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 HE2:sc= -0.604 K(o=-1.2,f=-0.41) USER MOD Set 1.2: B 617 HIS : no HD1:sc= -0.637 K(o=-1.2,f=-0.042) USER MOD Set 2.1: B 599 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B 602 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.0144 K(o=-0.014,f=-1.1) USER MOD Single : A 88 SER OG : rot 180:sc= -0.0078 USER MOD Single : B 542 GLN : amide:sc= 0 X(o=0,f=-0.00017) 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 -155:sc= -0.0848 (180deg=-0.745) USER MOD Single : B 552 SER OG : rot 180:sc= 0 USER MOD Single : B 556 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 558 GLN : amide:sc= -1.53 K(o=-1.5,f=-5.1!) USER MOD Single : B 559 LYS NZ :NH3+ 130:sc= -0.0887 (180deg=-0.455) USER MOD Single : B 560 GLN : amide:sc= -0.22 K(o=-0.22,f=-0.84) USER MOD Single : B 561 MET CE :methyl -109:sc= -0.0431 (180deg=-0.926) USER MOD Single : B 571 GLN : amide:sc= -0.713 K(o=-0.71,f=-2.2) USER MOD Single : B 573 MET CE :methyl -178:sc= 0 (180deg=-0.00419) USER MOD Single : B 574 HIS : no HD1:sc= -2.19! C(o=-2.2!,f=-5!) USER MOD Single : B 576 THR OG1 : rot 180:sc= 0.0071 USER MOD Single : B 580 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 582 THR OG1 : rot 62:sc= 1.21 USER MOD Single : B 584 MET CE :methyl 180:sc= -0.841 (180deg=-0.841) USER MOD Single : B 590 ASN : amide:sc= -0.0737 K(o=-0.074,f=-2!) USER MOD Single : B 591 SER OG : rot 180:sc= 0 USER MOD Single : B 595 HIS : no HD1:sc= -0.148 X(o=-0.15,f=-0.014) USER MOD Single : B 596 MET CE :methyl -165:sc= -4.45! (180deg=-4.83!) USER MOD Single : B 605 SER OG : rot 180:sc= 0 USER MOD Single : B 606 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 615 GLN : amide:sc= -0.241 K(o=-0.24,f=-2.1!) USER MOD Single : B 618 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : B 620 LYS NZ :NH3+ 160:sc= -0.0477 (180deg=-0.335) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 73 5.262 6.214 -11.534 1.00 0.00 N ATOM 2 CA ALA A 73 5.114 6.038 -10.095 1.00 0.00 C ATOM 3 C ALA A 73 4.806 4.586 -9.748 1.00 0.00 C ATOM 4 O ALA A 73 4.096 4.304 -8.782 1.00 0.00 O ATOM 5 CB ALA A 73 4.023 6.954 -9.561 1.00 0.00 C ATOM 0 HA ALA A 73 6.060 6.304 -9.622 1.00 0.00 H new ATOM 0 HB1 ALA A 73 3.923 6.812 -8.485 1.00 0.00 H new ATOM 0 HB2 ALA A 73 4.286 7.992 -9.767 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.077 6.716 -10.048 1.00 0.00 H new ATOM 11 N LYS A 74 5.342 3.666 -10.543 1.00 0.00 N ATOM 12 CA LYS A 74 5.125 2.241 -10.320 1.00 0.00 C ATOM 13 C LYS A 74 5.950 1.743 -9.138 1.00 0.00 C ATOM 14 O LYS A 74 6.933 2.363 -8.731 1.00 0.00 O ATOM 15 CB LYS A 74 5.485 1.447 -11.578 1.00 0.00 C ATOM 16 CG LYS A 74 4.357 1.369 -12.592 1.00 0.00 C ATOM 17 CD LYS A 74 3.617 0.045 -12.501 1.00 0.00 C ATOM 18 CE LYS A 74 2.594 -0.100 -13.618 1.00 0.00 C ATOM 19 NZ LYS A 74 3.214 -0.601 -14.876 1.00 0.00 N ATOM 0 H LYS A 74 5.930 3.882 -11.348 1.00 0.00 H new ATOM 0 HA LYS A 74 4.070 2.091 -10.092 1.00 0.00 H new ATOM 0 HB2 LYS A 74 6.355 1.904 -12.049 1.00 0.00 H new ATOM 0 HB3 LYS A 74 5.773 0.436 -11.289 1.00 0.00 H new ATOM 0 HG2 LYS A 74 3.659 2.189 -12.425 1.00 0.00 H new ATOM 0 HG3 LYS A 74 4.760 1.493 -13.597 1.00 0.00 H new ATOM 0 HD2 LYS A 74 4.332 -0.777 -12.552 1.00 0.00 H new ATOM 0 HD3 LYS A 74 3.116 -0.027 -11.536 1.00 0.00 H new ATOM 0 HE2 LYS A 74 1.807 -0.785 -13.303 1.00 0.00 H new ATOM 0 HE3 LYS A 74 2.121 0.864 -13.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 2.485 -0.686 -15.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 3.948 0.065 -15.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 3.643 -1.533 -14.704 1.00 0.00 H new ATOM 33 N PRO A 75 5.544 0.596 -8.573 1.00 0.00 N ATOM 34 CA PRO A 75 6.234 -0.011 -7.431 1.00 0.00 C ATOM 35 C PRO A 75 7.602 -0.568 -7.809 1.00 0.00 C ATOM 36 O PRO A 75 7.839 -0.931 -8.961 1.00 0.00 O ATOM 37 CB PRO A 75 5.294 -1.144 -7.011 1.00 0.00 C ATOM 38 CG PRO A 75 4.535 -1.485 -8.247 1.00 0.00 C ATOM 39 CD PRO A 75 4.381 -0.196 -9.007 1.00 0.00 C ATOM 0 HA PRO A 75 6.431 0.714 -6.641 1.00 0.00 H new ATOM 0 HB2 PRO A 75 5.852 -2.004 -6.639 1.00 0.00 H new ATOM 0 HB3 PRO A 75 4.625 -0.827 -6.211 1.00 0.00 H new ATOM 0 HG2 PRO A 75 5.069 -2.227 -8.841 1.00 0.00 H new ATOM 0 HG3 PRO A 75 3.563 -1.912 -8.002 1.00 0.00 H new ATOM 0 HD2 PRO A 75 4.387 -0.361 -10.084 1.00 0.00 H new ATOM 0 HD3 PRO A 75 3.442 0.303 -8.766 1.00 0.00 H new ATOM 47 N PHE A 76 8.500 -0.631 -6.832 1.00 0.00 N ATOM 48 CA PHE A 76 9.846 -1.143 -7.063 1.00 0.00 C ATOM 49 C PHE A 76 9.856 -2.669 -7.060 1.00 0.00 C ATOM 50 O PHE A 76 10.406 -3.299 -7.964 1.00 0.00 O ATOM 51 CB PHE A 76 10.806 -0.614 -5.994 1.00 0.00 C ATOM 52 CG PHE A 76 12.159 -1.265 -6.030 1.00 0.00 C ATOM 53 CD1 PHE A 76 12.713 -1.678 -7.231 1.00 0.00 C ATOM 54 CD2 PHE A 76 12.879 -1.462 -4.862 1.00 0.00 C ATOM 55 CE1 PHE A 76 13.958 -2.277 -7.267 1.00 0.00 C ATOM 56 CE2 PHE A 76 14.124 -2.061 -4.892 1.00 0.00 C ATOM 57 CZ PHE A 76 14.665 -2.467 -6.096 1.00 0.00 C ATOM 0 H PHE A 76 8.320 -0.334 -5.873 1.00 0.00 H new ATOM 0 HA PHE A 76 10.176 -0.797 -8.042 1.00 0.00 H new ATOM 0 HB2 PHE A 76 10.925 0.462 -6.124 1.00 0.00 H new ATOM 0 HB3 PHE A 76 10.363 -0.769 -5.010 1.00 0.00 H new ATOM 0 HD1 PHE A 76 12.165 -1.530 -8.150 1.00 0.00 H new ATOM 0 HD2 PHE A 76 12.462 -1.144 -3.918 1.00 0.00 H new ATOM 0 HE1 PHE A 76 14.377 -2.596 -8.210 1.00 0.00 H new ATOM 0 HE2 PHE A 76 14.674 -2.212 -3.975 1.00 0.00 H new ATOM 0 HZ PHE A 76 15.639 -2.932 -6.122 1.00 0.00 H new ATOM 67 N VAL A 77 9.243 -3.257 -6.038 1.00 0.00 N ATOM 68 CA VAL A 77 9.179 -4.709 -5.917 1.00 0.00 C ATOM 69 C VAL A 77 10.561 -5.300 -5.660 1.00 0.00 C ATOM 70 O VAL A 77 11.104 -6.049 -6.472 1.00 0.00 O ATOM 71 CB VAL A 77 8.586 -5.352 -7.185 1.00 0.00 C ATOM 72 CG1 VAL A 77 8.113 -6.768 -6.894 1.00 0.00 C ATOM 73 CG2 VAL A 77 7.447 -4.503 -7.729 1.00 0.00 C ATOM 0 H VAL A 77 8.783 -2.750 -5.281 1.00 0.00 H new ATOM 0 HA VAL A 77 8.530 -4.928 -5.069 1.00 0.00 H new ATOM 0 HB VAL A 77 9.366 -5.404 -7.944 1.00 0.00 H new ATOM 0 HG11 VAL A 77 7.697 -7.206 -7.801 1.00 0.00 H new ATOM 0 HG12 VAL A 77 8.955 -7.370 -6.553 1.00 0.00 H new ATOM 0 HG13 VAL A 77 7.347 -6.744 -6.119 1.00 0.00 H new ATOM 0 HG21 VAL A 77 7.040 -4.972 -8.625 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.664 -4.419 -6.975 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.820 -3.509 -7.977 1.00 0.00 H new ATOM 83 N PRO A 78 11.145 -4.956 -4.502 1.00 0.00 N ATOM 84 CA PRO A 78 12.471 -5.443 -4.110 1.00 0.00 C ATOM 85 C PRO A 78 12.468 -6.932 -3.781 1.00 0.00 C ATOM 86 O PRO A 78 11.790 -7.370 -2.853 1.00 0.00 O ATOM 87 CB PRO A 78 12.796 -4.619 -2.862 1.00 0.00 C ATOM 88 CG PRO A 78 11.468 -4.237 -2.304 1.00 0.00 C ATOM 89 CD PRO A 78 10.556 -4.068 -3.487 1.00 0.00 C ATOM 0 HA PRO A 78 13.200 -5.332 -4.912 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.375 -5.200 -2.144 1.00 0.00 H new ATOM 0 HB3 PRO A 78 13.388 -3.739 -3.112 1.00 0.00 H new ATOM 0 HG2 PRO A 78 11.093 -5.006 -1.628 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.537 -3.313 -1.729 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.532 -4.354 -3.249 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.527 -3.033 -3.827 1.00 0.00 H new ATOM 97 N ASN A 79 13.232 -7.704 -4.546 1.00 0.00 N ATOM 98 CA ASN A 79 13.318 -9.144 -4.335 1.00 0.00 C ATOM 99 C ASN A 79 14.021 -9.460 -3.018 1.00 0.00 C ATOM 100 O ASN A 79 15.242 -9.351 -2.912 1.00 0.00 O ATOM 101 CB ASN A 79 14.062 -9.808 -5.496 1.00 0.00 C ATOM 102 CG ASN A 79 13.443 -9.483 -6.841 1.00 0.00 C ATOM 103 OD1 ASN A 79 12.293 -9.049 -6.919 1.00 0.00 O ATOM 104 ND2 ASN A 79 14.204 -9.692 -7.909 1.00 0.00 N ATOM 0 H ASN A 79 13.801 -7.356 -5.318 1.00 0.00 H new ATOM 0 HA ASN A 79 12.304 -9.540 -4.289 1.00 0.00 H new ATOM 0 HB2 ASN A 79 15.103 -9.483 -5.490 1.00 0.00 H new ATOM 0 HB3 ASN A 79 14.064 -10.888 -5.352 1.00 0.00 H new ATOM 0 HD21 ASN A 79 13.841 -9.492 -8.841 1.00 0.00 H new ATOM 0 HD22 ASN A 79 15.151 -10.053 -7.797 1.00 0.00 H new ATOM 111 N VAL A 80 13.240 -9.854 -2.017 1.00 0.00 N ATOM 112 CA VAL A 80 13.787 -10.188 -0.707 1.00 0.00 C ATOM 113 C VAL A 80 14.834 -11.291 -0.814 1.00 0.00 C ATOM 114 O VAL A 80 15.674 -11.453 0.072 1.00 0.00 O ATOM 115 CB VAL A 80 12.681 -10.639 0.265 1.00 0.00 C ATOM 116 CG1 VAL A 80 11.875 -11.781 -0.335 1.00 0.00 C ATOM 117 CG2 VAL A 80 13.280 -11.044 1.603 1.00 0.00 C ATOM 0 H VAL A 80 12.227 -9.950 -2.088 1.00 0.00 H new ATOM 0 HA VAL A 80 14.254 -9.283 -0.319 1.00 0.00 H new ATOM 0 HB VAL A 80 12.006 -9.800 0.434 1.00 0.00 H new ATOM 0 HG11 VAL A 80 11.098 -12.086 0.366 1.00 0.00 H new ATOM 0 HG12 VAL A 80 11.414 -11.451 -1.266 1.00 0.00 H new ATOM 0 HG13 VAL A 80 12.534 -12.625 -0.536 1.00 0.00 H new ATOM 0 HG21 VAL A 80 12.484 -11.360 2.277 1.00 0.00 H new ATOM 0 HG22 VAL A 80 13.978 -11.868 1.455 1.00 0.00 H new ATOM 0 HG23 VAL A 80 13.808 -10.195 2.037 1.00 0.00 H new ATOM 127 N HIS A 81 14.780 -12.048 -1.906 1.00 0.00 N ATOM 128 CA HIS A 81 15.725 -13.136 -2.130 1.00 0.00 C ATOM 129 C HIS A 81 17.027 -12.611 -2.728 1.00 0.00 C ATOM 130 O HIS A 81 17.924 -13.384 -3.062 1.00 0.00 O ATOM 131 CB HIS A 81 15.113 -14.188 -3.055 1.00 0.00 C ATOM 132 CG HIS A 81 13.743 -14.627 -2.640 1.00 0.00 C ATOM 133 ND1 HIS A 81 12.588 -14.059 -3.135 1.00 0.00 N ATOM 134 CD2 HIS A 81 13.346 -15.587 -1.772 1.00 0.00 C ATOM 135 CE1 HIS A 81 11.540 -14.649 -2.588 1.00 0.00 C ATOM 136 NE2 HIS A 81 11.973 -15.580 -1.758 1.00 0.00 N ATOM 0 H HIS A 81 14.092 -11.928 -2.649 1.00 0.00 H new ATOM 0 HA HIS A 81 15.948 -13.595 -1.167 1.00 0.00 H new ATOM 0 HB2 HIS A 81 15.066 -13.786 -4.067 1.00 0.00 H new ATOM 0 HB3 HIS A 81 15.770 -15.057 -3.087 1.00 0.00 H new ATOM 0 HD1 HIS A 81 12.549 -13.302 -3.817 1.00 0.00 H new ATOM 0 HD2 HIS A 81 13.989 -16.237 -1.198 1.00 0.00 H new ATOM 0 HE1 HIS A 81 10.505 -14.410 -2.786 1.00 0.00 H new ATOM 144 N ALA A 82 17.122 -11.292 -2.860 1.00 0.00 N ATOM 145 CA ALA A 82 18.313 -10.663 -3.416 1.00 0.00 C ATOM 146 C ALA A 82 19.506 -10.821 -2.479 1.00 0.00 C ATOM 147 O ALA A 82 19.639 -10.088 -1.500 1.00 0.00 O ATOM 148 CB ALA A 82 18.052 -9.191 -3.697 1.00 0.00 C ATOM 0 H ALA A 82 16.388 -10.638 -2.589 1.00 0.00 H new ATOM 0 HA ALA A 82 18.552 -11.163 -4.354 1.00 0.00 H new ATOM 0 HB1 ALA A 82 18.951 -8.735 -4.112 1.00 0.00 H new ATOM 0 HB2 ALA A 82 17.234 -9.096 -4.411 1.00 0.00 H new ATOM 0 HB3 ALA A 82 17.784 -8.685 -2.769 1.00 0.00 H new ATOM 154 N ALA A 83 20.369 -11.784 -2.784 1.00 0.00 N ATOM 155 CA ALA A 83 21.551 -12.037 -1.970 1.00 0.00 C ATOM 156 C ALA A 83 22.343 -10.755 -1.737 1.00 0.00 C ATOM 157 O ALA A 83 22.147 -9.759 -2.433 1.00 0.00 O ATOM 158 CB ALA A 83 22.430 -13.090 -2.628 1.00 0.00 C ATOM 0 H ALA A 83 20.272 -12.402 -3.589 1.00 0.00 H new ATOM 0 HA ALA A 83 21.220 -12.410 -1.001 1.00 0.00 H new ATOM 0 HB1 ALA A 83 23.309 -13.269 -2.009 1.00 0.00 H new ATOM 0 HB2 ALA A 83 21.868 -14.017 -2.736 1.00 0.00 H new ATOM 0 HB3 ALA A 83 22.744 -12.739 -3.611 1.00 0.00 H new ATOM 164 N GLU A 84 23.237 -10.786 -0.754 1.00 0.00 N ATOM 165 CA GLU A 84 24.056 -9.624 -0.429 1.00 0.00 C ATOM 166 C GLU A 84 24.753 -9.085 -1.675 1.00 0.00 C ATOM 167 O GLU A 84 25.168 -9.849 -2.548 1.00 0.00 O ATOM 168 CB GLU A 84 25.096 -9.987 0.633 1.00 0.00 C ATOM 169 CG GLU A 84 26.080 -11.053 0.183 1.00 0.00 C ATOM 170 CD GLU A 84 26.919 -11.592 1.326 1.00 0.00 C ATOM 171 OE1 GLU A 84 27.294 -10.798 2.213 1.00 0.00 O ATOM 172 OE2 GLU A 84 