.00 0.00 N ATOM 84 CA PRO A 78 12.259 -5.050 -4.380 1.00 0.00 C ATOM 85 C PRO A 78 12.224 -6.566 -4.228 1.00 0.00 C ATOM 86 O PRO A 78 11.400 -7.107 -3.491 1.00 0.00 O ATOM 87 CB PRO A 78 12.665 -4.389 -3.061 1.00 0.00 C ATOM 88 CG PRO A 78 11.376 -4.041 -2.399 1.00 0.00 C ATOM 89 CD PRO A 78 10.417 -3.709 -3.509 1.00 0.00 C ATOM 0 HA PRO A 78 12.955 -4.863 -5.198 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.256 -5.066 -2.445 1.00 0.00 H new ATOM 0 HB3 PRO A 78 13.274 -3.501 -3.234 1.00 0.00 H new ATOM 0 HG2 PRO A 78 11.007 -4.874 -1.801 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.500 -3.194 -1.724 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.396 -3.995 -3.257 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.405 -2.640 -3.724 1.00 0.00 H new ATOM 97 N ASN A 79 13.124 -7.248 -4.929 1.00 0.00 N ATOM 98 CA ASN A 79 13.196 -8.703 -4.872 1.00 0.00 C ATOM 99 C ASN A 79 13.956 -9.161 -3.630 1.00 0.00 C ATOM 100 O ASN A 79 15.187 -9.136 -3.598 1.00 0.00 O ATOM 101 CB ASN A 79 13.874 -9.251 -6.129 1.00 0.00 C ATOM 102 CG ASN A 79 12.916 -9.364 -7.300 1.00 0.00 C ATOM 103 OD1 ASN A 79 12.858 -8.480 -8.155 1.00 0.00 O ATOM 104 ND2 ASN A 79 12.159 -10.454 -7.342 1.00 0.00 N ATOM 0 H ASN A 79 13.814 -6.816 -5.543 1.00 0.00 H new ATOM 0 HA ASN A 79 12.179 -9.091 -4.818 1.00 0.00 H new ATOM 0 HB2 ASN A 79 14.704 -8.600 -6.404 1.00 0.00 H new ATOM 0 HB3 ASN A 79 14.296 -10.232 -5.912 1.00 0.00 H new ATOM 0 HD21 ASN A 79 11.495 -10.585 -8.105 1.00 0.00 H new ATOM 0 HD22 ASN A 79 12.241 -11.161 -6.611 1.00 0.00 H new ATOM 111 N VAL A 80 13.214 -9.581 -2.610 1.00 0.00 N ATOM 112 CA VAL A 80 13.817 -10.046 -1.367 1.00 0.00 C ATOM 113 C VAL A 80 14.721 -11.249 -1.612 1.00 0.00 C ATOM 114 O VAL A 80 14.566 -11.965 -2.601 1.00 0.00 O ATOM 115 CB VAL A 80 12.743 -10.428 -0.331 1.00 0.00 C ATOM 116 CG1 VAL A 80 11.832 -11.514 -0.882 1.00 0.00 C ATOM 117 CG2 VAL A 80 13.393 -10.875 0.970 1.00 0.00 C ATOM 0 H VAL A 80 12.194 -9.609 -2.620 1.00 0.00 H new ATOM 0 HA VAL A 80 14.412 -9.221 -0.975 1.00 0.00 H new ATOM 0 HB VAL A 80 12.134 -9.548 -0.123 1.00 0.00 H new ATOM 0 HG11 VAL A 80 11.080 -11.771 -0.136 1.00 0.00 H new ATOM 0 HG12 VAL A 80 11.339 -11.152 -1.785 1.00 0.00 H new ATOM 0 HG13 VAL A 80 12.423 -12.398 -1.121 1.00 0.00 H new ATOM 0 HG21 VAL A 80 12.620 -11.141 1.691 1.00 0.00 H new ATOM 0 HG22 VAL A 80 14.027 -11.742 0.781 1.00 0.00 H new ATOM 0 HG23 VAL A 80 13.999 -10.063 1.372 1.00 0.00 H new ATOM 127 N HIS A 81 15.667 -11.466 -0.703 1.00 0.00 N ATOM 128 CA HIS A 81 16.597 -12.583 -0.820 1.00 0.00 C ATOM 129 C HIS A 81 17.555 -12.374 -1.989 1.00 0.00 C ATOM 130 O HIS A 81 18.037 -13.334 -2.589 1.00 0.00 O ATOM 131 CB HIS A 81 15.832 -13.894 -1.001 1.00 0.00 C ATOM 132 CG HIS A 81 14.716 -14.077 -0.019 1.00 0.00 C ATOM 133 ND1 HIS A 81 13.388 -14.118 -0.389 1.00 0.00 N ATOM 134 CD2 HIS A 81 14.735 -14.231 1.325 1.00 0.00 C ATOM 135 CE1 HIS A 81 12.639 -14.288 0.686 1.00 0.00 C ATOM 136 NE2 HIS A 81 13.432 -14.360 1.740 1.00 0.00 N ATOM 0 H HIS A 81 15.809 -10.883 0.122 1.00 0.00 H new ATOM 0 HA HIS A 81 17.180 -12.635 0.099 1.00 0.00 H new ATOM 0 HB2 HIS A 81 15.425 -13.931 -2.012 1.00 0.00 H new ATOM 0 HB3 HIS A 81 16.528 -14.727 -0.907 1.00 0.00 H new ATOM 0 HD2 HIS A 81 15.612 -14.249 1.955 1.00 0.00 H new ATOM 0 HE1 HIS A 81 11.561 -14.356 0.701 1.00 0.00 H new ATOM 0 HE2 HIS A 81 13.127 -14.490 2.704 1.00 0.00 H new ATOM 144 N ALA A 82 17.825 -11.112 -2.307 1.00 0.00 N ATOM 145 CA ALA A 82 18.726 -10.777 -3.403 1.00 0.00 C ATOM 146 C ALA A 82 20.182 -10.985 -3.001 1.00 0.00 C ATOM 147 O ALA A 82 20.583 -10.643 -1.889 1.00 0.00 O ATOM 148 CB ALA A 82 18.500 -9.341 -3.852 1.00 0.00 C ATOM 0 H ALA A 82 17.433 -10.305 -1.821 1.00 0.00 H new ATOM 0 HA ALA A 82 18.508 -11.445 -4.236 1.00 0.00 H new ATOM 0 HB1 ALA A 82 19.180 -9.105 -4.671 1.00 0.00 H new ATOM 0 HB2 ALA A 82 17.470 -9.223 -4.189 1.00 0.00 H new ATOM 0 HB3 ALA A 82 18.688 -8.665 -3.018 1.00 0.00 H new ATOM 154 N ALA A 83 20.969 -11.548 -3.912 1.00 0.00 N ATOM 155 CA ALA A 83 22.381 -11.800 -3.652 1.00 0.00 C ATOM 156 C ALA A 83 23.077 -10.544 -3.138 1.00 0.00 C ATOM 157 O ALA A 83 22.837 -9.444 -3.635 1.00 0.00 O ATOM 158 CB ALA A 83 23.067 -12.309 -4.910 1.00 0.00 C ATOM 0 H ALA A 83 20.652 -11.838 -4.837 1.00 0.00 H new ATOM 0 HA ALA A 83 22.452 -12.565 -2.879 1.00 0.00 H new ATOM 0 HB1 ALA A 83 24.121 -12.493 -4.701 1.00 0.00 H new ATOM 0 HB2 ALA A 83 22.594 -13.237 -5.232 1.00 0.00 H new ATOM 0 HB3 ALA A 83 22.979 -11.563 -5.700 1.00 0.00 H new ATOM 164 N GLU A 84 23.939 -10.716 -2.141 1.00 0.00 N ATOM 165 CA GLU A 84 24.668 -9.595 -1.560 1.00 0.00 C ATOM 166 C GLU A 84 25.349 -8.767 -2.646 1.00 0.00 C ATOM 167 O GLU A 84 25.929 -9.313 -3.586 1.00 0.00 O ATOM 168 CB GLU A 84 25.710 -10.099 -0.559 1.00 0.00 C ATOM 169 CG GLU A 84 26.614 -11.185 -1.117 1.00 0.00 C ATOM 170 CD GLU A 84 27.417 -11.886 -0.038 1.00 0.00 C ATOM 171 OE1 GLU A 84 27.878 -11.202 0.899 1.00 0.00 O ATOM 172 OE2 GLU A 84 27.583 -13.121 -0.131 1.00 0.00 O ATOM 0 H GLU A 84 24.149 -11.620 -1.719 1.00 0.00 H new ATOM 0 HA GLU A 84 23.951 -8.960 -1.039 1.00 0.00 H new ATOM 0 HB2 GLU A 84 26.324 -9.259 -0.232 1.00 0.00 H new ATOM 0 HB3 GLU A 84 25.198 -10.482 0.324 1.00 0.00 H new ATOM 0 HG2 GLU A 84 26.009 -11.919 -1.649 1.00 0.00 H new ATOM 0 HG3 GLU A 84 27.296 -10.746 -1.845 1.00 0.00 H new ATOM 179 N PHE A 85 25.274 -7.448 -2.511 1.00 0.00 N ATOM 180 CA PHE A 85 25.881 -6.544 -3.481 1.00 0.00 C ATOM 181 C PHE A 85 27.363 -6.859 -3.664 1.00 0.00 C ATOM 182 O PHE A 85 27.937 -6.607 -4.724 1.00 0.00 O ATOM 183 CB PHE A 85 25.709 -5.091 -3.034 1.00 0.00 C ATOM 184 CG PHE A 85 26.828 -4.594 -2.164 1.00 0.00 C ATOM 185 CD1 PHE A 85 26.768 -4.736 -0.787 1.00 0.00 C ATOM 186 CD2 PHE A 85 27.939 -3.984 -2.724 1.00 0.00 C ATOM 187 CE1 PHE A 85 27.796 -4.280 0.016 1.00 0.00 C ATOM 188 CE2 PHE A 85 28.971 -3.527 -1.926 1.00 0.00 C ATOM 189 CZ PHE A 85 28.899 -3.674 -0.554 1.00 0.00 C ATOM 0 H PHE A 85 24.799 -6.981 -1.739 1.00 0.00 H new ATOM 0 HA PHE A 85 25.376 -6.685 -4.437 1.00 0.00 H new ATOM 0 HB2 PHE A 85 25.635 -4.455 -3.916 1.00 0.00 H new ATOM 0 HB3 PHE A 85 24.768 -4.995 -2.492 1.00 0.00 H new ATOM 0 HD1 PHE A 85 25.908 -5.209 -0.336 1.00 0.00 H new ATOM 0 HD2 PHE A 85 27.999 -3.864 -3.796 1.00 0.00 H new ATOM 0 HE1 PHE A 85 27.737 -4.397 1.088 1.00 0.00 H new ATOM 0 HE2 PHE A 85 29.833 -3.055 -2.375 1.00 0.00 H new ATOM 0 HZ PHE A 85 29.703 -3.316 0.072 1.00 0.00 H new ATOM 199 N VAL A 86 27.978 -7.410 -2.622 1.00 0.00 N ATOM 200 CA VAL A 86 29.393 -7.760 -2.667 1.00 0.00 C ATOM 201 C VAL A 86 29.621 -9.022 -3.491 1.00 0.00 C ATOM 202 O VAL A 86 28.739 -9.869 -3.633 1.00 0.00 O ATOM 203 CB VAL A 86 29.963 -7.974 -1.252 1.00 0.00 C ATOM 204 CG1 VAL A 86 30.052 -6.652 -0.506 1.00 0.00 C ATOM 205 CG2 VAL A 86 29.113 -8.974 -0.482 1.00 0.00 C ATOM 0 H VAL A 86 27.519 -7.624 -1.737 1.00 0.00 H new ATOM 0 HA VAL A 86 29.911 -6.924 -3.137 1.00 0.00 H new ATOM 0 HB VAL A 86 30.970 -8.381 -1.342 1.00 0.00 H new ATOM 0 HG11 VAL A 86 30.457 -6.824 0.491 1.00 0.00 H new ATOM 0 HG12 VAL A 86 30.705 -5.970 -1.050 1.00 0.00 H new ATOM 0 HG13 VAL A 86 29.058 -6.213 -0.423 1.00 0.00 H new ATOM 0 HG21 VAL A 86 29.530 -9.114 0.516 1.00 0.00 H new ATOM 0 HG22 VAL A 86 28.093 -8.598 -0.400 1.00 0.00 H new ATOM 0 HG23 VAL A 86 29.106 -9.928 -1.009 1.00 0.00 H new ATOM 215 N PRO A 87 30.834 -9.153 -4.049 1.00 0.00 N ATOM 216 CA PRO A 87 31.207 -10.310 -4.868 1.00 0.00 C ATOM 217 C PRO A 87 31.340 -11.586 -4.044 1.00 0.00 C ATOM 218 O PRO A 87 30.799 -12.630 -4.407 1.00 0.00 O ATOM 219 CB PRO A 87 32.563 -9.907 -5.453 1.00 0.00 C ATOM 220 CG PRO A 87 33.117 -8.922 -4.482 1.00 0.00 C ATOM 221 CD PRO A 87 31.934 -8.183 -3.922 1.00 0.00 C ATOM 0 HA PRO A 87 30.452 -10.537 -5.621 1.00 0.00 H new ATOM 0 HB2 PRO A 87 33.220 -10.770 -5.560 1.00 0.00 H new ATOM 0 HB3 PRO A 87 32.452 -9.466 -6.444 1.00 0.00 H new ATOM 0 HG2 PRO A 87 33.673 -9.425 -3.691 1.00 0.00 H new ATOM 0 HG3 PRO A 87 33.809 -8.237 -4.973 1.00 0.00 H new ATOM 0 HD2 PRO A 87 32.096 -7.893 -2.884 1.00 0.00 H new ATOM 0 HD3 PRO A 87 31.730 -7.269 -4.480 1.00 0.00 H new ATOM 229 N SER A 88 32.064 -11.494 -2.933 1.00 0.00 N ATOM 230 CA SER A 88 32.271 -12.642 -2.058 1.00 0.00 C ATOM 231 C SER A 88 30.941 -13.294 -1.694 1.00 0.00 C ATOM 232 O SER A 88 30.063 -12.658 -1.110 1.00 0.00 O ATOM 233 CB SER A 88 33.008 -12.216 -0.787 1.00 0.00 C ATOM 234 OG SER A 88 32.392 -11.085 -0.195 1.00 0.00 O ATOM 0 H SER A 88 32.517 -10.636 -2.618 1.00 0.00 H new ATOM 0 HA SER A 88 32.879 -13.371 -2.594 1.00 0.00 H new ATOM 0 HB2 SER A 88 33.020 -13.042 -0.076 1.00 0.00 H new ATOM 0 HB3 SER A 88 34.046 -11.986 -1.025 1.00 0.00 H new ATOM 0 HG SER A 88 31.418 -11.167 -0.269 1.00 0.00 H new ATOM 240 N PHE A 89 30.798 -14.569 -2.043 1.00 0.00 N ATOM 241 CA PHE A 89 29.575 -15.308 -1.755 1.00 0.00 C ATOM 242 C PHE A 89 29.851 -16.460 -0.793 1.00 0.00 C ATOM 243 O PHE A 89 28.954 -16.920 -0.084 1.00 0.00 O ATOM 244 CB PHE A 89 28.961 -15.846 -3.049 1.00 0.00 C ATOM 245 CG PHE A 89 29.863 -16.788 -3.794 1.00 0.00 C ATOM 246 CD1 PHE A 89 30.031 -18.094 -3.362 1.00 0.00 C ATOM 247 CD2 PHE A 89 30.542 -16.369 -4.927 1.00 0.00 C ATOM 248 CE1 PHE A 89 30.861 -18.963 -4.045 1.00 0.00 C ATOM 249 CE2 PHE A 89 31.372 -17.234 -5.614 1.00 0.00 C ATOM 250 CZ PHE A 89 31.531 -18.533 -5.173 1.00 0.00 C ATOM 0 H PHE A 89 31.514 -15.111 -2.526 1.00 0.00 H new ATOM 0 HA PHE A 89 28.869 -14.624 -1.284 1.00 0.00 H new ATOM 0 HB2 PHE A 89 28.028 -16.359 -2.814 1.00 0.00 H new ATOM 0 HB3 PHE A 89 28.709 -15.007 -3.698 1.00 0.00 H new ATOM 0 HD1 PHE A 89 29.507 -18.437 -2.482 1.00 0.00 H new ATOM 0 HD2 PHE A 89 30.421 -15.355 -5.277 1.00 0.00 H new ATOM 0 HE1 PHE A 89 30.985 -19.978 -3.697 1.00 0.00 H new ATOM 0 HE2 PHE A 89 31.896 -16.895 -6.495 1.00 0.00 H new ATOM 0 HZ PHE A 89 32.178 -19.211 -5.709 1.00 0.00 H new ATOM 260 N LEU A 90 31.096 -16.923 -0.774 1.00 0.00 N ATOM 261 CA LEU A 90 31.491 -18.022 0.100 1.00 0.00 C ATOM 262 C LEU A 90 32.329 -17.514 1.269 1.00 0.00 C ATOM 263 O LEU A 90 33.421 -18.020 1.528 1.00 0.00 O ATOM 264 CB LEU A 90 32.278 -19.070 -0.689 1.00 0.00 C ATOM 265 CG LEU A 90 32.060 -20.525 -0.275 1.00 0.00 C ATOM 266 CD1 LEU A 90 31.841 -20.626 1.227 1.00 0.00 C ATOM 267 CD2 LEU A 90 30.881 -21.124 -1.028 1.00 0.00 C ATOM 0 H LEU A 90 31.850 -16.554 -1.354 1.00 0.00 H new ATOM 0 HA LEU A 90 30.586 -18.480 0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 90 32.020 -18.971 -1.743 1.00 0.00 H new ATOM 0 HB3 LEU A 90 33.340 -18.842 -0.598 1.00 0.00 H new ATOM 0 HG LEU A 90 32.955 -21.092 -0.531 1.00 