USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 679 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 45 LYS NZ :NH3+ 179:sc= 1.7 (180deg=1.66) USER MOD Set 1.2: A 59 MET CE :methyl -156:sc= -0.605 (180deg=-1.79!) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -161:sc= 2.11 (180deg=1.81) USER MOD Single : A 25 LYS NZ :NH3+ 167:sc= 1.3 (180deg=1.09) USER MOD Single : A 29 GLN : amide:sc= 0.0145 X(o=0.014,f=-0.041) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -90:sc= 1.29 USER MOD Single : A 35 HIS : no HD1:sc= 0.781 K(o=0.78,f=-4.4!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 175:sc= 0 (180deg=-0.0247) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.212 X(o=-0.21,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 171:sc= 1.26 (180deg=1.18) USER MOD Single : A 48 LYS NZ :NH3+ 167:sc= 2.4 (180deg=2.24) USER MOD Single : A 50 SER OG : rot 101:sc= 1.24 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 CYS SG : rot 80:sc= 0.053 USER MOD Single : A 53 GLN : amide:sc= -0.546 K(o=-0.55,f=-2.7!) USER MOD Single : A 55 GLN : amide:sc= -0.39 X(o=-0.39,f=-0.58) USER MOD Single : A 60 ASN : amide:sc= 0 K(o=0,f=-2.1) USER MOD Single : A 61 SER OG : rot -111:sc= 1.31 USER MOD Single : A 69 GLN : amide:sc= -0.345 K(o=-0.34,f=-4.3!) USER MOD Single : A 74 ASN : amide:sc=-0.00419 X(o=-0.0042,f=-0.11) USER MOD Single : A 75 HIS : no HD1:sc= 0.773 K(o=0.77,f=-6.3!) USER MOD Single : A 76 THR OG1 : rot 36:sc= 0.541 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot -170:sc= 1.26 USER MOD Single : A 92 GLN : amide:sc= 0.409 X(o=0.41,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0623 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 14.123 -4.996 -1.342 1.00 10.00 N ATOM 2 CA TYR A 21 12.838 -4.260 -1.296 1.00 10.00 C ATOM 3 C TYR A 21 12.027 -4.705 -0.091 1.00 10.00 C ATOM 4 O TYR A 21 12.369 -5.689 0.563 1.00 10.00 O ATOM 5 CB TYR A 21 12.029 -4.507 -2.573 1.00 10.00 C ATOM 6 CG TYR A 21 12.590 -3.832 -3.805 1.00 10.00 C ATOM 7 CD1 TYR A 21 12.335 -2.492 -4.061 1.00 10.00 C ATOM 8 CD2 TYR A 21 13.370 -4.536 -4.712 1.00 10.00 C ATOM 9 CE1 TYR A 21 12.841 -1.872 -5.186 1.00 10.00 C ATOM 10 CE2 TYR A 21 13.881 -3.923 -5.839 1.00 10.00 C ATOM 11 CZ TYR A 21 13.615 -2.592 -6.071 1.00 10.00 C ATOM 12 OH TYR A 21 14.115 -1.979 -7.197 1.00 10.00 O ATOM 0 HA TYR A 21 13.056 -3.195 -1.216 1.00 10.00 H new ATOM 0 HB2 TYR A 21 11.976 -5.581 -2.754 1.00 10.00 H new ATOM 0 HB3 TYR A 21 11.008 -4.159 -2.415 1.00 10.00 H new ATOM 0 HD1 TYR A 21 11.731 -1.925 -3.369 1.00 10.00 H new ATOM 0 HD2 TYR A 21 13.581 -5.580 -4.533 1.00 10.00 H new ATOM 0 HE1 TYR A 21 12.632 -0.829 -5.372 1.00 10.00 H new ATOM 0 HE2 TYR A 21 14.486 -4.485 -6.535 1.00 10.00 H new ATOM 0 HH TYR A 21 14.640 -2.624 -7.715 1.00 10.00 H new ATOM 22 N ILE A 22 10.956 -3.981 0.198 1.00 10.00 N ATOM 23 CA ILE A 22 10.092 -4.313 1.321 1.00 10.00 C ATOM 24 C ILE A 22 8.752 -4.824 0.806 1.00 10.00 C ATOM 25 O ILE A 22 8.089 -4.159 0.011 1.00 10.00 O ATOM 26 CB ILE A 22 9.858 -3.096 2.246 1.00 10.00 C ATOM 27 CG1 ILE A 22 11.190 -2.563 2.788 1.00 10.00 C ATOM 28 CG2 ILE A 22 8.923 -3.457 3.394 1.00 10.00 C ATOM 29 CD1 ILE A 22 11.941 -3.553 3.656 1.00 10.00 C ATOM 0 H ILE A 22 10.664 -3.159 -0.330 1.00 10.00 H new ATOM 0 HA ILE A 22 10.590 -5.088 1.904 1.00 10.00 H new ATOM 0 HB ILE A 22 9.386 -2.311 1.655 1.00 10.00 H new ATOM 0 HG12 ILE A 22 11.824 -2.277 1.949 1.00 10.00 H new ATOM 0 HG13 ILE A 22 11.000 -1.659 3.366 1.00 10.00 H new ATOM 0 HG21 ILE A 22 8.774 -2.585 4.030 1.00 10.00 H new ATOM 0 HG22 ILE A 22 7.963 -3.782 2.993 1.00 10.00 H new ATOM 0 HG23 ILE A 22 9.362 -4.264 3.981 1.00 10.00 H new ATOM 0 HD11 ILE A 22 12.872 -3.102 4.000 1.00 10.00 H new ATOM 0 HD12 ILE A 22 11.328 -3.821 4.516 1.00 10.00 H new ATOM 0 HD13 ILE A 22 12.165 -4.449 3.076 1.00 10.00 H new ATOM 41 N LYS A 23 8.368 -6.015 1.238 1.00 10.00 N ATOM 42 CA LYS A 23 7.113 -6.607 0.809 1.00 10.00 C ATOM 43 C LYS A 23 6.028 -6.414 1.865 1.00 10.00 C ATOM 44 O LYS A 23 6.080 -7.010 2.945 1.00 10.00 O ATOM 45 CB LYS A 23 7.309 -8.095 0.525 1.00 10.00 C ATOM 46 CG LYS A 23 6.177 -8.726 -0.264 1.00 10.00 C ATOM 47 CD LYS A 23 6.257 -10.243 -0.226 1.00 10.00 C ATOM 48 CE LYS A 23 5.745 -10.796 1.095 1.00 10.00 C ATOM 49 NZ LYS A 23 6.849 -11.220 1.994 1.00 10.00 N ATOM 0 H LYS A 23 8.908 -6.590 1.885 1.00 10.00 H new ATOM 0 HA LYS A 23 6.792 -6.106 -0.104 1.00 10.00 H new ATOM 0 HB2 LYS A 23 8.241 -8.230 -0.024 1.00 10.00 H new ATOM 0 HB3 LYS A 23 7.418 -8.624 1.472 1.00 10.00 H new ATOM 0 HG2 LYS A 23 5.220 -8.400 0.144 1.00 10.00 H new ATOM 0 HG3 LYS A 23 6.216 -8.383 -1.298 1.00 10.00 H new ATOM 0 HD2 LYS A 23 5.673 -10.660 -1.047 1.00 10.00 H new ATOM 0 HD3 LYS A 23 7.290 -10.558 -0.377 1.00 10.00 H new ATOM 0 HE2 LYS A 23 5.143 -10.037 1.595 1.00 10.00 H new ATOM 0 HE3 LYS A 23 5.090 -11.646 0.901 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 6.478 -11.868 2.718 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 7.582 -11.705 1.438 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 7.261 -10.384 2.456 1.00 10.00 H new ATOM 63 N LEU A 24 5.055 -5.574 1.549 1.00 10.00 N ATOM 64 CA LEU A 24 3.948 -5.300 2.454 1.00 10.00 C ATOM 65 C LEU A 24 2.736 -6.133 2.061 1.00 10.00 C ATOM 66 O LEU A 24 2.364 -6.182 0.889 1.00 10.00 O ATOM 67 CB LEU A 24 3.588 -3.811 2.425 1.00 10.00 C ATOM 68 CG LEU A 24 4.714 -2.853 2.822 1.00 10.00 C ATOM 69 CD1 LEU A 24 4.292 -1.411 2.579 1.00 10.00 C ATOM 70 CD2 LEU A 24 5.116 -3.063 4.277 1.00 10.00 C ATOM 0 H LEU A 24 5.009 -5.066 0.666 1.00 10.00 H new ATOM 0 HA LEU A 24 4.253 -5.566 3.466 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.255 -3.555 1.419 1.00 10.00 H new ATOM 0 HB3 LEU A 24 2.742 -3.646 3.093 1.00 10.00 H new ATOM 0 HG LEU A 24 5.583 -3.066 2.200 1.00 10.00 H new ATOM 0 HD11 LEU A 24 5.103 -0.741 2.866 1.00 10.00 H new ATOM 0 HD12 LEU A 24 4.063 -1.272 1.522 1.00 10.00 H new ATOM 0 HD13 LEU A 24 3.407 -1.186 3.174 1.00 10.00 H new ATOM 0 HD21 LEU A 24 5.918 -2.371 4.536 1.00 10.00 H new ATOM 0 HD22 LEU A 24 4.256 -2.881 4.922 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.462 -4.087 4.415 1.00 10.00 H new ATOM 82 N LYS A 25 2.133 -6.789 3.038 1.00 10.00 N ATOM 83 CA LYS A 25 0.969 -7.622 2.787 1.00 10.00 C ATOM 84 C LYS A 25 -0.311 -6.803 2.927 1.00 10.00 C ATOM 85 O LYS A 25 -0.728 -6.466 4.039 1.00 10.00 O ATOM 86 CB LYS A 25 0.963 -8.814 3.745 1.00 10.00 C ATOM 87 CG LYS A 25 2.256 -9.616 3.705 1.00 10.00 C ATOM 88 CD LYS A 25 2.451 -10.438 4.966 1.00 10.00 C ATOM 89 CE LYS A 25 1.886 -11.838 4.819 1.00 10.00 C ATOM 90 NZ LYS A 25 2.327 -12.727 5.924 1.00 10.00 N ATOM 0 H LYS A 25 2.430 -6.761 4.013 1.00 10.00 H new ATOM 0 HA LYS A 25 1.017 -8.001 1.766 1.00 10.00 H new ATOM 0 HB2 LYS A 25 0.795 -8.456 4.761 1.00 10.00 H new ATOM 0 HB3 LYS A 25 0.128 -9.469 3.496 1.00 10.00 H new ATOM 0 HG2 LYS A 25 2.247 -10.277 2.838 1.00 10.00 H new ATOM 0 HG3 LYS A 25 3.100 -8.938 3.579 1.00 10.00 H new ATOM 0 HD2 LYS A 25 3.514 -10.498 5.200 1.00 10.00 H new ATOM 0 HD3 LYS A 25 1.968 -9.937 5.805 1.00 10.00 H new ATOM 0 HE2 LYS A 25 0.797 -11.791 4.802 1.00 10.00 H new ATOM 0 HE3 LYS A 25 2.202 -12.260 3.865 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 1.758 -13.597 5.918 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 3.330 -12.969 5.796 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 2.202 -12.238 6.834 1.00 10.00 H new ATOM 104 N VAL A 26 -0.914 -6.476 1.793 1.00 10.00 N ATOM 105 CA VAL A 26 -2.138 -5.687 1.766 1.00 10.00 C ATOM 106 C VAL A 26 -3.357 -6.583 1.919 1.00 10.00 C ATOM 107 O VAL A 26 -3.647 -7.408 1.053 1.00 10.00 O ATOM 108 CB VAL A 26 -2.276 -4.880 0.458 1.00 10.00 C ATOM 109 CG1 VAL A 26 -3.285 -3.756 0.629 1.00 10.00 C ATOM 110 CG2 VAL A 26 -0.931 -4.327 0.014 1.00 10.00 C ATOM 0 H VAL A 26 -0.572 -6.748 0.871 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.080 -4.990 2.602 1.00 10.00 H new ATOM 0 HB VAL A 26 -2.637 -5.554 -0.319 1.00 10.00 H new ATOM 0 HG11 VAL A 26 -3.369 -3.198 -0.303 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -4.257 -4.176 0.890 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -2.954 -3.087 1.424 1.00 10.00 H new ATOM 0 HG21 VAL A 26 -1.057 -3.763 -0.910 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.534 -3.671 0.789 1.00 10.00 H new ATOM 0 HG23 VAL A 26 -0.237 -5.150 -0.155 1.00 10.00 H new ATOM 120 N ILE A 27 -4.062 -6.411 3.025 1.00 10.00 N ATOM 121 CA ILE A 27 -5.251 -7.196 3.306 1.00 10.00 C ATOM 122 C ILE A 27 -6.502 -6.441 2.870 1.00 10.00 C ATOM 123 O ILE A 27 -6.845 -5.403 3.444 1.00 10.00 O ATOM 124 CB ILE A 27 -5.360 -7.543 4.809 1.00 10.00 C ATOM 125 CG1 ILE A 27 -4.027 -8.086 5.335 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.477 -8.549 5.049 1.00 10.00 C ATOM 127 CD1 ILE A 27 -3.561 -9.350 4.644 1.00 10.00 C ATOM 0 H ILE A 27 -3.829 -5.729 3.747 1.00 10.00 H new ATOM 0 HA ILE A 27 -5.168 -8.125 2.742 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.599 -6.629 5.353 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -3.262 -7.318 5.219 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -4.122 -8.282 6.403 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -6.537 -8.780 6.113 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -7.425 -8.127 4.715 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.270 -9.462 4.491 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -2.611 -9.670 5.073 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -4.304 -10.135 4.782 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -3.431 -9.156 3.579 1.00 10.00 H new ATOM 139 N GLY A 28 -7.165 -6.954 1.842 1.00 10.00 N ATOM 140 CA GLY A 28 -8.369 -6.321 1.344 1.00 10.00 C ATOM 141 C GLY A 28 -9.615 -6.813 2.050 1.00 10.00 C ATOM 142 O GLY A 28 -9.566 -7.791 2.801 1.00 10.00 O ATOM 0 H GLY A 28 -6.889 -7.800 1.343 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -8.287 -5.241 1.469 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -8.461 -6.512 0.275 1.00 10.00 H new ATOM 146 N GLN A 29 -10.735 -6.143 1.798 1.00 10.00 N ATOM 147 CA GLN A 29 -12.014 -6.503 2.411 1.00 10.00 C ATOM 148 C GLN A 29 -12.447 -7.911 2.002 1.00 10.00 C ATOM 149 O GLN A 29 -13.148 -8.598 2.743 1.00 10.00 O ATOM 150 CB GLN A 29 -13.091 -5.488 2.014 1.00 10.00 C ATOM 151 CG GLN A 29 -14.425 -5.693 2.719 1.00 10.00 C ATOM 152 CD GLN A 29 -14.331 -5.510 4.222 1.00 10.00 C ATOM 153 OE1 GLN A 29 -14.487 -4.402 4.734 1.00 10.00 O ATOM 154 NE2 GLN A 29 -14.085 -6.595 4.939 1.00 10.00 N ATOM 0 H GLN A 29 -10.785 -5.342 1.169 1.00 10.00 H new ATOM 0 HA GLN A 29 -11.886 -6.489 3.493 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -12.727 -4.484 2.232 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -13.249 -5.543 0.937 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -15.155 -4.990 2.317 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -14.795 -6.695 2.502 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -13.962 -7.495 4.476 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -14.019 -6.531 5.955 1.00 10.00 H new ATOM 163 N ASP A 30 -12.000 -8.342 0.833 1.00 10.00 N ATOM 164 CA ASP A 30 -12.341 -9.665 0.322 1.00 10.00 C ATOM 165 C ASP A 30 -11.368 -10.716 0.847 1.00 10.00 C ATOM 166 O ASP A 30 -11.307 -11.833 0.332 1.00 10.00 O ATOM 167 CB ASP A 30 -12.345 -9.661 -1.209 1.00 10.00 C ATOM 168 CG ASP A 30 -10.957 -9.529 -1.796 1.00 10.00 C ATOM 169 OD1 ASP A 30 -10.287 -8.512 -1.523 1.00 10.00 O ATOM 170 OD2 ASP A 30 -10.536 -10.438 -2.540 1.00 10.00 O ATOM 0 H ASP A 30 -11.399 -7.795 0.217 1.00 10.00 H new ATOM 0 HA ASP A 30 -13.341 -9.919 0.674 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -12.801 -10.583 -1.569 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -12.965 -8.838 -1.565 1.00 10.00 H new ATOM 175 N SER A 31 -10.615 -10.347 1.882 1.00 10.00 N ATOM 176 CA SER A 31 -9.638 -11.235 2.506 1.00 10.00 C ATOM 177 C SER A 31 -8.526 -11.601 1.524 1.00 10.00 C ATOM 178 O SER A 31 -8.195 -12.772 1.338 1.00 10.00 O ATOM 179 CB SER A 31 -10.329 -12.492 3.051 1.00 10.00 C ATOM 180 OG SER A 31 -11.493 -12.147 3.790 1.00 10.00 O ATOM 0 H SER A 31 -10.666 -9.423 2.311 1.00 10.00 H new ATOM 0 HA SER A 31 -9.180 -10.708 3.343 1.00 10.00 H new ATOM 0 HB2 SER A 31 -10.599 -13.151 2.226 1.00 10.00 H new ATOM 0 HB3 SER A 31 -9.639 -13.045 3.688 1.00 10.00 H new ATOM 0 HG SER A 31 -11.920 -12.962 4.127 1.00 10.00 H new ATOM 186 N SER A 32 -7.966 -10.583 0.888 1.00 10.00 N ATOM 187 CA SER A 32 -6.888 -10.774 -0.067 1.00 10.00 C ATOM 188 C SER A 32 -5.543 -10.501 0.600 1.00 10.00 C ATOM 189 O SER A 32 -5.489 -9.831 1.633 1.00 10.00 O ATOM 190 CB SER A 32 -7.088 -9.837 -1.255 1.00 10.00 C ATOM 191 OG SER A 32 -7.770 -8.658 -0.853 1.00 10.00 O ATOM 0 H SER A 32 -8.244 -9.610 1.018 1.00 10.00 H new ATOM 0 HA SER A 32 -6.897 -11.805 -0.420 1.00 10.00 H new ATOM 0 HB2 SER A 32 -6.121 -9.575 -1.685 1.00 10.00 H new ATOM 0 HB3 SER A 32 -7.657 -10.345 -2.034 1.00 10.00 H new ATOM 0 HG SER A 32 -8.736 -8.790 -0.948 1.00 10.00 H new ATOM 197 N GLU A 33 -4.470 -11.035 0.035 1.00 10.00 N ATOM 198 CA GLU A 33 -3.139 -10.819 0.580 1.00 10.00 C ATOM 199 C GLU A 33 -2.198 -10.352 -0.524 1.00 10.00 C ATOM 200 O GLU A 33 -1.316 -11.088 -0.966 1.00 10.00 O ATOM 201 CB GLU A 33 -2.607 -12.099 1.228 1.00 10.00 C ATOM 202 CG GLU A 33 -1.508 -11.849 2.247 1.00 10.00 C ATOM 203 CD GLU A 33 -0.742 -13.105 2.599 1.00 10.00 C ATOM 204 OE1 GLU A 33 0.401 -13.260 2.126 1.00 10.00 O ATOM 205 OE2 GLU A 33 -1.278 -13.946 3.354 1.00 10.00 O ATOM 0 H GLU A 33 -4.496 -11.620 -0.800 1.00 10.00 H new ATOM 0 HA GLU A 33 -3.196 -10.048 1.348 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -3.431 -12.621 1.715 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -2.227 -12.760 0.449 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -0.816 -11.104 1.854 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -1.946 -11.430 3.153 1.00 10.00 H new ATOM 212 N ILE A 34 -2.405 -9.125 -0.974 1.00 10.00 N ATOM 213 CA ILE A 34 -1.594 -8.558 -2.038 1.00 10.00 C ATOM 214 C ILE A 34 -0.193 -8.240 -1.530 1.00 10.00 C ATOM 215 O ILE A 34 -0.028 -7.618 -0.483 1.00 10.00 O ATOM 216 CB ILE A 34 -2.240 -7.281 -2.617 1.00 10.00 C ATOM 217 CG1 ILE A 34 -3.728 -7.515 -2.921 1.00 10.00 C ATOM 218 CG2 ILE A 34 -1.506 -6.838 -3.872 1.00 10.00 C ATOM 219 CD1 ILE A 34 -3.991 -8.591 -3.957 1.00 10.00 C ATOM 0 H ILE A 34 -3.130 -8.502 -0.618 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.528 -9.301 -2.833 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.163 -6.490 -1.871 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -4.238 -7.785 -1.996 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -4.168 -6.579 -3.266 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -1.974 -5.937 -4.268 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.464 -6.630 -3.630 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.553 -7.630 -4.620 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -5.065 -8.692 -4.112 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -3.513 -8.316 -4.897 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -3.584 -9.540 -3.607 1.00 10.00 H new ATOM 231 N HIS A 35 0.812 -8.666 -2.276 1.00 10.00 N ATOM 232 CA HIS A 35 2.192 -8.438 -1.886 1.00 10.00 C ATOM 233 C HIS A 35 2.752 -7.211 -2.588 1.00 10.00 C ATOM 234 O HIS A 35 3.211 -7.279 -3.729 1.00 10.00 O ATOM 235 CB HIS A 35 3.043 -9.669 -2.196 1.00 10.00 C ATOM 236 CG HIS A 35 2.820 -10.811 -1.246 1.00 10.00 C ATOM 237 ND1 HIS A 35 3.458 -12.019 -1.413 1.00 10.00 N ATOM 238 CD2 HIS A 35 2.028 -10.880 -0.145 1.00 10.00 C ATOM 239 CE1 HIS A 35 3.044 -12.788 -0.420 1.00 10.00 C ATOM 240 NE2 HIS A 35 2.175 -12.142 0.374 1.00 10.00 N ATOM 0 H HIS A 35 0.698 -9.171 -3.155 1.00 10.00 H new ATOM 0 HA HIS A 35 2.221 -8.259 -0.811 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.826 -10.004 -3.210 1.00 10.00 H new ATOM 0 HB3 HIS A 35 4.096 -9.388 -2.172 1.00 10.00 H new ATOM 0 HD2 HIS A 35 1.402 -10.092 0.247 1.00 10.00 H new ATOM 0 HE1 HIS A 35 3.365 -13.808 -0.267 1.00 10.00 H new ATOM 0 HE2 HIS A 35 1.713 -12.517 1.203 1.00 10.00 H new ATOM 248 N PHE A 36 2.701 -6.086 -1.896 1.00 10.00 N ATOM 249 CA PHE A 36 3.192 -4.832 -2.437 1.00 10.00 C ATOM 250 C PHE A 36 4.694 -4.709 -2.213 1.00 10.00 C ATOM 251 O PHE A 36 5.155 -4.666 -1.072 1.00 10.00 O ATOM 252 CB PHE A 36 2.467 -3.658 -1.772 1.00 10.00 C ATOM 253 CG PHE A 36 2.172 -2.511 -2.698 1.00 10.00 C ATOM 254 CD1 PHE A 36 2.859 -2.361 -3.894 1.00 10.00 C ATOM 255 CD2 PHE A 36 1.204 -1.579 -2.366 1.00 10.00 C ATOM 256 CE1 PHE A 36 2.579 -1.307 -4.740 1.00 10.00 C ATOM 257 CE2 PHE A 36 0.921 -0.523 -3.209 1.00 10.00 C ATOM 258 CZ PHE A 36 1.613 -0.386 -4.397 1.00 10.00 C ATOM 0 H PHE A 36 2.322 -6.016 -0.952 1.00 10.00 H new ATOM 0 HA PHE A 36 2.996 -4.813 -3.509 1.00 10.00 H new ATOM 0 HB2 PHE A 36 1.530 -4.018 -1.348 1.00 10.00 H new ATOM 0 HB3 PHE A 36 3.073 -3.294 -0.943 1.00 10.00 H new ATOM 0 HD1 PHE A 36 3.621 -3.077 -4.166 1.00 10.00 H new ATOM 0 HD2 PHE A 36 0.664 -1.679 -1.436 1.00 10.00 H new ATOM 0 HE1 PHE A 36 3.117 -1.204 -5.671 1.00 10.00 H new ATOM 0 HE2 PHE A 36 0.160 0.195 -2.940 1.00 10.00 H new ATOM 0 HZ PHE A 36 1.397 0.442 -5.056 1.00 10.00 H new ATOM 268 N LYS A 37 5.450 -4.660 -3.296 1.00 10.00 N ATOM 269 CA LYS A 37 6.894 -4.537 -3.205 1.00 10.00 C ATOM 270 C LYS A 37 7.288 -3.066 -3.296 1.00 10.00 C ATOM 271 O LYS A 37 7.370 -2.498 -4.388 1.00 10.00 O ATOM 272 CB LYS A 37 7.563 -5.347 -4.316 1.00 10.00 C ATOM 273 CG LYS A 37 9.008 -5.713 -4.024 1.00 10.00 C ATOM 274 CD LYS A 37 9.564 -6.682 -5.058 1.00 10.00 C ATOM 275 CE LYS A 37 8.859 -8.032 -5.006 1.00 10.00 C ATOM 276 NZ LYS A 37 9.627 -9.090 -5.714 1.00 10.00 N ATOM 0 H LYS A 37 5.088 -4.704 -4.249 1.00 10.00 H new ATOM 0 HA LYS A 37 7.231 -4.932 -2.247 1.00 10.00 H new ATOM 0 HB2 LYS A 37 6.993 -6.261 -4.480 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.523 -4.776 -5.243 1.00 10.00 H new ATOM 0 HG2 LYS A 37 9.616 -4.809 -4.009 1.00 10.00 H new ATOM 0 HG3 LYS A 37 9.077 -6.160 -3.032 1.00 10.00 H new ATOM 0 HD2 LYS A 37 9.454 -6.253 -6.054 1.00 10.00 H new ATOM 0 HD3 LYS A 37 10.631 -6.823 -4.887 1.00 10.00 H new ATOM 0 HE2 LYS A 37 8.713 -8.325 -3.966 1.00 10.00 H new ATOM 0 HE3 LYS A 37 7.869 -7.941 -5.454 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 9.112 -9.992 -5.654 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 9.745 -8.824 -6.712 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 10.562 -9.195 -5.271 1.00 10.00 H new ATOM 290 N VAL A 38 7.521 -2.451 -2.145 1.00 10.00 N ATOM 291 CA VAL A 38 7.880 -1.042 -2.089 1.00 10.00 C ATOM 292 C VAL A 38 9.391 -0.853 -1.981 1.00 10.00 C ATOM 293 O VAL A 38 10.123 -1.777 -1.611 1.00 10.00 O ATOM 294 CB VAL A 38 7.184 -0.329 -0.904 1.00 10.00 C ATOM 295 CG1 VAL A 38 5.684 -0.578 -0.935 1.00 10.00 C ATOM 296 CG2 VAL A 38 7.769 -0.780 0.426 1.00 10.00 C ATOM 0 H VAL A 38 7.467 -2.908 -1.235 1.00 10.00 H new ATOM 0 HA VAL A 38 7.537 -0.593 -3.021 1.00 10.00 H new ATOM 0 HB VAL A 38 7.361 0.742 -1.007 1.00 10.00 H new ATOM 0 HG11 VAL A 38 5.213 -0.069 -0.094 1.00 10.00 H new ATOM 0 HG12 VAL A 38 5.271 -0.196 -1.868 1.00 10.00 H new ATOM 0 HG13 VAL A 38 5.491 -1.649 -0.865 1.00 10.00 H new ATOM 0 HG21 VAL A 38 7.262 -0.263 1.241 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.632 -1.856 0.538 1.00 10.00 H new ATOM 0 HG23 VAL A 38 8.833 -0.545 0.454 1.00 10.00 H new ATOM 306 N LYS A 39 9.848 0.350 -2.306 1.00 10.00 N ATOM 307 CA LYS A 39 11.262 0.680 -2.250 1.00 10.00 C ATOM 308 C LYS A 39 11.539 1.626 -1.087 1.00 10.00 C ATOM 309 O LYS A 39 10.770 2.556 -0.833 1.00 10.00 O ATOM 310 CB LYS A 39 11.720 1.317 -3.563 1.00 10.00 C ATOM 311 CG LYS A 39 13.222 1.528 -3.633 1.00 10.00 C ATOM 312 CD LYS A 39 13.637 2.200 -4.928 1.00 10.00 C ATOM 313 CE LYS A 39 15.121 2.530 -4.924 1.00 10.00 C ATOM 314 NZ LYS A 39 15.556 3.166 -6.194 1.00 10.00 N ATOM 0 H LYS A 39 9.251 1.118 -2.614 