27.198 -12.810 1.332 1.00 0.00 O ATOM 0 H GLU A 84 23.413 -11.603 -0.169 1.00 0.00 H new ATOM 0 HA GLU A 84 23.400 -8.847 -0.035 1.00 0.00 H new ATOM 0 HB2 GLU A 84 25.648 -9.089 0.910 1.00 0.00 H new ATOM 0 HB3 GLU A 84 24.582 -10.334 1.529 1.00 0.00 H new ATOM 0 HG2 GLU A 84 25.533 -11.874 -0.280 1.00 0.00 H new ATOM 0 HG3 GLU A 84 26.737 -10.637 -0.580 1.00 0.00 H new ATOM 179 N PHE A 85 24.877 -7.764 -1.752 1.00 0.00 N ATOM 180 CA PHE A 85 25.522 -7.122 -2.891 1.00 0.00 C ATOM 181 C PHE A 85 26.980 -7.556 -3.007 1.00 0.00 C ATOM 182 O PHE A 85 27.563 -7.528 -4.091 1.00 0.00 O ATOM 183 CB PHE A 85 25.440 -5.599 -2.758 1.00 0.00 C ATOM 184 CG PHE A 85 26.590 -5.002 -1.998 1.00 0.00 C ATOM 185 CD1 PHE A 85 26.555 -4.918 -0.616 1.00 0.00 C ATOM 186 CD2 PHE A 85 27.706 -4.525 -2.667 1.00 0.00 C ATOM 187 CE1 PHE A 85 27.612 -4.368 0.085 1.00 0.00 C ATOM 188 CE2 PHE A 85 28.766 -3.974 -1.971 1.00 0.00 C ATOM 189 CZ PHE A 85 28.719 -3.897 -0.593 1.00 0.00 C ATOM 0 H PHE A 85 24.539 -7.117 -1.039 1.00 0.00 H new ATOM 0 HA PHE A 85 24.997 -7.430 -3.795 1.00 0.00 H new ATOM 0 HB2 PHE A 85 25.404 -5.157 -3.754 1.00 0.00 H new ATOM 0 HB3 PHE A 85 24.508 -5.335 -2.258 1.00 0.00 H new ATOM 0 HD1 PHE A 85 25.693 -5.286 -0.080 1.00 0.00 H new ATOM 0 HD2 PHE A 85 27.748 -4.584 -3.745 1.00 0.00 H new ATOM 0 HE1 PHE A 85 27.572 -4.307 1.163 1.00 0.00 H new ATOM 0 HE2 PHE A 85 29.629 -3.604 -2.504 1.00 0.00 H new ATOM 0 HZ PHE A 85 29.547 -3.469 -0.047 1.00 0.00 H new ATOM 199 N VAL A 86 27.563 -7.958 -1.882 1.00 0.00 N ATOM 200 CA VAL A 86 28.952 -8.399 -1.857 1.00 0.00 C ATOM 201 C VAL A 86 29.051 -9.883 -1.520 1.00 0.00 C ATOM 202 O VAL A 86 29.367 -10.270 -0.395 1.00 0.00 O ATOM 203 CB VAL A 86 29.777 -7.596 -0.834 1.00 0.00 C ATOM 204 CG1 VAL A 86 29.109 -7.624 0.532 1.00 0.00 C ATOM 205 CG2 VAL A 86 31.197 -8.137 -0.753 1.00 0.00 C ATOM 0 H VAL A 86 27.095 -7.987 -0.976 1.00 0.00 H new ATOM 0 HA VAL A 86 29.357 -8.228 -2.854 1.00 0.00 H new ATOM 0 HB VAL A 86 29.825 -6.559 -1.167 1.00 0.00 H new ATOM 0 HG11 VAL A 86 29.707 -7.051 1.241 1.00 0.00 H new ATOM 0 HG12 VAL A 86 28.114 -7.186 0.459 1.00 0.00 H new ATOM 0 HG13 VAL A 86 29.027 -8.655 0.876 1.00 0.00 H new ATOM 0 HG21 VAL A 86 31.766 -7.558 -0.026 1.00 0.00 H new ATOM 0 HG22 VAL A 86 31.171 -9.182 -0.445 1.00 0.00 H new ATOM 0 HG23 VAL A 86 31.672 -8.059 -1.731 1.00 0.00 H new ATOM 215 N PRO A 87 28.776 -10.736 -2.519 1.00 0.00 N ATOM 216 CA PRO A 87 28.829 -12.191 -2.354 1.00 0.00 C ATOM 217 C PRO A 87 30.254 -12.704 -2.178 1.00 0.00 C ATOM 218 O PRO A 87 31.189 -12.188 -2.790 1.00 0.00 O ATOM 219 CB PRO A 87 28.228 -12.718 -3.659 1.00 0.00 C ATOM 220 CG PRO A 87 28.472 -11.635 -4.653 1.00 0.00 C ATOM 221 CD PRO A 87 28.393 -10.344 -3.886 1.00 0.00 C ATOM 0 HA PRO A 87 28.297 -12.519 -1.461 1.00 0.00 H new ATOM 0 HB2 PRO A 87 28.702 -13.650 -3.965 1.00 0.00 H new ATOM 0 HB3 PRO A 87 27.163 -12.923 -3.550 1.00 0.00 H new ATOM 0 HG2 PRO A 87 29.448 -11.750 -5.124 1.00 0.00 H new ATOM 0 HG3 PRO A 87 27.729 -11.662 -5.450 1.00 0.00 H new ATOM 0 HD2 PRO A 87 29.070 -9.593 -4.293 1.00 0.00 H new ATOM 0 HD3 PRO A 87 27.390 -9.919 -3.916 1.00 0.00 H new ATOM 229 N SER A 88 30.413 -13.722 -1.338 1.00 0.00 N ATOM 230 CA SER A 88 31.725 -14.302 -1.079 1.00 0.00 C ATOM 231 C SER A 88 31.637 -15.821 -0.977 1.00 0.00 C ATOM 232 O SER A 88 30.556 -16.381 -0.794 1.00 0.00 O ATOM 233 CB SER A 88 32.316 -13.726 0.210 1.00 0.00 C ATOM 234 OG SER A 88 33.671 -14.109 0.365 1.00 0.00 O ATOM 0 H SER A 88 29.649 -14.162 -0.825 1.00 0.00 H new ATOM 0 HA SER A 88 32.378 -14.049 -1.914 1.00 0.00 H new ATOM 0 HB2 SER A 88 32.242 -12.639 0.194 1.00 0.00 H new ATOM 0 HB3 SER A 88 31.737 -14.072 1.066 1.00 0.00 H new ATOM 0 HG SER A 88 34.026 -13.727 1.195 1.00 0.00 H new ATOM 240 N PHE A 89 32.783 -16.483 -1.097 1.00 0.00 N ATOM 241 CA PHE A 89 32.837 -17.939 -1.020 1.00 0.00 C ATOM 242 C PHE A 89 33.848 -18.390 0.030 1.00 0.00 C ATOM 243 O PHE A 89 34.235 -19.559 0.074 1.00 0.00 O ATOM 244 CB PHE A 89 33.202 -18.530 -2.383 1.00 0.00 C ATOM 245 CG PHE A 89 34.321 -17.803 -3.072 1.00 0.00 C ATOM 246 CD1 PHE A 89 35.585 -17.755 -2.506 1.00 0.00 C ATOM 247 CD2 PHE A 89 34.109 -17.167 -4.285 1.00 0.00 C ATOM 248 CE1 PHE A 89 36.617 -17.087 -3.137 1.00 0.00 C ATOM 249 CE2 PHE A 89 35.138 -16.498 -4.921 1.00 0.00 C ATOM 250 CZ PHE A 89 36.393 -16.457 -4.346 1.00 0.00 C ATOM 0 H PHE A 89 33.687 -16.035 -1.248 1.00 0.00 H new ATOM 0 HA PHE A 89 31.851 -18.300 -0.728 1.00 0.00 H new ATOM 0 HB2 PHE A 89 33.484 -19.575 -2.253 1.00 0.00 H new ATOM 0 HB3 PHE A 89 32.321 -18.515 -3.024 1.00 0.00 H new ATOM 0 HD1 PHE A 89 35.766 -18.245 -1.561 1.00 0.00 H new ATOM 0 HD2 PHE A 89 33.129 -17.194 -4.738 1.00 0.00 H new ATOM 0 HE1 PHE A 89 37.598 -17.057 -2.686 1.00 0.00 H new ATOM 0 HE2 PHE A 89 34.961 -16.008 -5.867 1.00 0.00 H new ATOM 0 HZ PHE A 89 37.198 -15.933 -4.841 1.00 0.00 H new ATOM 260 N LEU A 90 34.273 -17.457 0.874 1.00 0.00 N ATOM 261 CA LEU A 90 35.240 -17.757 1.924 1.00 0.00 C ATOM 262 C LEU A 90 34.560 -17.819 3.288 1.00 0.00 C ATOM 263 O LEU A 90 34.314 -16.789 3.917 1.00 0.00 O ATOM 264 CB LEU A 90 36.348 -16.703 1.941 1.00 0.00 C ATOM 265 CG LEU A 90 37.711 -17.154 1.414 1.00 0.00 C ATOM 266 CD1 LEU A 90 37.785 -16.978 -0.095 1.00 0.00 C ATOM 267 CD2 LEU A 90 38.829 -16.382 2.099 1.00 0.00 C ATOM 0 H LEU A 90 33.963 -16.485 0.852 1.00 0.00 H new ATOM 0 HA LEU A 90 35.679 -18.732 1.712 1.00 0.00 H new ATOM 0 HB2 LEU A 90 36.018 -15.848 1.351 1.00 0.00 H new ATOM 0 HB3 LEU A 90 36.474 -16.354 2.966 1.00 0.00 H new ATOM 0 HG LEU A 90 37.835 -18.213 1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 90 38.762 -17.304 -0.452 1.00 0.00 H new ATOM 0 HD12 LEU A 90 37.007 -17.576 -0.570 1.00 0.00 H new ATOM 0 HD13 LEU A 90 37.639 -15.927 -0.346 1.00 0.00 H new ATOM 0 HD21 LEU A 90 39.792 -16.716 1.712 1.00 0.00 H new ATOM 0 HD22 LEU A 90 38.709 -15.317 1.903 1.00 0.00 H new ATOM 0 HD23 LEU A 90 38.789 -16.560 3.174 1.00 0.00 H new ATOM 279 N ARG A 91 34.262 -19.032 3.741 1.00 0.00 N ATOM 280 CA ARG A 91 33.612 -19.228 5.031 1.00 0.00 C ATOM 281 C ARG A 91 34.377 -18.510 6.139 1.00 0.00 C ATOM 282 O ARG A 91 33.794 -18.092 7.139 1.00 0.00 O ATOM 283 CB ARG A 91 33.507 -20.720 5.352 1.00 0.00 C ATOM 284 CG ARG A 91 34.827 -21.346 5.774 1.00 0.00 C ATOM 285 CD ARG A 91 35.779 -21.485 4.596 1.00 0.00 C ATOM 286 NE ARG A 91 36.740 -22.567 4.794 1.00 0.00 N ATOM 287 CZ ARG A 91 37.766 -22.797 3.982 1.00 0.00 C ATOM 288 NH1 ARG A 91 37.963 -22.024 2.923 1.00 0.00 N ATOM 289 NH2 ARG A 91 38.597 -23.801 4.229 1.00 0.00 N ATOM 0 H ARG A 91 34.460 -19.894 3.234 1.00 0.00 H new ATOM 0 HA ARG A 91 32.609 -18.805 4.973 1.00 0.00 H new ATOM 0 HB2 ARG A 91 32.776 -20.861 6.148 1.00 0.00 H new ATOM 0 HB3 ARG A 91 33.129 -21.246 4.475 1.00 0.00 H new ATOM 0 HG2 ARG A 91 35.290 -20.734 6.548 1.00 0.00 H new ATOM 0 HG3 ARG A 91 34.642 -22.327 6.212 1.00 0.00 H new ATOM 0 HD2 ARG A 91 35.207 -21.670 3.687 1.00 0.00 H new ATOM 0 HD3 ARG A 91 36.314 -20.547 4.450 1.00 0.00 H new ATOM 0 HE ARG A 91 36.617 -23.180 5.600 1.00 0.00 H new ATOM 0 HH11 ARG A 91 37.326 -21.251 2.730 1.00 0.00 H new ATOM 0 HH12 ARG A 91 38.751 -22.202 2.301 1.00 0.00 H new ATOM 0 HH21 ARG A 91 38.449 -24.397 5.043 1.00 0.00 H new ATOM 0 HH22 ARG A 91 39.384 -23.977 3.605 1.00 0.00 H new ATOM 303 N GLY A 92 35.686 -18.373 5.955 1.00 0.00 N ATOM 304 CA GLY A 92 36.509 -17.707 6.947 1.00 0.00 C ATOM 305 C GLY A 92 37.294 -18.683 7.800 1.00 0.00 C ATOM 306 O GLY A 92 37.135 -19.900 7.694 1.00 0.00 O ATOM 0 H GLY A 92 36.192 -18.711 5.136 1.00 0.00 H new ATOM 0 HA2 GLY A 92 37.201 -17.030 6.445 1.00 0.00 H new ATOM 0 HA3 GLY A 92 35.875 -17.096 7.590 1.00 0.00 H new ATOM 310 N PRO A 93 38.165 -18.149 8.669 1.00 0.00 N ATOM 311 CA PRO A 93 38.995 -18.965 9.560 1.00 0.00 C ATOM 312 C PRO A 93 38.177 -19.649 10.650 1.00 0.00 C ATOM 313 O PRO A 93 38.626 -20.619 11.260 1.00 0.00 O ATOM 314 CB PRO A 93 39.961 -17.949 10.174 1.00 0.00 C ATOM 315 CG PRO A 93 39.240 -16.647 10.098 1.00 0.00 C ATOM 316 CD PRO A 93 38.406 -16.708 8.849 1.00 0.00 C ATOM 0 HA PRO A 93 39.490 -19.776 9.026 1.00 0.00 H new ATOM 0 HB2 PRO A 93 40.205 -18.207 11.205 1.00 0.00 H new ATOM 0 HB3 PRO A 93 40.901 -17.914 9.623 1.00 0.00 H new ATOM 0 HG2 PRO A 93 38.615 -16.495 10.978 1.00 0.00 H new ATOM 0 HG3 PRO A 93 39.942 -15.814 10.058 1.00 0.00 H new ATOM 0 HD2 PRO A 93 37.473 -16.156 8.962 1.00 0.00 H new ATOM 0 HD3 PRO A 93 38.930 -16.279 7.995 1.00 0.00 H new ATOM 324 N ALA A 94 36.975 -19.137 10.890 1.00 0.00 N ATOM 325 CA ALA A 94 36.093 -19.700 11.905 1.00 0.00 C ATOM 326 C ALA A 94 34.809 -20.235 11.281 1.00 0.00 C ATOM 327 O ALA A 94 33.750 -20.127 11.898 1.00 0.00 O ATOM 328 CB ALA A 94 35.773 -18.656 12.964 1.00 0.00 C ATOM 0 H ALA A 94 36.589 -18.333 10.395 1.00 0.00 H new ATOM 0 HA ALA A 94 36.611 -20.534 12.378 1.00 0.00 H new ATOM 0 HB1 ALA A 94 35.114 -19.090 13.715 1.00 0.00 H new ATOM 0 HB2 ALA A 94 36.696 -18.325 13.439 1.00 0.00 H new ATOM 0 HB3 ALA A 94 35.279 -17.804 12.497 1.00 0.00 H new TER 334 ALA A 94 ATOM 335 N GLY B 541 41.086 10.040 8.794 1.00 0.00 N ATOM 336 CA GLY B 541 41.365 11.040 7.779 1.00 0.00 C ATOM 337 C GLY B 541 41.092 10.535 6.377 1.00 0.00 C ATOM 338 O GLY B 541 42.015 10.368 5.580 1.00 0.00 O ATOM 0 HA2 GLY B 541 40.757 11.925 7.968 1.00 0.00 H new ATOM 0 HA3 GLY B 541 42.408 11.348 7.854 1.00 0.00 H new ATOM 342 N GLN B 542 39.821 10.289 6.075 1.00 0.00 N ATOM 343 CA GLN B 542 39.430 9.797 4.759 1.00 0.00 C ATOM 344 C GLN B 542 37.962 10.100 4.479 1.00 0.00 C ATOM 345 O GLN B 542 37.076 9.645 5.202 1.00 0.00 O ATOM 346 CB GLN B 542 39.681 8.291 4.659 1.00 0.00 C ATOM 347 CG GLN B 542 39.635 7.760 3.236 1.00 0.00 C ATOM 348 CD GLN B 542 40.494 6.526 3.045 1.00 0.00 C ATOM 349 OE1 GLN B 542 40.420 5.577 3.827 1.00 0.00 O ATOM 350 NE2 GLN B 542 41.317 6.531 2.003 1.00 0.00 N ATOM 0 H GLN B 542 39.045 10.422 6.723 1.00 0.00 H new ATOM 0 HA GLN B 542 40.036 10.309 4.012 1.00 0.00 H new ATOM 0 HB2 GLN B 542 40.656 8.064 5.091 1.00 0.00 H new ATOM 0 HB3 GLN B 542 38.937 7.766 5.258 1.00 0.00 H new ATOM 0 HG2 GLN B 542 38.604 7.524 2.974 1.00 0.00 H new ATOM 0 HG3 GLN B 542 39.968 8.539 2.551 1.00 0.00 H new ATOM 0 HE21 GLN B 542 41.346 7.338 1.380 1.00 0.00 H new ATOM 0 HE22 GLN B 542 41.920 5.728 1.825 1.00 0.00 H new ATOM 359 N GLU B 543 37.712 10.870 3.425 1.00 0.00 N ATOM 360 CA GLU B 543 36.351 11.234 3.051 1.00 0.00 C ATOM 361 C GLU B 543 35.724 10.160 2.166 1.00 0.00 C ATOM 362 O GLU B 543 36.413 9.337 1.563 1.00 0.00 O ATOM 363 CB GLU B 543 36.340 12.580 2.322 1.00 0.00 C ATOM 364 CG GLU B 543 36.225 13.775 3.253 1.00 0.00 C ATOM 365 CD GLU B 543 36.644 15.073 2.590 1.00 0.00 C ATOM 366 OE1 GLU B 543 37.862 15.285 2.417 1.00 0.00 O ATOM 367 OE2 GLU B 543 35.752 15.877 2.245 1.00 0.00 O ATOM 0 H GLU B 543 38.434 11.254 2.815 1.00 0.00 H new ATOM 0 HA GLU B 543 35.762 11.319 3.964 1.00 0.00 H new ATOM 0 HB2 GLU B 543 37.254 12.674 1.736 1.00 0.00 H new ATOM 0 HB3 GLU B 543 35.507 12.596 1.619 1.00 0.00 H new ATOM 0 HG2 GLU B 543 35.195 13.864 3.599 1.00 0.00 H new ATOM 0 HG3 GLU B 543 36.844 13.605 4.134 1.00 0.00 H new ATOM 374 N PRO B 544 34.385 10.166 2.088 1.00 0.00 N ATOM 375 CA PRO B 544 33.635 9.199 1.281 1.00 0.00 C ATOM 376 C PRO B 544 33.822 9.424 -0.216 1.00 0.00 C ATOM 377 O PRO B 544 34.694 10.187 -0.635 1.00 0.00 O ATOM 378 CB PRO B 544 32.180 9.454 1.682 1.00 0.00 C ATOM 379 