0.00 H new ATOM 0 HD11 LEU A 90 31.688 -21.669 1.503 1.00 0.00 H new ATOM 0 HD12 LEU A 90 32.715 -20.237 1.749 1.00 0.00 H new ATOM 0 HD13 LEU A 90 30.963 -20.044 1.507 1.00 0.00 H new ATOM 0 HD21 LEU A 90 30.741 -22.160 -0.720 1.00 0.00 H new ATOM 0 HD22 LEU A 90 29.979 -20.554 -0.804 1.00 0.00 H new ATOM 0 HD23 LEU A 90 31.077 -21.087 -2.100 1.00 0.00 H new ATOM 279 N ARG A 91 31.810 -16.513 1.971 1.00 0.00 N ATOM 280 CA ARG A 91 32.510 -15.937 3.113 1.00 0.00 C ATOM 281 C ARG A 91 31.533 -15.238 4.054 1.00 0.00 C ATOM 282 O ARG A 91 30.352 -15.092 3.742 1.00 0.00 O ATOM 283 CB ARG A 91 33.575 -14.946 2.639 1.00 0.00 C ATOM 284 CG ARG A 91 34.938 -15.579 2.413 1.00 0.00 C ATOM 285 CD ARG A 91 35.408 -16.343 3.642 1.00 0.00 C ATOM 286 NE ARG A 91 36.810 -16.073 3.951 1.00 0.00 N ATOM 287 CZ ARG A 91 37.823 -16.515 3.214 1.00 0.00 C ATOM 288 NH1 ARG A 91 37.591 -17.244 2.132 1.00 0.00 N ATOM 289 NH2 ARG A 91 39.071 -16.227 3.561 1.00 0.00 N ATOM 0 H ARG A 91 30.907 -16.084 1.769 1.00 0.00 H new ATOM 0 HA ARG A 91 32.994 -16.748 3.657 1.00 0.00 H new ATOM 0 HB2 ARG A 91 33.241 -14.483 1.711 1.00 0.00 H new ATOM 0 HB3 ARG A 91 33.672 -14.149 3.376 1.00 0.00 H new ATOM 0 HG2 ARG A 91 34.889 -16.255 1.559 1.00 0.00 H new ATOM 0 HG3 ARG A 91 35.664 -14.804 2.165 1.00 0.00 H new ATOM 0 HD2 ARG A 91 34.789 -16.070 4.497 1.00 0.00 H new ATOM 0 HD3 ARG A 91 35.272 -17.412 3.478 1.00 0.00 H new ATOM 0 HE ARG A 91 37.023 -15.515 4.778 1.00 0.00 H new ATOM 0 HH11 ARG A 91 36.633 -17.467 1.863 1.00 0.00 H new ATOM 0 HH12 ARG A 91 38.371 -17.582 1.568 1.00 0.00 H new ATOM 0 HH21 ARG A 91 39.252 -15.666 4.394 1.00 0.00 H new ATOM 0 HH22 ARG A 91 39.849 -16.566 2.995 1.00 0.00 H new ATOM 303 N GLY A 92 32.035 -14.808 5.208 1.00 0.00 N ATOM 304 CA GLY A 92 31.193 -14.131 6.177 1.00 0.00 C ATOM 305 C GLY A 92 30.426 -12.973 5.569 1.00 0.00 C ATOM 306 O GLY A 92 30.724 -12.513 4.467 1.00 0.00 O ATOM 0 H GLY A 92 33.010 -14.916 5.489 1.00 0.00 H new ATOM 0 HA2 GLY A 92 30.489 -14.845 6.604 1.00 0.00 H new ATOM 0 HA3 GLY A 92 31.810 -13.764 6.997 1.00 0.00 H new ATOM 310 N PRO A 93 29.410 -12.485 6.296 1.00 0.00 N ATOM 311 CA PRO A 93 28.576 -11.368 5.841 1.00 0.00 C ATOM 312 C PRO A 93 29.334 -10.045 5.832 1.00 0.00 C ATOM 313 O PRO A 93 29.286 -9.300 4.854 1.00 0.00 O ATOM 314 CB PRO A 93 27.444 -11.329 6.871 1.00 0.00 C ATOM 315 CG PRO A 93 28.026 -11.942 8.098 1.00 0.00 C ATOM 316 CD PRO A 93 28.998 -12.985 7.619 1.00 0.00 C ATOM 0 HA PRO A 93 28.233 -11.506 4.815 1.00 0.00 H new ATOM 0 HB2 PRO A 93 27.114 -10.307 7.058 1.00 0.00 H new ATOM 0 HB3 PRO A 93 26.574 -11.887 6.524 1.00 0.00 H new ATOM 0 HG2 PRO A 93 28.528 -11.192 8.708 1.00 0.00 H new ATOM 0 HG3 PRO A 93 27.248 -12.389 8.718 1.00 0.00 H new ATOM 0 HD2 PRO A 93 29.848 -13.083 8.294 1.00 0.00 H new ATOM 0 HD3 PRO A 93 28.531 -13.968 7.550 1.00 0.00 H new ATOM 324 N ALA A 94 30.032 -9.760 6.926 1.00 0.00 N ATOM 325 CA ALA A 94 30.802 -8.528 7.041 1.00 0.00 C ATOM 326 C ALA A 94 31.883 -8.654 8.110 1.00 0.00 C ATOM 327 O ALA A 94 31.908 -9.655 8.825 1.00 0.00 O ATOM 328 CB ALA A 94 29.881 -7.358 7.354 1.00 0.00 C ATOM 0 H ALA A 94 30.080 -10.366 7.745 1.00 0.00 H new ATOM 0 HA ALA A 94 31.293 -8.344 6.085 1.00 0.00 H new ATOM 0 HB1 ALA A 94 30.469 -6.444 7.437 1.00 0.00 H new ATOM 0 HB2 ALA A 94 29.149 -7.247 6.554 1.00 0.00 H new ATOM 0 HB3 ALA A 94 29.364 -7.544 8.295 1.00 0.00 H new TER 334 ALA A 94 ATOM 335 N GLY B 541 38.323 5.475 5.566 1.00 0.00 N ATOM 336 CA GLY B 541 38.209 5.862 4.173 1.00 0.00 C ATOM 337 C GLY B 541 38.511 7.332 3.952 1.00 0.00 C ATOM 338 O GLY B 541 38.327 8.150 4.853 1.00 0.00 O ATOM 0 HA2 GLY B 541 38.893 5.260 3.575 1.00 0.00 H new ATOM 0 HA3 GLY B 541 37.201 5.644 3.820 1.00 0.00 H new ATOM 342 N GLN B 542 38.976 7.665 2.753 1.00 0.00 N ATOM 343 CA GLN B 542 39.306 9.046 2.419 1.00 0.00 C ATOM 344 C GLN B 542 38.089 9.777 1.863 1.00 0.00 C ATOM 345 O GLN B 542 37.754 9.637 0.687 1.00 0.00 O ATOM 346 CB GLN B 542 40.450 9.087 1.404 1.00 0.00 C ATOM 347 CG GLN B 542 41.828 9.144 2.043 1.00 0.00 C ATOM 348 CD GLN B 542 42.153 7.899 2.843 1.00 0.00 C ATOM 349 OE1 GLN B 542 42.692 6.928 2.311 1.00 0.00 O ATOM 350 NE2 GLN B 542 41.825 7.920 4.130 1.00 0.00 N ATOM 0 H GLN B 542 39.133 6.999 1.997 1.00 0.00 H new ATOM 0 HA GLN B 542 39.622 9.550 3.332 1.00 0.00 H new ATOM 0 HB2 GLN B 542 40.391 8.205 0.766 1.00 0.00 H new ATOM 0 HB3 GLN B 542 40.321 9.956 0.759 1.00 0.00 H new ATOM 0 HG2 GLN B 542 42.580 9.278 1.265 1.00 0.00 H new ATOM 0 HG3 GLN B 542 41.886 10.015 2.695 1.00 0.00 H new ATOM 0 HE21 GLN B 542 41.380 8.746 4.529 1.00 0.00 H new ATOM 0 HE22 GLN B 542 42.019 7.110 4.719 1.00 0.00 H new ATOM 359 N GLU B 543 37.433 10.557 2.715 1.00 0.00 N ATOM 360 CA GLU B 543 36.252 11.309 2.308 1.00 0.00 C ATOM 361 C GLU B 543 35.131 10.369 1.873 1.00 0.00 C ATOM 362 O GLU B 543 35.355 9.202 1.553 1.00 0.00 O ATOM 363 CB GLU B 543 36.599 12.268 1.167 1.00 0.00 C ATOM 364 CG GLU B 543 36.764 13.711 1.613 1.00 0.00 C ATOM 365 CD GLU B 543 37.833 13.874 2.677 1.00 0.00 C ATOM 366 OE1 GLU B 543 38.963 13.391 2.460 1.00 0.00 O ATOM 367 OE2 GLU B 543 37.538 14.485 3.725 1.00 0.00 O ATOM 0 H GLU B 543 37.699 10.685 3.691 1.00 0.00 H new ATOM 0 HA GLU B 543 35.907 11.886 3.166 1.00 0.00 H new ATOM 0 HB2 GLU B 543 37.522 11.936 0.692 1.00 0.00 H new ATOM 0 HB3 GLU B 543 35.816 12.218 0.411 1.00 0.00 H new ATOM 0 HG2 GLU B 543 37.018 14.327 0.751 1.00 0.00 H new ATOM 0 HG3 GLU B 543 35.813 14.079 1.999 1.00 0.00 H new ATOM 374 N PRO B 544 33.895 10.889 1.862 1.00 0.00 N ATOM 375 CA PRO B 544 32.714 10.114 1.469 1.00 0.00 C ATOM 376 C PRO B 544 32.699 9.796 -0.022 1.00 0.00 C ATOM 377 O PRO B 544 33.637 10.128 -0.748 1.00 0.00 O ATOM 378 CB PRO B 544 31.548 11.037 1.830 1.00 0.00 C ATOM 379 CG PRO B 544 32.124 12.410 1.787 1.00 0.00 C ATOM 380 CD PRO B 544 33.554 12.273 2.232 1.00 0.00 C ATOM 0 HA PRO B 544 32.679 9.145 1.967 1.00 0.00 H new ATOM 0 HB2 PRO B 544 30.725 10.931 1.123 1.00 0.00 H new ATOM 0 HB3 PRO B 544 31.151 10.805 2.818 1.00 0.00 H new ATOM 0 HG2 PRO B 544 32.066 12.826 0.781 1.00 0.00 H new ATOM 0 HG3 PRO B 544 31.574 13.085 2.443 1.00 0.00 H new ATOM 0 HD2 PRO B 544 34.201 12.994 1.732 1.00 0.00 H new ATOM 0 HD3 PRO B 544 33.659 12.440 3.304 1.00 0.00 H new ATOM 388 N LEU B 545 31.630 9.150 -0.474 1.00 0.00 N ATOM 389 CA LEU B 545 31.493 8.787 -1.880 1.00 0.00 C ATOM 390 C LEU B 545 30.468 9.678 -2.575 1.00 0.00 C ATOM 391 O LEU B 545 29.415 9.985 -2.016 1.00 0.00 O ATOM 392 CB LEU B 545 31.081 7.319 -2.010 1.00 0.00 C ATOM 393 CG LEU B 545 32.218 6.321 -2.232 1.00 0.00 C ATOM 394 CD1 LEU B 545 33.156 6.305 -1.036 1.00 0.00 C ATOM 395 CD2 LEU B 545 31.662 4.929 -2.494 1.00 0.00 C ATOM 0 H LEU B 545 30.845 8.867 0.113 1.00 0.00 H new ATOM 0 HA LEU B 545 32.459 8.931 -2.363 1.00 0.00 H new ATOM 0 HB2 LEU B 545 30.543 7.032 -1.106 1.00 0.00 H new ATOM 0 HB3 LEU B 545 30.380 7.231 -2.840 1.00 0.00 H new ATOM 0 HG LEU B 545 32.785 6.635 -3.108 1.00 0.00 H new ATOM 0 HD11 LEU B 545 33.959 5.589 -1.213 1.00 0.00 H new ATOM 0 HD12 LEU B 545 33.581 7.299 -0.894 1.00 0.00 H new ATOM 0 HD13 LEU B 545 32.602 6.016 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU B 545 32.485 4.232 -2.650 1.00 0.00 H new ATOM 0 HD22 LEU B 545 31.070 4.606 -1.637 1.00 0.00 H new ATOM 0 HD23 LEU B 545 31.032 4.950 -3.383 1.00 0.00 H new ATOM 407 N THR B 546 30.783 10.089 -3.800 1.00 0.00 N ATOM 408 CA THR B 546 29.889 10.943 -4.572 1.00 0.00 C ATOM 409 C THR B 546 30.074 10.720 -6.069 1.00 0.00 C ATOM 410 O THR B 546 30.891 9.901 -6.488 1.00 0.00 O ATOM 411 CB THR B 546 30.122 12.432 -4.254 1.00 0.00 C ATOM 412 OG1 THR B 546 31.503 12.762 -4.436 1.00 0.00 O ATOM 413 CG2 THR B 546 29.702 12.752 -2.828 1.00 0.00 C ATOM 0 H THR B 546 31.650 9.844 -4.278 1.00 0.00 H new ATOM 0 HA THR B 546 28.871 10.674 -4.290 1.00 0.00 H new ATOM 0 HB THR B 546 29.515 13.026 -4.937 1.00 0.00 H new ATOM 0 HG1 THR B 546 31.642 13.711 -4.233 1.00 0.00 H new ATOM 0 HG21 THR B 546 29.876 13.809 -2.626 1.00 0.00 H new ATOM 0 HG22 THR B 546 28.643 12.528 -2.702 1.00 0.00 H new ATOM 0 HG23 THR B 546 30.286 12.149 -2.133 1.00 0.00 H new ATOM 421 N ALA B 547 29.309 11.454 -6.870 1.00 0.00 N ATOM 422 CA ALA B 547 29.390 11.338 -8.321 1.00 0.00 C ATOM 423 C ALA B 547 30.816 11.563 -8.811 1.00 0.00 C ATOM 424 O ALA B 547 31.272 10.908 -9.748 1.00 0.00 O ATOM 425 CB ALA B 547 28.440 12.325 -8.983 1.00 0.00 C ATOM 0 H ALA B 547 28.626 12.135 -6.539 1.00 0.00 H new ATOM 0 HA ALA B 547 29.095 10.326 -8.597 1.00 0.00 H new ATOM 0 HB1 ALA B 547 28.511 12.227 -10.066 1.00 0.00 H new ATOM 0 HB2 ALA B 547 27.418 12.115 -8.666 1.00 0.00 H new ATOM 0 HB3 ALA B 547 28.709 13.340 -8.692 1.00 0.00 H new ATOM 431 N SER B 548 31.516 12.495 -8.172 1.00 0.00 N ATOM 432 CA SER B 548 32.890 12.810 -8.546 1.00 0.00 C ATOM 433 C SER B 548 33.745 11.547 -8.585 1.00 0.00 C ATOM 434 O SER B 548 34.467 11.303 -9.552 1.00 0.00 O ATOM 435 CB SER B 548 33.491 13.816 -7.562 1.00 0.00 C ATOM 436 OG SER B 548 34.579 14.511 -8.145 1.00 0.00 O ATOM 0 H SER B 548 31.154 13.045 -7.393 1.00 0.00 H new ATOM 0 HA SER B 548 32.877 13.251 -9.543 1.00 0.00 H new ATOM 0 HB2 SER B 548 32.726 14.527 -7.251 1.00 0.00 H new ATOM 0 HB3 SER B 548 33.826 13.296 -6.665 1.00 0.00 H new ATOM 0 HG SER B 548 34.945 15.149 -7.497 1.00 0.00 H new ATOM 442 N MET B 549 33.658 10.747 -7.527 1.00 0.00 N ATOM 443 CA MET B 549 34.423 9.509 -7.441 1.00 0.00 C ATOM 444 C MET B 549 33.754 8.399 -8.247 1.00 0.00 C ATOM 445 O MET B 549 34.428 7.575 -8.867 1.00 0.00 O ATOM 446 CB MET B 549 34.570 9.076 -5.981 1.00 0.00 C ATOM 447 CG MET B 549 35.400 7.815 -5.802 1.00 0.00 C ATOM 448 SD MET B 549 36.185 7.725 -4.181 1.00 0.00 S ATOM 449 CE MET B 549 35.653 6.103 -3.637 1.00 0.00 C ATOM 0 H MET B 549 33.066 10.934 -6.718 1.00 0.00 H new ATOM 0 HA MET B 549 35.412 9.693 -7.860 1.00 0.00 H new ATOM 0 HB2 MET B 549 35.029 9.887 -5.415 1.00 0.00 H new ATOM 0 HB3 MET B 549 33.579 8.912 -5.558 1.00 0.00 H new ATOM 0 HG2 MET B 549 34.762 6.942 -5.942 1.00 0.00 H new ATOM 0 HG3 MET B 549 36.167 7.777 -6.576 1.00 0.00 H new ATOM 0 HE1 MET B 549 35.692 6.053 -2.549 1.00 0.00 H new ATOM 0 HE2 MET B 549 34.632 5.924 -3.972 1.00 0.00 H new ATOM 0 HE3 MET B 549 36.312 5.344 -4.058 1.00 0.00 H new ATOM 459 N LEU B 550 32.425 8.384 -8.234 1.00 0.00 N ATOM 460 CA LEU B 550 31.665 7.375 -8.964 1.00 0.00 C ATOM 461 C LEU B 550 31.929 7.474 -10.463 1.00 0.00 C ATOM 462 O LEU B 550 31.762 6.501 -11.198 1.00 0.00 O ATOM 463 CB LEU B 550 30.169 7.536 -8.686 1.00 0.00 C ATOM 464 CG LEU B 550 29.595 6.656 -7.575 1.00 0.00 C ATOM 465 CD1 LEU B 550 29.724 5.185 -7.938 1.00 0.00 C ATOM 466 CD2 LEU B 550 30.292 6.944 -6.253 1.00 0.00 C ATOM 0 H LEU B 550 31.852 9.058 -7.727 1.00 0.00 H new ATOM 0 HA LEU B 550 31.989 6.392 -8.621 1.00 0.00 H new ATOM 0 HB2 LEU B 550 29.977 8.579 -8.432 1.00 0.00 H new ATOM 0 HB3 LEU B 550 29.624 7.326 -9.606 1.00 0.00 H new ATOM 0 HG LEU B 550 28.536 6.890 -7.464 1.00 0.00 H new ATOM 0 HD11 LEU B 550 29.310 4.575 -7.135 1.00 0.00 H new ATOM 0 HD12 LEU B 550 29.179 4.989 -8.861 1.00 0.00 H new ATOM 0 HD13 LEU B 550 30.776 4.936 -8.078 1.00 0.00 H new ATOM 0 HD21 LEU B 550 29.871 6.309 -5.474 1.00 0.00 H new ATOM 0 HD22 LEU B 550 31.358 6.739 -6.352 1.00 0.00 H new ATOM 0 HD23 LEU B 550 30.147 7.991 -5.986 1.00 0.00 H new ATOM 478 N ALA B 551 32.343 8.655 -10.910 1.00 0.00 N ATOM 479 CA ALA B 551 32.634 8.880 -12.320 1.00 0.00 C ATOM 480 C ALA B 551 34.113 8.659 -12.617 1.00 0.00 C ATOM 481 O ALA B 551 34.628 9.122 -13.635 1.00 0.00 O ATOM 482 CB ALA B 551 32.216 10.284 -12.728 1.00 0.00 C ATOM 0 H ALA B 551 32.484 9.471 -10.315 1.00 0.00 H new ATOM 0 HA ALA B 551 32.061 8.159 -12.903 1.00 0.00 H new ATOM 0 HB1 ALA B 551 32.439 10.438 -13.784 1.00 0.00 H new ATOM 0 HB2 ALA B 551 31.146 10.408 -12.562 1.00 0.00 H new ATOM 0 HB3 ALA B 551 32.763 11.014 -12.131 1.00 0.00 H new ATOM 488 N SER B 552 34.792 7.948 -11.723 1.00 0.00 N ATOM 489 CA SER B 552 36.214 7.670 -11.887 1.00 0.00 C ATOM 490 C SER B 552 36.462 6.170 -12.023 1.00 0.00 C ATOM 491 O SER B 552 37.438 5.745 -12.640 1.00 0.00 O ATOM 492 CB SER B 552 37.005 8.223 -10.700 1.00 0.00 C ATOM 493 OG SER B 552 38.370 7.852 -10.779 1.00 0.00 O ATOM 0 H SER B 552 34.380 7.554 -10.877 1.00 0.00 H new ATOM 0 HA SER B 552 36.552 8.162 -12.799 1.00 0.00 H new ATOM 0 HB2 SER B 552 36.921 9.310 -10.678 1.00 0.00 H new ATOM 0 HB3 SER B 552 36.577 7.851 -9.769 1.00 0.00 H new ATOM 0 HG SER B 552 38.854 8.219 -10.010 1.00 0.00 H new ATOM 499 N ALA B 553 35.570 5.375 -11.442 1.00 0.00 N ATOM 500 CA ALA B 553 35.690 3.923 -11.498 1.00 0.00 C ATOM 501 C ALA B 553 34.711 3.331 -12.506 1.00 0.00 C ATOM 502 O ALA B 553 33.724 3.958 -12.892 1.00 0.00 O ATOM 503 CB ALA B 553 35.461 3.320 -10.120 1.00 0.00 C ATOM 0 H ALA B 553 34.756 5.712 -10.927 1.00 0.00 H new ATOM 0 HA ALA B 553 36.701 3.679 -11.825 1.00 0.00 H new ATOM 0 HB1 ALA B 553 35.554 2.235 -10.177 1.00 0.00 H new ATOM 0 HB2 ALA B 553 36.203 3.711 -9.424 1.00 0.00 H new ATOM 0 HB3 ALA B 553 34.462 3.581 -9.770 1.00 0.00 H new ATOM 509 N PRO B 554 34.988 2.094 -12.945 1.00 0.00 N ATOM 510 CA PRO B 554 34.143 1.390 -13.914 1.00 0.00 C ATOM 511 C PRO B 554 32.797 0.985 -13.324 1.00 0.00 C ATOM 512 O PRO B 554 32.581 1.040 -12.113 1.00 0.00 O ATOM 513 CB PRO B 554 34.967 0.149 -14.268 1.00 0.00 C ATOM 514 CG PRO B 554 35.839 -0.077 -13.082 1.00 0.00 C ATOM 515 CD PRO B 554 36.147 1.287 -12.528 1.00 0.00 C ATOM 0 HA PRO B 554 33.900 2.016 -14.772 1.00 0.00 H new ATOM 0 HB2 PRO B 554 34.325 -0.712 -14.457 1.00 0.00 H new ATOM 0 HB3 PRO B 554 35.558 0.310 -15.169 1.00 0.00 H new ATOM 0 HG2 PRO B 554 35.335 -0.695 -12.339 1.00 0.00 H new ATOM 0 HG3 PRO B 554 36.753 -0.599 -13.364 1.00 0.00 H new ATOM 0 HD2 PRO B 554 36.253 1.266 -11.443 1.00 0.00 H new ATOM 0 HD3 PRO B 554 37.079 1.684 -12.931 1.00 0.00 H new ATOM 523 N PRO B 555 31.868 0.568 -14.197 1.00 0.00 N ATOM 524 CA PRO B 555 30.527 0.144 -13.784 1.00 0.00 C ATOM 525 C PRO B 555 30.545 -1.177 -13.022 1.00 0.00 C ATOM 526 O PRO B 555 29.576 -1.529 -12.351 1.00 0.00 O ATOM 527 CB PRO B 555 29.781 -0.015 -15.111 1.00 0.00 C ATOM 528 CG PRO B 555 30.847 -0.290 -16.115 1.00 0.00 C ATOM 529 CD PRO B 555 32.056 0.476 -15.655 1.00 0.00 C ATOM 0 HA PRO B 555 30.066 0.859 -13.102 1.00 0.00 H new ATOM 0 HB2 PRO B 555 29.061 -0.832 -15.065 1.00 0.00 H new ATOM 0 HB3 PRO B 555 29.224 0.887 -15.362 1.00 0.00 H new ATOM 0 HG2 PRO B 555 31.061 -1.357 -16.175 1.00 0.00 H new ATOM 0 HG3 PRO B 555 30.538 0.030 -17.110 1.00 0.00 H new ATOM 0 HD2 PRO B 555 32.981 -0.042 -15.909 1.00 0.00 H new ATOM 0 HD3 PRO B 555 32.106 1.462 -16.117 1.00 0.00 H new ATOM 537 N GLN B 556 31.654 -1.902 -13.130 1.00 0.00 N ATOM 538 CA GLN B 556 31.796 -3.184 -12.451 1.00 0.00 C ATOM 539 C GLN B 556 32.173 -2.985 -10.987 1.00 0.00 C ATOM 540 O GLN B 556 31.892 -3.836 -10.143 1.00 0.00 O ATOM 541 CB GLN B 556 32.854 -4.041 -13.150 1.00 0.00 C ATOM 542 CG GLN B 556 32.519 -4.358 -14.598 1.00 0.00 C ATOM 543 CD GLN B 556 33.266 -5.570 -15.118 1.00 0.00 C ATOM 544 OE1 GLN B 556 33.688 -6.432 -14.346 1.00 0.00 O ATOM 545 NE2 GLN B 556 33.434 -5.644 -16.433 1.00 0.00 N ATOM 0 H GLN B 556 32.466 -1.624 -13.681 1.00 0.00 H new ATOM 0 HA GLN B 556 30.836 -3.698 -12.494 1.00 0.00 H new ATOM 0 HB2 GLN B 556 33.812 -3.523 -13.112 1.00 0.00 H new ATOM 0 HB3 GLN B 556 32.975 -4.975 -12.601 1.00 0.00 H new ATOM 0 HG2 GLN B 556 31.447 -4.530 -14.689 1.00 0.00 H new ATOM 0 HG3 GLN B 556 32.757 -3.495 -15.219 1.00 0.00 H new ATOM 0 HE21 GLN B 556 33.068 -4.907 -17.036 1.00 0.00 H new ATOM 0 HE22 GLN B 556 33.929 -6.437 -16.840 1.00 0.00 H new ATOM 554 N GLU B 557 32.812 -1.857 -10.693 1.00 0.00 N ATOM 555 CA GLU B 557 33.228 -1.548 -9.330 1.00 0.00 C ATOM 556 C GLU B 557 32.290 -0.526 -8.693 1.00 0.00 C ATOM 557 O GLU B 557 32.186 -0.442 -7.470 1.00 0.00 O ATOM 558 CB GLU B 557 34.663 -1.017 -9.319 1.00 0.00 C ATOM 559 CG GLU B 557 35.713 -2.095 -9.527 1.00 0.00 C ATOM 560 CD GLU B 557 35.786 -3.069 -8.367 1.00 0.00 C ATOM 561 OE1 GLU B 557 36.271 -2.671 -7.288 1.00 0.00 O ATOM 562 OE2 GLU B 557 35.359 -4.230 -8.540 1.00 0.00 O ATOM 0 H GLU B 557 33.053 -1.142 -11.380 1.00 0.00 H new ATOM 0 HA GLU B 557 33.185 -2.468 -8.747 1.00 0.00 H new ATOM 0 HB2 GLU B 557 34.769 -0.264 -10.100 1.00 0.00 H new ATOM 0 HB3 GLU B 557 34.850 -0.519 -8.368 1.00 0.00 H new ATOM 0 HG2 GLU B 557 35.490 -2.642 -10.443 1.00 0.00 H new ATOM 0 HG3 GLU B 557 36.687 -1.626 -9.665 1.00 0.00 H new ATOM 569 N GLN B 558 31.612 0.249 -9.533 1.00 0.00 N ATOM 570 CA GLN B 558 30.684 1.267 -9.052 1.00 0.00 C ATOM 571 C GLN B 558 29.690 0.672 -8.060 1.00 0.00 C ATOM 572 O GLN B 558 29.498 1.201 -6.965 1.00 0.00 O ATOM 573 CB GLN B 558 29.935 1.899 -10.226 1.00 0.00 C ATOM 574 CG GLN B 558 30.595 3.159 -10.762 1.00 0.00 C ATOM 575 CD GLN B 558 29.598 4.130 -11.364 1.00 0.00 C ATOM 576 OE1 GLN B 558 29.487 5.275 -10.924 1.00 0.00 O ATOM 577 NE2 GLN B 558 28.867 3.677 -12.375 1.00 0.00 N ATOM 0 H GLN B 558 31.687 0.192 -10.549 1.00 0.00 H new ATOM 0 HA GLN B 558 31.261 2.038 -8.541 1.00 0.00 H new ATOM 0 HB2 GLN B 558 29.857 1.169 -11.032 1.00 0.00 H new ATOM 0 HB3 GLN B 558 28.919 2.137 -9.912 1.00 0.00 H new ATOM 0 HG2 GLN B 558 31.135 3.653 -9.954 1.00 0.00 H new ATOM 0 HG3 GLN B 558 31.331 2.885 -11.518 1.00 0.00 H new ATOM 0 HE21 GLN B 558 28.993 2.721 -12.707 1.00 0.00 H new ATOM 0 HE22 GLN B 558 28.180 4.285 -12.820 1.00 0.00 H new ATOM 586 N LYS B 559 29.060 -0.430 -8.450 1.00 0.00 N ATOM 587 CA LYS B 559 28.086 -1.099 -7.596 1.00 0.00 C ATOM 588 C LYS B 559 28.668 -1.363 -6.211 1.00 0.00 C ATOM 589 O LYS B 559 28.032 -1.078 -5.197 1.00 0.00 O ATOM 590 CB LYS B 559 27.637 -2.416 -8.232 1.00 0.00 C ATOM 591 CG LYS B 559 28.790 -3.311 -8.654 1.00 0.00 C ATOM 592 CD LYS B 559 28.304 -4.498 -9.469 1.00 0.00 C ATOM 593 CE LYS B 559 29.253 -5.681 -9.350 1.00 0.00 C ATOM 594 NZ LYS B 559 28.555 -6.977 -9.576 1.00 0.00 N ATOM 0 H LYS B 559 29.207 -0.880 -9.354 1.00 0.00 H new ATOM 0 HA LYS B 559 27.223 -0.442 -7.489 1.00 0.00 H new ATOM 0 HB2 LYS B 559 27.009 -2.956 -7.524 1.00 0.00 H new ATOM 0 HB3 LYS B 559 27.020 -2.197 -9.103 1.00 0.00 H new ATOM 0 HG2 LYS B 559 29.504 -2.733 -9.241 1.00 0.00 H new ATOM 0 HG3 LYS B 559 29.318 -3.667 -7.770 1.00 0.00 H new ATOM 0 HD2 LYS B 559 27.311 -4.791 -9.130 1.00 0.00 H new ATOM 0 HD3 LYS B 559 28.211 -4.209 -10.516 1.00 0.00 H new ATOM 0 HE2 LYS B 559 30.061 -5.573 -10.074 1.00 0.00 H new ATOM 0 HE3 LYS B 559 29.710 -5.682 -8.360 1.00 0.00 H new ATOM 0 HZ1 LYS B 559 29.236 -7.758 -9.486 1.00 0.00 H new ATOM 0 HZ2 LYS B 559 27.800 -7.093 -8.870 1.00 0.00 H new ATOM 0 HZ3 LYS B 559 28.141 -6.987 -10.530 1.00 0.00 H new ATOM 608 N GLN B 560 29.880 -1.907 -6.177 1.00 0.00 N ATOM 609 CA GLN B 560 30.546 -2.209 -4.916 1.00 0.00 C ATOM 610 C GLN B 560 30.750 -0.942 -4.092 1.00 0.00 C ATOM 611 O GLN B 560 30.619 -0.958 -2.868 1.00 0.00 O ATOM 612 CB GLN B 560 31.894 -2.885 -5.176 1.00 0.00 C ATOM 613 CG GLN B 560 31.827 -3.997 -6.211 1.00 0.00 C ATOM 614 CD GLN B 560 33.018 -4.932 -6.140 1.00 0.00 C ATOM 615 OE1 GLN B 560 32.866 -6.153 -6.177 1.00 0.00 O ATOM 616 NE2 GLN B 560 34.213 -4.362 -6.037 1.00 0.00 N ATOM 0 H GLN B 560 30.420 -2.148 -7.008 1.00 0.00 H new ATOM 0 HA GLN B 560 29.909 -2.890 -4.351 1.00 0.00 H new ATOM 0 HB2 GLN B 560 32.610 -2.133 -5.508 1.00 0.00 H new ATOM 0 HB3 GLN B 560 32.273 -3.294 -4.239 1.00 0.00 H new ATOM 0 HG2 GLN B 560 30.911 -4.570 -6.065 1.00 0.00 H new ATOM 0 HG3 GLN B 560 31.773 -3.558 -7.207 1.00 0.00 H new ATOM 0 HE21 GLN B 560 34.293 -3.345 -6.010 1.00 0.00 H new ATOM 0 HE22 GLN B 560 35.051 -4.941 -5.985 1.00 0.00 H new ATOM 625 N MET B 561 31.073 0.154 -4.771 1.00 0.00 N ATOM 626 CA MET B 561 31.294 1.430 -4.100 1.00 0.00 C ATOM 627 C MET B 561 30.019 1.914 -3.417 1.00 0.00 C ATOM 628 O MET B 561 29.988 2.101 -2.200 1.00 0.00 O ATOM 629 CB MET B 561 31.778 2.480 -5.103 1.00 0.00 C ATOM 630 CG MET B 561 33.039 2.073 -5.848 1.00 0.00 C ATOM 631 SD MET B 561 34.182 3.447 -6.081 1.00 0.00 S ATOM 632 CE MET B 561 33.510 4.200 -7.560 1.00 0.00 C ATOM 0 H MET B 561 31.187 0.184 -5.784 1.00 0.00 H new ATOM 0 HA MET B 561 32.060 1.283 -3.338 1.00 0.00 H new ATOM 0 HB2 MET B 561 30.985 2.673 -5.826 1.00 0.00 H new ATOM 0 HB3 MET B 561 31.963 3.416 -4.576 1.00 0.00 H new ATOM 0 HG2 MET B 561 33.541 1.277 -5.297 1.00 0.00 H new ATOM 0 HG3 MET B 561 32.766 1.664 -6.821 1.00 0.00 H new ATOM 0 HE1 MET B 561 34.301 4.732 -8.089 1.00 0.00 H new ATOM 0 HE2 MET B 561 33.098 3.426 -8.207 1.00 0.00 H new ATOM 0 HE3 MET B 561 32.722 4.901 -7.285 1.00 0.00 H new ATOM 642 N LEU B 562 28.969 2.114 -4.206 1.00 0.00 N ATOM 643 CA LEU B 562 27.691 2.576 -3.676 1.00 0.00 C ATOM 644 C LEU B 562 27.239 1.705 -2.508 1.00 0.00 C ATOM 645 O LEU B 562 26.887 2.211 -1.443 1.00 0.00 O ATOM 646 CB LEU B 562 26.627 2.567 -4.776 1.00 0.00 C ATOM 647 CG LEU B 562 26.798 3.608 -5.883 1.00 0.00 C ATOM 648 CD1 LEU B 562 25.805 3.359 -7.007 1.00 0.00 C ATOM 649 CD2 LEU B 562 26.631 5.013 -5.323 1.00 0.00 C ATOM 0 H LEU B 562 28.977 1.963 -5.215 1.00 0.00 H new ATOM 0 HA LEU B 562 27.823 3.596 -3.315 1.00 0.00 H new ATOM 0 HB2 LEU B 562 26.614 1.578 -5.234 1.00 0.00 H new ATOM 0 HB3 LEU B 562 25.652 2.716 -4.312 1.00 0.00 