1.00 10.00 H new ATOM 0 HA LYS A 39 11.822 -0.242 -2.097 1.00 10.00 H new ATOM 0 HB2 LYS A 39 11.409 0.684 -4.394 1.00 10.00 H new ATOM 0 HB3 LYS A 39 11.218 2.277 -3.688 1.00 10.00 H new ATOM 0 HG2 LYS A 39 13.543 2.137 -2.788 1.00 10.00 H new ATOM 0 HG3 LYS A 39 13.729 0.567 -3.544 1.00 10.00 H new ATOM 0 HD2 LYS A 39 13.409 1.546 -5.770 1.00 10.00 H new ATOM 0 HD3 LYS A 39 13.059 3.113 -5.069 1.00 10.00 H new ATOM 0 HE2 LYS A 39 15.341 3.198 -4.091 1.00 10.00 H new ATOM 0 HE3 LYS A 39 15.694 1.617 -4.761 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 16.574 3.374 -6.147 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 15.371 2.520 -6.987 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 15.028 4.051 -6.338 1.00 10.00 H new ATOM 328 N MET A 40 12.641 1.388 -0.391 1.00 10.00 N ATOM 329 CA MET A 40 13.022 2.205 0.754 1.00 10.00 C ATOM 330 C MET A 40 13.711 3.497 0.309 1.00 10.00 C ATOM 331 O MET A 40 14.937 3.618 0.380 1.00 10.00 O ATOM 332 CB MET A 40 13.934 1.408 1.697 1.00 10.00 C ATOM 333 CG MET A 40 14.369 2.178 2.938 1.00 10.00 C ATOM 334 SD MET A 40 12.987 2.679 3.983 1.00 10.00 S ATOM 335 CE MET A 40 12.570 1.119 4.761 1.00 10.00 C ATOM 0 H MET A 40 13.292 0.631 -0.600 1.00 10.00 H new ATOM 0 HA MET A 40 12.113 2.478 1.290 1.00 10.00 H new ATOM 0 HB2 MET A 40 13.414 0.502 2.008 1.00 10.00 H new ATOM 0 HB3 MET A 40 14.821 1.094 1.148 1.00 10.00 H new ATOM 0 HG2 MET A 40 15.051 1.560 3.521 1.00 10.00 H new ATOM 0 HG3 MET A 40 14.925 3.064 2.632 1.00 10.00 H new ATOM 0 HE1 MET A 40 11.789 1.280 5.504 1.00 10.00 H new ATOM 0 HE2 MET A 40 12.212 0.420 4.005 1.00 10.00 H new ATOM 0 HE3 MET A 40 13.454 0.707 5.247 1.00 10.00 H new ATOM 345 N THR A 41 12.906 4.445 -0.173 1.00 10.00 N ATOM 346 CA THR A 41 13.401 5.747 -0.617 1.00 10.00 C ATOM 347 C THR A 41 12.296 6.533 -1.326 1.00 10.00 C ATOM 348 O THR A 41 12.299 7.766 -1.326 1.00 10.00 O ATOM 349 CB THR A 41 14.643 5.631 -1.543 1.00 10.00 C ATOM 350 OG1 THR A 41 15.463 6.802 -1.407 1.00 10.00 O ATOM 351 CG2 THR A 41 14.256 5.452 -3.009 1.00 10.00 C ATOM 0 H THR A 41 11.897 4.332 -0.266 1.00 10.00 H new ATOM 0 HA THR A 41 13.711 6.283 0.280 1.00 10.00 H new ATOM 0 HB THR A 41 15.196 4.744 -1.234 1.00 10.00 H new ATOM 0 HG1 THR A 41 16.245 6.723 -1.992 1.00 10.00 H new ATOM 0 HG21 THR A 41 15.158 5.376 -3.617 1.00 10.00 H new ATOM 0 HG22 THR A 41 13.665 4.543 -3.121 1.00 10.00 H new ATOM 0 HG23 THR A 41 13.669 6.309 -3.338 1.00 10.00 H new ATOM 359 N THR A 42 11.354 5.818 -1.923 1.00 10.00 N ATOM 360 CA THR A 42 10.258 6.451 -2.630 1.00 10.00 C ATOM 361 C THR A 42 9.090 6.717 -1.690 1.00 10.00 C ATOM 362 O THR A 42 8.814 5.921 -0.787 1.00 10.00 O ATOM 363 CB THR A 42 9.787 5.567 -3.800 1.00 10.00 C ATOM 364 OG1 THR A 42 10.911 4.880 -4.365 1.00 10.00 O ATOM 365 CG2 THR A 42 9.100 6.400 -4.875 1.00 10.00 C ATOM 0 H THR A 42 11.329 4.798 -1.930 1.00 10.00 H new ATOM 0 HA THR A 42 10.618 7.402 -3.023 1.00 10.00 H new ATOM 0 HB THR A 42 9.067 4.844 -3.417 1.00 10.00 H new ATOM 0 HG1 THR A 42 10.610 4.316 -5.108 1.00 10.00 H new ATOM 0 HG21 THR A 42 8.778 5.750 -5.689 1.00 10.00 H new ATOM 0 HG22 THR A 42 8.233 6.903 -4.447 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.797 7.144 -5.260 1.00 10.00 H new ATOM 373 N HIS A 43 8.423 7.848 -1.889 1.00 10.00 N ATOM 374 CA HIS A 43 7.276 8.216 -1.075 1.00 10.00 C ATOM 375 C HIS A 43 6.146 7.224 -1.288 1.00 10.00 C ATOM 376 O HIS A 43 5.929 6.749 -2.407 1.00 10.00 O ATOM 377 CB HIS A 43 6.791 9.626 -1.426 1.00 10.00 C ATOM 378 CG HIS A 43 7.556 10.723 -0.749 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.493 11.465 -1.428 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.482 11.166 0.530 1.00 10.00 C ATOM 381 CE1 HIS A 43 8.964 12.339 -0.553 1.00 10.00 C ATOM 382 NE2 HIS A 43 8.381 12.196 0.646 1.00 10.00 N ATOM 0 H HIS A 43 8.660 8.528 -2.612 1.00 10.00 H new ATOM 0 HA HIS A 43 7.582 8.200 -0.029 1.00 10.00 H new ATOM 0 HB2 HIS A 43 6.858 9.763 -2.505 1.00 10.00 H new ATOM 0 HB3 HIS A 43 5.738 9.713 -1.158 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.839 10.782 1.308 1.00 10.00 H new ATOM 0 HE1 HIS A 43 9.722 13.075 -0.776 1.00 10.00 H new ATOM 0 HE2 HIS A 43 8.570 12.747 1.483 1.00 10.00 H new ATOM 390 N LEU A 44 5.412 6.930 -0.220 1.00 10.00 N ATOM 391 CA LEU A 44 4.299 5.991 -0.289 1.00 10.00 C ATOM 392 C LEU A 44 3.189 6.529 -1.187 1.00 10.00 C ATOM 393 O LEU A 44 2.260 5.808 -1.545 1.00 10.00 O ATOM 394 CB LEU A 44 3.762 5.693 1.109 1.00 10.00 C ATOM 395 CG LEU A 44 4.659 4.789 1.961 1.00 10.00 C ATOM 396 CD1 LEU A 44 4.138 4.699 3.385 1.00 10.00 C ATOM 397 CD2 LEU A 44 4.751 3.400 1.342 1.00 10.00 C ATOM 0 H LEU A 44 5.569 7.330 0.705 1.00 10.00 H new ATOM 0 HA LEU A 44 4.665 5.061 -0.723 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.615 6.636 1.635 1.00 10.00 H new ATOM 0 HB3 LEU A 44 2.782 5.225 1.015 1.00 10.00 H new ATOM 0 HG LEU A 44 5.657 5.227 1.990 1.00 10.00 H new ATOM 0 HD11 LEU A 44 4.791 4.052 3.971 1.00 10.00 H new ATOM 0 HD12 LEU A 44 4.120 5.694 3.829 1.00 10.00 H new ATOM 0 HD13 LEU A 44 3.129 4.286 3.378 1.00 10.00 H new ATOM 0 HD21 LEU A 44 5.391 2.769 1.958 1.00 10.00 H new ATOM 0 HD22 LEU A 44 3.755 2.960 1.285 1.00 10.00 H new ATOM 0 HD23 LEU A 44 5.172 3.476 0.340 1.00 10.00 H new ATOM 409 N LYS A 45 3.304 7.801 -1.541 1.00 10.00 N ATOM 410 CA LYS A 45 2.351 8.460 -2.422 1.00 10.00 C ATOM 411 C LYS A 45 2.271 7.728 -3.759 1.00 10.00 C ATOM 412 O LYS A 45 1.182 7.404 -4.236 1.00 10.00 O ATOM 413 CB LYS A 45 2.779 9.915 -2.639 1.00 10.00 C ATOM 414 CG LYS A 45 2.219 10.561 -3.900 1.00 10.00 C ATOM 415 CD LYS A 45 0.720 10.778 -3.810 1.00 10.00 C ATOM 416 CE LYS A 45 0.245 11.791 -4.837 1.00 10.00 C ATOM 417 NZ LYS A 45 -1.231 11.953 -4.814 1.00 10.00 N ATOM 0 H LYS A 45 4.062 8.406 -1.225 1.00 10.00 H new ATOM 0 HA LYS A 45 1.364 8.441 -1.960 1.00 10.00 H new ATOM 0 HB2 LYS A 45 2.467 10.504 -1.776 1.00 10.00 H new ATOM 0 HB3 LYS A 45 3.867 9.958 -2.678 1.00 10.00 H new ATOM 0 HG2 LYS A 45 2.714 11.517 -4.068 1.00 10.00 H new ATOM 0 HG3 LYS A 45 2.443 9.931 -4.760 1.00 10.00 H new ATOM 0 HD2 LYS A 45 0.204 9.831 -3.965 1.00 10.00 H new ATOM 0 HD3 LYS A 45 0.460 11.123 -2.809 1.00 10.00 H new ATOM 0 HE2 LYS A 45 0.719 12.753 -4.644 1.00 10.00 H new ATOM 0 HE3 LYS A 45 0.560 11.475 -5.831 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 -1.513 12.665 -5.518 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 -1.684 11.044 -5.040 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 -1.531 12.263 -3.868 1.00 10.00 H new ATOM 431 N LYS A 46 3.435 7.436 -4.333 1.00 10.00 N ATOM 432 CA LYS A 46 3.506 6.751 -5.616 1.00 10.00 C ATOM 433 C LYS A 46 3.001 5.319 -5.490 1.00 10.00 C ATOM 434 O LYS A 46 2.468 4.749 -6.441 1.00 10.00 O ATOM 435 CB LYS A 46 4.943 6.757 -6.148 1.00 10.00 C ATOM 436 CG LYS A 46 5.046 6.413 -7.626 1.00 10.00 C ATOM 437 CD LYS A 46 4.427 7.499 -8.493 1.00 10.00 C ATOM 438 CE LYS A 46 4.133 6.999 -9.896 1.00 10.00 C ATOM 439 NZ LYS A 46 3.254 7.933 -10.641 1.00 10.00 N ATOM 0 H LYS A 46 4.343 7.665 -3.927 1.00 10.00 H new ATOM 0 HA LYS A 46 2.868 7.284 -6.321 1.00 10.00 H new ATOM 0 HB2 LYS A 46 5.379 7.742 -5.981 1.00 10.00 H new ATOM 0 HB3 LYS A 46 5.537 6.044 -5.575 1.00 10.00 H new ATOM 0 HG2 LYS A 46 6.093 6.281 -7.898 1.00 10.00 H new ATOM 0 HG3 LYS A 46 4.545 5.464 -7.816 1.00 10.00 H new ATOM 0 HD2 LYS A 46 3.504 7.851 -8.032 1.00 10.00 H new ATOM 0 HD3 LYS A 46 5.103 8.352 -8.545 1.00 10.00 H new ATOM 0 HE2 LYS A 46 5.069 6.870 -10.439 1.00 10.00 H new ATOM 0 HE3 LYS A 46 3.658 6.019 -9.841 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 3.199 7.639 -11.637 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 2.302 7.921 -10.224 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 3.644 8.896 -10.586 1.00 10.00 H new ATOM 453 N LEU A 47 3.158 4.749 -4.307 1.00 10.00 N ATOM 454 CA LEU A 47 2.712 3.387 -4.057 1.00 10.00 C ATOM 455 C LEU A 47 1.191 3.344 -3.967 1.00 10.00 C ATOM 456 O LEU A 47 0.544 2.482 -4.563 1.00 10.00 O ATOM 457 CB LEU A 47 3.335 2.843 -2.764 1.00 10.00 C ATOM 458 CG LEU A 47 4.780 2.337 -2.874 1.00 10.00 C ATOM 459 CD1 LEU A 47 4.918 1.337 -4.012 1.00 10.00 C ATOM 460 CD2 LEU A 47 5.754 3.490 -3.058 1.00 10.00 C ATOM 0 H LEU A 47 3.590 5.207 -3.505 1.00 10.00 H new ATOM 0 HA LEU A 47 3.036 2.758 -4.886 1.00 10.00 H new ATOM 0 HB2 LEU A 47 3.303 3.629 -2.010 1.00 10.00 H new ATOM 0 HB3 LEU A 47 2.712 2.026 -2.400 1.00 10.00 H new ATOM 0 HG LEU A 47 5.026 1.833 -1.940 1.00 10.00 H new ATOM 0 HD11 LEU A 47 5.950 0.993 -4.070 1.00 10.00 H new ATOM 0 HD12 LEU A 47 4.261 0.486 -3.830 1.00 10.00 H new ATOM 0 HD13 LEU A 47 4.641 1.815 -4.952 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.769 3.100 -3.133 1.00 10.00 H new ATOM 0 HD22 LEU A 47 5.506 4.034 -3.970 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.686 4.164 -2.204 1.00 10.00 H new ATOM 472 N LYS A 48 0.630 4.303 -3.240 1.00 10.00 N ATOM 473 CA LYS A 48 -0.813 4.391 -3.053 1.00 10.00 C ATOM 474 C LYS A 48 -1.550 4.484 -4.387 1.00 10.00 C ATOM 475 O LYS A 48 -2.510 3.749 -4.624 1.00 10.00 O ATOM 476 CB LYS A 48 -1.162 5.604 -2.189 1.00 10.00 C ATOM 477 CG LYS A 48 -0.803 5.436 -0.720 1.00 10.00 C ATOM 478 CD LYS A 48 -1.029 6.719 0.068 1.00 10.00 C ATOM 479 CE LYS A 48 -2.509 7.043 0.207 1.00 10.00 C ATOM 480 NZ LYS A 48 -2.730 8.357 0.866 1.00 10.00 N ATOM 0 H LYS A 48 1.158 5.036 -2.767 1.00 10.00 H new ATOM 0 HA LYS A 48 -1.134 3.479 -2.550 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -0.644 6.479 -2.582 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -2.231 5.802 -2.272 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -1.403 4.634 -0.289 1.00 10.00 H new ATOM 0 HG3 LYS A 48 0.241 5.135 -0.633 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -0.584 6.621 1.058 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -0.521 7.545 -0.429 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -2.973 7.049 -0.779 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -2.999 