CG PRO B 544 32.158 10.869 2.148 1.00 0.00 C ATOM 380 CD PRO B 544 33.500 11.117 2.780 1.00 0.00 C ATOM 0 HA PRO B 544 33.967 8.176 1.458 1.00 0.00 H new ATOM 0 HB2 PRO B 544 31.505 9.304 0.839 1.00 0.00 H new ATOM 0 HB3 PRO B 544 31.861 8.772 2.471 1.00 0.00 H new ATOM 0 HG2 PRO B 544 31.986 11.551 1.316 1.00 0.00 H new ATOM 0 HG3 PRO B 544 31.353 11.032 2.865 1.00 0.00 H new ATOM 0 HD2 PRO B 544 33.827 12.147 2.637 1.00 0.00 H new ATOM 0 HD3 PRO B 544 33.478 10.936 3.855 1.00 0.00 H new ATOM 388 N LEU B 545 32.998 8.758 -1.017 1.00 0.00 N ATOM 389 CA LEU B 545 33.072 8.886 -2.468 1.00 0.00 C ATOM 390 C LEU B 545 31.947 9.771 -2.995 1.00 0.00 C ATOM 391 O LEU B 545 30.920 9.946 -2.338 1.00 0.00 O ATOM 392 CB LEU B 545 33.002 7.507 -3.126 1.00 0.00 C ATOM 393 CG LEU B 545 32.090 6.485 -2.447 1.00 0.00 C ATOM 394 CD1 LEU B 545 30.692 7.055 -2.265 1.00 0.00 C ATOM 395 CD2 LEU B 545 32.041 5.195 -3.253 1.00 0.00 C ATOM 0 H LEU B 545 32.271 8.124 -0.686 1.00 0.00 H new ATOM 0 HA LEU B 545 34.024 9.353 -2.718 1.00 0.00 H new ATOM 0 HB2 LEU B 545 32.668 7.634 -4.156 1.00 0.00 H new ATOM 0 HB3 LEU B 545 34.010 7.094 -3.166 1.00 0.00 H new ATOM 0 HG LEU B 545 32.499 6.259 -1.462 1.00 0.00 H new ATOM 0 HD11 LEU B 545 30.057 6.313 -1.780 1.00 0.00 H new ATOM 0 HD12 LEU B 545 30.742 7.951 -1.646 1.00 0.00 H new ATOM 0 HD13 LEU B 545 30.274 7.310 -3.239 1.00 0.00 H new ATOM 0 HD21 LEU B 545 31.387 4.479 -2.755 1.00 0.00 H new ATOM 0 HD22 LEU B 545 31.656 5.404 -4.251 1.00 0.00 H new ATOM 0 HD23 LEU B 545 33.044 4.776 -3.331 1.00 0.00 H new ATOM 407 N THR B 546 32.146 10.327 -4.186 1.00 0.00 N ATOM 408 CA THR B 546 31.148 11.193 -4.802 1.00 0.00 C ATOM 409 C THR B 546 31.029 10.918 -6.297 1.00 0.00 C ATOM 410 O THR B 546 31.844 10.198 -6.872 1.00 0.00 O ATOM 411 CB THR B 546 31.487 12.680 -4.591 1.00 0.00 C ATOM 412 OG1 THR B 546 32.592 13.054 -5.422 1.00 0.00 O ATOM 413 CG2 THR B 546 31.827 12.956 -3.134 1.00 0.00 C ATOM 0 H THR B 546 32.990 10.193 -4.743 1.00 0.00 H new ATOM 0 HA THR B 546 30.197 10.973 -4.318 1.00 0.00 H new ATOM 0 HB THR B 546 30.612 13.271 -4.862 1.00 0.00 H new ATOM 0 HG1 THR B 546 32.800 14.002 -5.283 1.00 0.00 H new ATOM 0 HG21 THR B 546 32.063 14.013 -3.009 1.00 0.00 H new ATOM 0 HG22 THR B 546 30.974 12.698 -2.506 1.00 0.00 H new ATOM 0 HG23 THR B 546 32.688 12.355 -2.841 1.00 0.00 H new ATOM 421 N ALA B 547 30.007 11.496 -6.920 1.00 0.00 N ATOM 422 CA ALA B 547 29.783 11.315 -8.349 1.00 0.00 C ATOM 423 C ALA B 547 31.036 11.658 -9.149 1.00 0.00 C ATOM 424 O ALA B 547 31.410 10.937 -10.073 1.00 0.00 O ATOM 425 CB ALA B 547 28.610 12.166 -8.811 1.00 0.00 C ATOM 0 H ALA B 547 29.321 12.093 -6.458 1.00 0.00 H new ATOM 0 HA ALA B 547 29.548 10.265 -8.525 1.00 0.00 H new ATOM 0 HB1 ALA B 547 28.454 12.021 -9.880 1.00 0.00 H new ATOM 0 HB2 ALA B 547 27.711 11.871 -8.270 1.00 0.00 H new ATOM 0 HB3 ALA B 547 28.823 13.217 -8.615 1.00 0.00 H new ATOM 431 N SER B 548 31.679 12.764 -8.787 1.00 0.00 N ATOM 432 CA SER B 548 32.887 13.205 -9.474 1.00 0.00 C ATOM 433 C SER B 548 33.983 12.148 -9.378 1.00 0.00 C ATOM 434 O SER B 548 34.915 12.130 -10.182 1.00 0.00 O ATOM 435 CB SER B 548 33.382 14.526 -8.882 1.00 0.00 C ATOM 436 OG SER B 548 32.886 15.631 -9.617 1.00 0.00 O ATOM 0 H SER B 548 31.383 13.371 -8.022 1.00 0.00 H new ATOM 0 HA SER B 548 32.643 13.356 -10.526 1.00 0.00 H new ATOM 0 HB2 SER B 548 33.064 14.604 -7.842 1.00 0.00 H new ATOM 0 HB3 SER B 548 34.472 14.543 -8.884 1.00 0.00 H new ATOM 0 HG SER B 548 33.215 16.463 -9.218 1.00 0.00 H new ATOM 442 N MET B 549 33.864 11.270 -8.388 1.00 0.00 N ATOM 443 CA MET B 549 34.844 10.209 -8.186 1.00 0.00 C ATOM 444 C MET B 549 34.403 8.923 -8.877 1.00 0.00 C ATOM 445 O MET B 549 35.153 8.337 -9.659 1.00 0.00 O ATOM 446 CB MET B 549 35.050 9.954 -6.692 1.00 0.00 C ATOM 447 CG MET B 549 35.946 8.761 -6.397 1.00 0.00 C ATOM 448 SD MET B 549 36.842 8.933 -4.842 1.00 0.00 S ATOM 449 CE MET B 549 36.826 7.241 -4.254 1.00 0.00 C ATOM 0 H MET B 549 33.099 11.272 -7.713 1.00 0.00 H new ATOM 0 HA MET B 549 35.788 10.532 -8.626 1.00 0.00 H new ATOM 0 HB2 MET B 549 35.483 10.845 -6.236 1.00 0.00 H new ATOM 0 HB3 MET B 549 34.080 9.794 -6.222 1.00 0.00 H new ATOM 0 HG2 MET B 549 35.340 7.856 -6.364 1.00 0.00 H new ATOM 0 HG3 MET B 549 36.660 8.637 -7.211 1.00 0.00 H new ATOM 0 HE1 MET B 549 36.921 7.232 -3.168 1.00 0.00 H new ATOM 0 HE2 MET B 549 35.888 6.765 -4.540 1.00 0.00 H new ATOM 0 HE3 MET B 549 37.659 6.694 -4.696 1.00 0.00 H new ATOM 459 N LEU B 550 33.182 8.488 -8.584 1.00 0.00 N ATOM 460 CA LEU B 550 32.641 7.270 -9.178 1.00 0.00 C ATOM 461 C LEU B 550 32.550 7.397 -10.695 1.00 0.00 C ATOM 462 O LEU B 550 32.593 6.400 -11.415 1.00 0.00 O ATOM 463 CB LEU B 550 31.259 6.966 -8.597 1.00 0.00 C ATOM 464 CG LEU B 550 31.195 5.831 -7.575 1.00 0.00 C ATOM 465 CD1 LEU B 550 31.469 6.356 -6.174 1.00 0.00 C ATOM 466 CD2 LEU B 550 29.841 5.138 -7.631 1.00 0.00 C ATOM 0 H LEU B 550 32.548 8.960 -7.939 1.00 0.00 H new ATOM 0 HA LEU B 550 33.317 6.449 -8.941 1.00 0.00 H new ATOM 0 HB2 LEU B 550 30.877 7.873 -8.128 1.00 0.00 H new ATOM 0 HB3 LEU B 550 30.586 6.725 -9.420 1.00 0.00 H new ATOM 0 HG LEU B 550 31.965 5.101 -7.824 1.00 0.00 H new ATOM 0 HD11 LEU B 550 31.419 5.533 -5.461 1.00 0.00 H new ATOM 0 HD12 LEU B 550 32.462 6.805 -6.141 1.00 0.00 H new ATOM 0 HD13 LEU B 550 30.723 7.107 -5.914 1.00 0.00 H new ATOM 0 HD21 LEU B 550 29.814 4.333 -6.897 1.00 0.00 H new ATOM 0 HD22 LEU B 550 29.054 5.859 -7.409 1.00 0.00 H new ATOM 0 HD23 LEU B 550 29.684 4.725 -8.628 1.00 0.00 H new ATOM 478 N ALA B 551 32.428 8.631 -11.174 1.00 0.00 N ATOM 479 CA ALA B 551 32.336 8.889 -12.605 1.00 0.00 C ATOM 480 C ALA B 551 33.601 8.438 -13.327 1.00 0.00 C ATOM 481 O ALA B 551 33.609 8.282 -14.548 1.00 0.00 O ATOM 482 CB ALA B 551 32.080 10.367 -12.860 1.00 0.00 C ATOM 0 H ALA B 551 32.391 9.467 -10.591 1.00 0.00 H new ATOM 0 HA ALA B 551 31.499 8.313 -12.999 1.00 0.00 H new ATOM 0 HB1 ALA B 551 32.014 10.545 -13.933 1.00 0.00 H new ATOM 0 HB2 ALA B 551 31.144 10.661 -12.385 1.00 0.00 H new ATOM 0 HB3 ALA B 551 32.899 10.955 -12.445 1.00 0.00 H new ATOM 488 N SER B 552 34.670 8.230 -12.564 1.00 0.00 N ATOM 489 CA SER B 552 35.943 7.801 -13.132 1.00 0.00 C ATOM 490 C SER B 552 36.021 6.279 -13.202 1.00 0.00 C ATOM 491 O SER B 552 36.742 5.721 -14.027 1.00 0.00 O ATOM 492 CB SER B 552 37.106 8.345 -12.300 1.00 0.00 C ATOM 493 OG SER B 552 36.975 9.741 -12.092 1.00 0.00 O ATOM 0 H SER B 552 34.680 8.352 -11.551 1.00 0.00 H new ATOM 0 HA SER B 552 36.013 8.198 -14.145 1.00 0.00 H new ATOM 0 HB2 SER B 552 37.140 7.833 -11.339 1.00 0.00 H new ATOM 0 HB3 SER B 552 38.048 8.136 -12.806 1.00 0.00 H new ATOM 0 HG SER B 552 37.729 10.064 -11.556 1.00 0.00 H new ATOM 499 N ALA B 553 35.272 5.614 -12.328 1.00 0.00 N ATOM 500 CA ALA B 553 35.254 4.157 -12.291 1.00 0.00 C ATOM 501 C ALA B 553 34.170 3.598 -13.206 1.00 0.00 C ATOM 502 O ALA B 553 33.215 4.285 -13.570 1.00 0.00 O ATOM 503 CB ALA B 553 35.047 3.668 -10.865 1.00 0.00 C ATOM 0 H ALA B 553 34.670 6.061 -11.637 1.00 0.00 H new ATOM 0 HA ALA B 553 36.218 3.797 -12.651 1.00 0.00 H new ATOM 0 HB1 ALA B 553 35.036 2.578 -10.852 1.00 0.00 H new ATOM 0 HB2 ALA B 553 35.859 4.030 -10.235 1.00 0.00 H new ATOM 0 HB3 ALA B 553 34.097 4.045 -10.485 1.00 0.00 H new ATOM 509 N PRO B 554 34.319 2.321 -13.590 1.00 0.00 N ATOM 510 CA PRO B 554 33.362 1.641 -14.468 1.00 0.00 C ATOM 511 C PRO B 554 32.027 1.381 -13.779 1.00 0.00 C ATOM 512 O PRO B 554 31.889 1.524 -12.564 1.00 0.00 O ATOM 513 CB PRO B 554 34.060 0.319 -14.798 1.00 0.00 C ATOM 514 CG PRO B 554 34.983 0.082 -13.652 1.00 0.00 C ATOM 515 CD PRO B 554 35.433 1.442 -13.195 1.00 0.00 C ATOM 0 HA PRO B 554 33.117 2.240 -15.345 1.00 0.00 H new ATOM 0 HB2 PRO B 554 33.341 -0.493 -14.902 1.00 0.00 H new ATOM 0 HB3 PRO B 554 34.606 0.384 -15.739 1.00 0.00 H new ATOM 0 HG2 PRO B 554 34.477 -0.452 -12.848 1.00 0.00 H new ATOM 0 HG3 PRO B 554 35.833 -0.529 -13.955 1.00 0.00 H new ATOM 0 HD2 PRO B 554 35.603 1.468 -12.119 1.00 0.00 H new ATOM 0 HD3 PRO B 554 36.367 1.738 -13.673 1.00 0.00 H new ATOM 523 N PRO B 555 31.018 0.990 -14.572 1.00 0.00 N ATOM 524 CA PRO B 555 29.675 0.700 -14.059 1.00 0.00 C ATOM 525 C PRO B 555 29.637 -0.571 -13.217 1.00 0.00 C ATOM 526 O PRO B 555 28.643 -0.854 -12.550 1.00 0.00 O ATOM 527 CB PRO B 555 28.840 0.525 -15.330 1.00 0.00 C ATOM 528 CG PRO B 555 29.820 0.107 -16.372 1.00 0.00 C ATOM 529 CD PRO B 555 31.110 0.798 -16.029 1.00 0.00 C ATOM 0 HA PRO B 555 29.312 1.488 -13.399 1.00 0.00 H new ATOM 0 HB2 PRO B 555 28.063 -0.227 -15.193 1.00 0.00 H new ATOM 0 HB3 PRO B 555 28.340 1.453 -15.606 1.00 0.00 H new ATOM 0 HG2 PRO B 555 29.947 -0.976 -16.377 1.00 0.00 H new ATOM 0 HG3 PRO B 555 29.477 0.392 -17.367 1.00 0.00 H new ATOM 0 HD2 PRO B 555 31.975 0.192 -16.301 1.00 0.00 H new ATOM 0 HD3 PRO B 555 31.209 1.748 -16.554 1.00 0.00 H new ATOM 537 N GLN B 556 30.726 -1.332 -13.254 1.00 0.00 N ATOM 538 CA GLN B 556 30.816 -2.573 -12.494 1.00 0.00 C ATOM 539 C GLN B 556 31.458 -2.332 -11.132 1.00 0.00 C ATOM 540 O GLN B 556 31.106 -2.979 -10.146 1.00 0.00 O ATOM 541 CB GLN B 556 31.620 -3.615 -13.272 1.00 0.00 C ATOM 542 CG GLN B 556 30.886 -4.172 -14.481 1.00 0.00 C ATOM 543 CD GLN B 556 31.667 -5.260 -15.189 1.00 0.00 C ATOM 544 OE1 GLN B 556 31.739 -6.396 -14.718 1.00 0.00 O ATOM 545 NE2 GLN B 556 32.259 -4.919 -16.328 1.00 0.00 N ATOM 0 H GLN B 556 31.558 -1.111 -13.802 1.00 0.00 H new ATOM 0 HA GLN B 556 29.804 -2.947 -12.337 1.00 0.00 H new ATOM 0 HB2 GLN B 556 32.557 -3.167 -13.601 1.00 0.00 H new ATOM 0 HB3 GLN B 556 31.877 -4.437 -12.603 1.00 0.00 H new ATOM 0 HG2 GLN B 556 29.922 -4.570 -14.164 1.00 0.00 H new ATOM 0 HG3 GLN B 556 30.682 -3.362 -15.182 1.00 0.00 H new ATOM 0 HE21 GLN B 556 32.173 -3.966 -16.682 1.00 0.00 H new ATOM 0 HE22 GLN B 556 32.799 -5.610 -16.849 1.00 0.00 H new ATOM 554 N GLU B 557 32.402 -1.397 -11.085 1.00 0.00 N ATOM 555 CA GLU B 557 33.094 -1.072 -9.843 1.00 0.00 C ATOM 556 C GLU B 557 32.233 -0.174 -8.959 1.00 0.00 C ATOM 557 O GLU B 557 32.168 -0.360 -7.745 1.00 0.00 O ATOM 558 CB GLU B 557 34.428 -0.385 -10.141 1.00 0.00 C ATOM 559 CG GLU B 557 34.962 0.437 -8.980 1.00 0.00 C ATOM 560 CD GLU B 557 35.269 -0.408 -7.759 1.00 0.00 C ATOM 561 OE1 GLU B 557 35.094 -1.643 -7.834 1.00 0.00 O ATOM 562 OE2 GLU B 557 35.683 0.164 -6.729 1.00 0.00 O ATOM 0 H GLU B 557 32.705 -0.852 -11.892 1.00 0.00 H new ATOM 0 HA GLU B 557 33.284 -2.003 -9.309 1.00 0.00 H new ATOM 0 HB2 GLU B 557 35.165 -1.142 -10.409 1.00 0.00 H new ATOM 0 HB3 GLU B 557 34.307 0.263 -11.009 1.00 0.00 H new ATOM 0 HG2 GLU B 557 35.867 0.957 -9.294 1.00 0.00 H new ATOM 0 HG3 GLU B 557 34.231 1.201 -8.714 1.00 0.00 H new ATOM 569 N GLN B 558 31.574 0.800 -9.579 1.00 0.00 N ATOM 570 CA GLN B 558 30.719 1.728 -8.850 1.00 0.00 C ATOM 571 C GLN B 558 29.685 0.976 -8.018 1.00 0.00 C ATOM 572 O GLN B 558 29.297 1.423 -6.938 1.00 0.00 O ATOM 573 CB GLN B 558 30.016 2.678 -9.821 1.00 0.00 C ATOM 574 CG GLN B 558 30.949 3.689 -10.467 1.00 0.00 C ATOM 575 CD GLN B 558 30.274 4.490 -11.562 1.00 0.00 C ATOM 576 OE1 GLN B 558 29.912 5.651 -11.364 1.00 0.00 O ATOM 577 NE2 GLN B 558 30.102 3.875 -12.726 1.00 0.00 N ATOM 0 H GLN B 558 31.616 0.966 -10.584 1.00 0.00 H new ATOM 0 HA GLN B 558 31.348 2.309 -8.176 1.00 0.00 H new ATOM 0 HB2 GLN B 558 29.532 2.092 -10.602 1.00 0.00 H new ATOM 0 HB3 GLN B 558 29.229 3.211 -9.288 1.00 0.00 H new ATOM 0 HG2 GLN