H new ATOM 0 HG LEU B 562 27.805 3.517 -6.289 1.00 0.00 H new ATOM 0 HD11 LEU B 562 25.941 4.109 -7.786 1.00 0.00 H new ATOM 0 HD12 LEU B 562 25.971 2.367 -7.426 1.00 0.00 H new ATOM 0 HD13 LEU B 562 24.790 3.422 -6.616 1.00 0.00 H new ATOM 0 HD21 LEU B 562 26.756 5.741 -6.124 1.00 0.00 H new ATOM 0 HD22 LEU B 562 25.636 5.116 -4.890 1.00 0.00 H new ATOM 0 HD23 LEU B 562 27.382 5.189 -4.552 1.00 0.00 H new ATOM 661 N GLY B 563 27.253 0.392 -2.716 1.00 0.00 N ATOM 662 CA GLY B 563 26.844 -0.529 -1.671 1.00 0.00 C ATOM 663 C GLY B 563 27.778 -0.503 -0.477 1.00 0.00 C ATOM 664 O GLY B 563 27.348 -0.699 0.659 1.00 0.00 O ATOM 0 H GLY B 563 27.540 -0.050 -3.589 1.00 0.00 H new ATOM 0 HA2 GLY B 563 25.835 -0.278 -1.344 1.00 0.00 H new ATOM 0 HA3 GLY B 563 26.806 -1.540 -2.077 1.00 0.00 H new ATOM 668 N GLU B 564 29.060 -0.262 -0.736 1.00 0.00 N ATOM 669 CA GLU B 564 30.057 -0.214 0.327 1.00 0.00 C ATOM 670 C GLU B 564 29.751 0.912 1.310 1.00 0.00 C ATOM 671 O GLU B 564 29.756 0.709 2.524 1.00 0.00 O ATOM 672 CB GLU B 564 31.456 -0.025 -0.264 1.00 0.00 C ATOM 673 CG GLU B 564 32.210 -1.327 -0.472 1.00 0.00 C ATOM 674 CD GLU B 564 32.880 -1.822 0.795 1.00 0.00 C ATOM 675 OE1 GLU B 564 32.266 -1.704 1.875 1.00 0.00 O ATOM 676 OE2 GLU B 564 34.019 -2.327 0.705 1.00 0.00 O ATOM 0 H GLU B 564 29.432 -0.097 -1.671 1.00 0.00 H new ATOM 0 HA GLU B 564 30.023 -1.161 0.865 1.00 0.00 H new ATOM 0 HB2 GLU B 564 31.371 0.492 -1.220 1.00 0.00 H new ATOM 0 HB3 GLU B 564 32.036 0.619 0.396 1.00 0.00 H new ATOM 0 HG2 GLU B 564 31.519 -2.088 -0.835 1.00 0.00 H new ATOM 0 HG3 GLU B 564 32.964 -1.186 -1.246 1.00 0.00 H new ATOM 683 N ARG B 565 29.485 2.100 0.775 1.00 0.00 N ATOM 684 CA ARG B 565 29.179 3.259 1.604 1.00 0.00 C ATOM 685 C ARG B 565 27.758 3.175 2.153 1.00 0.00 C ATOM 686 O ARG B 565 27.467 3.686 3.236 1.00 0.00 O ATOM 687 CB ARG B 565 29.350 4.548 0.799 1.00 0.00 C ATOM 688 CG ARG B 565 29.639 5.769 1.657 1.00 0.00 C ATOM 689 CD ARG B 565 31.126 6.086 1.693 1.00 0.00 C ATOM 690 NE ARG B 565 31.519 6.725 2.946 1.00 0.00 N ATOM 691 CZ ARG B 565 31.743 6.058 4.073 1.00 0.00 C ATOM 692 NH1 ARG B 565 31.613 4.739 4.103 1.00 0.00 N ATOM 693 NH2 ARG B 565 32.097 6.711 5.172 1.00 0.00 N ATOM 0 H ARG B 565 29.475 2.284 -0.228 1.00 0.00 H new ATOM 0 HA ARG B 565 29.875 3.267 2.443 1.00 0.00 H new ATOM 0 HB2 ARG B 565 30.163 4.415 0.085 1.00 0.00 H new ATOM 0 HB3 ARG B 565 28.444 4.728 0.220 1.00 0.00 H new ATOM 0 HG2 ARG B 565 29.092 6.627 1.266 1.00 0.00 H new ATOM 0 HG3 ARG B 565 29.278 5.596 2.671 1.00 0.00 H new ATOM 0 HD2 ARG B 565 31.696 5.166 1.561 1.00 0.00 H new ATOM 0 HD3 ARG B 565 31.378 6.740 0.858 1.00 0.00 H new ATOM 0 HE ARG B 565 31.627 7.739 2.956 1.00 0.00 H new ATOM 0 HH11 ARG B 565 31.340 4.234 3.260 1.00 0.00 H new ATOM 0 HH12 ARG B 565 31.786 4.229 4.969 1.00 0.00 H new ATOM 0 HH21 ARG B 565 32.197 7.726 5.152 1.00 0.00 H new ATOM 0 HH22 ARG B 565 32.269 6.198 6.037 1.00 0.00 H new ATOM 707 N LEU B 566 26.876 2.527 1.400 1.00 0.00 N ATOM 708 CA LEU B 566 25.484 2.376 1.811 1.00 0.00 C ATOM 709 C LEU B 566 25.350 1.320 2.903 1.00 0.00 C ATOM 710 O LEU B 566 24.404 1.342 3.690 1.00 0.00 O ATOM 711 CB LEU B 566 24.616 1.996 0.610 1.00 0.00 C ATOM 712 CG LEU B 566 24.337 3.113 -0.396 1.00 0.00 C ATOM 713 CD1 LEU B 566 24.027 2.532 -1.767 1.00 0.00 C ATOM 714 CD2 LEU B 566 23.189 3.990 0.085 1.00 0.00 C ATOM 0 H LEU B 566 27.100 2.098 0.502 1.00 0.00 H new ATOM 0 HA LEU B 566 25.143 3.331 2.211 1.00 0.00 H new ATOM 0 HB2 LEU B 566 25.099 1.173 0.084 1.00 0.00 H new ATOM 0 HB3 LEU B 566 23.662 1.621 0.981 1.00 0.00 H new ATOM 0 HG LEU B 566 25.231 3.732 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU B 566 23.831 3.342 -2.470 1.00 0.00 H new ATOM 0 HD12 LEU B 566 24.878 1.947 -2.115 1.00 0.00 H new ATOM 0 HD13 LEU B 566 23.149 1.890 -1.700 1.00 0.00 H new ATOM 0 HD21 LEU B 566 23.004 4.780 -0.643 1.00 0.00 H new ATOM 0 HD22 LEU B 566 22.290 3.383 0.198 1.00 0.00 H new ATOM 0 HD23 LEU B 566 23.449 4.436 1.045 1.00 0.00 H new ATOM 726 N PHE B 567 26.306 0.397 2.947 1.00 0.00 N ATOM 727 CA PHE B 567 26.296 -0.667 3.944 1.00 0.00 C ATOM 728 C PHE B 567 26.151 -0.093 5.351 1.00 0.00 C ATOM 729 O PHE B 567 25.221 -0.419 6.089 1.00 0.00 O ATOM 730 CB PHE B 567 27.578 -1.496 3.849 1.00 0.00 C ATOM 731 CG PHE B 567 27.964 -2.154 5.143 1.00 0.00 C ATOM 732 CD1 PHE B 567 27.069 -2.973 5.813 1.00 0.00 C ATOM 733 CD2 PHE B 567 29.221 -1.954 5.689 1.00 0.00 C ATOM 734 CE1 PHE B 567 27.421 -3.580 7.004 1.00 0.00 C ATOM 735 CE2 PHE B 567 29.579 -2.558 6.879 1.00 0.00 C ATOM 736 CZ PHE B 567 28.678 -3.371 7.538 1.00 0.00 C ATOM 0 H PHE B 567 27.097 0.365 2.304 1.00 0.00 H new ATOM 0 HA PHE B 567 25.440 -1.311 3.743 1.00 0.00 H new ATOM 0 HB2 PHE B 567 27.450 -2.263 3.085 1.00 0.00 H new ATOM 0 HB3 PHE B 567 28.394 -0.852 3.520 1.00 0.00 H new ATOM 0 HD1 PHE B 567 26.085 -3.139 5.400 1.00 0.00 H new ATOM 0 HD2 PHE B 567 29.930 -1.319 5.179 1.00 0.00 H new ATOM 0 HE1 PHE B 567 26.715 -4.217 7.516 1.00 0.00 H new ATOM 0 HE2 PHE B 567 30.563 -2.394 7.293 1.00 0.00 H new ATOM 0 HZ PHE B 567 28.955 -3.843 8.469 1.00 0.00 H new ATOM 746 N PRO B 568 27.093 0.782 5.732 1.00 0.00 N ATOM 747 CA PRO B 568 27.093 1.420 7.052 1.00 0.00 C ATOM 748 C PRO B 568 25.958 2.425 7.210 1.00 0.00 C ATOM 749 O PRO B 568 25.418 2.600 8.303 1.00 0.00 O ATOM 750 CB PRO B 568 28.448 2.131 7.102 1.00 0.00 C ATOM 751 CG PRO B 568 28.801 2.374 5.675 1.00 0.00 C ATOM 752 CD PRO B 568 28.231 1.216 4.904 1.00 0.00 C ATOM 0 HA PRO B 568 26.946 0.697 7.854 1.00 0.00 H new ATOM 0 HB2 PRO B 568 28.384 3.066 7.659 1.00 0.00 H new ATOM 0 HB3 PRO B 568 29.200 1.516 7.597 1.00 0.00 H new ATOM 0 HG2 PRO B 568 28.384 3.318 5.325 1.00 0.00 H new ATOM 0 HG3 PRO B 568 29.882 2.435 5.545 1.00 0.00 H new ATOM 0 HD2 PRO B 568 27.911 1.516 3.906 1.00 0.00 H new ATOM 0 HD3 PRO B 568 28.963 0.418 4.777 1.00 0.00 H new ATOM 760 N LEU B 569 25.598 3.082 6.113 1.00 0.00 N ATOM 761 CA LEU B 569 24.525 4.070 6.129 1.00 0.00 C ATOM 762 C LEU B 569 23.224 3.452 6.633 1.00 0.00 C ATOM 763 O LEU B 569 22.633 3.929 7.602 1.00 0.00 O ATOM 764 CB LEU B 569 24.319 4.651 4.730 1.00 0.00 C ATOM 765 CG LEU B 569 25.364 5.666 4.264 1.00 0.00 C ATOM 766 CD1 LEU B 569 25.249 5.901 2.766 1.00 0.00 C ATOM 767 CD2 LEU B 569 25.213 6.975 5.025 1.00 0.00 C ATOM 0 H LEU B 569 26.034 2.948 5.201 1.00 0.00 H new ATOM 0 HA LEU B 569 24.812 4.872 6.809 1.00 0.00 H new ATOM 0 HB2 LEU B 569 24.298 3.828 4.016 1.00 0.00 H new ATOM 0 HB3 LEU B 569 23.339 5.127 4.697 1.00 0.00 H new ATOM 0 HG LEU B 569 26.354 5.261 4.472 1.00 0.00 H new ATOM 0 HD11 LEU B 569 26.000 6.626 2.453 1.00 0.00 H new ATOM 0 HD12 LEU B 569 25.409 4.961 2.237 1.00 0.00 H new ATOM 0 HD13 LEU B 569 24.256 6.284 2.533 1.00 0.00 H new ATOM 0 HD21 LEU B 569 25.965 7.685 4.680 1.00 0.00 H new ATOM 0 HD22 LEU B 569 24.219 7.385 4.849 1.00 0.00 H new ATOM 0 HD23 LEU B 569 25.347 6.794 6.091 1.00 0.00 H new ATOM 779 N ILE B 570 22.785 2.388 5.969 1.00 0.00 N ATOM 780 CA ILE B 570 21.557 1.703 6.351 1.00 0.00 C ATOM 781 C ILE B 570 21.764 0.860 7.605 1.00 0.00 C ATOM 782 O ILE B 570 20.807 0.516 8.298 1.00 0.00 O ATOM 783 CB ILE B 570 21.040 0.798 5.217 1.00 0.00 C ATOM 784 CG1 ILE B 570 20.816 1.617 3.944 1.00 0.00 C ATOM 785 CG2 ILE B 570 19.754 0.102 5.638 1.00 0.00 C ATOM 786 CD1 ILE B 570 21.178 0.874 2.677 1.00 0.00 C ATOM 0 H ILE B 570 23.262 1.982 5.164 1.00 0.00 H new ATOM 0 HA ILE B 570 20.816 2.476 6.554 1.00 0.00 H new ATOM 0 HB ILE B 570 21.791 0.036 5.010 1.00 0.00 H new ATOM 0 HG12 ILE B 570 19.769 1.916 3.894 1.00 0.00 H new ATOM 0 HG13 ILE B 570 21.407 2.531 4.001 1.00 0.00 H new ATOM 0 HG21 ILE B 570 19.402 -0.534 4.826 1.00 0.00 H new ATOM 0 HG22 ILE B 570 19.943 -0.509 6.521 1.00 0.00 H new ATOM 0 HG23 ILE B 570 18.995 0.849 5.869 1.00 0.00 H new ATOM 0 HD11 ILE B 570 20.994 1.515 1.814 1.00 0.00 H new ATOM 0 HD12 ILE B 570 22.232 0.598 2.706 1.00 0.00 H new ATOM 0 HD13 ILE B 570 20.569 -0.026 2.597 1.00 0.00 H new ATOM 798 N GLN B 571 23.020 0.532 7.889 1.00 0.00 N ATOM 799 CA GLN B 571 23.353 -0.271 9.060 1.00 0.00 C ATOM 800 C GLN B 571 22.861 0.401 10.338 1.00 0.00 C ATOM 801 O GLN B 571 22.648 -0.259 11.355 1.00 0.00 O ATOM 802 CB GLN B 571 24.864 -0.495 9.138 1.00 0.00 C ATOM 803 CG GLN B 571 25.307 -1.230 10.393 1.00 0.00 C ATOM 804 CD GLN B 571 26.814 -1.271 10.545 1.00 0.00 C ATOM 805 OE1 GLN B 571 27.479 -0.234 10.536 1.00 0.00 O ATOM 806 NE2 GLN B 571 27.363 -2.472 10.685 1.00 0.00 N ATOM 0 H GLN B 571 23.823 0.809 7.325 1.00 0.00 H new ATOM 0 HA GLN B 571 22.854 -1.235 8.962 1.00 0.00 H new ATOM 0 HB2 GLN B 571 25.184 -1.061 8.263 1.00 0.00 H new ATOM 0 HB3 GLN B 571 25.369 0.470 9.095 1.00 0.00 H new ATOM 0 HG2 GLN B 571 24.871 -0.745 11.266 1.00 0.00 H new ATOM 0 HG3 GLN B 571 24.921 -2.249 10.368 1.00 0.00 H new ATOM 0 HE21 GLN B 571 26.774 -3.305 10.687 1.00 0.00 H new ATOM 0 HE22 GLN B 571 28.374 -2.562 10.791 1.00 0.00 H new ATOM 815 N ALA B 572 22.683 1.716 10.278 1.00 0.00 N ATOM 816 CA ALA B 572 22.214 2.477 11.430 1.00 0.00 C ATOM 817 C ALA B 572 20.707 2.329 11.608 1.00 0.00 C ATOM 818 O ALA B 572 20.131 2.856 12.560 1.00 0.00 O ATOM 819 CB ALA B 572 22.589 3.944 11.282 1.00 0.00 C ATOM 0 H ALA B 572 22.856 2.277 9.444 1.00 0.00 H new ATOM 0 HA ALA B 572 22.700 2.078 12.321 1.00 0.00 H new ATOM 0 HB1 ALA B 572 22.233 4.500 12.149 1.00 0.00 H new ATOM 0 HB2 ALA B 572 23.673 4.037 11.212 1.00 0.00 H new ATOM 0 HB3 ALA B 572 22.131 4.347 10.379 1.00 0.00 H new ATOM 825 N MET B 573 20.074 1.611 10.687 1.00 0.00 N ATOM 826 CA MET B 573 18.633 1.395 10.743 1.00 0.00 C ATOM 827 C MET B 573 18.304 -0.093 10.688 1.00 0.00 C ATOM 828 O MET B 573 17.644 -0.627 11.581 1.00 0.00 O ATOM 829 CB MET B 573 17.940 2.125 9.591 1.00 0.00 C ATOM 830 CG MET B 573 18.454 3.539 9.370 1.00 0.00 C ATOM 831 SD MET B 573 17.365 4.518 8.319 1.00 0.00 S ATOM 832 CE MET B 573 18.250 4.453 6.762 1.00 0.00 C ATOM 0 H MET B 573 20.536 1.169 9.893 1.00 0.00 H new ATOM 0 HA MET B 573 18.268 1.796 11.689 1.00 0.00 H new ATOM 0 HB2 MET B 573 18.075 1.551 8.674 1.00 0.00 H new ATOM 0 HB3 MET B 573 16.869 2.163 9.788 1.00 0.00 H new ATOM 0 HG2 MET B 573 18.565 4.036 10.334 1.00 0.00 H new ATOM 0 HG3 MET B 573 19.445 3.495 8.918 1.00 0.00 H new ATOM 0 HE1 MET B 573 17.700 5.015 6.007 1.00 0.00 H new ATOM 0 HE2 MET B 573 19.241 4.889 6.888 1.00 0.00 H new ATOM 0 HE3 MET B 573 18.348 3.416 6.442 1.00 0.00 H new ATOM 842 N HIS B 574 18.767 -0.759 9.635 1.00 0.00 N ATOM 843 CA HIS B 574 18.522 -2.187 9.465 1.00 0.00 C ATOM 844 C HIS B 574 19.829 -2.939 9.234 1.00 0.00 C ATOM 845 O HIS B 574 20.097 -3.446 8.144 1.00 0.00 