6.260 0.785 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -3.723 8.643 0.747 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -2.512 8.278 1.880 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -2.110 9.071 0.433 1.00 10.00 H new ATOM 494 N GLU A 49 -1.095 5.378 -5.259 1.00 10.00 N ATOM 495 CA GLU A 49 -1.733 5.560 -6.559 1.00 10.00 C ATOM 496 C GLU A 49 -1.548 4.333 -7.455 1.00 10.00 C ATOM 497 O GLU A 49 -2.453 3.971 -8.205 1.00 10.00 O ATOM 498 CB GLU A 49 -1.212 6.819 -7.257 1.00 10.00 C ATOM 499 CG GLU A 49 0.302 6.923 -7.309 1.00 10.00 C ATOM 500 CD GLU A 49 0.774 8.223 -7.920 1.00 10.00 C ATOM 501 OE1 GLU A 49 0.830 9.239 -7.196 1.00 10.00 O ATOM 502 OE2 GLU A 49 1.088 8.237 -9.127 1.00 10.00 O ATOM 0 H GLU A 49 -0.292 5.984 -5.091 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.801 5.684 -6.380 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -1.601 6.844 -8.275 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -1.607 7.695 -6.743 1.00 10.00 H new ATOM 0 HG2 GLU A 49 0.704 6.833 -6.300 1.00 10.00 H new ATOM 0 HG3 GLU A 49 0.700 6.089 -7.886 1.00 10.00 H new ATOM 509 N SER A 50 -0.390 3.684 -7.358 1.00 10.00 N ATOM 510 CA SER A 50 -0.111 2.499 -8.167 1.00 10.00 C ATOM 511 C SER A 50 -1.079 1.364 -7.835 1.00 10.00 C ATOM 512 O SER A 50 -1.547 0.652 -8.727 1.00 10.00 O ATOM 513 CB SER A 50 1.332 2.042 -7.966 1.00 10.00 C ATOM 514 OG SER A 50 2.241 3.027 -8.431 1.00 10.00 O ATOM 0 H SER A 50 0.367 3.956 -6.731 1.00 10.00 H new ATOM 0 HA SER A 50 -0.251 2.767 -9.214 1.00 10.00 H new ATOM 0 HB2 SER A 50 1.512 1.844 -6.909 1.00 10.00 H new ATOM 0 HB3 SER A 50 1.499 1.106 -8.498 1.00 10.00 H new ATOM 0 HG SER A 50 2.593 3.533 -7.669 1.00 10.00 H new ATOM 520 N TYR A 51 -1.383 1.199 -6.551 1.00 10.00 N ATOM 521 CA TYR A 51 -2.314 0.166 -6.119 1.00 10.00 C ATOM 522 C TYR A 51 -3.695 0.447 -6.693 1.00 10.00 C ATOM 523 O TYR A 51 -4.402 -0.468 -7.116 1.00 10.00 O ATOM 524 CB TYR A 51 -2.378 0.101 -4.592 1.00 10.00 C ATOM 525 CG TYR A 51 -3.170 -1.077 -4.061 1.00 10.00 C ATOM 526 CD1 TYR A 51 -2.619 -2.352 -4.035 1.00 10.00 C ATOM 527 CD2 TYR A 51 -4.465 -0.915 -3.582 1.00 10.00 C ATOM 528 CE1 TYR A 51 -3.337 -3.430 -3.554 1.00 10.00 C ATOM 529 CE2 TYR A 51 -5.188 -1.987 -3.098 1.00 10.00 C ATOM 530 CZ TYR A 51 -4.618 -3.241 -3.083 1.00 10.00 C ATOM 531 OH TYR A 51 -5.334 -4.312 -2.602 1.00 10.00 O ATOM 0 H TYR A 51 -0.999 1.766 -5.795 1.00 10.00 H new ATOM 0 HA TYR A 51 -1.963 -0.798 -6.486 1.00 10.00 H new ATOM 0 HB2 TYR A 51 -1.363 0.052 -4.197 1.00 10.00 H new ATOM 0 HB3 TYR A 51 -2.822 1.023 -4.217 1.00 10.00 H new ATOM 0 HD1 TYR A 51 -1.613 -2.503 -4.397 1.00 10.00 H new ATOM 0 HD2 TYR A 51 -4.914 0.067 -3.589 1.00 10.00 H new ATOM 0 HE1 TYR A 51 -2.896 -4.416 -3.547 1.00 10.00 H new ATOM 0 HE2 TYR A 51 -6.194 -1.843 -2.733 1.00 10.00 H new ATOM 0 HH TYR A 51 -6.218 -4.009 -2.308 1.00 10.00 H new ATOM 541 N CYS A 52 -4.060 1.726 -6.729 1.00 10.00 N ATOM 542 CA CYS A 52 -5.349 2.138 -7.266 1.00 10.00 C ATOM 543 C CYS A 52 -5.438 1.785 -8.750 1.00 10.00 C ATOM 544 O CYS A 52 -6.422 1.199 -9.202 1.00 10.00 O ATOM 545 CB CYS A 52 -5.547 3.643 -7.059 1.00 10.00 C ATOM 546 SG CYS A 52 -5.355 4.185 -5.344 1.00 10.00 S ATOM 0 H CYS A 52 -3.479 2.494 -6.392 1.00 10.00 H new ATOM 0 HA CYS A 52 -6.140 1.607 -6.736 1.00 10.00 H new ATOM 0 HB2 CYS A 52 -4.832 4.181 -7.681 1.00 10.00 H new ATOM 0 HB3 CYS A 52 -6.543 3.919 -7.406 1.00 10.00 H new ATOM 0 HG CYS A 52 -4.091 4.297 -5.063 1.00 10.00 H new ATOM 552 N GLN A 53 -4.382 2.114 -9.494 1.00 10.00 N ATOM 553 CA GLN A 53 -4.324 1.826 -10.928 1.00 10.00 C ATOM 554 C GLN A 53 -4.448 0.326 -11.175 1.00 10.00 C ATOM 555 O GLN A 53 -5.157 -0.115 -12.085 1.00 10.00 O ATOM 556 CB GLN A 53 -3.005 2.325 -11.523 1.00 10.00 C ATOM 557 CG GLN A 53 -2.744 3.807 -11.303 1.00 10.00 C ATOM 558 CD GLN A 53 -1.306 4.200 -11.597 1.00 10.00 C ATOM 559 OE1 GLN A 53 -0.384 3.392 -11.456 1.00 10.00 O ATOM 560 NE2 GLN A 53 -1.103 5.442 -12.004 1.00 10.00 N ATOM 0 H GLN A 53 -3.553 2.581 -9.127 1.00 10.00 H new ATOM 0 HA GLN A 53 -5.155 2.343 -11.409 1.00 10.00 H new ATOM 0 HB2 GLN A 53 -2.184 1.754 -11.088 1.00 10.00 H new ATOM 0 HB3 GLN A 53 -3.002 2.122 -12.594 1.00 10.00 H new ATOM 0 HG2 GLN A 53 -3.412 4.388 -11.939 1.00 10.00 H new ATOM 0 HG3 GLN A 53 -2.983 4.064 -10.271 1.00 10.00 H new ATOM 0 HE21 GLN A 53 -1.892 6.080 -12.108 1.00 10.00 H new ATOM 0 HE22 GLN A 53 -0.157 5.762 -12.214 1.00 10.00 H new ATOM 569 N ARG A 54 -3.760 -0.445 -10.341 1.00 10.00 N ATOM 570 CA ARG A 54 -3.756 -1.901 -10.437 1.00 10.00 C ATOM 571 C ARG A 54 -5.151 -2.480 -10.200 1.00 10.00 C ATOM 572 O ARG A 54 -5.580 -3.400 -10.895 1.00 10.00 O ATOM 573 CB ARG A 54 -2.777 -2.478 -9.413 1.00 10.00 C ATOM 574 CG ARG A 54 -2.433 -3.940 -9.637 1.00 10.00 C ATOM 575 CD ARG A 54 -1.056 -4.090 -10.260 1.00 10.00 C ATOM 576 NE ARG A 54 -0.491 -5.421 -10.039 1.00 10.00 N ATOM 577 CZ ARG A 54 0.661 -5.838 -10.559 1.00 10.00 C ATOM 578 NH1 ARG A 54 1.365 -5.038 -11.347 1.00 10.00 N ATOM 579 NH2 ARG A 54 1.107 -7.053 -10.279 1.00 10.00 N ATOM 0 H ARG A 54 -3.189 -0.079 -9.579 1.00 10.00 H new ATOM 0 HA ARG A 54 -3.444 -2.175 -11.445 1.00 10.00 H new ATOM 0 HB2 ARG A 54 -1.858 -1.892 -9.435 1.00 10.00 H new ATOM 0 HB3 ARG A 54 -3.203 -2.365 -8.416 1.00 10.00 H new ATOM 0 HG2 ARG A 54 -2.466 -4.474 -8.687 1.00 10.00 H new ATOM 0 HG3 ARG A 54 -3.180 -4.397 -10.285 1.00 10.00 H new ATOM 0 HD2 ARG A 54 -1.121 -3.898 -11.331 1.00 10.00 H new ATOM 0 HD3 ARG A 54 -0.386 -3.339 -9.842 1.00 10.00 H new ATOM 0 HE ARG A 54 -1.012 -6.070 -9.450 1.00 10.00 H new ATOM 0 HH11 ARG A 54 1.024 -4.100 -11.557 1.00 10.00 H new ATOM 0 HH12 ARG A 54 2.247 -5.361 -11.744 1.00 10.00 H new ATOM 0 HH21 ARG A 54 0.568 -7.666 -9.667 1.00 10.00 H new ATOM 0 HH22 ARG A 54 1.989 -7.376 -10.676 1.00 10.00 H new ATOM 593 N GLN A 55 -5.860 -1.926 -9.226 1.00 10.00 N ATOM 594 CA GLN A 55 -7.198 -2.405 -8.891 1.00 10.00 C ATOM 595 C GLN A 55 -8.258 -1.824 -9.822 1.00 10.00 C ATOM 596 O GLN A 55 -9.422 -2.224 -9.773 1.00 10.00 O ATOM 597 CB GLN A 55 -7.528 -2.078 -7.437 1.00 10.00 C ATOM 598 CG GLN A 55 -6.685 -2.859 -6.439 1.00 10.00 C ATOM 599 CD GLN A 55 -6.725 -4.355 -6.692 1.00 10.00 C ATOM 600 OE1 GLN A 55 -5.917 -4.891 -7.452 1.00 10.00 O ATOM 601 NE2 GLN A 55 -7.662 -5.040 -6.058 1.00 10.00 N ATOM 0 H GLN A 55 -5.534 -1.147 -8.654 1.00 10.00 H new ATOM 0 HA GLN A 55 -7.204 -3.487 -9.023 1.00 10.00 H new ATOM 0 HB2 GLN A 55 -7.382 -1.011 -7.269 1.00 10.00 H new ATOM 0 HB3 GLN A 55 -8.582 -2.288 -7.255 1.00 10.00 H new ATOM 0 HG2 GLN A 55 -5.653 -2.512 -6.490 1.00 10.00 H new ATOM 0 HG3 GLN A 55 -7.040 -2.655 -5.429 1.00 10.00 H new ATOM 0 HE21 GLN A 55 -8.313 -4.559 -5.437 1.00 10.00 H new ATOM 0 HE22 GLN A 55 -7.734 -6.049 -6.190 1.00 10.00 H new ATOM 610 N GLY A 56 -7.853 -0.880 -10.661 1.00 10.00 N ATOM 611 CA GLY A 56 -8.777 -0.273 -11.600 1.00 10.00 C ATOM 612 C GLY A 56 -9.699 0.740 -10.952 1.00 10.00 C ATOM 613 O GLY A 56 -10.831 0.934 -11.396 1.00 10.00 O ATOM 0 H GLY A 56 -6.899 -0.523 -10.708 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -8.212 0.214 -12.394 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -9.376 -1.054 -12.068 1.00 10.00 H new ATOM 617 N VAL A 57 -9.217 1.393 -9.908 1.00 10.00 N ATOM 618 CA VAL A 57 -10.007 2.390 -9.203 1.00 10.00 C ATOM 619 C VAL A 57 -9.222 3.688 -9.066 1.00 10.00 C ATOM 620 O VAL A 57 -7.997 3.668 -8.976 1.00 10.00 O ATOM 621 CB VAL A 57 -10.436 1.900 -7.799 1.00 10.00 C ATOM 622 CG1 VAL A 57 -11.545 0.864 -7.904 1.00 10.00 C ATOM 623 CG2 VAL A 57 -9.243 1.339 -7.035 1.00 10.00 C ATOM 0 H VAL A 57 -8.281 1.251 -9.529 1.00 10.00 H new ATOM 0 HA VAL A 57 -10.907 2.563 -9.793 1.00 10.00 H new ATOM 0 HB VAL A 57 -10.823 2.755 -7.245 1.00 10.00 H new ATOM 0 HG11 VAL A 57 -11.830 0.534 -6.905 1.00 10.00 H new ATOM 0 HG12 VAL A 57 -12.409 1.305 -8.401 1.00 10.00 H new ATOM 0 HG13 VAL A 57 -11.191 0.010 -8.481 1.00 10.00 H new ATOM 0 HG21 VAL A 57 -9.568 1.001 -6.051 1.00 10.00 H new ATOM 0 HG22 VAL A 57 -8.820 0.499 -7.586 1.00 10.00 H new ATOM 0 HG23 VAL A 57 -8.487 2.115 -6.920 1.00 10.00 H new ATOM 633 N PRO A 58 -9.914 4.834 -9.080 1.00 10.00 N ATOM 634 CA PRO A 58 -9.268 6.141 -8.935 1.00 10.00 C ATOM 635 C PRO A 58 -8.620 6.289 -7.566 1.00 10.00 C ATOM 636 O PRO A 58 -9.007 5.610 -6.616 1.00 10.00 O ATOM 637 CB PRO A 58 -10.420 7.137 -9.089 1.00 10.00 C ATOM 638 CG PRO A 58 -11.651 6.352 -8.797 1.00 10.00 C ATOM 639 CD PRO A 58 -11.369 4.954 -9.257 1.00 10.00 C ATOM 0 HA PRO A 58 -8.470 6.291 -9.662 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -10.313 7.974 -8.399 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -10.448 7.555 -10.095 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -11.883 6.373 -7.732 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -12.512 6.768 -9.320 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -11.910 4.217 -8.663 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -11.663 4.804 -10.296 1.00 10.00 H new ATOM 647 N MET A 59 -7.640 7.169 -7.459 1.00 10.00 N ATOM 648 CA MET A 59 -6.959 7.373 -6.192 1.00 10.00 C ATOM 649 C MET A 59 -7.889 8.050 -5.192 1.00 10.00 C ATOM 650 O MET A 59 -8.832 8.740 -5.583 1.00 10.00 O ATOM 651 CB MET A 59 -5.691 8.211 -6.379 1.00 10.00 C ATOM 652 CG MET A 59 -4.702 8.061 -5.234 1.00 10.00 C ATOM 653 SD MET A 59 -3.465 9.369 -5.196 1.00 10.00 S ATOM 654 CE MET A 59 -2.435 8.794 -3.850 1.00 10.00 C ATOM 0 H MET A 59 -7.300 7.749 -8.226 1.00 10.00 H new ATOM 0 HA MET A 59 -6.671 6.396 -5.804 1.00 10.00 H new ATOM 0 HB2 MET A 59 -5.205 7.921 -7.311 1.00 10.00 H new ATOM 0 HB3 MET A 59 -5.968 9.261 -6.477 1.00 10.00 H new ATOM 0 HG2 MET A 59 -5.246 8.056 -4.290 1.00 10.00 H new ATOM 0 HG3 MET A 59 -4.201 7.097 -5.318 1.00 10.00 H new ATOM 0 HE1 MET A 59 -1.903 9.639 -3.412 1.00 10.00 H new ATOM 0 HE2 MET A 59 -3.059 8.325 -3.089 1.00 10.00 H new ATOM 0 HE3 MET A 59 -1.715 8.068 -4.227 1.00 10.00 H new ATOM 664 N ASN A 60 -7.624 7.815 -3.905 1.00 10.00 N ATOM 665 CA ASN A 60 -8.403 8.391 -2.802 1.00 10.00 C ATOM 666 C ASN A 60 -9.733 7.666 -2.614 1.00 10.00 C ATOM 667 O ASN A 60 -10.583 8.103 -1.840 1.00 10.00 O ATOM 668 CB ASN A 60 -8.637 9.899 -2.990 1.00 10.00 C ATOM 669 CG ASN A 60 -7.389 10.728 -2.735 1.00 10.00 C ATOM 670 OD1 ASN A 60 -6.271 10.313 -3.047 1.00 10.00 O ATOM 671 ND2 ASN A 60 -7.572 11.912 -2.174 1.00 10.00 N ATOM 0 H ASN A 60 -6.859 7.216 -3.595 1.00 10.00 H new ATOM 0 HA ASN A 60 -7.809 8.254 -1.898 1.00 10.00 H new ATOM 0 HB2 ASN A 60 -8.988 10.083 -4.005 1.00 10.00 H new ATOM 0 HB3 ASN A 60 -9.428 10.226 -2.315 1.00 10.00 H new ATOM 0 HD21 ASN A 60 -6.772 12.516 -1.986 1.00 10.00 H new ATOM 0 HD22 ASN A 60 -8.513 12.221 -1.930 1.00 10.00 H new ATOM 678 N SER A 61 -9.914 6.561 -3.326 1.00 10.00 N ATOM 679 CA SER A 61 -11.131 5.772 -3.200 1.00 10.00 C ATOM 680 C SER A 61 -10.929 4.695 -2.144 1.00 10.00 C ATOM 681 O SER A 61 -11.876 4.240 -1.499 1.00 10.00 O ATOM 682 CB SER A 61 -11.501 5.130 -4.538 1.00 10.00 C ATOM 683 OG SER A 61 -10.480 4.252 -4.983 1.00 10.00 O ATOM 0 H SER A 61 -9.237 6.193 -3.994 1.00 10.00 H new ATOM 0 HA SER A 61 -11.947 6.429 -2.900 1.00 10.00 H new ATOM 0 HB2 SER A 61 -12.437 4.581 -4.435 1.00 10.00 H new ATOM 0 HB3 SER A 61 -11.667 5.907 -5.284 1.00 10.00 H new ATOM 0 HG SER A 61 -10.043 4.632 -5.774 1.00 10.00 H new ATOM 689 N LEU A 62 -9.674 4.304 -1.973 1.00 10.00 N ATOM 690 CA LEU A 62 -9.301 3.289 -1.008 1.00 10.00 C ATOM 691 C LEU A 62 -8.334 3.873 0.012 1.00 10.00 C ATOM 692 O LEU A 62 -7.379 4.565 -0.351 1.00 10.00 O ATOM 693 CB LEU A 62 -8.652 2.093 -1.712 1.00 10.00 C ATOM 694 CG LEU A 62 -9.551 1.332 -2.688 1.00 10.00 C ATOM 695 CD1 LEU A 62 -8.764 0.235 -3.390 1.00 10.00 C ATOM 696 CD2 LEU A 62 -10.751 0.741 -1.962 1.00 10.00 C ATOM 0 H LEU A 62 -8.888 4.684 -2.501 1.00 10.00 H new ATOM 0 HA LEU A 62 -10.201 2.948 -0.497 1.00 10.00 H new ATOM 0 HB2 LEU A 62 -7.775 2.446 -2.254 1.00 10.00 H new ATOM 0 HB3 LEU A 62 -8.298 1.396 -0.953 1.00 10.00 H new ATOM 0 HG LEU A 62 -9.914 2.034 -3.438 1.00 10.00 H new ATOM 0 HD11 LEU A 62 -9.418 -0.297 -4.081 1.00 10.00 H new ATOM 0 HD12 LEU A 62 -7.936 0.678 -3.943 1.00 10.00 H new ATOM 0 HD13 LEU A 62 -8.374 -0.463 -2.650 1.00 10.00 H new ATOM 0 HD21 LEU A 62 -11.378 0.204 -2.673 1.00 10.00 H new ATOM 0 HD22 LEU A 62 -10.407 0.053 -1.190 1.00 10.00 H new ATOM 0 HD23 LEU A 62 -11.329 1.543 -1.502 1.00 10.00 H new ATOM 708 N ARG A 63 -8.586 3.604 1.280 1.00 10.00 N ATOM 709 CA ARG A 63 -7.732 4.101 2.342 1.00 10.00 C ATOM 710 C ARG A 63 -6.853 2.982 2.880 1.00 10.00 C ATOM 711 O ARG A 63 -7.336 1.895 3.205 1.00 10.00 O ATOM 712 CB ARG A 63 -8.557 4.724 3.475 1.00 10.00 C ATOM 713 CG ARG A 63 -9.623 3.805 4.053 1.00 10.00 C ATOM 714 CD ARG A 63 -10.354 4.473 5.203 1.00 10.00 C ATOM 715 NE ARG A 63 -11.442 3.648 5.724 1.00 10.00 N ATOM 716 CZ ARG A 63 -12.723 4.019 5.740 1.00 10.00 C ATOM 717 NH1 ARG A 63 -13.103 5.170 5.197 1.00 10.00 N ATOM 718 NH2 ARG A 63 -13.635 3.224 6.287 1.00 10.00 N ATOM 0 H ARG A 63 -9.376 3.043 1.599 1.00 10.00 H new ATOM 0 HA ARG A 63 -7.095 4.881 1.924 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -7.882 5.027 4.276 1.00 10.00 H new ATOM 0 HB3 ARG A 63 -9.037 5.629 3.103 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -10.335 3.534 3.274 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -9.162 2.880 4.399 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -9.647 4.686 6.005 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -10.755 5.430 4.869 1.00 10.00 H new ATOM 0 HE ARG A 63 -11.207 2.729 6.100 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -12.412 5.781 4.761 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -14.086 5.443 5.215 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -13.355 2.331 6.694 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -14.615 3.506 6.300 1.00 10.00 H new ATOM 732 N PHE A 64 -5.561 3.254 2.946 1.00 10.00 N ATOM 733 CA PHE A 64 -4.595 2.289 3.444 1.00 10.00 C ATOM 734 C PHE A 64 -4.388 2.501 4.934 1.00 10.00 C ATOM 735 O PHE A 64 -3.987 3.586 5.362 1.00 10.00 O ATOM 736 CB PHE A 64 -3.265 2.434 2.699 1.00 10.00 C ATOM 737 CG PHE A 64 -3.385 2.250 1.214 1.00 10.00 C ATOM 738 CD1 PHE A 64 -3.763 3.308 0.400 1.00 10.00 C ATOM 739 CD2 PHE A 64 -3.123 1.021 0.631 1.00 10.00 C ATOM 740 CE1 PHE A 64 -3.878 3.143 -0.965 1.00 10.00 C ATOM 741 CE2 PHE A 64 -3.235 0.851 -0.735 1.00 10.00 C ATOM 742 CZ PHE A 64 -3.615 1.913 -1.533 1.00 10.00 C ATOM 0 H PHE A 64 -5.154 4.144 2.658 1.00 10.00 H new ATOM 0 HA PHE A 64 -4.976 1.282 3.274 1.00 10.00 H new ATOM 0 HB2 PHE A 64 -2.850 3.421 2.902 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -2.557 1.704 3.091 1.00 10.00 H new ATOM 0 HD1 PHE A 64 -3.970 4.272 0.840 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -2.828 0.187 1.251 1.00 10.00 H new ATOM 0 HE1 PHE A 64 -4.173 3.975 -1.588 1.00 10.00 H new ATOM 0 HE2 PHE A 64 -3.026 -0.111 -1.179 1.00 10.00 H new ATOM 0 HZ PHE A 64 -3.706 1.781 -2.601 1.00 10.00 H new ATOM 752 N LEU A 65 -4.667 1.475 5.717 1.00 10.00 N ATOM 753 CA LEU A 65 -4.529 1.564 7.158 1.00 10.00 C ATOM 754 C LEU A 65 -3.338 0.762 7.661 1.00 10.00 C ATOM 755 O LEU A 65 -3.194 -0.432 7.378 1.00 10.00 O ATOM 756 CB LEU A 65 -5.811 1.096 7.846 1.00 10.00 C ATOM 757 CG LEU A 65 -7.036 1.989 7.622 1.00 10.00 C ATOM 758 CD1 LEU A 65 -8.242 1.420 8.342 1.00 10.00 C ATOM 759 CD2 LEU A 65 -6.764 3.408 8.095 1.00 10.00 C ATOM 0 H LEU A 65 -4.991 0.569 5.378 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.352 2.610 7.407 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -6.046 0.091 7.496 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -5.624 1.025 8.918 1.00 10.00 H new ATOM 0 HG LEU A 65 -7.245 2.017 6.553 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -9.104 2.065 8.174 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -8.456 0.422 7.961 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -8.035 1.363 9.411 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -7.648 4.024 7.926 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -6.527 3.398 9.159 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -5.922 3.822 7.540 1.00 10.00 H new ATOM 771 N PHE A 66 -2.489 1.441 8.410 1.00 10.00 N ATOM 772 CA PHE A 66 -1.308 0.841 8.997 1.00 10.00 C ATOM 773 C PHE A 66 -1.263 1.188 10.478 1.00 10.00 C ATOM 774 O PHE A 66 -1.170 2.361 10.844 1.00 10.00 O ATOM 775 CB PHE A 66 -0.042 1.335 8.288 1.00 10.00 C ATOM 776 CG PHE A 66 1.225 0.711 8.799 1.00 10.00 C ATOM 777 CD1 PHE A 66 1.458 -0.648 8.647 1.00 10.00 C ATOM 778 CD2 PHE A 66 2.186 1.485 9.429 1.00 10.00 C ATOM 779 CE1 PHE A 66 2.625 -1.221 9.115 1.00 10.00 C ATOM 780 CE2 PHE A 66 3.354 0.918 9.899 1.00 10.00 C ATOM 781 CZ PHE A 66 3.575 -0.437 9.743 1.00 10.00 C ATOM 0 H PHE A 66 -2.601 2.431 8.629 1.00 10.00 H new ATOM 0 HA PHE A 66 -1.353 -0.242 8.879 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -0.132 1.130 7.221 1.00 10.00 H new ATOM 0 HB3 PHE A 66 0.027 2.417 8.400 1.00 10.00 H new ATOM 0 HD1 PHE A 66 0.719 -1.265 8.157 1.00 10.00 H new ATOM 0 HD2 PHE A 66 2.020 2.545 9.554 1.00 10.00 H new ATOM 0 HE1 PHE A 66 2.795 -2.280 8.990 1.00 10.00 H new ATOM 0 HE2 PHE A 66 4.094 1.533 10.388 1.00 10.00 H new ATOM 0 HZ PHE A 66 4.488 -0.883 10.111 1.00 10.00 H new ATOM 791 N GLU A 67 -1.377 0.166 11.319 1.00 10.00 N ATOM 792 CA GLU A 67 -1.363 0.339 12.770 1.00 10.00 C ATOM 793 C GLU A 67 -2.558 1.174 13.227 1.00 10.00 C ATOM 794 O GLU A 67 -2.488 1.886 14.231 1.00 10.00 O ATOM 795 CB GLU A 67 -0.051 0.989 13.225 1.00 10.00 C ATOM 796 CG GLU A 67 1.180 0.148 12.928 1.00 10.00 C ATOM 797 CD GLU A 67 1.126 -1.212 13.589 1.00 10.00 C ATOM 798 OE1 GLU A 67 0.540 -2.142 12.999 1.00 10.00 O ATOM 799 OE2 GLU A 67 1.670 -1.359 14.707 1.00 10.00 O ATOM 0 H GLU A 67 -1.481 -0.803 11.017 1.00 10.00 H new ATOM 0 HA GLU A 67 -1.437 -0.647 13.229 1.00 10.00 H new ATOM 0 HB2 GLU A 67 0.054 1.957 12.735 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -0.102 1.178 14.297 1.00 10.00 H new ATOM 0 HG2 GLU A 67 1.278 0.021 11.850 1.00 10.00 H new ATOM 0 HG3 GLU A 67 2.069 0.679 13.268 1.00 10.00 H new ATOM 806 N GLY A 68 -3.652 1.083 12.477 1.00 10.00 N ATOM 807 CA GLY A 68 -4.858 1.821 12.812 1.00 10.00 C ATOM 808 C GLY A 68 -4.899 3.201 12.179 1.00 10.00 C ATOM 809 O GLY A 68 -5.960 3.821 12.088 1.00 10.00 O ATOM 0 H GLY A 68 -3.725 0.508 11.638 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -5.729 1.251 12.487 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -4.928 1.921 13.895 1.00 10.00 H new ATOM 813 N GLN A 69 -3.744 3.681 11.732 1.00 10.00 N ATOM 814 CA GLN A 69 -3.646 4.996 11.113 1.00 10.00 C ATOM 815 C GLN A 69 -3.728 4.877 9.598 1.00 10.00 C ATOM 816 O GLN A 69 -3.574 3.789 9.053 1.00 10.00 O ATOM 817 CB GLN A 69 -2.334 5.672 11.511 1.00 10.00 C ATOM 818 CG GLN A 69 -2.041 5.607 13.001 1.00 10.00 C ATOM 819 CD GLN A 69 -2.917 6.535 13.824 1.00 10.00 C ATOM 820 OE1 GLN A 69 -4.067 6.814 13.477 1.00 10.00 O ATOM 821 NE2 GLN A 69 -2.378 7.016 14.930 1.00 10.00 N ATOM 0 H GLN A 69 -2.859 3.176 11.788 1.00 10.00 H new ATOM 0 HA GLN A 69 -4.479 5.605 11.464 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -1.514 5.202 10.968 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -2.365 6.717 11.201 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -2.181 4.583 13.348 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -0.995 5.861 13.170 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -1.423 6.762 15.184 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -2.917 7.641 15.530 1.00 10.00 H new ATOM 830 N ARG A 70 -3.971 5.989 8.921 1.00 10.00 N ATOM 831 CA ARG A 70 -4.065 5.977 7.468 1.00 10.00 C ATOM 832 C ARG A 70 -2.808 6.562 6.843 1.00 10.00 C ATOM 833 O ARG A 70 -2.302 7.593 7.288 1.00 10.00 O ATOM 834 CB ARG A 70 -5.312 6.732 6.987 1.00 10.00 C ATOM 835 CG ARG A 70 -5.459 8.133 7.563 1.00 10.00 C ATOM 836 CD ARG A 70 -6.812 8.738 7.217 