B 558 31.325 4.370 -9.704 1.00 0.00 H new ATOM 0 HG3 GLN B 558 31.812 3.168 -10.882 1.00 0.00 H new ATOM 0 HE21 GLN B 558 30.417 2.912 -12.846 1.00 0.00 H new ATOM 0 HE22 GLN B 558 29.654 4.365 -13.501 1.00 0.00 H new ATOM 586 N LYS B 559 29.242 -0.168 -8.527 1.00 0.00 N ATOM 587 CA LYS B 559 28.254 -0.984 -7.832 1.00 0.00 C ATOM 588 C LYS B 559 28.732 -1.339 -6.427 1.00 0.00 C ATOM 589 O LYS B 559 28.129 -0.929 -5.436 1.00 0.00 O ATOM 590 CB LYS B 559 27.970 -2.263 -8.623 1.00 0.00 C ATOM 591 CG LYS B 559 27.164 -2.029 -9.889 1.00 0.00 C ATOM 592 CD LYS B 559 27.126 -3.270 -10.764 1.00 0.00 C ATOM 593 CE LYS B 559 26.251 -4.355 -10.154 1.00 0.00 C ATOM 594 NZ LYS B 559 24.835 -3.915 -10.019 1.00 0.00 N ATOM 0 H LYS B 559 29.552 -0.552 -9.420 1.00 0.00 H new ATOM 0 HA LYS B 559 27.335 -0.404 -7.749 1.00 0.00 H new ATOM 0 HB2 LYS B 559 28.917 -2.735 -8.887 1.00 0.00 H new ATOM 0 HB3 LYS B 559 27.432 -2.963 -7.984 1.00 0.00 H new ATOM 0 HG2 LYS B 559 26.147 -1.738 -9.625 1.00 0.00 H new ATOM 0 HG3 LYS B 559 27.598 -1.201 -10.449 1.00 0.00 H new ATOM 0 HD2 LYS B 559 26.747 -3.008 -11.752 1.00 0.00 H new ATOM 0 HD3 LYS B 559 28.138 -3.651 -10.901 1.00 0.00 H new ATOM 0 HE2 LYS B 559 26.296 -5.249 -10.775 1.00 0.00 H new ATOM 0 HE3 LYS B 559 26.641 -4.628 -9.174 1.00 0.00 H new ATOM 0 HZ1 LYS B 559 24.207 -4.638 -10.425 1.00 0.00 H new ATOM 0 HZ2 LYS B 559 24.607 -3.783 -9.013 1.00 0.00 H new ATOM 0 HZ3 LYS B 559 24.701 -3.016 -10.525 1.00 0.00 H new ATOM 608 N GLN B 560 29.818 -2.100 -6.352 1.00 0.00 N ATOM 609 CA GLN B 560 30.377 -2.508 -5.068 1.00 0.00 C ATOM 610 C GLN B 560 30.703 -1.294 -4.206 1.00 0.00 C ATOM 611 O GLN B 560 30.545 -1.326 -2.985 1.00 0.00 O ATOM 612 CB GLN B 560 31.636 -3.351 -5.280 1.00 0.00 C ATOM 613 CG GLN B 560 31.465 -4.450 -6.316 1.00 0.00 C ATOM 614 CD GLN B 560 30.201 -5.260 -6.105 1.00 0.00 C ATOM 615 OE1 GLN B 560 29.771 -5.477 -4.972 1.00 0.00 O ATOM 616 NE2 GLN B 560 29.597 -5.712 -7.198 1.00 0.00 N ATOM 0 H GLN B 560 30.329 -2.447 -7.164 1.00 0.00 H new ATOM 0 HA GLN B 560 29.630 -3.109 -4.550 1.00 0.00 H new ATOM 0 HB2 GLN B 560 32.453 -2.698 -5.587 1.00 0.00 H new ATOM 0 HB3 GLN B 560 31.926 -3.800 -4.330 1.00 0.00 H new ATOM 0 HG2 GLN B 560 31.445 -4.006 -7.311 1.00 0.00 H new ATOM 0 HG3 GLN B 560 32.328 -5.115 -6.281 1.00 0.00 H new ATOM 0 HE21 GLN B 560 29.988 -5.509 -8.118 1.00 0.00 H new ATOM 0 HE22 GLN B 560 28.742 -6.263 -7.118 1.00 0.00 H new ATOM 625 N MET B 561 31.158 -0.223 -4.848 1.00 0.00 N ATOM 626 CA MET B 561 31.506 1.003 -4.139 1.00 0.00 C ATOM 627 C MET B 561 30.287 1.586 -3.432 1.00 0.00 C ATOM 628 O MET B 561 30.277 1.732 -2.209 1.00 0.00 O ATOM 629 CB MET B 561 32.088 2.032 -5.110 1.00 0.00 C ATOM 630 CG MET B 561 33.466 1.662 -5.633 1.00 0.00 C ATOM 631 SD MET B 561 34.697 2.940 -5.312 1.00 0.00 S ATOM 632 CE MET B 561 34.571 3.915 -6.810 1.00 0.00 C ATOM 0 H MET B 561 31.294 -0.179 -5.858 1.00 0.00 H new ATOM 0 HA MET B 561 32.257 0.758 -3.388 1.00 0.00 H new ATOM 0 HB2 MET B 561 31.408 2.149 -5.953 1.00 0.00 H new ATOM 0 HB3 MET B 561 32.146 2.999 -4.610 1.00 0.00 H new ATOM 0 HG2 MET B 561 33.787 0.729 -5.170 1.00 0.00 H new ATOM 0 HG3 MET B 561 33.407 1.482 -6.706 1.00 0.00 H new ATOM 0 HE1 MET B 561 35.464 3.767 -7.417 1.00 0.00 H new ATOM 0 HE2 MET B 561 33.693 3.602 -7.375 1.00 0.00 H new ATOM 0 HE3 MET B 561 34.479 4.970 -6.551 1.00 0.00 H new ATOM 642 N LEU B 562 29.261 1.918 -4.208 1.00 0.00 N ATOM 643 CA LEU B 562 28.036 2.486 -3.656 1.00 0.00 C ATOM 644 C LEU B 562 27.488 1.611 -2.533 1.00 0.00 C ATOM 645 O LEU B 562 27.189 2.096 -1.443 1.00 0.00 O ATOM 646 CB LEU B 562 26.984 2.645 -4.754 1.00 0.00 C ATOM 647 CG LEU B 562 27.141 3.865 -5.663 1.00 0.00 C ATOM 648 CD1 LEU B 562 26.102 3.841 -6.774 1.00 0.00 C ATOM 649 CD2 LEU B 562 27.031 5.150 -4.855 1.00 0.00 C ATOM 0 H LEU B 562 29.253 1.804 -5.222 1.00 0.00 H new ATOM 0 HA LEU B 562 28.273 3.467 -3.244 1.00 0.00 H new ATOM 0 HB2 LEU B 562 26.998 1.750 -5.376 1.00 0.00 H new ATOM 0 HB3 LEU B 562 26.002 2.691 -4.284 1.00 0.00 H new ATOM 0 HG LEU B 562 28.131 3.829 -6.119 1.00 0.00 H new ATOM 0 HD11 LEU B 562 26.229 4.717 -7.410 1.00 0.00 H new ATOM 0 HD12 LEU B 562 26.228 2.937 -7.371 1.00 0.00 H new ATOM 0 HD13 LEU B 562 25.103 3.852 -6.338 1.00 0.00 H new ATOM 0 HD21 LEU B 562 27.145 6.008 -5.518 1.00 0.00 H new ATOM 0 HD22 LEU B 562 26.055 5.193 -4.371 1.00 0.00 H new ATOM 0 HD23 LEU B 562 27.814 5.171 -4.097 1.00 0.00 H new ATOM 661 N GLY B 563 27.359 0.316 -2.808 1.00 0.00 N ATOM 662 CA GLY B 563 26.849 -0.607 -1.811 1.00 0.00 C ATOM 663 C GLY B 563 27.720 -0.661 -0.572 1.00 0.00 C ATOM 664 O GLY B 563 27.215 -0.634 0.550 1.00 0.00 O ATOM 0 H GLY B 563 27.599 -0.110 -3.703 1.00 0.00 H new ATOM 0 HA2 GLY B 563 25.839 -0.310 -1.529 1.00 0.00 H new ATOM 0 HA3 GLY B 563 26.779 -1.604 -2.246 1.00 0.00 H new ATOM 668 N GLU B 564 29.031 -0.740 -0.775 1.00 0.00 N ATOM 669 CA GLU B 564 29.973 -0.802 0.336 1.00 0.00 C ATOM 670 C GLU B 564 29.791 0.391 1.270 1.00 0.00 C ATOM 671 O GLU B 564 29.839 0.249 2.492 1.00 0.00 O ATOM 672 CB GLU B 564 31.411 -0.839 -0.187 1.00 0.00 C ATOM 673 CG GLU B 564 31.946 -2.245 -0.396 1.00 0.00 C ATOM 674 CD GLU B 564 33.445 -2.337 -0.180 1.00 0.00 C ATOM 675 OE1 GLU B 564 34.154 -1.366 -0.517 1.00 0.00 O ATOM 676 OE2 GLU B 564 33.908 -3.381 0.325 1.00 0.00 O ATOM 0 H GLU B 564 29.465 -0.763 -1.698 1.00 0.00 H new ATOM 0 HA GLU B 564 29.774 -1.715 0.897 1.00 0.00 H new ATOM 0 HB2 GLU B 564 31.459 -0.297 -1.131 1.00 0.00 H new ATOM 0 HB3 GLU B 564 32.058 -0.314 0.516 1.00 0.00 H new ATOM 0 HG2 GLU B 564 31.442 -2.927 0.288 1.00 0.00 H new ATOM 0 HG3 GLU B 564 31.708 -2.574 -1.407 1.00 0.00 H new ATOM 683 N ARG B 565 29.583 1.567 0.686 1.00 0.00 N ATOM 684 CA ARG B 565 29.395 2.784 1.465 1.00 0.00 C ATOM 685 C ARG B 565 28.000 2.825 2.083 1.00 0.00 C ATOM 686 O ARG B 565 27.799 3.406 3.150 1.00 0.00 O ATOM 687 CB ARG B 565 29.611 4.017 0.585 1.00 0.00 C ATOM 688 CG ARG B 565 30.948 4.022 -0.138 1.00 0.00 C ATOM 689 CD ARG B 565 31.991 4.823 0.625 1.00 0.00 C ATOM 690 NE ARG B 565 32.338 4.197 1.898 1.00 0.00 N ATOM 691 CZ ARG B 565 31.826 4.572 3.065 1.00 0.00 C ATOM 692 NH1 ARG B 565 30.949 5.564 3.120 1.00 0.00 N ATOM 693 NH2 ARG B 565 32.192 3.953 4.181 1.00 0.00 N ATOM 0 H ARG B 565 29.541 1.702 -0.324 1.00 0.00 H new ATOM 0 HA ARG B 565 30.130 2.787 2.270 1.00 0.00 H new ATOM 0 HB2 ARG B 565 28.809 4.073 -0.151 1.00 0.00 H new ATOM 0 HB3 ARG B 565 29.538 4.912 1.203 1.00 0.00 H new ATOM 0 HG2 ARG B 565 31.297 2.997 -0.267 1.00 0.00 H new ATOM 0 HG3 ARG B 565 30.822 4.443 -1.135 1.00 0.00 H new ATOM 0 HD2 ARG B 565 32.888 4.924 0.014 1.00 0.00 H new ATOM 0 HD3 ARG B 565 31.614 5.829 0.807 1.00 0.00 H new ATOM 0 HE ARG B 565 33.010 3.430 1.891 1.00 0.00 H new ATOM 0 HH11 ARG B 565 30.665 6.042 2.265 1.00 0.00 H new ATOM 0 HH12 ARG B 565 30.558 5.850 4.018 1.00 0.00 H new ATOM 0 HH21 ARG B 565 32.867 3.189 4.143 1.00 0.00 H new ATOM 0 HH22 ARG B 565 31.799 4.241 5.077 1.00 0.00 H new ATOM 707 N LEU B 566 27.040 2.207 1.404 1.00 0.00 N ATOM 708 CA LEU B 566 25.663 2.172 1.885 1.00 0.00 C ATOM 709 C LEU B 566 25.512 1.177 3.031 1.00 0.00 C ATOM 710 O LEU B 566 24.597 1.289 3.847 1.00 0.00 O ATOM 711 CB LEU B 566 24.713 1.804 0.745 1.00 0.00 C ATOM 712 CG LEU B 566 24.487 2.882 -0.316 1.00 0.00 C ATOM 713 CD1 LEU B 566 24.122 2.250 -1.650 1.00 0.00 C ATOM 714 CD2 LEU B 566 23.404 3.852 0.131 1.00 0.00 C ATOM 0 H LEU B 566 27.190 1.723 0.519 1.00 0.00 H new ATOM 0 HA LEU B 566 25.408 3.165 2.255 1.00 0.00 H new ATOM 0 HB2 LEU B 566 25.099 0.912 0.251 1.00 0.00 H new ATOM 0 HB3 LEU B 566 23.747 1.538 1.175 1.00 0.00 H new ATOM 0 HG LEU B 566 25.415 3.439 -0.443 1.00 0.00 H new ATOM 0 HD11 LEU B 566 23.965 3.032 -2.392 1.00 0.00 H new ATOM 0 HD12 LEU B 566 24.931 1.597 -1.977 1.00 0.00 H new ATOM 0 HD13 LEU B 566 23.208 1.667 -1.538 1.00 0.00 H new ATOM 0 HD21 LEU B 566 23.257 4.612 -0.636 1.00 0.00 H new ATOM 0 HD22 LEU B 566 22.472 3.309 0.288 1.00 0.00 H new ATOM 0 HD23 LEU B 566 23.706 4.331 1.062 1.00 0.00 H new ATOM 726 N PHE B 567 26.415 0.204 3.086 1.00 0.00 N ATOM 727 CA PHE B 567 26.383 -0.811 4.133 1.00 0.00 C ATOM 728 C PHE B 567 26.347 -0.166 5.515 1.00 0.00 C ATOM 729 O PHE B 567 25.437 -0.394 6.311 1.00 0.00 O ATOM 730 CB PHE B 567 27.599 -1.731 4.018 1.00 0.00 C ATOM 731 CG PHE B 567 28.004 -2.356 5.323 1.00 0.00 C ATOM 732 CD1 PHE B 567 27.092 -3.083 6.070 1.00 0.00 C ATOM 733 CD2 PHE B 567 29.297 -2.215 5.802 1.00 0.00 C ATOM 734 CE1 PHE B 567 27.461 -3.659 7.271 1.00 0.00 C ATOM 735 CE2 PHE B 567 29.671 -2.790 7.002 1.00 0.00 C ATOM 736 CZ PHE B 567 28.752 -3.511 7.738 1.00 0.00 C ATOM 0 H PHE B 567 27.178 0.097 2.418 1.00 0.00 H new ATOM 0 HA PHE B 567 25.476 -1.402 4.004 1.00 0.00 H new ATOM 0 HB2 PHE B 567 27.381 -2.520 3.299 1.00 0.00 H new ATOM 0 HB3 PHE B 567 28.439 -1.161 3.621 1.00 0.00 H new ATOM 0 HD1 PHE B 567 26.081 -3.201 5.710 1.00 0.00 H new ATOM 0 HD2 PHE B 567 30.020 -1.650 5.232 1.00 0.00 H new ATOM 0 HE1 PHE B 567 26.740 -4.224 7.844 1.00 0.00 H new ATOM 0 HE2 PHE B 567 30.682 -2.675 7.364 1.00 0.00 H new ATOM 0 HZ PHE B 567 29.042 -3.958 8.677 1.00 0.00 H new ATOM 746 N PRO B 568 27.363 0.660 5.808 1.00 0.00 N ATOM 747 CA PRO B 568 27.472 1.355 7.094 1.00 0.00 C ATOM 748 C PRO B 568 26.414 2.441 7.257 1.00 0.00 C ATOM 749 O PRO B 568 25.956 2.713 8.368 1.00 0.00 O ATOM 750 CB PRO B 568 28.871 1.975 7.044 1.00 0.00 C ATOM 751 CG PRO B 568 29.166 2.129 5.592 1.00 0.00 C ATOM 752 CD PRO B 568 28.483 0.978 4.907 1.00 0.00 C ATOM 0 HA PRO B 568 27.319 0.680 7.936 1.00 0.00 H new ATOM 0 HB2 PRO B 568 28.896 2.936 7.557 1.00 0.00 H new ATOM 0 HB3 PRO B 568 29.606 1.334 7.531 1.00 0.00 H new ATOM 0 HG2 PRO B 568 28.794 3.083 5.217 1.00 0.00 H new ATOM 0 HG3 PRO B 568 30.240 2.111 5.408 1.00 0.00 H new ATOM 0 HD2 PRO B 568 28.133 1.253 3.912 1.00 0.00 H new ATOM 0 HD3 PRO B 568 29.154 0.128 4.785 1.00 0.00 H new ATOM 760 N LEU B 569 26.029 3.058 6.146 1.00 0.00 N ATOM 761 CA LEU B 569 25.024 4.114 6.166 1.00 0.00 C ATOM 762 C LEU B 569 23.701 3.596 6.720 1.00 0.00 C ATOM 763 O LEU B 569 23.187 4.114 7.713 1.00 0.00 O ATOM 764 CB LEU B 569 24.815 4.674 4.757 1.00 0.00 C ATOM 765 CG LEU B 569 25.849 5.695 4.281 1.00 0.00 C ATOM 766 CD1 LEU B 569 25.539 6.145 2.861 1.00 0.00 C ATOM 767 CD2 LEU B 569 25.893 6.889 5.223 1.00 0.00 C ATOM 0 H LEU B 569 26.398 2.845 5.219 1.00 0.00 H new ATOM 0 HA LEU B 569 25.383 4.911 6.818 1.00 0.00 H new ATOM 0 HB2 LEU B 569 24.806 3.841 4.054 1.00 0.00 H new ATOM 0 HB3 LEU B 569 23.829 5.138 4.714 1.00 0.00 H new ATOM 0 HG LEU B 569 26.830 5.219 4.284 1.00 0.00 H new ATOM 0 HD11 LEU B 569 26.285 6.871 2.539 1.00 0.00 H new ATOM 0 HD12 LEU B 569 25.559 5.283 2.194 1.00 0.00 H new ATOM 0 HD13 LEU B 569 24.550 6.603 2.832 1.00 0.00 H new ATOM 0 HD21 LEU B 569 26.634 7.605 4.868 1.00 0.00 H new ATOM 0 HD22 LEU B 569 24.913 7.366 5.252 1.00 0.00 H new ATOM 0 HD23 LEU B 569 26.163 6.553 6.224 1.00 0.00 H new ATOM 779 N ILE B 570 23.155 2.571 6.075 1.00 0.00 N ATOM 780 CA ILE B 570 21.894 1.981 6.506 1.00 0.00 C ATOM 781 C ILE B 570 22.085 1.126 7.754 1.00 0.00 C ATOM 782 O ILE B 570 21.127 0.827 8.466 1.00 0.00 O ATOM 783 CB ILE B 570 21.268 1.116 5.396 1.00 0.00 C ATOM 784 CG1 ILE B 570 21.092 1.938 4.117 1.00 0.00 C ATOM 785 CG2 ILE B 570 19.934 0.549 5.855 1.00 0.00 C ATOM 786 CD1 ILE B 570 21.463 1.185 2.859 1.00 0.00 C ATOM 0 H ILE B 570 23.566 2.132 5.252 1.00 0.00 