O ATOM 846 CB HIS B 574 17.568 -2.426 8.294 1.00 0.00 C ATOM 847 CG HIS B 574 16.259 -1.711 8.432 1.00 0.00 C ATOM 848 ND1 HIS B 574 15.834 -0.742 7.547 1.00 0.00 N ATOM 849 CD2 HIS B 574 15.279 -1.830 9.357 1.00 0.00 C ATOM 850 CE1 HIS B 574 14.650 -0.294 7.924 1.00 0.00 C ATOM 851 NE2 HIS B 574 14.290 -0.939 9.019 1.00 0.00 N ATOM 0 H HIS B 574 19.314 -0.333 8.887 1.00 0.00 H new ATOM 0 HA HIS B 574 18.064 -2.564 10.380 1.00 0.00 H new ATOM 0 HB2 HIS B 574 18.052 -2.106 7.371 1.00 0.00 H new ATOM 0 HB3 HIS B 574 17.380 -3.496 8.202 1.00 0.00 H new ATOM 0 HD2 HIS B 574 15.275 -2.501 10.204 1.00 0.00 H new ATOM 0 HE1 HIS B 574 14.074 0.470 7.422 1.00 0.00 H new ATOM 0 HE2 HIS B 574 13.419 -0.798 9.531 1.00 0.00 H new ATOM 859 N PRO B 575 20.663 -3.013 10.281 1.00 0.00 N ATOM 860 CA PRO B 575 21.956 -3.701 10.217 1.00 0.00 C ATOM 861 C PRO B 575 21.803 -5.214 10.107 1.00 0.00 C ATOM 862 O PRO B 575 22.762 -5.925 9.805 1.00 0.00 O ATOM 863 CB PRO B 575 22.624 -3.326 11.542 1.00 0.00 C ATOM 864 CG PRO B 575 21.493 -3.026 12.465 1.00 0.00 C ATOM 865 CD PRO B 575 20.408 -2.431 11.610 1.00 0.00 C ATOM 0 HA PRO B 575 22.530 -3.409 9.337 1.00 0.00 H new ATOM 0 HB2 PRO B 575 23.238 -4.143 11.921 1.00 0.00 H new ATOM 0 HB3 PRO B 575 23.279 -2.463 11.425 1.00 0.00 H new ATOM 0 HG2 PRO B 575 21.145 -3.931 12.963 1.00 0.00 H new ATOM 0 HG3 PRO B 575 21.800 -2.330 13.246 1.00 0.00 H new ATOM 0 HD2 PRO B 575 19.416 -2.692 11.980 1.00 0.00 H new ATOM 0 HD3 PRO B 575 20.464 -1.343 11.590 1.00 0.00 H new ATOM 873 N THR B 576 20.591 -5.701 10.353 1.00 0.00 N ATOM 874 CA THR B 576 20.312 -7.130 10.282 1.00 0.00 C ATOM 875 C THR B 576 20.550 -7.667 8.876 1.00 0.00 C ATOM 876 O THR B 576 21.120 -8.744 8.700 1.00 0.00 O ATOM 877 CB THR B 576 18.863 -7.441 10.701 1.00 0.00 C ATOM 878 OG1 THR B 576 18.578 -6.837 11.967 1.00 0.00 O ATOM 879 CG2 THR B 576 18.635 -8.942 10.786 1.00 0.00 C ATOM 0 H THR B 576 19.786 -5.126 10.603 1.00 0.00 H new ATOM 0 HA THR B 576 20.995 -7.621 10.975 1.00 0.00 H new ATOM 0 HB THR B 576 18.194 -7.030 9.945 1.00 0.00 H new ATOM 0 HG1 THR B 576 17.654 -7.038 12.225 1.00 0.00 H new ATOM 0 HG21 THR B 576 17.605 -9.137 11.084 1.00 0.00 H new ATOM 0 HG22 THR B 576 18.823 -9.394 9.812 1.00 0.00 H new ATOM 0 HG23 THR B 576 19.313 -9.372 11.523 1.00 0.00 H new ATOM 887 N LEU B 577 20.109 -6.911 7.876 1.00 0.00 N ATOM 888 CA LEU B 577 20.275 -7.311 6.483 1.00 0.00 C ATOM 889 C LEU B 577 20.668 -6.119 5.617 1.00 0.00 C ATOM 890 O LEU B 577 20.245 -6.008 4.467 1.00 0.00 O ATOM 891 CB LEU B 577 18.983 -7.936 5.955 1.00 0.00 C ATOM 892 CG LEU B 577 18.178 -8.763 6.958 1.00 0.00 C ATOM 893 CD1 LEU B 577 17.198 -7.879 7.714 1.00 0.00 C ATOM 894 CD2 LEU B 577 17.443 -9.892 6.250 1.00 0.00 C ATOM 0 H LEU B 577 19.634 -6.018 8.004 1.00 0.00 H new ATOM 0 HA LEU B 577 21.075 -8.050 6.435 1.00 0.00 H new ATOM 0 HB2 LEU B 577 18.344 -7.137 5.578 1.00 0.00 H new ATOM 0 HB3 LEU B 577 19.232 -8.573 5.106 1.00 0.00 H new ATOM 0 HG LEU B 577 18.870 -9.201 7.677 1.00 0.00 H new ATOM 0 HD11 LEU B 577 16.634 -8.485 8.423 1.00 0.00 H new ATOM 0 HD12 LEU B 577 17.746 -7.106 8.253 1.00 0.00 H new ATOM 0 HD13 LEU B 577 16.511 -7.412 7.009 1.00 0.00 H new ATOM 0 HD21 LEU B 577 16.875 -10.470 6.979 1.00 0.00 H new ATOM 0 HD22 LEU B 577 16.762 -9.474 5.509 1.00 0.00 H new ATOM 0 HD23 LEU B 577 18.165 -10.541 5.754 1.00 0.00 H new ATOM 906 N ALA B 578 21.483 -5.230 6.177 1.00 0.00 N ATOM 907 CA ALA B 578 21.937 -4.048 5.455 1.00 0.00 C ATOM 908 C ALA B 578 22.462 -4.419 4.072 1.00 0.00 C ATOM 909 O ALA B 578 22.030 -3.862 3.063 1.00 0.00 O ATOM 910 CB ALA B 578 23.010 -3.323 6.252 1.00 0.00 C ATOM 0 H ALA B 578 21.842 -5.307 7.129 1.00 0.00 H new ATOM 0 HA ALA B 578 21.084 -3.381 5.325 1.00 0.00 H new ATOM 0 HB1 ALA B 578 23.340 -2.442 5.701 1.00 0.00 H new ATOM 0 HB2 ALA B 578 22.603 -3.017 7.216 1.00 0.00 H new ATOM 0 HB3 ALA B 578 23.857 -3.990 6.412 1.00 0.00 H new ATOM 916 N GLY B 579 23.397 -5.363 4.032 1.00 0.00 N ATOM 917 CA GLY B 579 23.967 -5.790 2.767 1.00 0.00 C ATOM 918 C GLY B 579 22.911 -6.259 1.785 1.00 0.00 C ATOM 919 O GLY B 579 22.950 -5.907 0.606 1.00 0.00 O ATOM 0 H GLY B 579 23.770 -5.840 4.853 1.00 0.00 H new ATOM 0 HA2 GLY B 579 24.527 -4.965 2.327 1.00 0.00 H new ATOM 0 HA3 GLY B 579 24.677 -6.598 2.946 1.00 0.00 H new ATOM 923 N LYS B 580 21.966 -7.056 2.271 1.00 0.00 N ATOM 924 CA LYS B 580 20.894 -7.574 1.429 1.00 0.00 C ATOM 925 C LYS B 580 20.113 -6.436 0.780 1.00 0.00 C ATOM 926 O LYS B 580 20.064 -6.324 -0.445 1.00 0.00 O ATOM 927 CB LYS B 580 19.949 -8.451 2.253 1.00 0.00 C ATOM 928 CG LYS B 580 20.643 -9.613 2.942 1.00 0.00 C ATOM 929 CD LYS B 580 20.899 -10.760 1.979 1.00 0.00 C ATOM 930 CE LYS B 580 22.305 -10.698 1.400 1.00 0.00 C ATOM 931 NZ LYS B 580 23.266 -11.518 2.189 1.00 0.00 N ATOM 0 H LYS B 580 21.920 -7.358 3.244 1.00 0.00 H new ATOM 0 HA LYS B 580 21.344 -8.177 0.641 1.00 0.00 H new ATOM 0 HB2 LYS B 580 19.458 -7.834 3.006 1.00 0.00 H new ATOM 0 HB3 LYS B 580 19.167 -8.841 1.601 1.00 0.00 H new ATOM 0 HG2 LYS B 580 21.589 -9.274 3.365 1.00 0.00 H new ATOM 0 HG3 LYS B 580 20.030 -9.964 3.772 1.00 0.00 H new ATOM 0 HD2 LYS B 580 20.759 -11.709 2.496 1.00 0.00 H new ATOM 0 HD3 LYS B 580 20.169 -10.727 1.170 1.00 0.00 H new ATOM 0 HE2 LYS B 580 22.289 -11.050 0.368 1.00 0.00 H new ATOM 0 HE3 LYS B 580 22.644 -9.662 1.378 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 24.204 -11.069 2.169 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 22.936 -11.588 3.173 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 23.330 -12.471 1.777 1.00 0.00 H new ATOM 945 N ILE B 581 19.504 -5.595 1.609 1.00 0.00 N ATOM 946 CA ILE B 581 18.728 -4.464 1.115 1.00 0.00 C ATOM 947 C ILE B 581 19.602 -3.506 0.313 1.00 0.00 C ATOM 948 O ILE B 581 19.112 -2.772 -0.547 1.00 0.00 O ATOM 949 CB ILE B 581 18.063 -3.691 2.269 1.00 0.00 C ATOM 950 CG1 ILE B 581 19.116 -3.234 3.279 1.00 0.00 C ATOM 951 CG2 ILE B 581 17.010 -4.555 2.947 1.00 0.00 C ATOM 952 CD1 ILE B 581 18.532 -2.796 4.604 1.00 0.00 C ATOM 0 H ILE B 581 19.533 -5.675 2.625 1.00 0.00 H new ATOM 0 HA ILE B 581 17.952 -4.872 0.467 1.00 0.00 H new ATOM 0 HB ILE B 581 17.572 -2.808 1.860 1.00 0.00 H new ATOM 0 HG12 ILE B 581 19.819 -4.049 3.453 1.00 0.00 H new ATOM 0 HG13 ILE B 581 19.684 -2.408 2.851 1.00 0.00 H new ATOM 0 HG21 ILE B 581 16.549 -3.995 3.761 1.00 0.00 H new ATOM 0 HG22 ILE B 581 16.247 -4.835 2.221 1.00 0.00 H new ATOM 0 HG23 ILE B 581 17.479 -5.454 3.346 1.00 0.00 H new ATOM 0 HD11 ILE B 581 19.336 -2.485 5.271 1.00 0.00 H new ATOM 0 HD12 ILE B 581 17.851 -1.960 4.443 1.00 0.00 H new ATOM 0 HD13 ILE B 581 17.988 -3.626 5.054 1.00 0.00 H new ATOM 964 N THR B 582 20.900 -3.518 0.598 1.00 0.00 N ATOM 965 CA THR B 582 21.843 -2.651 -0.097 1.00 0.00 C ATOM 966 C THR B 582 22.005 -3.069 -1.554 1.00 0.00 C ATOM 967 O THR B 582 22.019 -2.230 -2.453 1.00 0.00 O ATOM 968 CB THR B 582 23.224 -2.662 0.585 1.00 0.00 C ATOM 969 OG1 THR B 582 23.169 -1.934 1.817 1.00 0.00 O ATOM 970 CG2 THR B 582 24.282 -2.053 -0.323 1.00 0.00 C ATOM 0 H THR B 582 21.322 -4.119 1.306 1.00 0.00 H new ATOM 0 HA THR B 582 21.433 -1.642 -0.055 1.00 0.00 H new ATOM 0 HB THR B 582 23.495 -3.698 0.788 1.00 0.00 H new ATOM 0 HG1 THR B 582 22.926 -2.542 2.546 1.00 0.00 H new ATOM 0 HG21 THR B 582 25.248 -2.072 0.181 1.00 0.00 H new ATOM 0 HG22 THR B 582 24.343 -2.628 -1.247 1.00 0.00 H new ATOM 0 HG23 THR B 582 24.014 -1.022 -0.554 1.00 0.00 H new ATOM 978 N GLY B 583 22.126 -4.374 -1.780 1.00 0.00 N ATOM 979 CA GLY B 583 22.284 -4.881 -3.130 1.00 0.00 C ATOM 980 C GLY B 583 21.117 -4.518 -4.026 1.00 0.00 C ATOM 981 O GLY B 583 21.308 -4.113 -5.173 1.00 0.00 O ATOM 0 H GLY B 583 22.117 -5.088 -1.052 1.00 0.00 H new ATOM 0 HA2 GLY B 583 23.204 -4.484 -3.558 1.00 0.00 H new ATOM 0 HA3 GLY B 583 22.389 -5.965 -3.097 1.00 0.00 H new ATOM 985 N MET B 584 19.904 -4.665 -3.504 1.00 0.00 N ATOM 986 CA MET B 584 18.700 -4.350 -4.265 1.00 0.00 C ATOM 987 C MET B 584 18.564 -2.844 -4.467 1.00 0.00 C ATOM 988 O MET B 584 18.300 -2.378 -5.577 1.00 0.00 O ATOM 989 CB MET B 584 17.462 -4.895 -3.551 1.00 0.00 C ATOM 990 CG MET B 584 17.565 -6.369 -3.195 1.00 0.00 C ATOM 991 SD MET B 584 17.160 -6.697 -1.469 1.00 0.00 S ATOM 992 CE MET B 584 15.370 -6.635 -1.524 1.00 0.00 C ATOM 0 H MET B 584 19.728 -5.000 -2.557 1.00 0.00 H new ATOM 0 HA MET B 584 18.784 -4.824 -5.243 1.00 0.00 H new ATOM 0 HB2 MET B 584 17.296 -4.320 -2.640 1.00 0.00 H new ATOM 0 HB3 MET B 584 16.590 -4.743 -4.187 1.00 0.00 H new ATOM 0 HG2 MET B 584 16.895 -6.941 -3.836 1.00 0.00 H new ATOM 0 HG3 MET B 584 18.577 -6.718 -3.399 1.00 0.00 H new ATOM 0 HE1 MET B 584 14.959 -7.337 -0.798 1.00 0.00 H new ATOM 0 HE2 MET B 584 15.033 -5.626 -1.285 1.00 0.00 H new ATOM 0 HE3 MET B 584 15.027 -6.904 -2.523 1.00 0.00 H new ATOM 1002 N LEU B 585 18.744 -2.089 -3.390 1.00 0.00 N ATOM 1003 CA LEU B 585 18.640 -0.635 -3.449 1.00 0.00 C ATOM 1004 C LEU B 585 19.586 -0.064 -4.501 1.00 0.00 C ATOM 1005 O LEU B 585 19.158 0.626 -5.428 1.00 0.00 O ATOM 1006 CB LEU B 585 18.952 -0.025 -2.081 1.00 0.00 C ATOM 1007 CG LEU B 585 17.744 0.361 -1.227 1.00 0.00 C ATOM 1008 CD1 LEU B 585 16.857 1.346 -1.971 1.00 0.00 C ATOM 1009 CD2 LEU B 585 16.954 -0.878 -0.830 1.00 0.00 C ATOM 0 H LEU B 585 18.963 -2.459 -2.465 1.00 0.00 H new ATOM 0 HA LEU B 585 17.618 -0.380 -3.729 1.00 0.00 H new ATOM 0 HB2 LEU B 585 19.557 -0.736 -1.518 1.00 0.00 H new ATOM 0 HB3 LEU B 585 19.563 0.865 -2.233 1.00 0.00 H new ATOM 0 HG LEU B 585 18.105 0.844 -0.319 1.00 0.00 H new ATOM 0 HD11 LEU B 585 16.003 1.609 -1.347 1.00 0.00 H new ATOM 0 HD12 LEU B 585 17.427 2.245 -2.203 1.00 0.00 H new ATOM 0 HD13 LEU B 585 16.504 0.891 -2.896 1.00 0.00 H new ATOM 0 HD21 LEU B 585 16.098 -0.584 -0.223 1.00 0.00 H new ATOM 0 HD22 LEU B 585 16.604 -1.389 -1.727 1.00 0.00 H new ATOM 0 HD23 LEU B 585 17.593 -1.549 -0.256 1.00 0.00 H new ATOM 1021 N LEU B 586 20.873 -0.357 -4.353 1.00 0.00 N ATOM 1022 CA LEU B 586 21.880 0.125 -5.292 1.00 0.00 C ATOM 1023 C LEU B 586 21.637 -0.438 -6.688 1.00 0.00 C ATOM 1024 O LEU B 586 22.070 0.141 -7.684 1.00 0.00 O ATOM 1025 CB LEU B 586 23.280 -0.261 -4.811 1.00 0.00 C ATOM 1026 CG LEU B 586 23.608 -1.754 -4.827 1.00 0.00 C ATOM 1027 CD1 LEU B 586 24.139 -2.169 -6.190 1.00 0.00 C ATOM 1028 CD2 LEU B 586 24.613 -2.092 -3.735 1.00 0.00 C ATOM 0 H LEU B 586 21.244 -0.926 -3.592 1.00 0.00 H new ATOM 0 HA LEU B 586 21.805 1.211 -5.341 1.00 0.00 H new ATOM 0 HB2 LEU B 586 24.011 0.258 -5.431 1.00 0.00 H new ATOM 0 HB3 LEU B 586 23.407 0.107 -3.793 1.00 0.00 H new ATOM 0 HG LEU B 586 22.691 -2.310 -4.633 1.00 0.00 H new ATOM 0 