1.00 10.00 C ATOM 837 NE ARG A 70 -6.907 9.111 5.804 1.00 10.00 N ATOM 838 CZ ARG A 70 -7.948 8.820 5.021 1.00 10.00 C ATOM 839 NH1 ARG A 70 -8.970 8.110 5.485 1.00 10.00 N ATOM 840 NH2 ARG A 70 -7.968 9.239 3.763 1.00 10.00 N ATOM 0 H ARG A 70 -4.106 6.905 9.350 1.00 10.00 H new ATOM 0 HA ARG A 70 -4.157 4.939 7.147 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -5.284 6.800 5.900 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -6.197 6.151 7.247 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -5.342 8.097 8.646 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -4.664 8.772 7.177 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -7.599 8.023 7.456 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -6.983 9.619 7.836 1.00 10.00 H new ATOM 0 HE ARG A 70 -6.129 9.626 5.392 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -8.965 7.780 6.450 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -9.759 7.895 4.876 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -7.188 9.783 3.394 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -8.763 9.017 3.164 1.00 10.00 H new ATOM 854 N ILE A 71 -2.298 5.879 5.828 1.00 10.00 N ATOM 855 CA ILE A 71 -1.100 6.318 5.128 1.00 10.00 C ATOM 856 C ILE A 71 -1.373 7.591 4.333 1.00 10.00 C ATOM 857 O ILE A 71 -2.265 7.630 3.480 1.00 10.00 O ATOM 858 CB ILE A 71 -0.569 5.220 4.178 1.00 10.00 C ATOM 859 CG1 ILE A 71 -0.247 3.939 4.957 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.661 5.708 3.422 1.00 10.00 C ATOM 861 CD1 ILE A 71 0.844 4.109 5.993 1.00 10.00 C ATOM 0 H ILE A 71 -2.699 5.012 5.469 1.00 10.00 H new ATOM 0 HA ILE A 71 -0.341 6.523 5.883 1.00 10.00 H new ATOM 0 HB ILE A 71 -1.350 4.994 3.452 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.153 3.589 5.452 1.00 10.00 H new ATOM 0 HG13 ILE A 71 0.052 3.163 4.253 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.018 4.919 2.760 1.00 10.00 H new ATOM 0 HG22 ILE A 71 0.401 6.587 2.832 1.00 10.00 H new ATOM 0 HG23 ILE A 71 1.446 5.967 4.133 1.00 10.00 H new ATOM 0 HD11 ILE A 71 1.014 3.160 6.501 1.00 10.00 H new ATOM 0 HD12 ILE A 71 1.764 4.428 5.503 1.00 10.00 H new ATOM 0 HD13 ILE A 71 0.540 4.861 6.721 1.00 10.00 H new ATOM 873 N ALA A 72 -0.602 8.626 4.615 1.00 10.00 N ATOM 874 CA ALA A 72 -0.752 9.905 3.941 1.00 10.00 C ATOM 875 C ALA A 72 0.010 9.922 2.623 1.00 10.00 C ATOM 876 O ALA A 72 0.835 9.048 2.355 1.00 10.00 O ATOM 877 CB ALA A 72 -0.275 11.035 4.842 1.00 10.00 C ATOM 0 H ALA A 72 0.141 8.605 5.313 1.00 10.00 H new ATOM 0 HA ALA A 72 -1.810 10.051 3.722 1.00 10.00 H new ATOM 0 HB1 ALA A 72 -0.393 11.987 4.325 1.00 10.00 H new ATOM 0 HB2 ALA A 72 -0.866 11.044 5.758 1.00 10.00 H new ATOM 0 HB3 ALA A 72 0.776 10.884 5.089 1.00 10.00 H new ATOM 883 N ASP A 73 -0.264 10.932 1.812 1.00 10.00 N ATOM 884 CA ASP A 73 0.380 11.087 0.507 1.00 10.00 C ATOM 885 C ASP A 73 1.777 11.673 0.647 1.00 10.00 C ATOM 886 O ASP A 73 2.429 12.001 -0.342 1.00 10.00 O ATOM 887 CB ASP A 73 -0.467 11.986 -0.397 1.00 10.00 C ATOM 888 CG ASP A 73 -1.478 11.213 -1.220 1.00 10.00 C ATOM 889 OD1 ASP A 73 -1.800 10.065 -0.852 1.00 10.00 O ATOM 890 OD2 ASP A 73 -1.954 11.753 -2.243 1.00 10.00 O ATOM 0 H ASP A 73 -0.935 11.667 2.034 1.00 10.00 H new ATOM 0 HA ASP A 73 0.466 10.097 0.058 1.00 10.00 H new ATOM 0 HB2 ASP A 73 -0.990 12.719 0.217 1.00 10.00 H new ATOM 0 HB3 ASP A 73 0.190 12.541 -1.066 1.00 10.00 H new ATOM 895 N ASN A 74 2.230 11.802 1.881 1.00 10.00 N ATOM 896 CA ASN A 74 3.549 12.351 2.162 1.00 10.00 C ATOM 897 C ASN A 74 4.319 11.445 3.116 1.00 10.00 C ATOM 898 O ASN A 74 5.315 11.855 3.710 1.00 10.00 O ATOM 899 CB ASN A 74 3.414 13.755 2.757 1.00 10.00 C ATOM 900 CG ASN A 74 2.551 13.782 4.005 1.00 10.00 C ATOM 901 OD1 ASN A 74 1.327 13.910 3.929 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.182 13.666 5.161 1.00 10.00 N ATOM 0 H ASN A 74 1.702 11.533 2.711 1.00 10.00 H new ATOM 0 HA ASN A 74 4.106 12.413 1.227 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.405 14.140 2.997 1.00 10.00 H new ATOM 0 HB3 ASN A 74 2.985 14.422 2.009 1.00 10.00 H new ATOM 0 HD21 ASN A 74 2.654 13.681 6.034 1.00 10.00 H new ATOM 0 HD22 ASN A 74 4.196 13.562 5.180 1.00 10.00 H new ATOM 909 N HIS A 75 3.858 10.207 3.246 1.00 10.00 N ATOM 910 CA HIS A 75 4.497 9.242 4.135 1.00 10.00 C ATOM 911 C HIS A 75 5.557 8.429 3.399 1.00 10.00 C ATOM 912 O HIS A 75 5.560 8.352 2.168 1.00 10.00 O ATOM 913 CB HIS A 75 3.458 8.294 4.738 1.00 10.00 C ATOM 914 CG HIS A 75 2.792 8.813 5.977 1.00 10.00 C ATOM 915 ND1 HIS A 75 1.593 8.298 6.405 1.00 10.00 N ATOM 916 CD2 HIS A 75 3.200 9.768 6.848 1.00 10.00 C ATOM 917 CE1 HIS A 75 1.299 8.940 7.521 1.00 10.00 C ATOM 918 NE2 HIS A 75 2.241 9.841 7.830 1.00 10.00 N ATOM 0 H HIS A 75 3.044 9.847 2.748 1.00 10.00 H new ATOM 0 HA HIS A 75 4.980 9.805 4.934 1.00 10.00 H new ATOM 0 HB2 HIS A 75 2.694 8.088 3.989 1.00 10.00 H new ATOM 0 HB3 HIS A 75 3.941 7.345 4.970 1.00 10.00 H new ATOM 0 HD2 HIS A 75 4.103 10.357 6.783 1.00 10.00 H new ATOM 0 HE1 HIS A 75 0.412 8.761 8.110 1.00 10.00 H new ATOM 0 HE2 HIS A 75 2.246 10.462 8.639 1.00 10.00 H new ATOM 926 N THR A 76 6.454 7.831 4.166 1.00 10.00 N ATOM 927 CA THR A 76 7.521 7.008 3.623 1.00 10.00 C ATOM 928 C THR A 76 7.720 5.770 4.496 1.00 10.00 C ATOM 929 O THR A 76 7.412 5.800 5.686 1.00 10.00 O ATOM 930 CB THR A 76 8.847 7.796 3.545 1.00 10.00 C ATOM 931 OG1 THR A 76 8.792 8.938 4.411 1.00 10.00 O ATOM 932 CG2 THR A 76 9.133 8.249 2.120 1.00 10.00 C ATOM 0 H THR A 76 6.462 7.903 5.183 1.00 10.00 H new ATOM 0 HA THR A 76 7.234 6.708 2.615 1.00 10.00 H new ATOM 0 HB THR A 76 9.652 7.134 3.865 1.00 10.00 H new ATOM 0 HG1 THR A 76 8.287 8.711 5.220 1.00 10.00 H new ATOM 0 HG21 THR A 76 10.072 8.801 2.095 1.00 10.00 H new ATOM 0 HG22 THR A 76 9.207 7.378 1.469 1.00 10.00 H new ATOM 0 HG23 THR A 76 8.325 8.893 1.774 1.00 10.00 H new ATOM 940 N PRO A 77 8.236 4.663 3.927 1.00 10.00 N ATOM 941 CA PRO A 77 8.473 3.421 4.682 1.00 10.00 C ATOM 942 C PRO A 77 9.565 3.582 5.740 1.00 10.00 C ATOM 943 O PRO A 77 9.772 2.705 6.581 1.00 10.00 O ATOM 944 CB PRO A 77 8.922 2.417 3.609 1.00 10.00 C ATOM 945 CG PRO A 77 8.558 3.032 2.302 1.00 10.00 C ATOM 946 CD PRO A 77 8.612 4.517 2.511 1.00 10.00 C ATOM 0 HA PRO A 77 7.583 3.110 5.229 1.00 10.00 H new ATOM 0 HB2 PRO A 77 9.995 2.233 3.670 1.00 10.00 H new ATOM 0 HB3 PRO A 77 8.426 1.455 3.741 1.00 10.00 H new ATOM 0 HG2 PRO A 77 9.251 2.723 1.520 1.00 10.00 H new ATOM 0 HG3 PRO A 77 7.562 2.719 1.988 1.00 10.00 H new ATOM 0 HD2 PRO A 77 9.607 4.917 2.314 1.00 10.00 H new ATOM 0 HD3 PRO A 77 7.920 5.043 1.853 1.00 10.00 H new ATOM 954 N LYS A 78 10.263 4.710 5.684 1.00 10.00 N ATOM 955 CA LYS A 78 11.339 5.007 6.620 1.00 10.00 C ATOM 956 C LYS A 78 10.785 5.455 7.974 1.00 10.00 C ATOM 957 O LYS A 78 11.455 5.335 9.003 1.00 10.00 O ATOM 958 CB LYS A 78 12.244 6.095 6.035 1.00 10.00 C ATOM 959 CG LYS A 78 13.452 6.431 6.898 1.00 10.00 C ATOM 960 CD LYS A 78 14.533 5.365 6.804 1.00 10.00 C ATOM 961 CE LYS A 78 15.254 5.425 5.469 1.00 10.00 C ATOM 962 NZ LYS A 78 16.632 4.880 5.562 1.00 10.00 N ATOM 0 H LYS A 78 10.100 5.441 4.992 1.00 10.00 H new ATOM 0 HA LYS A 78 11.919 4.098 6.779 1.00 10.00 H new ATOM 0 HB2 LYS A 78 12.591 5.774 5.053 1.00 10.00 H new ATOM 0 HB3 LYS A 78 11.655 7.000 5.885 1.00 10.00 H new ATOM 0 HG2 LYS A 78 13.863 7.392 6.589 1.00 10.00 H new ATOM 0 HG3 LYS A 78 13.138 6.538 7.936 1.00 10.00 H new ATOM 0 HD2 LYS A 78 15.251 5.500 7.613 1.00 10.00 H new ATOM 0 HD3 LYS A 78 14.087 4.379 6.934 1.00 10.00 H new ATOM 0 HE2 LYS A 78 14.690 4.862 4.725 1.00 10.00 H new ATOM 0 HE3 LYS A 78 15.294 6.458 5.124 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 17.092 4.938 4.631 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 17.178 5.433 6.253 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 16.593 3.887 5.867 1.00 10.00 H new ATOM 976 N GLU A 79 9.561 5.962 7.975 1.00 10.00 N ATOM 977 CA GLU A 79 8.938 6.426 9.206 1.00 10.00 C ATOM 978 C GLU A 79 7.886 5.429 9.679 1.00 10.00 C ATOM 979 O GLU A 79 7.619 4.437 8.996 1.00 10.00 O ATOM 980 CB GLU A 79 8.317 7.811 9.003 1.00 10.00 C ATOM 981 CG GLU A 79 7.185 7.830 7.990 1.00 10.00 C ATOM 982 CD GLU A 79 6.870 9.220 7.488 1.00 10.00 C ATOM 983 OE1 GLU A 79 6.582 10.106 8.315 1.00 10.00 O ATOM 984 OE2 GLU A 79 6.908 9.430 6.263 1.00 10.00 O ATOM 0 H GLU A 79 8.982 6.062 7.141 1.00 10.00 H new ATOM 0 HA GLU A 79 9.706 6.505 9.975 1.00 10.00 H new ATOM 0 HB2 GLU A 79 7.943 8.175 9.960 1.00 10.00 H new ATOM 0 HB3 GLU A 79 9.094 8.504 8.680 1.00 10.00 H new ATOM 0 HG2 GLU A 79 7.450 7.195 7.145 1.00 10.00 H new ATOM 0 HG3 GLU A 79 6.291 7.401 8.443 1.00 10.00 H new ATOM 991 N LEU A 80 7.308 5.705 10.852 1.00 10.00 N ATOM 992 CA LEU A 80 6.281 4.856 11.468 1.00 10.00 C ATOM 993 C LEU A 80 6.879 3.542 11.974 1.00 10.00 C ATOM 994 O LEU A 80 6.859 3.261 13.173 1.00 10.00 O ATOM 995 CB LEU A 80 5.126 4.576 10.492 1.00 10.00 C ATOM 996 CG LEU A 80 4.333 5.809 10.045 1.00 10.00 C ATOM 997 CD1 LEU A 80 3.451 5.474 8.852 1.00 10.00 C ATOM 998 CD2 LEU A 80 3.493 6.354 11.192 1.00 10.00 C ATOM 0 H LEU A 80 7.541 6.530 11.406 1.00 10.00 H new ATOM 0 HA LEU A 80 5.880 5.402 12.322 1.00 10.00 H new ATOM 0 HB2 LEU A 80 5.531 4.084 9.607 1.00 10.00 H new ATOM 0 HB3 LEU A 80 4.438 3.872 10.961 1.00 10.00 H new ATOM 0 HG LEU A 80 5.043 6.580 9.744 1.00 10.00 H new ATOM 0 HD11 LEU A 80 2.896 6.362 8.549 1.00 10.00 H new ATOM 0 HD12 LEU A 80 4.073 5.135 8.024 1.00 10.00 H new ATOM 0 HD13 LEU A 80 2.751 4.685 9.127 1.00 10.00 H new ATOM 0 HD21 LEU A 80 2.938 7.229 10.853 1.00 10.00 H new ATOM 0 HD22 LEU A 80 2.793 5.588 11.527 1.00 10.00 H new ATOM 0 HD23 LEU A 80 4.145 6.636 12.019 1.00 10.00 H new ATOM 1010 N GLY A 81 7.418 2.749 11.062 1.00 10.00 N ATOM 1011 CA GLY A 81 8.010 1.479 11.429 1.00 10.00 C ATOM 1012 C GLY A 81 7.553 0.355 10.526 1.00 10.00 C ATOM 1013 O GLY A 81 6.883 -0.578 10.972 1.00 10.00 O ATOM 0 H GLY A 81 7.456 2.964 10.066 1.00 10.00 H new ATOM 0 HA2 GLY A 