H new ATOM 0 HA ILE B 570 21.221 2.808 6.734 1.00 0.00 H new ATOM 0 HB ILE B 570 21.939 0.284 5.182 1.00 0.00 H new ATOM 0 HG12 ILE B 570 20.054 2.263 4.044 1.00 0.00 H new ATOM 0 HG13 ILE B 570 21.704 2.838 4.186 1.00 0.00 H new ATOM 0 HG21 ILE B 570 19.504 -0.060 5.059 1.00 0.00 H new ATOM 0 HG22 ILE B 570 20.086 -0.067 6.741 1.00 0.00 H new ATOM 0 HG23 ILE B 570 19.254 1.367 6.094 1.00 0.00 H new ATOM 0 HD11 ILE B 570 21.314 1.829 1.992 1.00 0.00 H new ATOM 0 HD12 ILE B 570 22.509 0.883 2.911 1.00 0.00 H new ATOM 0 HD13 ILE B 570 20.834 0.300 2.766 1.00 0.00 H new ATOM 798 N GLN B 571 23.329 0.737 8.013 1.00 0.00 N ATOM 799 CA GLN B 571 23.646 -0.083 9.176 1.00 0.00 C ATOM 800 C GLN B 571 23.207 0.606 10.464 1.00 0.00 C ATOM 801 O GLN B 571 23.008 -0.044 11.490 1.00 0.00 O ATOM 802 CB GLN B 571 25.147 -0.376 9.227 1.00 0.00 C ATOM 803 CG GLN B 571 25.648 -0.749 10.613 1.00 0.00 C ATOM 804 CD GLN B 571 26.921 -1.571 10.572 1.00 0.00 C ATOM 805 OE1 GLN B 571 27.647 -1.562 9.577 1.00 0.00 O ATOM 806 NE2 GLN B 571 27.199 -2.287 11.655 1.00 0.00 N ATOM 0 H GLN B 571 24.134 0.976 7.433 1.00 0.00 H new ATOM 0 HA GLN B 571 23.102 -1.023 9.085 1.00 0.00 H new ATOM 0 HB2 GLN B 571 25.374 -1.189 8.537 1.00 0.00 H new ATOM 0 HB3 GLN B 571 25.692 0.501 8.877 1.00 0.00 H new ATOM 0 HG2 GLN B 571 25.825 0.160 11.188 1.00 0.00 H new ATOM 0 HG3 GLN B 571 24.874 -1.311 11.136 1.00 0.00 H new ATOM 0 HE21 GLN B 571 26.569 -2.264 12.457 1.00 0.00 H new ATOM 0 HE22 GLN B 571 28.043 -2.860 11.685 1.00 0.00 H new ATOM 815 N ALA B 572 23.057 1.925 10.402 1.00 0.00 N ATOM 816 CA ALA B 572 22.640 2.702 11.563 1.00 0.00 C ATOM 817 C ALA B 572 21.119 2.746 11.675 1.00 0.00 C ATOM 818 O ALA B 572 20.572 3.424 12.545 1.00 0.00 O ATOM 819 CB ALA B 572 23.207 4.111 11.486 1.00 0.00 C ATOM 0 H ALA B 572 23.218 2.478 9.560 1.00 0.00 H new ATOM 0 HA ALA B 572 23.030 2.214 12.456 1.00 0.00 H new ATOM 0 HB1 ALA B 572 22.888 4.680 12.359 1.00 0.00 H new ATOM 0 HB2 ALA B 572 24.296 4.064 11.462 1.00 0.00 H new ATOM 0 HB3 ALA B 572 22.845 4.600 10.582 1.00 0.00 H new ATOM 825 N MET B 573 20.444 2.022 10.790 1.00 0.00 N ATOM 826 CA MET B 573 18.986 1.979 10.791 1.00 0.00 C ATOM 827 C MET B 573 18.484 0.540 10.725 1.00 0.00 C ATOM 828 O MET B 573 17.775 0.077 11.619 1.00 0.00 O ATOM 829 CB MET B 573 18.430 2.780 9.613 1.00 0.00 C ATOM 830 CG MET B 573 19.066 4.152 9.456 1.00 0.00 C ATOM 831 SD MET B 573 18.085 5.259 8.426 1.00 0.00 S ATOM 832 CE MET B 573 18.261 4.477 6.824 1.00 0.00 C ATOM 0 H MET B 573 20.882 1.457 10.063 1.00 0.00 H new ATOM 0 HA MET B 573 18.635 2.425 11.722 1.00 0.00 H new ATOM 0 HB2 MET B 573 18.580 2.212 8.695 1.00 0.00 H new ATOM 0 HB3 MET B 573 17.354 2.900 9.741 1.00 0.00 H new ATOM 0 HG2 MET B 573 19.199 4.601 10.440 1.00 0.00 H new ATOM 0 HG3 MET B 573 20.058 4.040 9.019 1.00 0.00 H new ATOM 0 HE1 MET B 573 17.737 5.067 6.072 1.00 0.00 H new ATOM 0 HE2 MET B 573 19.318 4.413 6.564 1.00 0.00 H new ATOM 0 HE3 MET B 573 17.835 3.474 6.860 1.00 0.00 H new ATOM 842 N HIS B 574 18.856 -0.163 9.659 1.00 0.00 N ATOM 843 CA HIS B 574 18.443 -1.550 9.477 1.00 0.00 C ATOM 844 C HIS B 574 19.634 -2.426 9.097 1.00 0.00 C ATOM 845 O HIS B 574 19.748 -2.904 7.969 1.00 0.00 O ATOM 846 CB HIS B 574 17.361 -1.645 8.401 1.00 0.00 C ATOM 847 CG HIS B 574 16.008 -1.210 8.872 1.00 0.00 C ATOM 848 ND1 HIS B 574 15.023 -0.761 8.018 1.00 0.00 N ATOM 849 CD2 HIS B 574 15.478 -1.158 10.116 1.00 0.00 C ATOM 850 CE1 HIS B 574 13.946 -0.450 8.718 1.00 0.00 C ATOM 851 NE2 HIS B 574 14.196 -0.683 9.993 1.00 0.00 N ATOM 0 H HIS B 574 19.442 0.205 8.909 1.00 0.00 H new ATOM 0 HA HIS B 574 18.037 -1.910 10.422 1.00 0.00 H new ATOM 0 HB2 HIS B 574 17.654 -1.033 7.548 1.00 0.00 H new ATOM 0 HB3 HIS B 574 17.300 -2.675 8.048 1.00 0.00 H new ATOM 0 HD2 HIS B 574 15.972 -1.438 11.035 1.00 0.00 H new ATOM 0 HE1 HIS B 574 13.019 -0.070 8.315 1.00 0.00 H new ATOM 0 HE2 HIS B 574 13.543 -0.534 10.762 1.00 0.00 H new ATOM 859 N PRO B 575 20.542 -2.640 10.060 1.00 0.00 N ATOM 860 CA PRO B 575 21.740 -3.459 9.850 1.00 0.00 C ATOM 861 C PRO B 575 21.411 -4.939 9.695 1.00 0.00 C ATOM 862 O PRO B 575 22.145 -5.685 9.045 1.00 0.00 O ATOM 863 CB PRO B 575 22.558 -3.223 11.122 1.00 0.00 C ATOM 864 CG PRO B 575 21.553 -2.850 12.156 1.00 0.00 C ATOM 865 CD PRO B 575 20.470 -2.101 11.428 1.00 0.00 C ATOM 0 HA PRO B 575 22.264 -3.188 8.933 1.00 0.00 H new ATOM 0 HB2 PRO B 575 23.109 -4.118 11.410 1.00 0.00 H new ATOM 0 HB3 PRO B 575 23.292 -2.430 10.979 1.00 0.00 H new ATOM 0 HG2 PRO B 575 21.152 -3.736 12.648 1.00 0.00 H new ATOM 0 HG3 PRO B 575 22.003 -2.230 12.932 1.00 0.00 H new ATOM 0 HD2 PRO B 575 19.492 -2.273 11.877 1.00 0.00 H new ATOM 0 HD3 PRO B 575 20.644 -1.025 11.446 1.00 0.00 H new ATOM 873 N THR B 576 20.302 -5.360 10.295 1.00 0.00 N ATOM 874 CA THR B 576 19.875 -6.752 10.223 1.00 0.00 C ATOM 875 C THR B 576 19.854 -7.248 8.782 1.00 0.00 C ATOM 876 O THR B 576 20.113 -8.422 8.514 1.00 0.00 O ATOM 877 CB THR B 576 18.477 -6.944 10.841 1.00 0.00 C ATOM 878 OG1 THR B 576 18.400 -6.264 12.099 1.00 0.00 O ATOM 879 CG2 THR B 576 18.170 -8.421 11.038 1.00 0.00 C ATOM 0 H THR B 576 19.683 -4.757 10.836 1.00 0.00 H new ATOM 0 HA THR B 576 20.599 -7.334 10.793 1.00 0.00 H new ATOM 0 HB THR B 576 17.741 -6.524 10.156 1.00 0.00 H new ATOM 0 HG1 THR B 576 17.508 -6.389 12.485 1.00 0.00 H new ATOM 0 HG21 THR B 576 17.178 -8.531 11.476 1.00 0.00 H new ATOM 0 HG22 THR B 576 18.201 -8.931 10.075 1.00 0.00 H new ATOM 0 HG23 THR B 576 18.911 -8.861 11.705 1.00 0.00 H new ATOM 887 N LEU B 577 19.544 -6.347 7.856 1.00 0.00 N ATOM 888 CA LEU B 577 19.489 -6.692 6.440 1.00 0.00 C ATOM 889 C LEU B 577 20.018 -5.549 5.580 1.00 0.00 C ATOM 890 O LEU B 577 19.628 -5.398 4.423 1.00 0.00 O ATOM 891 CB LEU B 577 18.054 -7.031 6.033 1.00 0.00 C ATOM 892 CG LEU B 577 17.227 -7.799 7.064 1.00 0.00 C ATOM 893 CD1 LEU B 577 16.435 -6.837 7.936 1.00 0.00 C ATOM 894 CD2 LEU B 577 16.297 -8.786 6.374 1.00 0.00 C ATOM 0 H LEU B 577 19.327 -5.372 8.061 1.00 0.00 H new ATOM 0 HA LEU B 577 20.121 -7.565 6.279 1.00 0.00 H new ATOM 0 HB2 LEU B 577 17.535 -6.101 5.800 1.00 0.00 H new ATOM 0 HB3 LEU B 577 18.087 -7.617 5.114 1.00 0.00 H new ATOM 0 HG LEU B 577 17.909 -8.360 7.704 1.00 0.00 H new ATOM 0 HD11 LEU B 577 15.852 -7.401 8.664 1.00 0.00 H new ATOM 0 HD12 LEU B 577 17.121 -6.171 8.459 1.00 0.00 H new ATOM 0 HD13 LEU B 577 15.763 -6.249 7.311 1.00 0.00 H new ATOM 0 HD21 LEU B 577 15.716 -9.324 7.124 1.00 0.00 H new ATOM 0 HD22 LEU B 577 15.622 -8.246 5.710 1.00 0.00 H new ATOM 0 HD23 LEU B 577 16.886 -9.496 5.793 1.00 0.00 H new ATOM 906 N ALA B 578 20.910 -4.748 6.153 1.00 0.00 N ATOM 907 CA ALA B 578 21.496 -3.621 5.437 1.00 0.00 C ATOM 908 C ALA B 578 22.030 -4.054 4.075 1.00 0.00 C ATOM 909 O ALA B 578 21.642 -3.506 3.044 1.00 0.00 O ATOM 910 CB ALA B 578 22.605 -2.990 6.265 1.00 0.00 C ATOM 0 H ALA B 578 21.243 -4.858 7.111 1.00 0.00 H new ATOM 0 HA ALA B 578 20.714 -2.880 5.272 1.00 0.00 H new ATOM 0 HB1 ALA B 578 23.034 -2.150 5.719 1.00 0.00 H new ATOM 0 HB2 ALA B 578 22.196 -2.637 7.212 1.00 0.00 H new ATOM 0 HB3 ALA B 578 23.381 -3.731 6.459 1.00 0.00 H new ATOM 916 N GLY B 579 22.922 -5.039 4.080 1.00 0.00 N ATOM 917 CA GLY B 579 23.495 -5.527 2.839 1.00 0.00 C ATOM 918 C GLY B 579 22.437 -5.933 1.832 1.00 0.00 C ATOM 919 O GLY B 579 22.559 -5.644 0.642 1.00 0.00 O ATOM 0 H GLY B 579 23.258 -5.508 4.921 1.00 0.00 H new ATOM 0 HA2 GLY B 579 24.127 -4.752 2.405 1.00 0.00 H new ATOM 0 HA3 GLY B 579 24.138 -6.381 3.050 1.00 0.00 H new ATOM 923 N LYS B 580 21.396 -6.607 2.310 1.00 0.00 N ATOM 924 CA LYS B 580 20.312 -7.054 1.444 1.00 0.00 C ATOM 925 C LYS B 580 19.661 -5.873 0.732 1.00 0.00 C ATOM 926 O LYS B 580 19.669 -5.796 -0.497 1.00 0.00 O ATOM 927 CB LYS B 580 19.262 -7.815 2.257 1.00 0.00 C ATOM 928 CG LYS B 580 19.804 -9.060 2.937 1.00 0.00 C ATOM 929 CD LYS B 580 19.716 -10.275 2.028 1.00 0.00 C ATOM 930 CE LYS B 580 18.285 -10.774 1.903 1.00 0.00 C ATOM 931 NZ LYS B 580 17.952 -11.774 2.955 1.00 0.00 N ATOM 0 H LYS B 580 21.281 -6.855 3.293 1.00 0.00 H new ATOM 0 HA LYS B 580 20.734 -7.721 0.692 1.00 0.00 H new ATOM 0 HB2 LYS B 580 18.848 -7.149 3.014 1.00 0.00 H new ATOM 0 HB3 LYS B 580 18.441 -8.099 1.599 1.00 0.00 H new ATOM 0 HG2 LYS B 580 20.842 -8.895 3.226 1.00 0.00 H new ATOM 0 HG3 LYS B 580 19.244 -9.248 3.853 1.00 0.00 H new ATOM 0 HD2 LYS B 580 20.102 -10.021 1.041 1.00 0.00 H new ATOM 0 HD3 LYS B 580 20.347 -11.072 2.421 1.00 0.00 H new ATOM 0 HE2 LYS B 580 17.599 -9.930 1.974 1.00 0.00 H new ATOM 0 HE3 LYS B 580 18.141 -11.220 0.919 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 16.968 -12.089 2.835 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 18.590 -12.591 2.872 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 18.065 -11.341 3.894 1.00 0.00 H new ATOM 945 N ILE B 581 19.100 -4.955 1.511 1.00 0.00 N ATOM 946 CA ILE B 581 18.447 -3.776 0.955 1.00 0.00 C ATOM 947 C ILE B 581 19.440 -2.908 0.190 1.00 0.00 C ATOM 948 O ILE B 581 19.059 -2.139 -0.693 1.00 0.00 O ATOM 949 CB ILE B 581 17.782 -2.928 2.055 1.00 0.00 C ATOM 950 CG1 ILE B 581 18.811 -2.534 3.117 1.00 0.00 C ATOM 951 CG2 ILE B 581 16.627 -3.691 2.687 1.00 0.00 C ATOM 952 CD1 ILE B 581 18.192 -1.976 4.380 1.00 0.00 C ATOM 0 H ILE B 581 19.084 -5.005 2.530 1.00 0.00 H new ATOM 0 HA ILE B 581 17.678 -4.135 0.271 1.00 0.00 H new ATOM 0 HB ILE B 581 17.387 -2.018 1.603 1.00 0.00 H new ATOM 0 HG12 ILE B 581 19.411 -3.407 3.371 1.00 0.00 H new ATOM 0 HG13 ILE B 581 19.490 -1.792 2.696 1.00 0.00 H new ATOM 0 HG21 ILE B 581 16.167 -3.078 3.463 1.00 0.00 H new ATOM 0 HG22 ILE B 581 15.886 -3.927 1.924 1.00 0.00 H new ATOM 0 HG23 ILE B 581 17.000 -4.615 3.128 1.00 0.00 H new ATOM 0 HD11 ILE B 581 18.980 -1.718 5.088 1.00 0.00 H new ATOM 0 HD12 ILE B 581 17.615 -1.083 4.139 1.00 0.00 H new ATOM 0 HD13 ILE B 581 17.535 -2.724 4.824 1.00 0.00 H new ATOM 964 N THR B 582 20.718 -3.036 0.533 1.00 0.00 N ATOM 965 CA THR B 582 21.767 -2.264 -0.121 1.00 0.00 C ATOM 966 C THR B 582 21.964 -2.716 -1.563 1.00 0.00 C ATOM 967 O THR B 582 22.058 -1.895 -2.474 1.00 0.00 O ATOM 968 CB THR B 582 23.106 -2.386 0.631 1.00 0.00 C ATOM 969 OG1 THR B 582 23.033 -1.687 1.878 1.00 0.00 O ATOM 970 CG2 THR B 582 24.248 -1.827 -0.205 1.00 0.00 C ATOM 0 H THR B 582 21.052 -3.668 1.261 1.00 0.00 H new ATOM 0 HA THR B 582 21.446 -1.222 -0.110 1.00 0.00 H new ATOM 0 HB THR B 582 23.298 -3.442 0.819 1.00 0.00 H new ATOM 0 HG1 THR B 582 22.344 -2.096 2.442 1.00 0.00 H new ATOM 0 HG21 THR B 582 25.183 -1.924 0.346 1.00 0.00 H new ATOM 0 HG22 THR B 582 24.319 -2.381 -1.141 1.00 0.00 H new ATOM 0 HG23 THR B 582 24.061 -0.775 -0.420 1.00 0.00 H new ATOM 978 N GLY B 583 22.025 -4.029 -1.765 1.00 0.00 N ATOM 979 CA GLY B 583 22.209 -4.567 -3.100 1.00 0.00 C ATOM 980 C GLY B 583 21.114 -4.137 -4.055 1.00 0.00 C ATOM 981 O GLY B 583 21.384 -3.799 -5.207 1.00 0.00 O ATOM 0 H GLY B 583 21.950 -4.730 -1.027 1.00 0.00 H new ATOM 0 HA2 GLY B 583 23.174 -4.243 -3.489 1.00 0.00 H new ATOM 0 HA3 GLY B 583 22.235 -5.655 -3.049 1.00 0.00 H new ATOM 985 N MET B 584 19.874 -4.151 -3.576 1.00 0.00 N ATOM 986 CA MET B 584 18.734 -3.759 -4.396 1.00 0.00 C ATOM 987 C MET B 584 18.750 -2.259 -4.669 1.00 0.00 C ATOM 988 O MET B 584 18.716 -1.826 -5.822 1.00 0.00 O ATOM 989 CB MET B 584 17.425 -4.151 -3.708 1.00 0.00 C ATOM 990 CG MET B 584 17.449 -5.546 -3.105 1.00 0.00 C ATOM 991 SD MET B 584 15.859 -6.386 -3.236 