HD11 LEU B 586 24.367 -3.235 -6.183 1.00 0.00 H new ATOM 0 HD12 LEU B 586 23.386 -1.964 -6.951 1.00 0.00 H new ATOM 0 HD13 LEU B 586 25.045 -1.606 -6.415 1.00 0.00 H new ATOM 0 HD21 LEU B 586 24.834 -3.159 -3.762 1.00 0.00 H new ATOM 0 HD22 LEU B 586 25.531 -1.527 -3.898 1.00 0.00 H new ATOM 0 HD23 LEU B 586 24.195 -1.833 -2.763 1.00 0.00 H new ATOM 1040 N GLU B 587 20.940 -1.568 -6.752 1.00 0.00 N ATOM 1041 CA GLU B 587 20.638 -2.207 -8.027 1.00 0.00 C ATOM 1042 C GLU B 587 19.525 -1.463 -8.759 1.00 0.00 C ATOM 1043 O GLU B 587 19.361 -1.606 -9.971 1.00 0.00 O ATOM 1044 CB GLU B 587 20.232 -3.666 -7.808 1.00 0.00 C ATOM 1045 CG GLU B 587 19.702 -4.345 -9.060 1.00 0.00 C ATOM 1046 CD GLU B 587 20.029 -5.825 -9.104 1.00 0.00 C ATOM 1047 OE1 GLU B 587 21.229 -6.170 -9.066 1.00 0.00 O ATOM 1048 OE2 GLU B 587 19.084 -6.639 -9.175 1.00 0.00 O ATOM 0 H GLU B 587 20.574 -2.059 -5.936 1.00 0.00 H new ATOM 0 HA GLU B 587 21.538 -2.176 -8.642 1.00 0.00 H new ATOM 0 HB2 GLU B 587 21.094 -4.223 -7.440 1.00 0.00 H new ATOM 0 HB3 GLU B 587 19.469 -3.709 -7.031 1.00 0.00 H new ATOM 0 HG2 GLU B 587 18.621 -4.214 -9.110 1.00 0.00 H new ATOM 0 HG3 GLU B 587 20.123 -3.857 -9.939 1.00 0.00 H new ATOM 1055 N ILE B 588 18.763 -0.668 -8.015 1.00 0.00 N ATOM 1056 CA ILE B 588 17.667 0.099 -8.592 1.00 0.00 C ATOM 1057 C ILE B 588 18.128 0.879 -9.819 1.00 0.00 C ATOM 1058 O ILE B 588 17.643 0.655 -10.928 1.00 0.00 O ATOM 1059 CB ILE B 588 17.066 1.081 -7.569 1.00 0.00 C ATOM 1060 CG1 ILE B 588 16.459 0.316 -6.391 1.00 0.00 C ATOM 1061 CG2 ILE B 588 16.018 1.962 -8.232 1.00 0.00 C ATOM 1062 CD1 ILE B 588 16.065 1.205 -5.232 1.00 0.00 C ATOM 0 H ILE B 588 18.885 -0.539 -7.011 1.00 0.00 H new ATOM 0 HA ILE B 588 16.901 -0.619 -8.887 1.00 0.00 H new ATOM 0 HB ILE B 588 17.863 1.721 -7.191 1.00 0.00 H new ATOM 0 HG12 ILE B 588 15.580 -0.228 -6.736 1.00 0.00 H new ATOM 0 HG13 ILE B 588 17.177 -0.426 -6.042 1.00 0.00 H new ATOM 0 HG21 ILE B 588 15.603 2.650 -7.496 1.00 0.00 H new ATOM 0 HG22 ILE B 588 16.479 2.530 -9.040 1.00 0.00 H new ATOM 0 HG23 ILE B 588 15.221 1.338 -8.635 1.00 0.00 H new ATOM 0 HD11 ILE B 588 15.642 0.596 -4.433 1.00 0.00 H new ATOM 0 HD12 ILE B 588 16.945 1.730 -4.861 1.00 0.00 H new ATOM 0 HD13 ILE B 588 15.323 1.931 -5.566 1.00 0.00 H new ATOM 1074 N ASP B 589 19.068 1.794 -9.612 1.00 0.00 N ATOM 1075 CA ASP B 589 19.598 2.606 -10.701 1.00 0.00 C ATOM 1076 C ASP B 589 20.594 3.636 -10.177 1.00 0.00 C ATOM 1077 O ASP B 589 20.293 4.389 -9.252 1.00 0.00 O ATOM 1078 CB ASP B 589 18.459 3.310 -11.441 1.00 0.00 C ATOM 1079 CG ASP B 589 18.477 3.030 -12.931 1.00 0.00 C ATOM 1080 OD1 ASP B 589 18.701 1.862 -13.313 1.00 0.00 O ATOM 1081 OD2 ASP B 589 18.265 3.978 -13.715 1.00 0.00 O ATOM 0 H ASP B 589 19.479 1.992 -8.700 1.00 0.00 H new ATOM 0 HA ASP B 589 20.118 1.945 -11.394 1.00 0.00 H new ATOM 0 HB2 ASP B 589 17.505 2.987 -11.025 1.00 0.00 H new ATOM 0 HB3 ASP B 589 18.531 4.385 -11.275 1.00 0.00 H new ATOM 1086 N ASN B 590 21.781 3.660 -10.773 1.00 0.00 N ATOM 1087 CA ASN B 590 22.822 4.597 -10.365 1.00 0.00 C ATOM 1088 C ASN B 590 22.397 6.036 -10.639 1.00 0.00 C ATOM 1089 O ASN B 590 22.798 6.958 -9.929 1.00 0.00 O ATOM 1090 CB ASN B 590 24.129 4.290 -11.099 1.00 0.00 C ATOM 1091 CG ASN B 590 24.722 2.955 -10.693 1.00 0.00 C ATOM 1092 OD1 ASN B 590 23.997 2.019 -10.355 1.00 0.00 O ATOM 1093 ND2 ASN B 590 26.046 2.862 -10.723 1.00 0.00 N ATOM 0 H ASN B 590 22.046 3.042 -11.540 1.00 0.00 H new ATOM 0 HA ASN B 590 22.980 4.482 -9.293 1.00 0.00 H new ATOM 0 HB2 ASN B 590 23.948 4.292 -12.174 1.00 0.00 H new ATOM 0 HB3 ASN B 590 24.851 5.081 -10.896 1.00 0.00 H new ATOM 0 HD21 ASN B 590 26.502 1.989 -10.459 1.00 0.00 H new ATOM 0 HD22 ASN B 590 26.607 3.664 -11.010 1.00 0.00 H new ATOM 1100 N SER B 591 21.582 6.220 -11.673 1.00 0.00 N ATOM 1101 CA SER B 591 21.105 7.547 -12.043 1.00 0.00 C ATOM 1102 C SER B 591 20.300 8.171 -10.907 1.00 0.00 C ATOM 1103 O SER B 591 20.534 9.316 -10.523 1.00 0.00 O ATOM 1104 CB SER B 591 20.249 7.470 -13.308 1.00 0.00 C ATOM 1105 OG SER B 591 19.885 8.764 -13.758 1.00 0.00 O ATOM 0 H SER B 591 21.239 5.467 -12.269 1.00 0.00 H new ATOM 0 HA SER B 591 21.973 8.177 -12.238 1.00 0.00 H new ATOM 0 HB2 SER B 591 20.800 6.951 -14.092 1.00 0.00 H new ATOM 0 HB3 SER B 591 19.351 6.885 -13.108 1.00 0.00 H new ATOM 0 HG SER B 591 19.340 8.687 -14.569 1.00 0.00 H new ATOM 1111 N GLU B 592 19.349 7.409 -10.376 1.00 0.00 N ATOM 1112 CA GLU B 592 18.508 7.887 -9.285 1.00 0.00 C ATOM 1113 C GLU B 592 19.290 7.934 -7.975 1.00 0.00 C ATOM 1114 O GLU B 592 19.213 8.909 -7.227 1.00 0.00 O ATOM 1115 CB GLU B 592 17.280 6.988 -9.126 1.00 0.00 C ATOM 1116 CG GLU B 592 16.418 6.910 -10.375 1.00 0.00 C ATOM 1117 CD GLU B 592 15.999 8.277 -10.881 1.00 0.00 C ATOM 1118 OE1 GLU B 592 15.603 9.121 -10.051 1.00 0.00 O ATOM 1119 OE2 GLU B 592 16.068 8.501 -12.108 1.00 0.00 O ATOM 0 H GLU B 592 19.142 6.459 -10.683 1.00 0.00 H new ATOM 0 HA GLU B 592 18.181 8.898 -9.529 1.00 0.00 H new ATOM 0 HB2 GLU B 592 17.608 5.984 -8.857 1.00 0.00 H new ATOM 0 HB3 GLU B 592 16.674 7.358 -8.299 1.00 0.00 H new ATOM 0 HG2 GLU B 592 16.967 6.389 -11.159 1.00 0.00 H new ATOM 0 HG3 GLU B 592 15.528 6.317 -10.162 1.00 0.00 H new ATOM 1126 N LEU B 593 20.042 6.873 -7.704 1.00 0.00 N ATOM 1127 CA LEU B 593 20.839 6.791 -6.485 1.00 0.00 C ATOM 1128 C LEU B 593 21.725 8.023 -6.330 1.00 0.00 C ATOM 1129 O LEU B 593 21.823 8.598 -5.245 1.00 0.00 O ATOM 1130 CB LEU B 593 21.701 5.527 -6.498 1.00 0.00 C ATOM 1131 CG LEU B 593 20.946 4.199 -6.424 1.00 0.00 C ATOM 1132 CD1 LEU B 593 21.763 3.084 -7.058 1.00 0.00 C ATOM 1133 CD2 LEU B 593 20.605 3.860 -4.981 1.00 0.00 C ATOM 0 H LEU B 593 20.117 6.057 -8.312 1.00 0.00 H new ATOM 0 HA LEU B 593 20.156 6.748 -5.637 1.00 0.00 H new ATOM 0 HB2 LEU B 593 22.302 5.530 -7.408 1.00 0.00 H new ATOM 0 HB3 LEU B 593 22.394 5.575 -5.658 1.00 0.00 H new ATOM 0 HG LEU B 593 20.015 4.300 -6.982 1.00 0.00 H new ATOM 0 HD11 LEU B 593 21.210 2.147 -6.996 1.00 0.00 H new ATOM 0 HD12 LEU B 593 21.955 3.323 -8.104 1.00 0.00 H new ATOM 0 HD13 LEU B 593 22.711 2.981 -6.529 1.00 0.00 H new ATOM 0 HD21 LEU B 593 20.068 2.912 -4.947 1.00 0.00 H new ATOM 0 HD22 LEU B 593 21.523 3.778 -4.400 1.00 0.00 H new ATOM 0 HD23 LEU B 593 19.979 4.647 -4.561 1.00 0.00 H new ATOM 1145 N LEU B 594 22.368 8.423 -7.421 1.00 0.00 N ATOM 1146 CA LEU B 594 23.245 9.589 -7.407 1.00 0.00 C ATOM 1147 C LEU B 594 22.552 10.785 -6.763 1.00 0.00 C ATOM 1148 O LEU B 594 23.183 11.583 -6.070 1.00 0.00 O ATOM 1149 CB LEU B 594 23.679 9.942 -8.831 1.00 0.00 C ATOM 1150 CG LEU B 594 25.074 10.549 -8.977 1.00 0.00 C ATOM 1151 CD1 LEU B 594 26.029 9.547 -9.606 1.00 0.00 C ATOM 1152 CD2 LEU B 594 25.017 11.826 -9.804 1.00 0.00 C ATOM 0 H LEU B 594 22.299 7.958 -8.326 1.00 0.00 H new ATOM 0 HA LEU B 594 24.127 9.342 -6.815 1.00 0.00 H new ATOM 0 HB2 LEU B 594 23.633 9.038 -9.438 1.00 0.00 H new ATOM 0 HB3 LEU B 594 22.955 10.642 -9.247 1.00 0.00 H new ATOM 0 HG LEU B 594 25.446 10.800 -7.983 1.00 0.00 H new ATOM 0 HD11 LEU B 594 27.017 9.997 -9.702 1.00 0.00 H new ATOM 0 HD12 LEU B 594 26.094 8.661 -8.975 1.00 0.00 H new ATOM 0 HD13 LEU B 594 25.662 9.264 -10.593 1.00 0.00 H new ATOM 0 HD21 LEU B 594 26.019 12.244 -9.897 1.00 0.00 H new ATOM 0 HD22 LEU B 594 24.624 11.600 -10.795 1.00 0.00 H new ATOM 0 HD23 LEU B 594 24.367 12.549 -9.312 1.00 0.00 H new ATOM 1164 N HIS B 595 21.248 10.902 -6.995 1.00 0.00 N ATOM 1165 CA HIS B 595 20.467 11.999 -6.434 1.00 0.00 C ATOM 1166 C HIS B 595 19.932 11.635 -5.053 1.00 0.00 C ATOM 1167 O HIS B 595 19.693 12.508 -4.219 1.00 0.00 O ATOM 1168 CB HIS B 595 19.309 12.357 -7.366 1.00 0.00 C ATOM 1169 CG HIS B 595 18.932 13.806 -7.325 1.00 0.00 C ATOM 1170 ND1 HIS B 595 19.147 14.608 -6.225 1.00 0.00 N ATOM 1171 CD2 HIS B 595 18.353 14.596 -8.259 1.00 0.00 C ATOM 1172 CE1 HIS B 595 18.715 15.830 -6.482 1.00 0.00 C ATOM 1173 NE2 HIS B 595 18.229 15.849 -7.710 1.00 0.00 N ATOM 0 H HIS B 595 20.710 10.251 -7.567 1.00 0.00 H new ATOM 0 HA HIS B 595 21.122 12.864 -6.333 1.00 0.00 H new ATOM 0 HB2 HIS B 595 19.580 12.089 -8.387 1.00 0.00 H new ATOM 0 HB3 HIS B 595 18.440 11.756 -7.099 1.00 0.00 H new ATOM 0 HD1 HIS B 595 19.573 14.305 -5.349 1.00 0.00 H new ATOM 0 HD2 HIS B 595 18.046 14.297 -9.250 1.00 0.00 H new ATOM 0 HE1 HIS B 595 18.753 16.670 -5.804 1.00 0.00 H new ATOM 1181 N MET B 596 19.744 10.340 -4.819 1.00 0.00 N ATOM 1182 CA MET B 596 19.237 9.861 -3.539 1.00 0.00 C ATOM 1183 C MET B 596 20.262 10.083 -2.431 1.00 0.00 C ATOM 1184 O MET B 596 19.908 10.183 -1.255 1.00 0.00 O ATOM 1185 CB MET B 596 18.880 8.376 -3.630 1.00 0.00 C ATOM 1186 CG MET B 596 17.676 8.094 -4.515 1.00 0.00 C ATOM 1187 SD MET B 596 17.490 6.342 -4.895 1.00 0.00 S ATOM 1188 CE MET B 596 17.732 5.616 -3.276 1.00 0.00 C ATOM 0 H MET B 596 19.935 9.604 -5.499 1.00 0.00 H new ATOM 0 HA MET B 596 18.338 10.428 -3.297 1.00 0.00 H new ATOM 0 HB2 MET B 596 19.740 7.827 -4.014 1.00 0.00 H new ATOM 0 HB3 MET B 596 18.681 7.996 -2.628 1.00 0.00 H new ATOM 0 HG2 MET B 596 16.774 8.452 -4.019 1.00 0.00 H new ATOM 0 HG3 MET B 596 17.773 8.655 -5.444 1.00 0.00 H new ATOM 0 HE1 MET B 596 17.440 4.566 -3.301 1.00 0.00 H new ATOM 0 HE2 MET B 596 18.783 5.694 -2.996 1.00 0.00 H new ATOM 0 HE3 MET B 596 17.121 6.146 -2.545 1.00 0.00 H new ATOM 1198 N LEU B 597 21.532 10.158 -2.812 1.00 0.00 N ATOM 1199 CA LEU B 597 22.609 10.367 -1.851 1.00 0.00 C ATOM 1200 C LEU B 597 22.284 11.526 -0.914 1.00 0.00 C ATOM 1201 O LEU B 597 22.364 11.390 0.307 1.00 0.00 O ATOM 1202 CB LEU B 597 23.925 10.639 -2.581 1.00 0.00 C ATOM 1203 CG LEU B 597 24.263 9.690 -3.731 1.00 0.00 C ATOM 1204 CD1 LEU B 597 25.676 9.944 -4.234 1.00 0.00 C ATOM 1205 CD2 LEU B 597 24.104 8.242 -3.292 1.00 0.00 C ATOM 0 H LEU B 597 21.842 10.077 -3.781 1.00 0.00 H new ATOM 0 HA LEU B 597 22.713 9.460 -1.255 1.00 0.00 H new ATOM 0 HB2 LEU B 597 23.897 11.656 -2.972 1.00 0.00 H new ATOM 0 HB3 LEU B 597 24.736 10.599 -1.854 1.00 0.00 H new ATOM 0 HG LEU B 597 23.568 9.879 -4.549 1.00 0.00 H new ATOM 0 HD11 LEU B 597 25.899 9.260 -5.052 1.00 0.00 H new ATOM 0 HD12 LEU B 597 25.757 10.972 -4.588 1.00 0.00 H new ATOM 0 HD13 LEU B 597 26.386 9.783 -3.422 1.00 0.00 H new ATOM 0 HD21 LEU B 597 24.349 7.581 -4.123 1.00 0.00 H new ATOM 0 HD22 LEU B 597 24.775 8.039 -2.457 1.00 0.00 H new ATOM 0 HD23 LEU B 597 23.074 8.067 -2.980 1.00 0.00 H new ATOM 1217 N GLU B 598 21.916 12.664 -1.494 1.00 0.00 N ATOM 1218 CA GLU B 598 21.578 13.846 -0.709 1.00 0.00 C ATOM 1219 C GLU B 598 20.065 14.005 -0.589 1.00 0.00 C ATOM 1220 O GLU B 598 19.563 15.105 -0.357 1.00 0.00 O ATOM 1221 CB GLU B 598 22.185 