81 9.096 1.560 11.385 1.00 10.00 H new ATOM 0 HA3 GLY A 81 7.750 1.243 12.461 1.00 10.00 H new ATOM 1017 N MET A 82 7.910 0.446 9.254 1.00 10.00 N ATOM 1018 CA MET A 82 7.537 -0.571 8.281 1.00 10.00 C ATOM 1019 C MET A 82 8.648 -1.599 8.129 1.00 10.00 C ATOM 1020 O MET A 82 9.822 -1.243 7.980 1.00 10.00 O ATOM 1021 CB MET A 82 7.231 0.065 6.923 1.00 10.00 C ATOM 1022 CG MET A 82 5.797 0.540 6.784 1.00 10.00 C ATOM 1023 SD MET A 82 5.472 1.299 5.185 1.00 10.00 S ATOM 1024 CE MET A 82 3.701 1.524 5.281 1.00 10.00 C ATOM 0 H MET A 82 8.459 1.215 8.870 1.00 10.00 H new ATOM 0 HA MET A 82 6.639 -1.071 8.645 1.00 10.00 H new ATOM 0 HB2 MET A 82 7.902 0.910 6.768 1.00 10.00 H new ATOM 0 HB3 MET A 82 7.443 -0.659 6.136 1.00 10.00 H new ATOM 0 HG2 MET A 82 5.123 -0.305 6.925 1.00 10.00 H new ATOM 0 HG3 MET A 82 5.578 1.258 7.574 1.00 10.00 H new ATOM 0 HE1 MET A 82 3.343 1.986 4.361 1.00 10.00 H new ATOM 0 HE2 MET A 82 3.218 0.556 5.413 1.00 10.00 H new ATOM 0 HE3 MET A 82 3.461 2.167 6.128 1.00 10.00 H new ATOM 1034 N GLU A 83 8.284 -2.868 8.195 1.00 10.00 N ATOM 1035 CA GLU A 83 9.246 -3.945 8.049 1.00 10.00 C ATOM 1036 C GLU A 83 8.755 -4.953 7.021 1.00 10.00 C ATOM 1037 O GLU A 83 7.649 -4.827 6.495 1.00 10.00 O ATOM 1038 CB GLU A 83 9.481 -4.640 9.391 1.00 10.00 C ATOM 1039 CG GLU A 83 10.893 -4.472 9.925 1.00 10.00 C ATOM 1040 CD GLU A 83 11.943 -4.977 8.959 1.00 10.00 C ATOM 1041 OE1 GLU A 83 11.905 -6.172 8.605 1.00 10.00 O ATOM 1042 OE2 GLU A 83 12.811 -4.182 8.548 1.00 10.00 O ATOM 0 H GLU A 83 7.325 -3.178 8.349 1.00 10.00 H new ATOM 0 HA GLU A 83 10.189 -3.520 7.706 1.00 10.00 H new ATOM 0 HB2 GLU A 83 8.776 -4.246 10.123 1.00 10.00 H new ATOM 0 HB3 GLU A 83 9.267 -5.703 9.282 1.00 10.00 H new ATOM 0 HG2 GLU A 83 11.075 -3.418 10.136 1.00 10.00 H new ATOM 0 HG3 GLU A 83 10.986 -5.007 10.870 1.00 10.00 H new ATOM 1049 N GLU A 84 9.586 -5.940 6.731 1.00 10.00 N ATOM 1050 CA GLU A 84 9.236 -6.976 5.776 1.00 10.00 C ATOM 1051 C GLU A 84 8.189 -7.901 6.391 1.00 10.00 C ATOM 1052 O GLU A 84 8.302 -8.260 7.567 1.00 10.00 O ATOM 1053 CB GLU A 84 10.494 -7.757 5.376 1.00 10.00 C ATOM 1054 CG GLU A 84 10.220 -9.030 4.593 1.00 10.00 C ATOM 1055 CD GLU A 84 9.569 -8.775 3.252 1.00 10.00 C ATOM 1056 OE1 GLU A 84 9.941 -7.791 2.580 1.00 10.00 O ATOM 1057 OE2 GLU A 84 8.702 -9.580 2.855 1.00 10.00 O ATOM 0 H GLU A 84 10.512 -6.045 7.146 1.00 10.00 H new ATOM 0 HA GLU A 84 8.814 -6.525 4.878 1.00 10.00 H new ATOM 0 HB2 GLU A 84 11.135 -7.108 4.779 1.00 10.00 H new ATOM 0 HB3 GLU A 84 11.050 -8.012 6.278 1.00 10.00 H new ATOM 0 HG2 GLU A 84 11.158 -9.563 4.439 1.00 10.00 H new ATOM 0 HG3 GLU A 84 9.576 -9.681 5.184 1.00 10.00 H new ATOM 1064 N GLU A 85 7.175 -8.257 5.594 1.00 10.00 N ATOM 1065 CA GLU A 85 6.078 -9.129 6.031 1.00 10.00 C ATOM 1066 C GLU A 85 5.109 -8.373 6.935 1.00 10.00 C ATOM 1067 O GLU A 85 4.402 -8.973 7.749 1.00 10.00 O ATOM 1068 CB GLU A 85 6.603 -10.379 6.749 1.00 10.00 C ATOM 1069 CG GLU A 85 6.943 -11.531 5.820 1.00 10.00 C ATOM 1070 CD GLU A 85 5.706 -12.200 5.263 1.00 10.00 C ATOM 1071 OE1 GLU A 85 4.960 -12.824 6.049 1.00 10.00 O ATOM 1072 OE2 GLU A 85 5.473 -12.106 4.041 1.00 10.00 O ATOM 0 H GLU A 85 7.092 -7.948 4.626 1.00 10.00 H new ATOM 0 HA GLU A 85 5.545 -9.451 5.136 1.00 10.00 H new ATOM 0 HB2 GLU A 85 7.493 -10.111 7.318 1.00 10.00 H new ATOM 0 HB3 GLU A 85 5.854 -10.714 7.467 1.00 10.00 H new ATOM 0 HG2 GLU A 85 7.557 -11.163 4.998 1.00 10.00 H new ATOM 0 HG3 GLU A 85 7.540 -12.266 6.359 1.00 10.00 H new ATOM 1079 N ASP A 86 5.063 -7.056 6.776 1.00 10.00 N ATOM 1080 CA ASP A 86 4.176 -6.228 7.581 1.00 10.00 C ATOM 1081 C ASP A 86 2.739 -6.339 7.089 1.00 10.00 C ATOM 1082 O ASP A 86 2.487 -6.796 5.970 1.00 10.00 O ATOM 1083 CB ASP A 86 4.623 -4.769 7.568 1.00 10.00 C ATOM 1084 CG ASP A 86 4.738 -4.204 8.966 1.00 10.00 C ATOM 1085 OD1 ASP A 86 3.767 -4.319 9.741 1.00 10.00 O ATOM 1086 OD2 ASP A 86 5.809 -3.657 9.303 1.00 10.00 O ATOM 0 H ASP A 86 5.627 -6.541 6.100 1.00 10.00 H new ATOM 0 HA ASP A 86 4.224 -6.593 8.607 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.586 -4.688 7.063 1.00 10.00 H new ATOM 0 HB3 ASP A 86 3.911 -4.176 6.994 1.00 10.00 H new ATOM 1091 N VAL A 87 1.802 -5.905 7.918 1.00 10.00 N ATOM 1092 CA VAL A 87 0.389 -5.983 7.577 1.00 10.00 C ATOM 1093 C VAL A 87 -0.206 -4.602 7.336 1.00 10.00 C ATOM 1094 O VAL A 87 -0.149 -3.728 8.203 1.00 10.00 O ATOM 1095 CB VAL A 87 -0.423 -6.686 8.687 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -1.858 -6.925 8.236 1.00 10.00 C ATOM 1097 CG2 VAL A 87 0.241 -7.994 9.091 1.00 10.00 C ATOM 0 H VAL A 87 1.994 -5.495 8.832 1.00 10.00 H new ATOM 0 HA VAL A 87 0.326 -6.567 6.659 1.00 10.00 H new ATOM 0 HB VAL A 87 -0.446 -6.033 9.559 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -2.412 -7.421 9.033 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -2.331 -5.970 8.005 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -1.860 -7.555 7.346 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -0.346 -8.474 9.874 1.00 10.00 H new ATOM 0 HG22 VAL A 87 0.300 -8.654 8.226 1.00 10.00 H new ATOM 0 HG23 VAL A 87 1.245 -7.792 9.463 1.00 10.00 H new ATOM 1107 N ILE A 88 -0.771 -4.413 6.154 1.00 10.00 N ATOM 1108 CA ILE A 88 -1.404 -3.157 5.795 1.00 10.00 C ATOM 1109 C ILE A 88 -2.791 -3.446 5.222 1.00 10.00 C ATOM 1110 O ILE A 88 -2.935 -4.196 4.259 1.00 10.00 O ATOM 1111 CB ILE A 88 -0.537 -2.343 4.798 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -1.258 -1.063 4.367 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -0.154 -3.182 3.585 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -0.391 -0.127 3.548 1.00 10.00 C ATOM 0 H ILE A 88 -0.803 -5.122 5.422 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.505 -2.542 6.689 1.00 10.00 H new ATOM 0 HB ILE A 88 0.382 -2.061 5.312 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.140 -1.331 3.785 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.609 -0.537 5.255 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.453 -2.584 2.906 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.416 -4.052 3.910 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.057 -3.511 3.071 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -0.966 0.758 3.277 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.478 0.170 4.134 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.061 -0.636 2.642 1.00 10.00 H new ATOM 1126 N GLU A 89 -3.812 -2.881 5.839 1.00 10.00 N ATOM 1127 CA GLU A 89 -5.183 -3.108 5.406 1.00 10.00 C ATOM 1128 C GLU A 89 -5.652 -2.002 4.472 1.00 10.00 C ATOM 1129 O GLU A 89 -5.149 -0.881 4.519 1.00 10.00 O ATOM 1130 CB GLU A 89 -6.114 -3.194 6.619 1.00 10.00 C ATOM 1131 CG GLU A 89 -5.724 -4.278 7.614 1.00 10.00 C ATOM 1132 CD GLU A 89 -6.673 -4.372 8.795 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -7.628 -3.573 8.874 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -6.468 -5.258 9.652 1.00 10.00 O ATOM 0 H GLU A 89 -3.720 -2.260 6.643 1.00 10.00 H new ATOM 0 HA GLU A 89 -5.212 -4.052 4.863 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -6.122 -2.231 7.129 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -7.131 -3.380 6.273 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -5.695 -5.240 7.102 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -4.716 -4.081 7.980 1.00 10.00 H new ATOM 1141 N VAL A 90 -6.613 -2.323 3.622 1.00 10.00 N ATOM 1142 CA VAL A 90 -7.154 -1.352 2.685 1.00 10.00 C ATOM 1143 C VAL A 90 -8.683 -1.408 2.693 1.00 10.00 C ATOM 1144 O VAL A 90 -9.279 -2.480 2.572 1.00 10.00 O ATOM 1145 CB VAL A 90 -6.609 -1.573 1.252 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -6.963 -2.958 0.731 1.00 10.00 C ATOM 1147 CG2 VAL A 90 -7.124 -0.500 0.308 1.00 10.00 C ATOM 0 H VAL A 90 -7.035 -3.250 3.561 1.00 10.00 H new ATOM 0 HA VAL A 90 -6.832 -0.362 3.007 1.00 10.00 H new ATOM 0 HB VAL A 90 -5.522 -1.501 1.298 1.00 10.00 H new ATOM 0 HG11 VAL A 90 -6.566 -3.080 -0.277 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -6.531 -3.715 1.386 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -8.047 -3.073 0.710 1.00 10.00 H new ATOM 0 HG21 VAL A 90 -6.728 -0.675 -0.692 1.00 10.00 H new ATOM 0 HG22 VAL A 90 -8.213 -0.533 0.279 1.00 10.00 H new ATOM 0 HG23 VAL A 90 -6.800 0.480 0.660 1.00 10.00 H new ATOM 1157 N TYR A 91 -9.311 -0.254 2.873 1.00 10.00 N ATOM 1158 CA TYR A 91 -10.768 -0.173 2.912 1.00 10.00 C ATOM 1159 C TYR A 91 -11.272 0.892 1.952 1.00 10.00 C ATOM 1160 O TYR A 91 -10.502 1.719 1.472 1.00 10.00 O ATOM 1161 CB TYR A 91 -11.251 0.140 4.329 1.00 10.00 C ATOM 1162 CG TYR A 91 -10.948 -0.952 5.329 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -11.892 -1.922 5.639 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -9.715 -1.009 5.963 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -11.613 -2.919 6.555 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -9.429 -2.001 6.877 1.00 10.00 C ATOM 1167 CZ TYR A 91 -10.382 -2.955 7.171 1.00 10.00 C ATOM 1168 OH TYR A 91 -10.100 -3.948 8.082 1.00 10.00 O ATOM 0 H TYR A 91 -8.836 0.640 2.995 1.00 10.00 H new ATOM 0 HA TYR A 91 -11.167 -1.140 2.607 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -10.787 1.067 4.665 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -12.327 0.312 4.307 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -12.858 -1.897 5.157 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -8.967 -0.264 5.737 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -12.357 -3.667 6.787 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -8.464 -2.031 7.361 1.00 10.00 H new ATOM 0 HH TYR A 91 -9.258 -3.743 8.540 1.00 10.00 H new ATOM 1178 N GLN A 92 -12.568 0.870 1.683 1.00 10.00 N ATOM 1179 CA GLN A 92 -13.175 1.833 0.779 1.00 10.00 C ATOM 1180 C GLN A 92 -13.504 3.117 1.527 1.00 10.00 C ATOM 1181 O GLN A 92 -14.046 3.078 2.631 1.00 10.00 O ATOM 1182 CB GLN A 92 -14.446 1.250 0.156 1.00 10.00 C ATOM 1183 CG GLN A 92 -14.933 2.011 -1.066 1.00 10.00 C ATOM 1184 CD GLN A 92 -16.443 2.002 -1.188 1.00 10.00 C ATOM 1185 OE1 GLN A 92 -17.029 1.066 -1.733 1.00 10.00 O ATOM 1186 NE2 GLN A 92 -17.085 3.044 -0.683 1.00 10.00 N ATOM 0 H GLN A 92 -13.221 0.194 2.079 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.466 2.058 -0.018 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -14.260 0.213 -0.123 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -15.237 1.241 0.906 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -14.582 3.041 -1.013 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -14.496 1.571 -1.963 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -16.562 3.799 -0.239 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -18.102 3.092 -0.738 1.00 10.00 H new ATOM 1195 N GLU A 93 -13.163 4.247 0.930 1.00 10.00 N ATOM 1196 CA GLU A 93 -13.430 5.541 1.536 1.00 10.00 C ATOM 1197 C GLU A 93 -14.898 5.920 1.377 1.00 10.00 C ATOM 1198 O GLU A 93 -15.575 5.461 0.453 1.00 10.00 O ATOM 1199 CB GLU A 93 -12.542 6.612 0.907 1.00 10.00 C ATOM 1200 CG GLU A 93 -11.123 6.615 1.445 1.00 10.00 C ATOM 1201 CD GLU A 93 -11.010 7.310 2.787 1.00 10.00 C ATOM 1202 OE1 GLU A 93 -11.669 6.872 3.754 1.00 10.00 O ATOM 1203 OE2 GLU A 93 -10.264 8.303 2.883 1.00 10.00 O ATOM 0 H GLU A 93 -12.699 4.294 0.023 1.00 10.00 H new ATOM 0 HA GLU A 93 -13.205 5.473 2.600 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -12.513 6.460 -0.172 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -12.989 7.591 1.079 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -10.773 5.587 1.542 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -10.467 7.109 0.728 1.00 10.00 H new ATOM 1210 N GLN A 94 -15.379 6.761 2.284 1.00 10.00 N ATOM 1211 CA GLN A 94 -16.767 7.215 2.260 1.00 10.00 C ATOM 1212 C GLN A 94 -17.013 8.130 1.064 1.00 10.00 C ATOM 1213 O GLN A 94 -18.128 8.208 0.543 1.00 10.00 O ATOM 1214 CB GLN A 94 -17.094 7.940 3.569 1.00 10.00 C ATOM 1215 CG GLN A 94 -18.497 8.520 3.627 1.00 10.00 C ATOM 1216 CD GLN A 94 -18.907 8.898 5.034 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -18.654 10.014 5.489 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -19.543 7.971 5.732 1.00 10.00 N ATOM 0 H GLN A 94 -14.826 7.145 3.050 1.00 10.00 H new ATOM 0 HA GLN A 94 -17.421 6.349 2.161 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -16.966 7.244 4.398 1.00 10.00 H new ATOM 0 HB3 GLN A 94 -16.374 8.745 3.715 1.00 10.00 H new ATOM 0 HG2 GLN A 94 -18.550 9.401 2.987 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -19.205 7.793 3.228 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -19.732 7.059 5.316 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -19.844 8.168 6.686 1.00 10.00 H new ATOM 1227 N THR A 95 -15.960 8.803 0.625 1.00 10.00 N ATOM 1228 CA THR A 95 -16.042 9.712 -0.505 1.00 10.00 C ATOM 1229 C THR A 95 -16.306 8.950 -1.799 1.00 10.00 C ATOM 1230 O THR A 95 -17.145 9.344 -2.606 1.00 10.00 O ATOM 1231 CB THR A 95 -14.733 10.503 -0.653 1.00 10.00 C ATOM 1232 OG1 THR A 95 -13.622 9.649 -0.341 1.00 10.00 O ATOM 1233 CG2 THR A 95 -14.721 11.710 0.268 1.00 10.00 C ATOM 0 H THR A 95 -15.031 8.734 1.040 1.00 10.00 H new ATOM 0 HA THR A 95 -16.868 10.398 -0.317 1.00 10.00 H new ATOM 0 HB THR A 95 -14.655 10.855 -1.682 1.00 10.00 H new ATOM 0 HG1 THR A 95 -12.786 10.152 -0.437 1.00 10.00 H new ATOM 0 HG21 THR A 95 -13.784 12.253 0.144 1.00 10.00 H new ATOM 0 HG22 THR A 95 -15.556 12.365 0.020 1.00 10.00 H new ATOM 0 HG23 THR A 95 -14.815 11.379 1.302 1.00 10.00 H new ATOM 1241 N GLY A 96 -15.588 7.850 -1.981 1.00 10.00 N ATOM 1242 CA GLY A 96 -15.743 7.054 -3.181 1.00 10.00 C ATOM 1243 C GLY A 96 -14.664 7.358 -4.198 1.00 10.00 C ATOM 1244 O GLY A 96 -14.632 6.774 -5.283 1.00 10.00 O ATOM 0 H GLY A 96 -14.900 7.495 -1.317 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -15.711 5.996 -2.922 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -16.722 7.245 -3.621 1.00 10.00 H new ATOM 1286 N ARG B 359 -2.242 -13.527 -3.816 1.00 10.00 N ATOM 1287 CA ARG B 359 -0.956 -12.914 -3.516 1.00 10.00 C ATOM 1288 C ARG B 359 -0.338 -12.325 -4.781 1.00 10.00 C ATOM 1289 O ARG B 359 0.482 -12.964 -5.441 1.00 10.00 O ATOM 1290 CB ARG B 359 -0.003 -13.943 -2.896 1.00 10.00 C ATOM 1291 CG ARG B 359 -0.314 -14.265 -1.445 1.00 10.00 C ATOM 1292 CD ARG B 359 0.587 -15.365 -0.907 1.00 10.00 C ATOM 1293 NE ARG B 359 0.598 -15.385 0.553 1.00 10.00 N ATOM 1294 CZ ARG B 359 0.966 -16.427 1.293 1.00 10.00 C ATOM 1295 NH1 ARG B 359 1.406 -17.542 0.724 1.00 10.00 N ATOM 1296 NH2 ARG B 359 0.913 -16.337 2.612 1.00 10.00 N ATOM 0 HA ARG B 359 -1.119 -12.110 -2.798 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -0.045 -14.862 -3.480 1.00 10.00 H new ATOM 0 HB3 ARG B 359 1.018 -13.568 -2.965 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -0.193 -13.367 -0.839 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -1.356 -14.572 -1.356 1.00 10.00 H new ATOM 0 HD2 ARG B 359 0.247 -16.330 -1.282 1.00 10.00 H new ATOM 0 HD3 ARG B 359 1.602 -15.218 -1.277 1.00 10.00 H new ATOM 0 HE ARG B 359 0.302 -14.539 1.040 1.00 10.00 H new ATOM 0 HH11 ARG B 359 1.465 -17.607 -0.292 1.00 10.00 H new ATOM 0 HH12 ARG B 359 1.685 -18.334 1.303 1.00 10.00 H new ATOM 0 HH21 ARG B 359 0.592 -15.474 3.052 1.00 10.00 H new ATOM 0 HH22 ARG B 359 1.193 -17.130 3.189 1.00 10.00 H new ATOM 1310 N ASP B 360 -0.744 -11.111 -5.122 1.00 10.00 N ATOM 1311 CA ASP B 360 -0.228 -10.441 -6.313 1.00 10.00 C ATOM 1312 C ASP B 360 0.972 -9.567 -5.964 1.00 10.00 C ATOM 1313 O ASP B 360 0.879 -8.703 -5.099 1.00 10.00 O ATOM 1314 CB ASP B 360 -1.315 -9.581 -6.961 1.00 10.00 C ATOM 1315 CG ASP B 360 -0.878 -9.004 -8.296 1.00 10.00 C ATOM 1316 OD1 ASP B 360 -0.697 -7.775 -8.391 1.00 10.00 O ATOM 1317 OD2 ASP B 360 -0.728 -9.781 -9.262 1.00 10.00 O ATOM 0 H ASP B 360 -1.428 -10.568 -4.594 1.00 10.00 H new ATOM 0 HA ASP B 360 0.087 -11.210 -7.019 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -2.213 -10.182 -7.105 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -1.581 -8.767 -6.286 1.00 10.00 H new ATOM 1322 N PRO B 361 2.123 -9.807 -6.612 1.00 10.00 N ATOM 1323 CA PRO B 361 3.342 -9.034 -6.377 1.00 10.00 C ATOM 1324 C PRO B 361 3.382 -7.747 -7.207 1.00 10.00 C ATOM 1325 O PRO B 361 3.591 -7.783 -8.426 1.00 10.00 O ATOM 1326 CB PRO B 361 4.441 -10.001 -6.818 1.00 10.00 C ATOM 1327 CG PRO B 361 3.814 -10.849 -7.876 1.00 10.00 C ATOM 1328 CD PRO B 361 2.329 -10.866 -7.616 1.00 10.00 C ATOM 0 HA PRO B 361 3.434 -8.699 -5.344 1.00 10.00 H new ATOM 0 HB2 PRO B 361 5.306 -9.463 -7.206 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.790 -10.608 -5.983 1.00 10.00 H new ATOM 0 HG2 PRO B 361 4.026 -10.447 -8.867 1.00 10.00 H new ATOM 0 HG3 PRO B 361 4.220 -11.860 -7.849 1.00 10.00 H new ATOM 0 HD2 PRO B 361 1.763 -10.667 -8.526 1.00 10.00 H new ATOM 0 HD3 PRO B 361 2.001 -11.837 -7.243 1.00 10.00 H new ATOM 1336 N ILE B 362 3.184 -6.614 -6.547 1.00 10.00 N ATOM 1337 CA ILE B 362 3.184 -5.330 -7.232 1.00 10.00 C ATOM 1338 C ILE B 362 4.494 -4.583 -7.033 1.00 10.00 C ATOM 1339 O ILE B 362 4.882 -4.279 -5.908 1.00 10.00 O ATOM 1340 CB ILE B 362 2.019 -4.433 -6.765 1.00 10.00 C ATOM 1341 CG1 ILE B 362 0.707 -5.222 -6.740 1.00 10.00 C ATOM 1342 CG2 ILE B 362 1.892 -3.217 -7.679 1.00 10.00 C ATOM 1343 CD1 ILE B 362 -0.472 -4.423 -6.235 1.00 10.00 C ATOM 0 H ILE B 362 3.022 -6.558 -5.542 1.00 10.00 H new ATOM 0 HA ILE B 362 3.060 -5.553 -8.292 1.00 10.00 H new ATOM 0 HB ILE B 362 2.231 -4.090 -5.752 1.00 10.00 H new ATOM 0 HG12 ILE B 362 0.489 -5.579 -7.746 1.00 10.00 H new ATOM 0 HG13 ILE B 362 0.835 -6.102 -6.110 1.00 10.00 H new ATOM 0 HG21 ILE B 362 1.067 -2.591 -7.340 1.00 10.00 H new ATOM 0 HG22 ILE B 362 2.818 -2.643 -7.651 1.00 10.00 H new ATOM 0 HG23 ILE B 362 1.701 -3.548 -8.700 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -1.366 -5.047 -6.246 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -0.275 -4.088 -5.216 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -0.627 -3.557 -6.878 1.00 10.00 H new ATOM 1355 N VAL B 363 5.172 -4.300 -8.137 1.00 10.00 N ATOM 1356 CA VAL B 363 6.432 -3.569 -8.108 1.00 10.00 C ATOM 1357 C VAL B 363 6.287 -2.290 -8.926 1.00 10.00 C ATOM 1358 O VAL B 363 5.687 -2.306 -10.001 1.00 10.00 O ATOM 1359 CB VAL B 363 7.605 -4.406 -8.672 1.00 10.00 C ATOM 1360 CG1 VAL B 363 8.943 -3.778 -8.303 1.00 10.00 C ATOM 1361 CG2 VAL B 363 7.534 -5.846 -8.177 1.00 10.00 C ATOM 0 H VAL B 363 4.867 -4.569 -9.072 1.00 10.00 H new ATOM 0 HA VAL B 363 6.660 -3.338 -7.067 1.00 10.00 H new ATOM 0 HB VAL B 363 7.519 -4.416 -9.759 1.00 10.00 H new ATOM 0 HG11 VAL B 363 9.753 -4.383 -8.710 1.00 10.00 H new ATOM 0 HG12 VAL B 363 8.999 -2.771 -8.717 1.00 10.00 H new ATOM 0 HG13 VAL B 363 9.035 -3.730 -7.218 1.00 10.00 H new ATOM 0 HG21 VAL B 363 8.369 -6.413 -8.587 1.00 10.00 H new ATOM 0 HG22 VAL B 363 7.586 -5.860 -7.088 1.00 10.00 H new ATOM 0 HG23 VAL B 363 6.596 -6.296 -8.501 1.00 10.00 H new ATOM 1371 N ILE B 364 6.820 -1.185 -8.424 1.00 10.00 N ATOM 1372 CA ILE B 364 6.715 0.089 -9.124 1.00 10.00 C ATOM 1373 C ILE B 364 8.065 0.558 -9.657 1.00 10.00 C ATOM 1374 O ILE B 364 9.094 -0.088 -9.442 1.00 10.00 O ATOM 1375 CB ILE B 364 6.129 1.188 -8.212 1.00 10.00 C ATOM 1376 CG1 ILE B 364 7.078 1.485 -7.047 1.00 10.00 C ATOM 1377 CG2 ILE B 364 4.761 0.770 -7.698 1.00 10.00 C ATOM 1378 CD1 ILE B 364 7.149 2.951 -6.677 1.00 10.00 C ATOM 0 H ILE B 364 7.327 -1.144 -7.540 1.00 10.00 H new ATOM 0 HA ILE B 364 6.042 -0.080 -9.965 1.00 10.00 H new ATOM 0 HB ILE B 364 6.015 2.101 -8.797 1.00 10.00 H new ATOM 0 HG12 ILE B 364 6.758 0.915 -6.175 1.00 10.00 H new ATOM 0 HG13 ILE B 364 8.078 1.136 -7.307 1.00 10.00 H new ATOM 0 HG21 ILE B 364 4.359 1.554 -7.056 1.00 10.00 H new ATOM 0 HG22 ILE B 364 4.089 0.611 -8.541 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.853 -0.154 -7.128 1.00 10.00 H new ATOM 0 HD11 ILE B 364 7.840 3.083 -5.845 1.00 10.00 H new ATOM 0 HD12 ILE B 364 7.499 3.526 -7.534 1.00 10.00 H new ATOM 0 HD13 ILE B 364 6.159 3.301 -6.385 1.00 10.00 H new