1.00 0.00 S ATOM 992 CE MET B 584 15.443 -6.595 -1.506 1.00 0.00 C ATOM 0 H MET B 584 19.634 -4.429 -2.625 1.00 0.00 H new ATOM 0 HA MET B 584 18.806 -4.284 -5.349 1.00 0.00 H new ATOM 0 HB2 MET B 584 17.207 -3.428 -2.922 1.00 0.00 H new ATOM 0 HB3 MET B 584 16.612 -4.091 -4.431 1.00 0.00 H new ATOM 0 HG2 MET B 584 18.212 -6.141 -3.606 1.00 0.00 H new ATOM 0 HG3 MET B 584 17.735 -5.479 -2.055 1.00 0.00 H new ATOM 0 HE1 MET B 584 14.482 -7.102 -1.422 1.00 0.00 H new ATOM 0 HE2 MET B 584 16.212 -7.192 -1.016 1.00 0.00 H new ATOM 0 HE3 MET B 584 15.382 -5.618 -1.026 1.00 0.00 H new ATOM 1002 N LEU B 585 18.802 -1.469 -3.602 1.00 0.00 N ATOM 1003 CA LEU B 585 18.822 -0.015 -3.726 1.00 0.00 C ATOM 1004 C LEU B 585 19.924 0.434 -4.681 1.00 0.00 C ATOM 1005 O LEU B 585 19.663 1.120 -5.669 1.00 0.00 O ATOM 1006 CB LEU B 585 19.025 0.631 -2.355 1.00 0.00 C ATOM 1007 CG LEU B 585 17.758 1.110 -1.645 1.00 0.00 C ATOM 1008 CD1 LEU B 585 16.654 0.070 -1.762 1.00 0.00 C ATOM 1009 CD2 LEU B 585 18.049 1.419 -0.184 1.00 0.00 C ATOM 0 H LEU B 585 18.831 -1.811 -2.641 1.00 0.00 H new ATOM 0 HA LEU B 585 17.862 0.304 -4.132 1.00 0.00 H new ATOM 0 HB2 LEU B 585 19.531 -0.087 -1.709 1.00 0.00 H new ATOM 0 HB3 LEU B 585 19.696 1.482 -2.472 1.00 0.00 H new ATOM 0 HG LEU B 585 17.419 2.026 -2.129 1.00 0.00 H new ATOM 0 HD11 LEU B 585 15.761 0.429 -1.251 1.00 0.00 H new ATOM 0 HD12 LEU B 585 16.426 -0.102 -2.814 1.00 0.00 H new ATOM 0 HD13 LEU B 585 16.983 -0.863 -1.305 1.00 0.00 H new ATOM 0 HD21 LEU B 585 17.136 1.758 0.305 1.00 0.00 H new ATOM 0 HD22 LEU B 585 18.414 0.520 0.312 1.00 0.00 H new ATOM 0 HD23 LEU B 585 18.806 2.201 -0.121 1.00 0.00 H new ATOM 1021 N LEU B 586 21.157 0.041 -4.379 1.00 0.00 N ATOM 1022 CA LEU B 586 22.300 0.402 -5.211 1.00 0.00 C ATOM 1023 C LEU B 586 22.122 -0.117 -6.634 1.00 0.00 C ATOM 1024 O LEU B 586 22.655 0.456 -7.584 1.00 0.00 O ATOM 1025 CB LEU B 586 23.590 -0.157 -4.609 1.00 0.00 C ATOM 1026 CG LEU B 586 23.999 -1.554 -5.078 1.00 0.00 C ATOM 1027 CD1 LEU B 586 24.835 -1.469 -6.346 1.00 0.00 C ATOM 1028 CD2 LEU B 586 24.763 -2.282 -3.982 1.00 0.00 C ATOM 0 H LEU B 586 21.391 -0.527 -3.565 1.00 0.00 H new ATOM 0 HA LEU B 586 22.365 1.490 -5.246 1.00 0.00 H new ATOM 0 HB2 LEU B 586 24.402 0.533 -4.836 1.00 0.00 H new ATOM 0 HB3 LEU B 586 23.483 -0.177 -3.524 1.00 0.00 H new ATOM 0 HG LEU B 586 23.095 -2.120 -5.301 1.00 0.00 H new ATOM 0 HD11 LEU B 586 25.116 -2.473 -6.664 1.00 0.00 H new ATOM 0 HD12 LEU B 586 24.254 -0.988 -7.133 1.00 0.00 H new ATOM 0 HD13 LEU B 586 25.734 -0.885 -6.150 1.00 0.00 H new ATOM 0 HD21 LEU B 586 25.046 -3.274 -4.333 1.00 0.00 H new ATOM 0 HD22 LEU B 586 25.660 -1.718 -3.727 1.00 0.00 H new ATOM 0 HD23 LEU B 586 24.131 -2.376 -3.099 1.00 0.00 H new ATOM 1040 N GLU B 587 21.369 -1.204 -6.773 1.00 0.00 N ATOM 1041 CA GLU B 587 21.120 -1.798 -8.081 1.00 0.00 C ATOM 1042 C GLU B 587 20.092 -0.985 -8.862 1.00 0.00 C ATOM 1043 O GLU B 587 20.001 -1.091 -10.085 1.00 0.00 O ATOM 1044 CB GLU B 587 20.635 -3.241 -7.926 1.00 0.00 C ATOM 1045 CG GLU B 587 20.206 -3.882 -9.235 1.00 0.00 C ATOM 1046 CD GLU B 587 21.337 -3.966 -10.242 1.00 0.00 C ATOM 1047 OE1 GLU B 587 21.757 -2.907 -10.753 1.00 0.00 O ATOM 1048 OE2 GLU B 587 21.801 -5.092 -10.518 1.00 0.00 O ATOM 0 H GLU B 587 20.921 -1.691 -5.996 1.00 0.00 H new ATOM 0 HA GLU B 587 22.057 -1.795 -8.637 1.00 0.00 H new ATOM 0 HB2 GLU B 587 21.432 -3.838 -7.483 1.00 0.00 H new ATOM 0 HB3 GLU B 587 19.797 -3.261 -7.229 1.00 0.00 H new ATOM 0 HG2 GLU B 587 19.826 -4.884 -9.037 1.00 0.00 H new ATOM 0 HG3 GLU B 587 19.384 -3.308 -9.664 1.00 0.00 H new ATOM 1055 N ILE B 588 19.321 -0.174 -8.146 1.00 0.00 N ATOM 1056 CA ILE B 588 18.300 0.658 -8.771 1.00 0.00 C ATOM 1057 C ILE B 588 18.874 1.445 -9.944 1.00 0.00 C ATOM 1058 O ILE B 588 18.462 1.262 -11.089 1.00 0.00 O ATOM 1059 CB ILE B 588 17.679 1.641 -7.762 1.00 0.00 C ATOM 1060 CG1 ILE B 588 16.939 0.878 -6.662 1.00 0.00 C ATOM 1061 CG2 ILE B 588 16.738 2.604 -8.470 1.00 0.00 C ATOM 1062 CD1 ILE B 588 16.341 1.775 -5.600 1.00 0.00 C ATOM 0 H ILE B 588 19.384 -0.075 -7.133 1.00 0.00 H new ATOM 0 HA ILE B 588 17.524 -0.015 -9.134 1.00 0.00 H new ATOM 0 HB ILE B 588 18.480 2.219 -7.302 1.00 0.00 H new ATOM 0 HG12 ILE B 588 16.144 0.285 -7.114 1.00 0.00 H new ATOM 0 HG13 ILE B 588 17.629 0.179 -6.189 1.00 0.00 H new ATOM 0 HG21 ILE B 588 16.307 3.292 -7.743 1.00 0.00 H new ATOM 0 HG22 ILE B 588 17.292 3.168 -9.220 1.00 0.00 H new ATOM 0 HG23 ILE B 588 15.940 2.042 -8.955 1.00 0.00 H new ATOM 0 HD11 ILE B 588 15.832 1.165 -4.853 1.00 0.00 H new ATOM 0 HD12 ILE B 588 17.134 2.350 -5.121 1.00 0.00 H new ATOM 0 HD13 ILE B 588 15.626 2.457 -6.060 1.00 0.00 H new ATOM 1074 N ASP B 589 19.829 2.321 -9.650 1.00 0.00 N ATOM 1075 CA ASP B 589 20.464 3.135 -10.680 1.00 0.00 C ATOM 1076 C ASP B 589 21.433 4.137 -10.060 1.00 0.00 C ATOM 1077 O ASP B 589 21.071 4.887 -9.155 1.00 0.00 O ATOM 1078 CB ASP B 589 19.405 3.872 -11.501 1.00 0.00 C ATOM 1079 CG ASP B 589 19.494 3.554 -12.981 1.00 0.00 C ATOM 1080 OD1 ASP B 589 20.593 3.704 -13.555 1.00 0.00 O ATOM 1081 OD2 ASP B 589 18.466 3.153 -13.564 1.00 0.00 O ATOM 0 H ASP B 589 20.180 2.485 -8.707 1.00 0.00 H new ATOM 0 HA ASP B 589 21.027 2.472 -11.337 1.00 0.00 H new ATOM 0 HB2 ASP B 589 18.414 3.605 -11.134 1.00 0.00 H new ATOM 0 HB3 ASP B 589 19.520 4.946 -11.356 1.00 0.00 H new ATOM 1086 N ASN B 590 22.667 4.142 -10.555 1.00 0.00 N ATOM 1087 CA ASN B 590 23.689 5.050 -10.048 1.00 0.00 C ATOM 1088 C ASN B 590 23.271 6.504 -10.246 1.00 0.00 C ATOM 1089 O ASN B 590 23.622 7.375 -9.449 1.00 0.00 O ATOM 1090 CB ASN B 590 25.024 4.792 -10.751 1.00 0.00 C ATOM 1091 CG ASN B 590 25.605 3.434 -10.406 1.00 0.00 C ATOM 1092 OD1 ASN B 590 24.919 2.576 -9.851 1.00 0.00 O ATOM 1093 ND2 ASN B 590 26.876 3.234 -10.735 1.00 0.00 N ATOM 0 H ASN B 590 22.983 3.528 -11.306 1.00 0.00 H new ATOM 0 HA ASN B 590 23.806 4.866 -8.980 1.00 0.00 H new ATOM 0 HB2 ASN B 590 24.883 4.861 -11.830 1.00 0.00 H new ATOM 0 HB3 ASN B 590 25.735 5.570 -10.472 1.00 0.00 H new ATOM 0 HD21 ASN B 590 27.322 2.340 -10.528 1.00 0.00 H new ATOM 0 HD22 ASN B 590 27.406 3.974 -11.194 1.00 0.00 H new ATOM 1100 N SER B 591 22.520 6.759 -11.312 1.00 0.00 N ATOM 1101 CA SER B 591 22.056 8.107 -11.617 1.00 0.00 C ATOM 1102 C SER B 591 21.128 8.623 -10.521 1.00 0.00 C ATOM 1103 O SER B 591 21.316 9.722 -10.001 1.00 0.00 O ATOM 1104 CB SER B 591 21.333 8.129 -12.965 1.00 0.00 C ATOM 1105 OG SER B 591 22.238 7.905 -14.032 1.00 0.00 O ATOM 0 H SER B 591 22.220 6.049 -11.980 1.00 0.00 H new ATOM 0 HA SER B 591 22.927 8.760 -11.670 1.00 0.00 H new ATOM 0 HB2 SER B 591 20.556 7.365 -12.977 1.00 0.00 H new ATOM 0 HB3 SER B 591 20.837 9.090 -13.100 1.00 0.00 H new ATOM 0 HG SER B 591 21.752 7.922 -14.883 1.00 0.00 H new ATOM 1111 N GLU B 592 20.126 7.820 -10.176 1.00 0.00 N ATOM 1112 CA GLU B 592 19.168 8.195 -9.143 1.00 0.00 C ATOM 1113 C GLU B 592 19.819 8.171 -7.763 1.00 0.00 C ATOM 1114 O GLU B 592 19.660 9.102 -6.972 1.00 0.00 O ATOM 1115 CB GLU B 592 17.963 7.253 -9.168 1.00 0.00 C ATOM 1116 CG GLU B 592 17.254 7.207 -10.511 1.00 0.00 C ATOM 1117 CD GLU B 592 16.196 8.284 -10.650 1.00 0.00 C ATOM 1118 OE1 GLU B 592 15.393 8.453 -9.709 1.00 0.00 O ATOM 1119 OE2 GLU B 592 16.173 8.959 -11.701 1.00 0.00 O ATOM 0 H GLU B 592 19.957 6.906 -10.597 1.00 0.00 H new ATOM 0 HA GLU B 592 18.830 9.211 -9.348 1.00 0.00 H new ATOM 0 HB2 GLU B 592 18.293 6.248 -8.906 1.00 0.00 H new ATOM 0 HB3 GLU B 592 17.253 7.565 -8.402 1.00 0.00 H new ATOM 0 HG2 GLU B 592 17.988 7.319 -11.309 1.00 0.00 H new ATOM 0 HG3 GLU B 592 16.790 6.229 -10.639 1.00 0.00 H new ATOM 1126 N LEU B 593 20.551 7.099 -7.480 1.00 0.00 N ATOM 1127 CA LEU B 593 21.226 6.951 -6.195 1.00 0.00 C ATOM 1128 C LEU B 593 22.098 8.166 -5.895 1.00 0.00 C ATOM 1129 O LEU B 593 22.080 8.698 -4.784 1.00 0.00 O ATOM 1130 CB LEU B 593 22.081 5.682 -6.189 1.00 0.00 C ATOM 1131 CG LEU B 593 21.322 4.362 -6.325 1.00 0.00 C ATOM 1132 CD1 LEU B 593 22.191 3.315 -7.005 1.00 0.00 C ATOM 1133 CD2 LEU B 593 20.858 3.870 -4.962 1.00 0.00 C ATOM 0 H LEU B 593 20.692 6.320 -8.123 1.00 0.00 H new ATOM 0 HA LEU B 593 20.464 6.873 -5.419 1.00 0.00 H new ATOM 0 HB2 LEU B 593 22.802 5.749 -7.004 1.00 0.00 H new ATOM 0 HB3 LEU B 593 22.651 5.656 -5.260 1.00 0.00 H new ATOM 0 HG LEU B 593 20.442 4.533 -6.945 1.00 0.00 H new ATOM 0 HD11 LEU B 593 21.635 2.382 -7.093 1.00 0.00 H new ATOM 0 HD12 LEU B 593 22.473 3.665 -7.998 1.00 0.00 H new ATOM 0 HD13 LEU B 593 23.090 3.147 -6.411 1.00 0.00 H new ATOM 0 HD21 LEU B 593 20.320 2.929 -5.079 1.00 0.00 H new ATOM 0 HD22 LEU B 593 21.723 3.715 -4.317 1.00 0.00 H new ATOM 0 HD23 LEU B 593 20.198 4.612 -4.512 1.00 0.00 H new ATOM 1145 N LEU B 594 22.859 8.603 -6.893 1.00 0.00 N ATOM 1146 CA LEU B 594 23.736 9.758 -6.737 1.00 0.00 C ATOM 1147 C LEU B 594 22.979 10.941 -6.141 1.00 0.00 C ATOM 1148 O LEU B 594 23.549 11.752 -5.410 1.00 0.00 O ATOM 1149 CB LEU B 594 24.339 10.151 -8.086 1.00 0.00 C ATOM 1150 CG LEU B 594 25.682 9.509 -8.434 1.00 0.00 C ATOM 1151 CD1 LEU B 594 26.089 9.860 -9.857 1.00 0.00 C ATOM 1152 CD2 LEU B 594 26.755 9.949 -7.448 1.00 0.00 C ATOM 0 H LEU B 594 22.886 8.175 -7.818 1.00 0.00 H new ATOM 0 HA LEU B 594 24.539 9.483 -6.053 1.00 0.00 H new ATOM 0 HB2 LEU B 594 23.624 9.897 -8.869 1.00 0.00 H new ATOM 0 HB3 LEU B 594 24.461 11.234 -8.105 1.00 0.00 H new ATOM 0 HG LEU B 594 25.574 8.427 -8.365 1.00 0.00 H new ATOM 0 HD11 LEU B 594 27.047 9.394 -10.087 1.00 0.00 H new ATOM 0 HD12 LEU B 594 25.333 9.496 -10.552 1.00 0.00 H new ATOM 0 HD13 LEU B 594 26.179 10.942 -9.953 1.00 0.00 H new ATOM 0 HD21 LEU B 594 27.704 9.482 -7.711 1.00 0.00 H new ATOM 0 HD22 LEU B 594 26.861 11.033 -7.485 1.00 0.00 H new ATOM 0 HD23 LEU B 594 26.469 9.647 -6.440 1.00 0.00 H new ATOM 1164 N HIS B 595 21.691 11.032 -6.457 1.00 0.00 N ATOM 1165 CA HIS B 595 20.855 12.114 -5.951 1.00 0.00 C ATOM 1166 C HIS B 595 20.157 11.702 -4.658 1.00 0.00 C ATOM 1167 O HIS B 595 19.802 12.547 -3.836 1.00 0.00 O ATOM 1168 CB HIS B 595 19.816 12.517 -6.998 1.00 0.00 C ATOM 1169 CG HIS B 595 19.334 13.928 -6.851 1.00 0.00 C ATOM 1170 ND1 HIS B 595 18.239 14.423 -7.527 1.00 0.00 N ATOM 1171 CD2 HIS B 595 19.803 14.950 -6.099 1.00 0.00 C ATOM 1172 CE1 HIS B 595 18.056 15.689 -7.198 1.00 0.00 C ATOM 1173 NE2 HIS B 595 18.993 16.034 -6.332 1.00 0.00 N ATOM 0 H HIS B 595 21.204 10.370 -7.061 1.00 0.00 H new ATOM 0 HA HIS B 595 21.498 12.968 -5.740 1.00 0.00 H new ATOM 0 HB2 HIS B 595 20.245 12.390 -7.992 1.00 0.00 H new ATOM 0 HB3 HIS B 595 18.963 11.841 -6.931 1.00 0.00 H new ATOM 0 HD2 HIS B 595 20.656 14.919 -5.438 1.00 0.00 H new ATOM 0 HE1 HIS B 595 17.274 16.333 -7.573 1.00 0.00 H new ATOM 0 HE2 HIS B 595 19.097 16.955 -5.906 1.00 0.00 H new ATOM 1181 N MET B 596 19.963 10.399 -4.485 1.00 0.00 N ATOM 1182 CA MET B 596 19.308 9.876 -3.292 1.00 0.00 C ATOM 1183 C MET B 596 20.201 10.037 -2.066 1.00 0.00 C ATOM 1184 O MET B 596 19.718 10.084 -0.934 1.00 0.00 O ATOM 1185 CB MET B 596 18.949 8.401 -3.486 1.00 0.00 C ATOM 1186 CG MET B 596 17.821 8.175 -4.479 1.00 0.00 C ATOM 1187 SD MET B 596 16.868 6.687 -4.122 1.00 0.00 S ATOM 1188 CE MET B 596 18.182 5.509 -3.817 1.00 0.00 C ATOM 0 H MET B 596 20.250 9.686 -5.156 1.00 0.00 H new ATOM 0 HA MET B 596 18.394 10.447 -3.131 1.00 0.00 H new ATOM 0 HB2 MET B 596 19.834 7.862 -3.825 1.00 0.00 H new ATOM 0 HB3 MET B 596 18.665 7.975 -2.524 1.00 0.00 H new ATOM 0 HG2 MET B 596 