15.098 -1.346 1.00 0.00 C ATOM 1222 CG GLU B 598 21.466 15.550 -2.606 1.00 0.00 C ATOM 1223 CD GLU B 598 22.342 16.402 -3.504 1.00 0.00 C ATOM 1224 OE1 GLU B 598 22.706 17.522 -3.087 1.00 0.00 O ATOM 1225 OE2 GLU B 598 22.663 15.950 -4.623 1.00 0.00 O ATOM 0 H GLU B 598 21.844 12.793 -2.503 1.00 0.00 H new ATOM 0 HA GLU B 598 21.993 13.718 0.291 1.00 0.00 H new ATOM 0 HB2 GLU B 598 22.170 15.909 -0.618 1.00 0.00 H new ATOM 0 HB3 GLU B 598 23.231 14.903 -1.585 1.00 0.00 H new ATOM 0 HG2 GLU B 598 21.127 14.675 -3.160 1.00 0.00 H new ATOM 0 HG3 GLU B 598 20.577 16.116 -2.329 1.00 0.00 H new ATOM 1232 N SER B 599 19.346 12.900 -0.750 1.00 0.00 N ATOM 1233 CA SER B 599 17.890 12.916 -0.664 1.00 0.00 C ATOM 1234 C SER B 599 17.404 12.052 0.495 1.00 0.00 C ATOM 1235 O SER B 599 16.994 10.905 0.319 1.00 0.00 O ATOM 1236 CB SER B 599 17.275 12.422 -1.975 1.00 0.00 C ATOM 1237 OG SER B 599 15.981 12.967 -2.169 1.00 0.00 O ATOM 0 H SER B 599 19.747 11.982 -0.941 1.00 0.00 H new ATOM 0 HA SER B 599 17.573 13.944 -0.486 1.00 0.00 H new ATOM 0 HB2 SER B 599 17.919 12.700 -2.810 1.00 0.00 H new ATOM 0 HB3 SER B 599 17.217 11.334 -1.966 1.00 0.00 H new ATOM 0 HG SER B 599 15.610 12.637 -3.014 1.00 0.00 H new ATOM 1243 N PRO B 600 17.451 12.615 1.712 1.00 0.00 N ATOM 1244 CA PRO B 600 17.020 11.915 2.925 1.00 0.00 C ATOM 1245 C PRO B 600 15.509 11.711 2.971 1.00 0.00 C ATOM 1246 O PRO B 600 14.995 11.011 3.842 1.00 0.00 O ATOM 1247 CB PRO B 600 17.467 12.850 4.052 1.00 0.00 C ATOM 1248 CG PRO B 600 17.518 14.201 3.426 1.00 0.00 C ATOM 1249 CD PRO B 600 17.929 13.979 1.996 1.00 0.00 C ATOM 0 HA PRO B 600 17.444 10.913 2.990 1.00 0.00 H new ATOM 0 HB2 PRO B 600 16.767 12.827 4.887 1.00 0.00 H new ATOM 0 HB3 PRO B 600 18.441 12.559 4.445 1.00 0.00 H new ATOM 0 HG2 PRO B 600 16.547 14.694 3.481 1.00 0.00 H new ATOM 0 HG3 PRO B 600 18.231 14.844 3.942 1.00 0.00 H new ATOM 0 HD2 PRO B 600 17.474 14.711 1.329 1.00 0.00 H new ATOM 0 HD3 PRO B 600 19.009 14.061 1.871 1.00 0.00 H new ATOM 1257 N GLU B 601 14.805 12.326 2.026 1.00 0.00 N ATOM 1258 CA GLU B 601 13.353 12.211 1.960 1.00 0.00 C ATOM 1259 C GLU B 601 12.940 10.998 1.130 1.00 0.00 C ATOM 1260 O GLU B 601 11.847 10.459 1.301 1.00 0.00 O ATOM 1261 CB GLU B 601 12.745 13.482 1.363 1.00 0.00 C ATOM 1262 CG GLU B 601 13.256 13.804 -0.031 1.00 0.00 C ATOM 1263 CD GLU B 601 12.446 14.890 -0.712 1.00 0.00 C ATOM 1264 OE1 GLU B 601 12.648 16.077 -0.379 1.00 0.00 O ATOM 1265 OE2 GLU B 601 11.611 14.554 -1.578 1.00 0.00 O ATOM 0 H GLU B 601 15.216 12.908 1.296 1.00 0.00 H new ATOM 0 HA GLU B 601 12.978 12.080 2.975 1.00 0.00 H new ATOM 0 HB2 GLU B 601 11.661 13.374 1.328 1.00 0.00 H new ATOM 0 HB3 GLU B 601 12.960 14.322 2.023 1.00 0.00 H new ATOM 0 HG2 GLU B 601 14.298 14.118 0.031 1.00 0.00 H new ATOM 0 HG3 GLU B 601 13.231 12.901 -0.641 1.00 0.00 H new ATOM 1272 N SER B 602 13.824 10.576 0.231 1.00 0.00 N ATOM 1273 CA SER B 602 13.551 9.430 -0.629 1.00 0.00 C ATOM 1274 C SER B 602 14.260 8.182 -0.112 1.00 0.00 C ATOM 1275 O SER B 602 13.730 7.074 -0.195 1.00 0.00 O ATOM 1276 CB SER B 602 13.993 9.726 -2.063 1.00 0.00 C ATOM 1277 OG SER B 602 13.018 10.489 -2.751 1.00 0.00 O ATOM 0 H SER B 602 14.734 11.010 0.079 1.00 0.00 H new ATOM 0 HA SER B 602 12.477 9.246 -0.619 1.00 0.00 H new ATOM 0 HB2 SER B 602 14.940 10.266 -2.051 1.00 0.00 H new ATOM 0 HB3 SER B 602 14.167 8.790 -2.593 1.00 0.00 H new ATOM 0 HG SER B 602 13.326 10.666 -3.664 1.00 0.00 H new ATOM 1283 N LEU B 603 15.462 8.371 0.420 1.00 0.00 N ATOM 1284 CA LEU B 603 16.246 7.261 0.951 1.00 0.00 C ATOM 1285 C LEU B 603 15.415 6.417 1.912 1.00 0.00 C ATOM 1286 O LEU B 603 15.185 5.232 1.674 1.00 0.00 O ATOM 1287 CB LEU B 603 17.494 7.787 1.664 1.00 0.00 C ATOM 1288 CG LEU B 603 18.365 6.737 2.354 1.00 0.00 C ATOM 1289 CD1 LEU B 603 18.945 5.770 1.333 1.00 0.00 C ATOM 1290 CD2 LEU B 603 19.477 7.406 3.149 1.00 0.00 C ATOM 0 H LEU B 603 15.915 9.282 0.495 1.00 0.00 H new ATOM 0 HA LEU B 603 16.551 6.632 0.115 1.00 0.00 H new ATOM 0 HB2 LEU B 603 18.108 8.318 0.936 1.00 0.00 H new ATOM 0 HB3 LEU B 603 17.181 8.518 2.410 1.00 0.00 H new ATOM 0 HG LEU B 603 17.740 6.172 3.045 1.00 0.00 H new ATOM 0 HD11 LEU B 603 19.562 5.030 1.842 1.00 0.00 H new ATOM 0 HD12 LEU B 603 18.134 5.266 0.807 1.00 0.00 H new ATOM 0 HD13 LEU B 603 19.555 6.320 0.617 1.00 0.00 H new ATOM 0 HD21 LEU B 603 20.087 6.644 3.634 1.00 0.00 H new ATOM 0 HD22 LEU B 603 20.100 7.997 2.477 1.00 0.00 H new ATOM 0 HD23 LEU B 603 19.041 8.058 3.906 1.00 0.00 H new ATOM 1302 N ARG B 604 14.965 7.038 2.998 1.00 0.00 N ATOM 1303 CA ARG B 604 14.158 6.344 3.995 1.00 0.00 C ATOM 1304 C ARG B 604 12.977 5.634 3.340 1.00 0.00 C ATOM 1305 O ARG B 604 12.556 4.567 3.786 1.00 0.00 O ATOM 1306 CB ARG B 604 13.653 7.331 5.049 1.00 0.00 C ATOM 1307 CG ARG B 604 12.510 8.208 4.565 1.00 0.00 C ATOM 1308 CD ARG B 604 11.159 7.584 4.877 1.00 0.00 C ATOM 1309 NE ARG B 604 10.375 8.408 5.793 1.00 0.00 N ATOM 1310 CZ ARG B 604 9.123 8.131 6.143 1.00 0.00 C ATOM 1311 NH1 ARG B 604 8.517 7.057 5.655 1.00 0.00 N ATOM 1312 NH2 ARG B 604 8.476 8.929 6.982 1.00 0.00 N ATOM 0 H ARG B 604 15.145 8.019 3.210 1.00 0.00 H new ATOM 0 HA ARG B 604 14.786 5.596 4.479 1.00 0.00 H new ATOM 0 HB2 ARG B 604 13.326 6.775 5.928 1.00 0.00 H new ATOM 0 HB3 ARG B 604 14.480 7.968 5.364 1.00 0.00 H new ATOM 0 HG2 ARG B 604 12.577 9.188 5.037 1.00 0.00 H new ATOM 0 HG3 ARG B 604 12.600 8.365 3.490 1.00 0.00 H new ATOM 0 HD2 ARG B 604 10.603 7.442 3.951 1.00 0.00 H new ATOM 0 HD3 ARG B 604 11.308 6.597 5.314 1.00 0.00 H new ATOM 0 HE ARG B 604 10.812 9.242 6.186 1.00 0.00 H new ATOM 0 HH11 ARG B 604 9.012 6.441 5.010 1.00 0.00 H new ATOM 0 HH12 ARG B 604 7.556 6.847 5.925 1.00 0.00 H new ATOM 0 HH21 ARG B 604 8.939 9.756 7.359 1.00 0.00 H new ATOM 0 HH22 ARG B 604 7.515 8.716 7.250 1.00 0.00 H new ATOM 1326 N SER B 605 12.446 6.235 2.279 1.00 0.00 N ATOM 1327 CA SER B 605 11.311 5.662 1.565 1.00 0.00 C ATOM 1328 C SER B 605 11.670 4.302 0.975 1.00 0.00 C ATOM 1329 O SER B 605 11.057 3.287 1.307 1.00 0.00 O ATOM 1330 CB SER B 605 10.852 6.608 0.453 1.00 0.00 C ATOM 1331 OG SER B 605 10.938 7.961 0.866 1.00 0.00 O ATOM 0 H SER B 605 12.784 7.118 1.896 1.00 0.00 H new ATOM 0 HA SER B 605 10.497 5.526 2.277 1.00 0.00 H new ATOM 0 HB2 SER B 605 11.466 6.456 -0.435 1.00 0.00 H new ATOM 0 HB3 SER B 605 9.825 6.374 0.174 1.00 0.00 H new ATOM 0 HG SER B 605 10.495 8.534 0.205 1.00 0.00 H new ATOM 1337 N LYS B 606 12.668 4.289 0.099 1.00 0.00 N ATOM 1338 CA LYS B 606 13.112 3.054 -0.538 1.00 0.00 C ATOM 1339 C LYS B 606 13.436 1.990 0.505 1.00 0.00 C ATOM 1340 O LYS B 606 13.034 0.834 0.374 1.00 0.00 O ATOM 1341 CB LYS B 606 14.340 3.319 -1.411 1.00 0.00 C ATOM 1342 CG LYS B 606 14.177 4.504 -2.347 1.00 0.00 C ATOM 1343 CD LYS B 606 12.931 4.368 -3.207 1.00 0.00 C ATOM 1344 CE LYS B 606 13.024 5.223 -4.461 1.00 0.00 C ATOM 1345 NZ LYS B 606 13.137 6.672 -4.139 1.00 0.00 N ATOM 0 H LYS B 606 13.186 5.120 -0.187 1.00 0.00 H new ATOM 0 HA LYS B 606 12.300 2.686 -1.166 1.00 0.00 H new ATOM 0 HB2 LYS B 606 15.203 3.491 -0.767 1.00 0.00 H new ATOM 0 HB3 LYS B 606 14.555 2.428 -2.001 1.00 0.00 H new ATOM 0 HG2 LYS B 606 14.120 5.424 -1.765 1.00 0.00 H new ATOM 0 HG3 LYS B 606 15.055 4.586 -2.987 1.00 0.00 H new ATOM 0 HD2 LYS B 606 12.793 3.324 -3.487 1.00 0.00 H new ATOM 0 HD3 LYS B 606 12.055 4.662 -2.629 1.00 0.00 H new ATOM 0 HE2 LYS B 606 13.889 4.913 -5.048 1.00 0.00 H new ATOM 0 HE3 LYS B 606 12.142 5.057 -5.080 1.00 0.00 H new ATOM 0 HZ1 LYS B 606 13.147 7.224 -5.021 1.00 0.00 H new ATOM 0 HZ2 LYS B 606 12.325 6.963 -3.557 1.00 0.00 H new ATOM 0 HZ3 LYS B 606 14.018 6.843 -3.614 1.00 0.00 H new ATOM 1359 N VAL B 607 14.165 2.388 1.543 1.00 0.00 N ATOM 1360 CA VAL B 607 14.541 1.469 2.611 1.00 0.00 C ATOM 1361 C VAL B 607 13.315 0.785 3.205 1.00 0.00 C ATOM 1362 O VAL B 607 13.254 -0.442 3.284 1.00 0.00 O ATOM 1363 CB VAL B 607 15.304 2.196 3.734 1.00 0.00 C ATOM 1364 CG1 VAL B 607 15.660 1.228 4.852 1.00 0.00 C ATOM 1365 CG2 VAL B 607 16.553 2.867 3.182 1.00 0.00 C ATOM 0 H VAL B 607 14.507 3.341 1.667 1.00 0.00 H new ATOM 0 HA VAL B 607 15.193 0.717 2.166 1.00 0.00 H new ATOM 0 HB VAL B 607 14.656 2.969 4.147 1.00 0.00 H new ATOM 0 HG11 VAL B 607 16.199 1.760 5.636 1.00 0.00 H new ATOM 0 HG12 VAL B 607 14.748 0.799 5.266 1.00 0.00 H new ATOM 0 HG13 VAL B 607 16.289 0.431 4.456 1.00 0.00 H new ATOM 0 HG21 VAL B 607 17.080 3.376 3.989 1.00 0.00 H new ATOM 0 HG22 VAL B 607 17.206 2.114 2.741 1.00 0.00 H new ATOM 0 HG23 VAL B 607 16.269 3.593 2.420 1.00 0.00 H new ATOM 1375 N ASP B 608 12.340 1.587 3.620 1.00 0.00 N ATOM 1376 CA ASP B 608 11.114 1.059 4.205 1.00 0.00 C ATOM 1377 C ASP B 608 10.437 0.076 3.255 1.00 0.00 C ATOM 1378 O ASP B 608 9.932 -0.963 3.679 1.00 0.00 O ATOM 1379 CB ASP B 608 10.154 2.200 4.546 1.00 0.00 C ATOM 1380 CG ASP B 608 9.064 1.772 5.509 1.00 0.00 C ATOM 1381 OD1 ASP B 608 9.400 1.328 6.627 1.00 0.00 O ATOM 1382 OD2 ASP B 608 7.875 1.881 5.144 1.00 0.00 O ATOM 0 H ASP B 608 12.375 2.605 3.562 1.00 0.00 H new ATOM 0 HA ASP B 608 11.377 0.529 5.120 1.00 0.00 H new ATOM 0 HB2 ASP B 608 10.716 3.026 4.982 1.00 0.00 H new ATOM 0 HB3 ASP B 608 9.698 2.574 3.629 1.00 0.00 H new ATOM 1387 N GLU B 609 10.431 0.412 1.969 1.00 0.00 N ATOM 1388 CA GLU B 609 9.814 -0.441 0.960 1.00 0.00 C ATOM 1389 C GLU B 609 10.439 -1.833 0.969 1.00 0.00 C ATOM 1390 O GLU B 609 9.735 -2.840 1.045 1.00 0.00 O ATOM 1391 CB GLU B 609 9.960 0.186 -0.428 1.00 0.00 C ATOM 1392 CG GLU B 609 9.113 1.432 -0.626 1.00 0.00 C ATOM 1393 CD GLU B 609 7.661 1.217 -0.243 1.00 0.00 C ATOM 1394 OE1 GLU B 609 7.181 0.070 -0.363 1.00 0.00 O ATOM 1395 OE2 GLU B 609 7.006 2.194 0.175 1.00 0.00 O ATOM 0 H GLU B 609 10.846 1.268 1.601 1.00 0.00 H new ATOM 0 HA GLU B 609 8.755 -0.535 1.199 1.00 0.00 H new ATOM 0 HB2 GLU B 609 11.007 0.439 -0.595 1.00 0.00 H new ATOM 0 HB3 GLU B 609 9.686 -0.553 -1.182 1.00 0.00 H new ATOM 0 HG2 GLU B 609 9.526 2.246 -0.030 1.00 0.00 H new ATOM 0 HG3 GLU B 609 9.168 1.742 -1.670 1.00 0.00 H new ATOM 1402 N ALA B 610 11.764 -1.881 0.891 1.00 0.00 N ATOM 1403 CA ALA B 610 12.484 -3.148 0.892 1.00 0.00 C ATOM 1404 C ALA B 610 12.164 -3.961 2.142 1.00 0.00 C ATOM 1405 O ALA B 610 11.897 -5.160 2.064 1.00 0.00 O ATOM 1406 CB ALA B 610 13.982 -2.904 0.788 1.00 0.00 C ATOM 0 H ALA B 610 12.361 -1.057 0.826 1.00 0.00 H new ATOM 0 HA ALA B 610 12.159 -3.722 0.024 1.00 0.00 H new ATOM 0 HB1 ALA B 610 14.507 -3.859 0.790 1.00 0.00 H new ATOM 0 HB2 ALA B 610 14.201 -2.372 -0.138 1.00 0.00 H new ATOM 0 HB3 ALA B 610 14.313 -2.306 1.637 1.00 0.00 H new ATOM 1412 N VAL B 611 12.194 -3.300 3.295 