17.156 9.038 -4.470 1.00 0.00 H new ATOM 0 HG3 MET B 596 18.236 8.103 -5.484 1.00 0.00 H new ATOM 0 HE1 MET B 596 17.778 4.497 -3.846 1.00 0.00 H new ATOM 0 HE2 MET B 596 18.950 5.614 -4.583 1.00 0.00 H new ATOM 0 HE3 MET B 596 18.619 5.697 -2.836 1.00 0.00 H new ATOM 1198 N LEU B 597 21.507 10.121 -2.298 1.00 0.00 N ATOM 1199 CA LEU B 597 22.468 10.277 -1.213 1.00 0.00 C ATOM 1200 C LEU B 597 22.038 11.387 -0.259 1.00 0.00 C ATOM 1201 O LEU B 597 22.139 11.246 0.959 1.00 0.00 O ATOM 1202 CB LEU B 597 23.858 10.582 -1.775 1.00 0.00 C ATOM 1203 CG LEU B 597 24.329 9.687 -2.922 1.00 0.00 C ATOM 1204 CD1 LEU B 597 25.791 9.954 -3.242 1.00 0.00 C ATOM 1205 CD2 LEU B 597 24.117 8.220 -2.575 1.00 0.00 C ATOM 0 H LEU B 597 21.924 10.084 -3.228 1.00 0.00 H new ATOM 0 HA LEU B 597 22.505 9.340 -0.657 1.00 0.00 H new ATOM 0 HB2 LEU B 597 23.870 11.616 -2.119 1.00 0.00 H new ATOM 0 HB3 LEU B 597 24.581 10.508 -0.963 1.00 0.00 H new ATOM 0 HG LEU B 597 23.736 9.921 -3.806 1.00 0.00 H new ATOM 0 HD11 LEU B 597 26.108 9.308 -4.061 1.00 0.00 H new ATOM 0 HD12 LEU B 597 25.915 10.997 -3.534 1.00 0.00 H new ATOM 0 HD13 LEU B 597 26.400 9.749 -2.361 1.00 0.00 H new ATOM 0 HD21 LEU B 597 24.458 7.598 -3.402 1.00 0.00 H new ATOM 0 HD22 LEU B 597 24.684 7.973 -1.678 1.00 0.00 H new ATOM 0 HD23 LEU B 597 23.057 8.038 -2.396 1.00 0.00 H new ATOM 1217 N GLU B 598 21.557 12.491 -0.823 1.00 0.00 N ATOM 1218 CA GLU B 598 21.110 13.625 -0.022 1.00 0.00 C ATOM 1219 C GLU B 598 19.590 13.754 -0.063 1.00 0.00 C ATOM 1220 O GLU B 598 19.043 14.837 0.146 1.00 0.00 O ATOM 1221 CB GLU B 598 21.757 14.918 -0.523 1.00 0.00 C ATOM 1222 CG GLU B 598 21.224 15.384 -1.868 1.00 0.00 C ATOM 1223 CD GLU B 598 22.206 16.269 -2.610 1.00 0.00 C ATOM 1224 OE1 GLU B 598 23.408 15.929 -2.638 1.00 0.00 O ATOM 1225 OE2 GLU B 598 21.773 17.301 -3.163 1.00 0.00 O ATOM 0 H GLU B 598 21.467 12.624 -1.830 1.00 0.00 H new ATOM 0 HA GLU B 598 21.415 13.451 1.010 1.00 0.00 H new ATOM 0 HB2 GLU B 598 21.596 15.704 0.214 1.00 0.00 H new ATOM 0 HB3 GLU B 598 22.834 14.769 -0.600 1.00 0.00 H new ATOM 0 HG2 GLU B 598 20.988 14.515 -2.482 1.00 0.00 H new ATOM 0 HG3 GLU B 598 20.292 15.929 -1.716 1.00 0.00 H new ATOM 1232 N SER B 599 18.915 12.642 -0.334 1.00 0.00 N ATOM 1233 CA SER B 599 17.458 12.631 -0.406 1.00 0.00 C ATOM 1234 C SER B 599 16.867 11.747 0.687 1.00 0.00 C ATOM 1235 O SER B 599 16.530 10.583 0.466 1.00 0.00 O ATOM 1236 CB SER B 599 16.999 12.139 -1.780 1.00 0.00 C ATOM 1237 OG SER B 599 15.747 12.704 -2.132 1.00 0.00 O ATOM 0 H SER B 599 19.353 11.737 -0.507 1.00 0.00 H new ATOM 0 HA SER B 599 17.103 13.651 -0.255 1.00 0.00 H new ATOM 0 HB2 SER B 599 17.744 12.401 -2.531 1.00 0.00 H new ATOM 0 HB3 SER B 599 16.922 11.052 -1.773 1.00 0.00 H new ATOM 0 HG SER B 599 15.476 12.375 -3.015 1.00 0.00 H new ATOM 1243 N PRO B 600 16.736 12.310 1.897 1.00 0.00 N ATOM 1244 CA PRO B 600 16.185 11.592 3.050 1.00 0.00 C ATOM 1245 C PRO B 600 14.690 11.325 2.906 1.00 0.00 C ATOM 1246 O PRO B 600 14.099 10.608 3.711 1.00 0.00 O ATOM 1247 CB PRO B 600 16.447 12.544 4.220 1.00 0.00 C ATOM 1248 CG PRO B 600 16.521 13.896 3.598 1.00 0.00 C ATOM 1249 CD PRO B 600 17.117 13.693 2.233 1.00 0.00 C ATOM 0 HA PRO B 600 16.639 10.609 3.173 1.00 0.00 H new ATOM 0 HB2 PRO B 600 15.648 12.492 4.960 1.00 0.00 H new ATOM 0 HB3 PRO B 600 17.375 12.293 4.734 1.00 0.00 H new ATOM 0 HG2 PRO B 600 15.532 14.348 3.528 1.00 0.00 H new ATOM 0 HG3 PRO B 600 17.137 14.567 4.196 1.00 0.00 H new ATOM 0 HD2 PRO B 600 16.720 14.406 1.511 1.00 0.00 H new ATOM 0 HD3 PRO B 600 18.199 13.820 2.244 1.00 0.00 H new ATOM 1257 N GLU B 601 14.087 11.906 1.874 1.00 0.00 N ATOM 1258 CA GLU B 601 12.661 11.730 1.625 1.00 0.00 C ATOM 1259 C GLU B 601 12.416 10.578 0.655 1.00 0.00 C ATOM 1260 O GLU B 601 11.272 10.244 0.348 1.00 0.00 O ATOM 1261 CB GLU B 601 12.055 13.019 1.067 1.00 0.00 C ATOM 1262 CG GLU B 601 12.759 13.535 -0.177 1.00 0.00 C ATOM 1263 CD GLU B 601 11.814 14.230 -1.137 1.00 0.00 C ATOM 1264 OE1 GLU B 601 11.606 15.452 -0.986 1.00 0.00 O ATOM 1265 OE2 GLU B 601 11.282 13.551 -2.040 1.00 0.00 O ATOM 0 H GLU B 601 14.563 12.502 1.197 1.00 0.00 H new ATOM 0 HA GLU B 601 12.180 11.492 2.573 1.00 0.00 H new ATOM 0 HB2 GLU B 601 11.005 12.845 0.834 1.00 0.00 H new ATOM 0 HB3 GLU B 601 12.087 13.789 1.838 1.00 0.00 H new ATOM 0 HG2 GLU B 601 13.547 14.229 0.117 1.00 0.00 H new ATOM 0 HG3 GLU B 601 13.242 12.702 -0.688 1.00 0.00 H new ATOM 1272 N SER B 602 13.499 9.975 0.175 1.00 0.00 N ATOM 1273 CA SER B 602 13.403 8.864 -0.764 1.00 0.00 C ATOM 1274 C SER B 602 14.116 7.630 -0.219 1.00 0.00 C ATOM 1275 O SER B 602 13.571 6.525 -0.239 1.00 0.00 O ATOM 1276 CB SER B 602 14.003 9.257 -2.115 1.00 0.00 C ATOM 1277 OG SER B 602 13.344 10.390 -2.654 1.00 0.00 O ATOM 0 H SER B 602 14.453 10.238 0.421 1.00 0.00 H new ATOM 0 HA SER B 602 12.348 8.624 -0.899 1.00 0.00 H new ATOM 0 HB2 SER B 602 15.065 9.472 -1.996 1.00 0.00 H new ATOM 0 HB3 SER B 602 13.923 8.421 -2.810 1.00 0.00 H new ATOM 0 HG SER B 602 13.746 10.623 -3.517 1.00 0.00 H new ATOM 1283 N LEU B 603 15.336 7.825 0.268 1.00 0.00 N ATOM 1284 CA LEU B 603 16.125 6.729 0.819 1.00 0.00 C ATOM 1285 C LEU B 603 15.314 5.932 1.836 1.00 0.00 C ATOM 1286 O LEU B 603 15.307 4.701 1.812 1.00 0.00 O ATOM 1287 CB LEU B 603 17.397 7.269 1.475 1.00 0.00 C ATOM 1288 CG LEU B 603 18.289 6.234 2.161 1.00 0.00 C ATOM 1289 CD1 LEU B 603 18.651 5.116 1.196 1.00 0.00 C ATOM 1290 CD2 LEU B 603 19.546 6.894 2.711 1.00 0.00 C ATOM 0 H LEU B 603 15.801 8.733 0.293 1.00 0.00 H new ATOM 0 HA LEU B 603 16.400 6.065 -0.000 1.00 0.00 H new ATOM 0 HB2 LEU B 603 17.986 7.779 0.713 1.00 0.00 H new ATOM 0 HB3 LEU B 603 17.111 8.019 2.213 1.00 0.00 H new ATOM 0 HG LEU B 603 17.735 5.801 2.994 1.00 0.00 H new ATOM 0 HD11 LEU B 603 19.286 4.389 1.703 1.00 0.00 H new ATOM 0 HD12 LEU B 603 17.741 4.625 0.851 1.00 0.00 H new ATOM 0 HD13 LEU B 603 19.185 5.532 0.342 1.00 0.00 H new ATOM 0 HD21 LEU B 603 20.169 6.143 3.196 1.00 0.00 H new ATOM 0 HD22 LEU B 603 20.102 7.355 1.895 1.00 0.00 H new ATOM 0 HD23 LEU B 603 19.268 7.658 3.437 1.00 0.00 H new ATOM 1302 N ARG B 604 14.630 6.643 2.727 1.00 0.00 N ATOM 1303 CA ARG B 604 13.814 6.002 3.751 1.00 0.00 C ATOM 1304 C ARG B 604 12.745 5.115 3.120 1.00 0.00 C ATOM 1305 O ARG B 604 12.651 3.926 3.424 1.00 0.00 O ATOM 1306 CB ARG B 604 13.156 7.056 4.643 1.00 0.00 C ATOM 1307 CG ARG B 604 14.142 7.818 5.515 1.00 0.00 C ATOM 1308 CD ARG B 604 13.648 7.927 6.949 1.00 0.00 C ATOM 1309 NE ARG B 604 14.250 9.057 7.650 1.00 0.00 N ATOM 1310 CZ ARG B 604 13.834 9.494 8.834 1.00 0.00 C ATOM 1311 NH1 ARG B 604 12.819 8.898 9.445 1.00 0.00 N ATOM 1312 NH2 ARG B 604 14.433 10.529 9.409 1.00 0.00 N ATOM 0 H ARG B 604 14.625 7.662 2.760 1.00 0.00 H new ATOM 0 HA ARG B 604 14.467 5.376 4.360 1.00 0.00 H new ATOM 0 HB2 ARG B 604 12.616 7.765 4.015 1.00 0.00 H new ATOM 0 HB3 ARG B 604 12.419 6.570 5.282 1.00 0.00 H new ATOM 0 HG2 ARG B 604 15.108 7.314 5.499 1.00 0.00 H new ATOM 0 HG3 ARG B 604 14.296 8.816 5.105 1.00 0.00 H new ATOM 0 HD2 ARG B 604 12.563 8.035 6.952 1.00 0.00 H new ATOM 0 HD3 ARG B 604 13.878 7.005 7.483 1.00 0.00 H new ATOM 0 HE ARG B 604 15.033 9.538 7.207 1.00 0.00 H new ATOM 0 HH11 ARG B 604 12.356 8.102 9.006 1.00 0.00 H new ATOM 0 HH12 ARG B 604 12.502 9.235 10.354 1.00 0.00 H new ATOM 0 HH21 ARG B 604 15.214 10.990 8.942 1.00 0.00 H new ATOM 0 HH22 ARG B 604 14.113 10.863 10.318 1.00 0.00 H new ATOM 1326 N SER B 605 11.941 5.703 2.239 1.00 0.00 N ATOM 1327 CA SER B 605 10.875 4.968 1.568 1.00 0.00 C ATOM 1328 C SER B 605 11.402 3.662 0.980 1.00 0.00 C ATOM 1329 O SER B 605 10.783 2.608 1.123 1.00 0.00 O ATOM 1330 CB SER B 605 10.255 5.824 0.462 1.00 0.00 C ATOM 1331 OG SER B 605 9.560 5.021 -0.476 1.00 0.00 O ATOM 0 H SER B 605 12.008 6.686 1.974 1.00 0.00 H new ATOM 0 HA SER B 605 10.110 4.731 2.307 1.00 0.00 H new ATOM 0 HB2 SER B 605 9.571 6.551 0.901 1.00 0.00 H new ATOM 0 HB3 SER B 605 11.037 6.388 -0.046 1.00 0.00 H new ATOM 0 HG SER B 605 9.172 5.592 -1.171 1.00 0.00 H new ATOM 1337 N LYS B 606 12.552 3.741 0.318 1.00 0.00 N ATOM 1338 CA LYS B 606 13.165 2.567 -0.292 1.00 0.00 C ATOM 1339 C LYS B 606 13.483 1.510 0.762 1.00 0.00 C ATOM 1340 O LYS B 606 13.069 0.357 0.643 1.00 0.00 O ATOM 1341 CB LYS B 606 14.444 2.962 -1.034 1.00 0.00 C ATOM 1342 CG LYS B 606 14.187 3.663 -2.357 1.00 0.00 C ATOM 1343 CD LYS B 606 13.577 2.719 -3.379 1.00 0.00 C ATOM 1344 CE LYS B 606 12.517 3.415 -4.219 1.00 0.00 C ATOM 1345 NZ LYS B 606 13.108 4.450 -5.111 1.00 0.00 N ATOM 0 H LYS B 606 13.078 4.606 0.190 1.00 0.00 H new ATOM 0 HA LYS B 606 12.455 2.145 -1.003 1.00 0.00 H new ATOM 0 HB2 LYS B 606 15.038 3.616 -0.395 1.00 0.00 H new ATOM 0 HB3 LYS B 606 15.040 2.067 -1.216 1.00 0.00 H new ATOM 0 HG2 LYS B 606 13.519 4.509 -2.198 1.00 0.00 H new ATOM 0 HG3 LYS B 606 15.123 4.065 -2.745 1.00 0.00 H new ATOM 0 HD2 LYS B 606 14.360 2.330 -4.029 1.00 0.00 H new ATOM 0 HD3 LYS B 606 13.134 1.865 -2.867 1.00 0.00 H new ATOM 0 HE2 LYS B 606 11.988 2.676 -4.821 1.00 0.00 H new ATOM 0 HE3 LYS B 606 11.780 3.879 -3.563 1.00 0.00 H new ATOM 0 HZ1 LYS B 606 12.354 4.901 -5.667 1.00 0.00 H new ATOM 0 HZ2 LYS B 606 13.592 5.169 -4.536 1.00 0.00 H new ATOM 0 HZ3 LYS B 606 13.792 4.004 -5.755 1.00 0.00 H new ATOM 1359 N VAL B 607 14.219 1.912 1.793 1.00 0.00 N ATOM 1360 CA VAL B 607 14.590 1.000 2.869 1.00 0.00 C ATOM 1361 C VAL B 607 13.367 0.277 3.422 1.00 0.00 C ATOM 1362 O VAL B 607 13.370 -0.945 3.571 1.00 0.00 O ATOM 1363 CB VAL B 607 15.296 1.744 4.017 1.00 0.00 C ATOM 1364 CG1 VAL B 607 15.797 0.760 5.063 1.00 0.00 C ATOM 1365 CG2 VAL B 607 16.440 2.591 3.479 1.00 0.00 C ATOM 0 H VAL B 607 14.570 2.863 1.906 1.00 0.00 H new ATOM 0 HA VAL B 607 15.278 0.270 2.442 1.00 0.00 H new ATOM 0 HB VAL B 607 14.575 2.408 4.494 1.00 0.00 H new ATOM 0 HG11 VAL B 607 16.293 1.304 5.866 1.00 0.00 H new ATOM 0 HG12 VAL B 607 14.954 0.201 5.470 1.00 0.00 H new ATOM 0 HG13 VAL B 607 16.503 0.068 4.603 1.00 0.00 H new ATOM 0 HG21 VAL B 607 16.928 3.110 4.304 1.00 0.00 H new ATOM 0 HG22 VAL B 607 17.163 1.949 2.976 1.00 0.00 H new ATOM 0 HG23 VAL B 607 16.050 3.322 2.771 1.00 0.00 H new ATOM 1375 N ASP B 608 12.323 1.040 3.725 1.00 0.00 N ATOM 1376 CA ASP B 608 11.091 0.473 4.262 1.00 0.00 C ATOM 1377 C ASP B 608 10.445 -0.474 3.254 1.00 0.00 C ATOM 1378 O ASP B 608 9.947 -1.537 3.620 1.00 0.00 O ATOM 1379 CB ASP B 608 10.112 1.587 4.635 1.00 0.00 C ATOM 1380 CG ASP B 608 9.080 1.134 5.649 1.00 0.00 C ATOM 1381 OD1 ASP B 608 9.285 0.070 6.269 1.00 0.00 O ATOM 1382 OD2 ASP B 608 8.067 1.844 5.823 1.00 0.00 O ATOM 0 H ASP B 608 12.305 2.053 3.608 1.00 0.00 H new ATOM 0 HA ASP B 608 11.341 -0.095 5.158 1.00 0.00 H new ATOM 0 HB2 ASP B 608 10.667 2.434 5.039 1.00 0.00 H new ATOM 0 HB3 ASP B 608 9.605 1.937 3.736 1.00 0.00 H new ATOM 1387 N GLU B 609 10.458 -0.077 1.986 1.00 0.00 N ATOM 1388 CA GLU B 609 9.871 -0.890 0.927 1.00 0.00 C ATOM 1389 C GLU B 609 10.481 -2.289 0.914 1.00 0.00 C ATOM 1390 O GLU B 609 9.768 -3.287 0.807 1.00 0.00 O ATOM 1391 CB GLU B 609 10.076 -0.220 -0.434 1.00 0.00 C ATOM 1392 CG GLU B 609 9.108 0.920 -0.703 1.00 0.00 C ATOM 1393 CD GLU B 609 7.861 0.466 -1.436 1.00 0.00 C ATOM 1394 OE1 GLU B 609 6.882 0.084 -0.760 1.00 0.00 O ATOM 1395 OE2 GLU B 609 7.863 0.492 -2.684 1.00 0.00 O ATOM 0 H GLU B 609 10.868 0.801 1.667 1.00 0.00 H new ATOM 0 HA GLU B 609 8.802 -0.980 1.123 1.00 0.00 H new ATOM 0 HB2 GLU B 609 