1.00 0.00 N ATOM 1413 CA VAL B 611 11.906 -3.961 4.563 1.00 0.00 C ATOM 1414 C VAL B 611 10.533 -4.623 4.538 1.00 0.00 C ATOM 1415 O VAL B 611 10.384 -5.780 4.930 1.00 0.00 O ATOM 1416 CB VAL B 611 11.964 -2.968 5.739 1.00 0.00 C ATOM 1417 CG1 VAL B 611 11.569 -3.655 7.037 1.00 0.00 C ATOM 1418 CG2 VAL B 611 13.353 -2.357 5.851 1.00 0.00 C ATOM 0 H VAL B 611 12.415 -2.308 3.377 1.00 0.00 H new ATOM 0 HA VAL B 611 12.671 -4.724 4.704 1.00 0.00 H new ATOM 0 HB VAL B 611 11.252 -2.164 5.550 1.00 0.00 H new ATOM 0 HG11 VAL B 611 11.616 -2.938 7.857 1.00 0.00 H new ATOM 0 HG12 VAL B 611 10.553 -4.041 6.950 1.00 0.00 H new ATOM 0 HG13 VAL B 611 12.254 -4.479 7.236 1.00 0.00 H new ATOM 0 HG21 VAL B 611 13.377 -1.658 6.687 1.00 0.00 H new ATOM 0 HG22 VAL B 611 14.086 -3.147 6.018 1.00 0.00 H new ATOM 0 HG23 VAL B 611 13.593 -1.828 4.929 1.00 0.00 H new ATOM 1428 N ALA B 612 9.533 -3.881 4.075 1.00 0.00 N ATOM 1429 CA ALA B 612 8.172 -4.397 3.997 1.00 0.00 C ATOM 1430 C ALA B 612 8.096 -5.608 3.073 1.00 0.00 C ATOM 1431 O ALA B 612 7.305 -6.525 3.298 1.00 0.00 O ATOM 1432 CB ALA B 612 7.221 -3.308 3.521 1.00 0.00 C ATOM 0 H ALA B 612 9.640 -2.921 3.748 1.00 0.00 H new ATOM 0 HA ALA B 612 7.873 -4.715 4.996 1.00 0.00 H new ATOM 0 HB1 ALA B 612 6.208 -3.707 3.467 1.00 0.00 H new ATOM 0 HB2 ALA B 612 7.245 -2.473 4.221 1.00 0.00 H new ATOM 0 HB3 ALA B 612 7.528 -2.963 2.534 1.00 0.00 H new ATOM 1438 N VAL B 613 8.923 -5.606 2.033 1.00 0.00 N ATOM 1439 CA VAL B 613 8.950 -6.705 1.075 1.00 0.00 C ATOM 1440 C VAL B 613 9.514 -7.972 1.709 1.00 0.00 C ATOM 1441 O VAL B 613 9.202 -9.085 1.281 1.00 0.00 O ATOM 1442 CB VAL B 613 9.789 -6.348 -0.166 1.00 0.00 C ATOM 1443 CG1 VAL B 613 11.021 -7.236 -0.252 1.00 0.00 C ATOM 1444 CG2 VAL B 613 8.948 -6.464 -1.428 1.00 0.00 C ATOM 0 H VAL B 613 9.584 -4.855 1.832 1.00 0.00 H new ATOM 0 HA VAL B 613 7.919 -6.883 0.768 1.00 0.00 H new ATOM 0 HB VAL B 613 10.123 -5.314 -0.073 1.00 0.00 H new ATOM 0 HG11 VAL B 613 11.601 -6.969 -1.135 1.00 0.00 H new ATOM 0 HG12 VAL B 613 11.633 -7.097 0.640 1.00 0.00 H new ATOM 0 HG13 VAL B 613 10.713 -8.279 -0.322 1.00 0.00 H new ATOM 0 HG21 VAL B 613 9.556 -6.208 -2.295 1.00 0.00 H new ATOM 0 HG22 VAL B 613 8.583 -7.486 -1.529 1.00 0.00 H new ATOM 0 HG23 VAL B 613 8.101 -5.781 -1.365 1.00 0.00 H new ATOM 1454 N LEU B 614 10.345 -7.797 2.730 1.00 0.00 N ATOM 1455 CA LEU B 614 10.953 -8.927 3.424 1.00 0.00 C ATOM 1456 C LEU B 614 9.942 -9.612 4.338 1.00 0.00 C ATOM 1457 O LEU B 614 9.646 -10.795 4.174 1.00 0.00 O ATOM 1458 CB LEU B 614 12.161 -8.460 4.239 1.00 0.00 C ATOM 1459 CG LEU B 614 12.825 -9.518 5.120 1.00 0.00 C ATOM 1460 CD1 LEU B 614 12.075 -9.666 6.435 1.00 0.00 C ATOM 1461 CD2 LEU B 614 12.895 -10.852 4.391 1.00 0.00 C ATOM 0 H LEU B 614 10.613 -6.884 3.096 1.00 0.00 H new ATOM 0 HA LEU B 614 11.284 -9.647 2.675 1.00 0.00 H new ATOM 0 HB2 LEU B 614 12.909 -8.068 3.550 1.00 0.00 H new ATOM 0 HB3 LEU B 614 11.847 -7.632 4.874 1.00 0.00 H new ATOM 0 HG LEU B 614 13.842 -9.193 5.340 1.00 0.00 H new ATOM 0 HD11 LEU B 614 12.563 -10.424 7.049 1.00 0.00 H new ATOM 0 HD12 LEU B 614 12.078 -8.713 6.965 1.00 0.00 H new ATOM 0 HD13 LEU B 614 11.047 -9.967 6.235 1.00 0.00 H new ATOM 0 HD21 LEU B 614 13.371 -11.593 5.033 1.00 0.00 H new ATOM 0 HD22 LEU B 614 11.887 -11.183 4.140 1.00 0.00 H new ATOM 0 HD23 LEU B 614 13.477 -10.737 3.477 1.00 0.00 H new ATOM 1473 N GLN B 615 9.416 -8.859 5.299 1.00 0.00 N ATOM 1474 CA GLN B 615 8.438 -9.395 6.238 1.00 0.00 C ATOM 1475 C GLN B 615 7.243 -9.989 5.500 1.00 0.00 C ATOM 1476 O GLN B 615 6.558 -10.871 6.017 1.00 0.00 O ATOM 1477 CB GLN B 615 7.966 -8.299 7.196 1.00 0.00 C ATOM 1478 CG GLN B 615 7.692 -6.969 6.512 1.00 0.00 C ATOM 1479 CD GLN B 615 6.657 -6.139 7.244 1.00 0.00 C ATOM 1480 OE1 GLN B 615 5.595 -5.830 6.702 1.00 0.00 O ATOM 1481 NE2 GLN B 615 6.960 -5.773 8.484 1.00 0.00 N ATOM 0 H GLN B 615 9.650 -7.877 5.447 1.00 0.00 H new ATOM 0 HA GLN B 615 8.919 -10.188 6.811 1.00 0.00 H new ATOM 0 HB2 GLN B 615 7.058 -8.633 7.698 1.00 0.00 H new ATOM 0 HB3 GLN B 615 8.722 -8.152 7.968 1.00 0.00 H new ATOM 0 HG2 GLN B 615 8.621 -6.404 6.440 1.00 0.00 H new ATOM 0 HG3 GLN B 615 7.351 -7.152 5.493 1.00 0.00 H new ATOM 0 HE21 GLN B 615 7.851 -6.051 8.894 1.00 0.00 H new ATOM 0 HE22 GLN B 615 6.301 -5.214 9.026 1.00 0.00 H new ATOM 1490 N ALA B 616 6.999 -9.500 4.288 1.00 0.00 N ATOM 1491 CA ALA B 616 5.889 -9.985 3.478 1.00 0.00 C ATOM 1492 C ALA B 616 6.099 -11.439 3.073 1.00 0.00 C ATOM 1493 O ALA B 616 5.168 -12.111 2.627 1.00 0.00 O ATOM 1494 CB ALA B 616 5.715 -9.111 2.245 1.00 0.00 C ATOM 0 H ALA B 616 7.556 -8.768 3.846 1.00 0.00 H new ATOM 0 HA ALA B 616 4.982 -9.931 4.079 1.00 0.00 H new ATOM 0 HB1 ALA B 616 4.882 -9.485 1.649 1.00 0.00 H new ATOM 0 HB2 ALA B 616 5.510 -8.085 2.552 1.00 0.00 H new ATOM 0 HB3 ALA B 616 6.628 -9.136 1.650 1.00 0.00 H new ATOM 1500 N HIS B 617 7.328 -11.921 3.229 1.00 0.00 N ATOM 1501 CA HIS B 617 7.660 -13.297 2.878 1.00 0.00 C ATOM 1502 C HIS B 617 7.350 -14.243 4.035 1.00 0.00 C ATOM 1503 O HIS B 617 6.765 -15.307 3.838 1.00 0.00 O ATOM 1504 CB HIS B 617 9.136 -13.407 2.497 1.00 0.00 C ATOM 1505 CG HIS B 617 9.633 -14.818 2.423 1.00 0.00 C ATOM 1506 ND1 HIS B 617 10.821 -15.229 2.990 1.00 0.00 N ATOM 1507 CD2 HIS B 617 9.094 -15.917 1.845 1.00 0.00 C ATOM 1508 CE1 HIS B 617 10.992 -16.519 2.762 1.00 0.00 C ATOM 1509 NE2 HIS B 617 9.957 -16.961 2.070 1.00 0.00 N ATOM 0 H HIS B 617 8.110 -11.379 3.596 1.00 0.00 H new ATOM 0 HA HIS B 617 7.049 -13.584 2.022 1.00 0.00 H new ATOM 0 HB2 HIS B 617 9.290 -12.925 1.531 1.00 0.00 H new ATOM 0 HB3 HIS B 617 9.733 -12.858 3.226 1.00 0.00 H new ATOM 0 HD2 HIS B 617 8.159 -15.964 1.307 1.00 0.00 H new ATOM 0 HE1 HIS B 617 11.835 -17.112 3.086 1.00 0.00 H new ATOM 0 HE2 HIS B 617 9.821 -17.921 1.754 1.00 0.00 H new ATOM 1517 N GLN B 618 7.746 -13.846 5.240 1.00 0.00 N ATOM 1518 CA GLN B 618 7.512 -14.659 6.427 1.00 0.00 C ATOM 1519 C GLN B 618 7.368 -13.783 7.667 1.00 0.00 C ATOM 1520 O GLN B 618 8.221 -12.940 7.946 1.00 0.00 O ATOM 1521 CB GLN B 618 8.655 -15.656 6.622 1.00 0.00 C ATOM 1522 CG GLN B 618 8.458 -16.583 7.811 1.00 0.00 C ATOM 1523 CD GLN B 618 9.404 -17.767 7.792 1.00 0.00 C ATOM 1524 OE1 GLN B 618 9.328 -18.622 6.909 1.00 0.00 O ATOM 1525 NE2 GLN B 618 10.303 -17.823 8.768 1.00 0.00 N ATOM 0 H GLN B 618 8.230 -12.966 5.420 1.00 0.00 H new ATOM 0 HA GLN B 618 6.582 -15.208 6.283 1.00 0.00 H new ATOM 0 HB2 GLN B 618 8.761 -16.256 5.718 1.00 0.00 H new ATOM 0 HB3 GLN B 618 9.587 -15.106 6.751 1.00 0.00 H new ATOM 0 HG2 GLN B 618 8.605 -16.021 8.733 1.00 0.00 H new ATOM 0 HG3 GLN B 618 7.430 -16.945 7.818 1.00 0.00 H new ATOM 0 HE21 GLN B 618 10.330 -17.092 9.479 1.00 0.00 H new ATOM 0 HE22 GLN B 618 10.967 -18.597 8.806 1.00 0.00 H new ATOM 1534 N ALA B 619 6.284 -13.987 8.408 1.00 0.00 N ATOM 1535 CA ALA B 619 6.029 -13.217 9.619 1.00 0.00 C ATOM 1536 C ALA B 619 6.283 -14.056 10.866 1.00 0.00 C ATOM 1537 O ALA B 619 5.435 -14.139 11.755 1.00 0.00 O ATOM 1538 CB ALA B 619 4.603 -12.687 9.618 1.00 0.00 C ATOM 0 H ALA B 619 5.568 -14.680 8.191 1.00 0.00 H new ATOM 0 HA ALA B 619 6.718 -12.372 9.635 1.00 0.00 H new ATOM 0 HB1 ALA B 619 4.427 -12.114 10.528 1.00 0.00 H new ATOM 0 HB2 ALA B 619 4.454 -12.044 8.750 1.00 0.00 H new ATOM 0 HB3 ALA B 619 3.904 -13.523 9.575 1.00 0.00 H new ATOM 1544 N LYS B 620 7.456 -14.678 10.927 1.00 0.00 N ATOM 1545 CA LYS B 620 7.823 -15.511 12.066 1.00 0.00 C ATOM 1546 C LYS B 620 9.232 -15.183 12.548 1.00 0.00 C ATOM 1547 O LYS B 620 10.116 -14.881 11.748 1.00 0.00 O ATOM 1548 CB LYS B 620 7.732 -16.992 11.691 1.00 0.00 C ATOM 1549 CG LYS B 620 7.458 -17.904 12.874 1.00 0.00 C ATOM 1550 CD LYS B 620 6.013 -17.804 13.332 1.00 0.00 C ATOM 1551 CE LYS B 620 5.077 -18.546 12.390 1.00 0.00 C ATOM 1552 NZ LYS B 620 5.003 -19.998 12.712 1.00 0.00 N ATOM 0 H LYS B 620 8.169 -14.621 10.200 1.00 0.00 H new ATOM 0 HA LYS B 620 7.124 -15.304 12.876 1.00 0.00 H new ATOM 0 HB2 LYS B 620 6.942 -17.123 10.952 1.00 0.00 H new ATOM 0 HB3 LYS B 620 8.665 -17.296 11.217 1.00 0.00 H new ATOM 0 HG2 LYS B 620 7.683 -18.935 12.600 1.00 0.00 H new ATOM 0 HG3 LYS B 620 8.121 -17.641 13.698 1.00 0.00 H new ATOM 0 HD2 LYS B 620 5.920 -18.215 14.337 1.00 0.00 H new ATOM 0 HD3 LYS B 620 5.719 -16.756 13.387 1.00 0.00 H new ATOM 0 HE2 LYS B 620 4.080 -18.109 12.450 1.00 0.00 H new ATOM 0 HE3 LYS B 620 5.419 -18.419 11.363 1.00 0.00 H new ATOM 0 HZ1 LYS B 620 4.355 -20.468 12.048 1.00 0.00 H new ATOM 0 HZ2 LYS B 620 5.950 -20.420 12.630 1.00 0.00 H new ATOM 0 HZ3 LYS B 620 4.652 -20.121 13.683 1.00 0.00 H new ATOM 1566 N GLU B 621 9.433 -15.247 13.861 1.00 0.00 N ATOM 1567 CA GLU B 621 10.736 -14.957 14.448 1.00 0.00 C ATOM 1568 C GLU B 621 11.155 -16.061 15.415 1.00 0.00 C ATOM 1569 O GLU B 621 11.787 -15.798 16.437 1.00 0.00 O ATOM 1570 CB GLU B 621 10.703 -13.612 15.177 1.00 0.00 C ATOM 1571 CG GLU B 621 9.705 -13.563 16.322 1.00 0.00 C ATOM 1572 CD GLU B 621 8.314 -13.167 15.866 1.00 0.00 C ATOM 1573 OE1 GLU B 621 8.192 -12.150 15.151 1.00 0.00 O ATOM 1574 OE2 GLU B 621 7.348 -13.873 16.224 1.00 0.00 O ATOM 0 H GLU B 621 8.711 -15.497 14.537 1.00 0.00 H new ATOM 0 HA GLU B 621 11.467 -14.908 13.641 1.00 0.00 H new ATOM 0 HB2 GLU B 621 11.698 -13.394 15.564 1.00 0.00 H new ATOM 0 HB3 GLU B 621 10.461 -12.826 14.461 1.00 0.00 H new ATOM 0 HG2 GLU B 621 9.661 -14.540 16.803 1.00 0.00 H new ATOM 0 HG3 GLU B 621 10.053 -12.853 17.073 1.00 0.00 H new ATOM 1581 N ALA B 622 10.798 -17.297 15.082 1.00 0.00 N ATOM 1582 CA ALA B 622 11.138 -18.442 15.918 1.00 0.00 C ATOM 1583 C ALA B 622 11.690 -19.589 15.080 1.00 0.00 C ATOM 1584 O ALA B 622 11.246 -20.730 15.203 1.00 0.00 O ATOM 1585 CB ALA B 622 9.919 -18.900 16.706 1.00 0.00 C ATOM 0 H ALA B 622 10.273 -17.531 14.239 1.00 0.00 H new ATOM 0 HA ALA B 622 11.914 -18.132 16.618 1.00 0.00 H new ATOM 0 HB1 ALA B 622 10.187 -19.756 17.326 1.00 0.00 H new ATOM 0 HB2 ALA B 622 9.570 -18.086 17.342 1.00 0.00 H new ATOM 0 HB3 ALA B 622 9.126 -19.187 16.015 1.00 0.00 H new ATOM 1591 N ALA B 623 12.661 -19.279 14.227 1.00 0.00 N ATOM 1592 CA ALA B 623 13.274 -20.285 13.369 1.00 0.00 C ATOM 1593 C ALA B 623 14.582 -20.793 13.967 1.00 0.00 C ATOM 1594 O ALA B 623 14.881 -21.987 13.907 1.00 0.00 O ATOM 1595 CB ALA B 623 13.514 -19.718 11.977 1.00 0.00 C ATOM 0 H ALA B 623 13.040 -18.339 14.112 1.00 0.00 H new ATOM 0 HA ALA B 623 12.587 -21.128 13.292 1.00 0.00 H new ATOM 0 HB1 ALA B 623 13.972 -20.481 11.347 1.00 0.00 H new ATOM 0 HB2 ALA B 623 12.564 -19.410 11.541 1.00 0.00 H new ATOM 0 HB3 ALA B 623 14.178 -18.856 12.045 1.00 0.00 H new TER 1601 ALA B 623