11.096 0.159 -0.493 1.00 0.00 H new ATOM 0 HB3 GLU B 609 9.969 -0.969 -1.218 1.00 0.00 H new ATOM 0 HG2 GLU B 609 8.822 1.379 0.243 1.00 0.00 H new ATOM 0 HG3 GLU B 609 9.611 1.688 -1.291 1.00 0.00 H new ATOM 1402 N ALA B 610 11.804 -2.353 1.022 1.00 0.00 N ATOM 1403 CA ALA B 610 12.509 -3.628 1.024 1.00 0.00 C ATOM 1404 C ALA B 610 12.205 -4.422 2.290 1.00 0.00 C ATOM 1405 O ALA B 610 11.719 -5.551 2.225 1.00 0.00 O ATOM 1406 CB ALA B 610 14.008 -3.402 0.888 1.00 0.00 C ATOM 0 H ALA B 610 12.409 -1.536 1.109 1.00 0.00 H new ATOM 0 HA ALA B 610 12.161 -4.209 0.170 1.00 0.00 H new ATOM 0 HB1 ALA B 610 14.523 -4.363 0.891 1.00 0.00 H new ATOM 0 HB2 ALA B 610 14.214 -2.883 -0.048 1.00 0.00 H new ATOM 0 HB3 ALA B 610 14.362 -2.798 1.724 1.00 0.00 H new ATOM 1412 N VAL B 611 12.494 -3.825 3.442 1.00 0.00 N ATOM 1413 CA VAL B 611 12.251 -4.476 4.723 1.00 0.00 C ATOM 1414 C VAL B 611 10.822 -5.003 4.809 1.00 0.00 C ATOM 1415 O VAL B 611 10.574 -6.062 5.383 1.00 0.00 O ATOM 1416 CB VAL B 611 12.503 -3.514 5.899 1.00 0.00 C ATOM 1417 CG1 VAL B 611 12.233 -4.208 7.225 1.00 0.00 C ATOM 1418 CG2 VAL B 611 13.924 -2.974 5.850 1.00 0.00 C ATOM 0 H VAL B 611 12.897 -2.891 3.514 1.00 0.00 H new ATOM 0 HA VAL B 611 12.948 -5.311 4.791 1.00 0.00 H new ATOM 0 HB VAL B 611 11.816 -2.673 5.811 1.00 0.00 H new ATOM 0 HG11 VAL B 611 12.417 -3.512 8.044 1.00 0.00 H new ATOM 0 HG12 VAL B 611 11.195 -4.540 7.257 1.00 0.00 H new ATOM 0 HG13 VAL B 611 12.893 -5.069 7.326 1.00 0.00 H new ATOM 0 HG21 VAL B 611 14.085 -2.296 6.688 1.00 0.00 H new ATOM 0 HG22 VAL B 611 14.630 -3.802 5.912 1.00 0.00 H new ATOM 0 HG23 VAL B 611 14.077 -2.437 4.914 1.00 0.00 H new ATOM 1428 N ALA B 612 9.886 -4.255 4.234 1.00 0.00 N ATOM 1429 CA ALA B 612 8.483 -4.648 4.243 1.00 0.00 C ATOM 1430 C ALA B 612 8.218 -5.763 3.237 1.00 0.00 C ATOM 1431 O ALA B 612 7.357 -6.616 3.453 1.00 0.00 O ATOM 1432 CB ALA B 612 7.597 -3.447 3.948 1.00 0.00 C ATOM 0 H ALA B 612 10.074 -3.374 3.756 1.00 0.00 H new ATOM 0 HA ALA B 612 8.244 -5.027 5.237 1.00 0.00 H new ATOM 0 HB1 ALA B 612 6.551 -3.755 3.958 1.00 0.00 H new ATOM 0 HB2 ALA B 612 7.757 -2.682 4.707 1.00 0.00 H new ATOM 0 HB3 ALA B 612 7.847 -3.043 2.967 1.00 0.00 H new ATOM 1438 N VAL B 613 8.962 -5.749 2.136 1.00 0.00 N ATOM 1439 CA VAL B 613 8.808 -6.760 1.096 1.00 0.00 C ATOM 1440 C VAL B 613 9.019 -8.162 1.657 1.00 0.00 C ATOM 1441 O VAL B 613 8.504 -9.142 1.117 1.00 0.00 O ATOM 1442 CB VAL B 613 9.796 -6.528 -0.063 1.00 0.00 C ATOM 1443 CG1 VAL B 613 10.993 -7.457 0.062 1.00 0.00 C ATOM 1444 CG2 VAL B 613 9.100 -6.719 -1.402 1.00 0.00 C ATOM 0 H VAL B 613 9.678 -5.049 1.941 1.00 0.00 H new ATOM 0 HA VAL B 613 7.789 -6.673 0.718 1.00 0.00 H new ATOM 0 HB VAL B 613 10.157 -5.501 -0.010 1.00 0.00 H new ATOM 0 HG11 VAL B 613 11.680 -7.279 -0.765 1.00 0.00 H new ATOM 0 HG12 VAL B 613 11.504 -7.267 1.006 1.00 0.00 H new ATOM 0 HG13 VAL B 613 10.654 -8.493 0.035 1.00 0.00 H new ATOM 0 HG21 VAL B 613 9.813 -6.551 -2.210 1.00 0.00 H new ATOM 0 HG22 VAL B 613 8.710 -7.735 -1.468 1.00 0.00 H new ATOM 0 HG23 VAL B 613 8.278 -6.008 -1.490 1.00 0.00 H new ATOM 1454 N LEU B 614 9.779 -8.250 2.743 1.00 0.00 N ATOM 1455 CA LEU B 614 10.058 -9.533 3.379 1.00 0.00 C ATOM 1456 C LEU B 614 8.843 -10.032 4.154 1.00 0.00 C ATOM 1457 O LEU B 614 8.385 -11.156 3.951 1.00 0.00 O ATOM 1458 CB LEU B 614 11.260 -9.409 4.316 1.00 0.00 C ATOM 1459 CG LEU B 614 11.548 -10.620 5.204 1.00 0.00 C ATOM 1460 CD1 LEU B 614 10.721 -10.556 6.479 1.00 0.00 C ATOM 1461 CD2 LEU B 614 11.268 -11.912 4.449 1.00 0.00 C ATOM 0 H LEU B 614 10.213 -7.449 3.201 1.00 0.00 H new ATOM 0 HA LEU B 614 10.288 -10.256 2.597 1.00 0.00 H new ATOM 0 HB2 LEU B 614 12.145 -9.207 3.713 1.00 0.00 H new ATOM 0 HB3 LEU B 614 11.107 -8.541 4.958 1.00 0.00 H new ATOM 0 HG LEU B 614 12.603 -10.603 5.479 1.00 0.00 H new ATOM 0 HD11 LEU B 614 10.939 -11.426 7.098 1.00 0.00 H new ATOM 0 HD12 LEU B 614 10.969 -9.648 7.028 1.00 0.00 H new ATOM 0 HD13 LEU B 614 9.661 -10.548 6.225 1.00 0.00 H new ATOM 0 HD21 LEU B 614 11.478 -12.764 5.095 1.00 0.00 H new ATOM 0 HD22 LEU B 614 10.221 -11.936 4.145 1.00 0.00 H new ATOM 0 HD23 LEU B 614 11.904 -11.962 3.565 1.00 0.00 H new ATOM 1473 N GLN B 615 8.326 -9.188 5.041 1.00 0.00 N ATOM 1474 CA GLN B 615 7.163 -9.545 5.846 1.00 0.00 C ATOM 1475 C GLN B 615 6.030 -10.061 4.966 1.00 0.00 C ATOM 1476 O GLN B 615 5.234 -10.899 5.390 1.00 0.00 O ATOM 1477 CB GLN B 615 6.687 -8.337 6.655 1.00 0.00 C ATOM 1478 CG GLN B 615 7.795 -7.657 7.443 1.00 0.00 C ATOM 1479 CD GLN B 615 7.306 -7.075 8.754 1.00 0.00 C ATOM 1480 OE1 GLN B 615 6.296 -7.515 9.304 1.00 0.00 O ATOM 1481 NE2 GLN B 615 8.022 -6.079 9.264 1.00 0.00 N ATOM 0 H GLN B 615 8.693 -8.253 5.221 1.00 0.00 H new ATOM 0 HA GLN B 615 7.457 -10.340 6.532 1.00 0.00 H new ATOM 0 HB2 GLN B 615 6.236 -7.611 5.978 1.00 0.00 H new ATOM 0 HB3 GLN B 615 5.906 -8.657 7.345 1.00 0.00 H new ATOM 0 HG2 GLN B 615 8.588 -8.377 7.643 1.00 0.00 H new ATOM 0 HG3 GLN B 615 8.231 -6.863 6.838 1.00 0.00 H new ATOM 0 HE21 GLN B 615 8.853 -5.745 8.775 1.00 0.00 H new ATOM 0 HE22 GLN B 615 7.741 -5.648 10.145 1.00 0.00 H new ATOM 1490 N ALA B 616 5.963 -9.555 3.739 1.00 0.00 N ATOM 1491 CA ALA B 616 4.928 -9.966 2.799 1.00 0.00 C ATOM 1492 C ALA B 616 5.084 -11.435 2.418 1.00 0.00 C ATOM 1493 O ALA B 616 4.097 -12.152 2.253 1.00 0.00 O ATOM 1494 CB ALA B 616 4.965 -9.090 1.556 1.00 0.00 C ATOM 0 H ALA B 616 6.613 -8.860 3.373 1.00 0.00 H new ATOM 0 HA ALA B 616 3.961 -9.845 3.287 1.00 0.00 H new ATOM 0 HB1 ALA B 616 4.186 -9.409 0.863 1.00 0.00 H new ATOM 0 HB2 ALA B 616 4.796 -8.051 1.838 1.00 0.00 H new ATOM 0 HB3 ALA B 616 5.939 -9.182 1.075 1.00 0.00 H new ATOM 1500 N HIS B 617 6.330 -11.876 2.279 1.00 0.00 N ATOM 1501 CA HIS B 617 6.616 -13.259 1.917 1.00 0.00 C ATOM 1502 C HIS B 617 6.321 -14.198 3.083 1.00 0.00 C ATOM 1503 O HIS B 617 5.425 -15.037 3.004 1.00 0.00 O ATOM 1504 CB HIS B 617 8.076 -13.405 1.486 1.00 0.00 C ATOM 1505 CG HIS B 617 8.334 -14.619 0.648 1.00 0.00 C ATOM 1506 ND1 HIS B 617 8.774 -14.553 -0.658 1.00 0.00 N ATOM 1507 CD2 HIS B 617 8.214 -15.936 0.936 1.00 0.00 C ATOM 1508 CE1 HIS B 617 8.911 -15.777 -1.136 1.00 0.00 C ATOM 1509 NE2 HIS B 617 8.579 -16.635 -0.189 1.00 0.00 N ATOM 0 H HIS B 617 7.158 -11.295 2.412 1.00 0.00 H new ATOM 0 HA HIS B 617 5.970 -13.531 1.082 1.00 0.00 H new ATOM 0 HB2 HIS B 617 8.372 -12.518 0.926 1.00 0.00 H new ATOM 0 HB3 HIS B 617 8.706 -13.446 2.374 1.00 0.00 H new ATOM 0 HD2 HIS B 617 7.891 -16.359 1.876 1.00 0.00 H new ATOM 0 HE1 HIS B 617 9.239 -16.033 -2.133 1.00 0.00 H new ATOM 0 HE2 HIS B 617 8.591 -17.651 -0.278 1.00 0.00 H new ATOM 1517 N GLN B 618 7.082 -14.049 4.163 1.00 0.00 N ATOM 1518 CA GLN B 618 6.903 -14.885 5.344 1.00 0.00 C ATOM 1519 C GLN B 618 7.640 -14.298 6.543 1.00 0.00 C ATOM 1520 O GLN B 618 8.515 -13.446 6.390 1.00 0.00 O ATOM 1521 CB GLN B 618 7.401 -16.305 5.070 1.00 0.00 C ATOM 1522 CG GLN B 618 8.911 -16.404 4.929 1.00 0.00 C ATOM 1523 CD GLN B 618 9.384 -17.826 4.698 1.00 0.00 C ATOM 1524 OE1 GLN B 618 8.579 -18.752 4.600 1.00 0.00 O ATOM 1525 NE2 GLN B 618 10.697 -18.006 4.607 1.00 0.00 N ATOM 0 H GLN B 618 7.828 -13.358 4.244 1.00 0.00 H new ATOM 0 HA GLN B 618 5.838 -14.919 5.576 1.00 0.00 H new ATOM 0 HB2 GLN B 618 7.077 -16.957 5.881 1.00 0.00 H new ATOM 0 HB3 GLN B 618 6.934 -16.675 4.157 1.00 0.00 H new ATOM 0 HG2 GLN B 618 9.236 -15.778 4.098 1.00 0.00 H new ATOM 0 HG3 GLN B 618 9.383 -16.010 5.829 1.00 0.00 H new ATOM 0 HE21 GLN B 618 11.328 -17.210 4.694 1.00 0.00 H new ATOM 0 HE22 GLN B 618 11.074 -18.941 4.450 1.00 0.00 H new ATOM 1534 N ALA B 619 7.280 -14.759 7.736 1.00 0.00 N ATOM 1535 CA ALA B 619 7.907 -14.280 8.962 1.00 0.00 C ATOM 1536 C ALA B 619 7.758 -15.297 10.088 1.00 0.00 C ATOM 1537 O ALA B 619 6.716 -15.937 10.227 1.00 0.00 O ATOM 1538 CB ALA B 619 7.311 -12.942 9.373 1.00 0.00 C ATOM 0 H ALA B 619 6.557 -15.464 7.880 1.00 0.00 H new ATOM 0 HA ALA B 619 8.971 -14.146 8.768 1.00 0.00 H new ATOM 0 HB1 ALA B 619 7.789 -12.597 10.290 1.00 0.00 H new ATOM 0 HB2 ALA B 619 7.476 -12.212 8.581 1.00 0.00 H new ATOM 0 HB3 ALA B 619 6.241 -13.057 9.543 1.00 0.00 H new ATOM 1544 N LYS B 620 8.806 -15.440 10.892 1.00 0.00 N ATOM 1545 CA LYS B 620 8.793 -16.379 12.008 1.00 0.00 C ATOM 1546 C LYS B 620 9.344 -15.729 13.273 1.00 0.00 C ATOM 1547 O LYS B 620 10.079 -14.744 13.205 1.00 0.00 O ATOM 1548 CB LYS B 620 9.612 -17.625 11.663 1.00 0.00 C ATOM 1549 CG LYS B 620 8.924 -18.551 10.675 1.00 0.00 C ATOM 1550 CD LYS B 620 7.819 -19.355 11.339 1.00 0.00 C ATOM 1551 CE LYS B 620 7.382 -20.525 10.471 1.00 0.00 C ATOM 1552 NZ LYS B 620 8.447 -21.560 10.359 1.00 0.00 N ATOM 0 H LYS B 620 9.676 -14.917 10.792 1.00 0.00 H new ATOM 0 HA LYS B 620 7.759 -16.671 12.192 1.00 0.00 H new ATOM 0 HB2 LYS B 620 10.572 -17.316 11.250 1.00 0.00 H new ATOM 0 HB3 LYS B 620 9.822 -18.177 12.579 1.00 0.00 H new ATOM 0 HG2 LYS B 620 8.507 -17.965 9.856 1.00 0.00 H new ATOM 0 HG3 LYS B 620 9.658 -19.230 10.240 1.00 0.00 H new ATOM 0 HD2 LYS B 620 8.167 -19.726 12.303 1.00 0.00 H new ATOM 0 HD3 LYS B 620 6.965 -18.708 11.536 1.00 0.00 H new ATOM 0 HE2 LYS B 620 6.482 -20.974 10.892 1.00 0.00 H new ATOM 0 HE3 LYS B 620 7.122 -20.162 9.477 1.00 0.00 H new ATOM 0 HZ1 LYS B 620 8.024 -22.463 10.065 1.00 0.00 H new ATOM 0 HZ2 LYS B 620 9.149 -21.261 9.653 1.00 0.00 H new ATOM 0 HZ3 LYS B 620 8.913 -21.680 11.281 1.00 0.00 H new ATOM 1566 N GLU B 621 8.986 -16.287 14.425 1.00 0.00 N ATOM 1567 CA GLU B 621 9.446 -15.760 15.704 1.00 0.00 C ATOM 1568 C GLU B 621 10.674 -16.522 16.195 1.00 0.00 C ATOM 1569 O GLU B 621 10.555 -17.566 16.836 1.00 0.00 O ATOM 1570 CB GLU B 621 8.330 -15.844 16.747 1.00 0.00 C ATOM 1571 CG GLU B 621 8.578 -14.985 17.975 1.00 0.00 C ATOM 1572 CD GLU B 621 7.532 -15.191 19.053 1.00 0.00 C ATOM 1573 OE1 GLU B 621 6.391 -14.717 18.869 1.00 0.00 O ATOM 1574 OE2 GLU B 621 7.853 -15.825 20.079 1.00 0.00 O ATOM 0 H GLU B 621 8.379 -17.104 14.499 1.00 0.00 H new ATOM 0 HA GLU B 621 9.720 -14.715 15.560 1.00 0.00 H new ATOM 0 HB2 GLU B 621 7.390 -15.541 16.286 1.00 0.00 H new ATOM 0 HB3 GLU B 621 8.212 -16.882 17.058 1.00 0.00 H new ATOM 0 HG2 GLU B 621 9.563 -15.215 18.381 1.00 0.00 H new ATOM 0 HG3 GLU B 621 8.591 -13.935 17.683 1.00 0.00 H new ATOM 1581 N ALA B 622 11.854 -15.990 15.890 1.00 0.00 N ATOM 1582 CA ALA B 622 13.103 -16.618 16.301 1.00 0.00 C ATOM 1583 C ALA B 622 13.762 -15.838 17.434 1.00 0.00 C ATOM 1584 O ALA B 622 14.753 -15.140 17.225 1.00 0.00 O ATOM 1585 CB ALA B 622 14.051 -16.733 15.116 1.00 0.00 C ATOM 0 H ALA B 622 11.970 -15.126 15.360 1.00 0.00 H new ATOM 0 HA ALA B 622 12.875 -17.619 16.668 1.00 0.00 H new ATOM 0 HB1 ALA B 622 14.980 -17.204 15.438 1.00 0.00 H new ATOM 0 HB2 ALA B 622 13.588 -17.339 14.337 1.00 0.00 H new ATOM 0 HB3 ALA B 622 14.265 -15.739 14.724 1.00 0.00 H new ATOM 1591 N ALA B 623 13.205 -15.963 18.634 1.00 0.00 N ATOM 1592 CA ALA B 623 13.739 -15.271 19.800 1.00 0.00 C ATOM 1593 C ALA B 623 15.193 -15.658 20.049 1.00 0.00 C ATOM 1594 O ALA B 623 15.689 -15.553 21.172 1.00 0.00 O ATOM 1595 CB ALA B 623 12.892 -15.573 21.027 1.00 0.00 C ATOM 0 H ALA B 623 12.384 -16.537 18.824 1.00 0.00 H new ATOM 0 HA ALA B 623 13.704 -14.199 19.604 1.00 0.00 H new ATOM 0 HB1 ALA B 623 13.303 -15.050 21.890 1.00 0.00 H new ATOM 0 HB2 ALA B 623 11.869 -15.240 20.854 1.00 0.00 H new ATOM 0 HB3 ALA B 623 12.897 -16.646 21.217 1.00 0.00 H new TER 1601 ALA B 623