USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 586 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 60 ASN : amide:sc= 0.982 K(o=1.9,f=-3.1) USER MOD Set 1.2: A 62 GLN : amide:sc= 0.919 K(o=1.9,f=-3.1!) USER MOD Single : A 1 MET CE :methyl -117:sc= 0 (180deg=-0.115) USER MOD Single : A 1 MET N :NH3+ -155:sc= 2.04 (180deg=1.32) USER MOD Single : A 2 GLN : amide:sc= -1.09 K(o=-1.1,f=-0.021) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 89:sc= 0.56 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0748 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.0357 USER MOD Single : A 14 THR OG1 : rot -76:sc= 0.113 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0658 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0.285! K(o=0.28!,f=-0.31) USER MOD Single : A 27 LYS NZ :NH3+ -134:sc= 1.11 (180deg=0.0489) USER MOD Single : A 29 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00166) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 33 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0739) USER MOD Single : A 40 GLN : amide:sc= -0.47 K(o=-0.47,f=-1.2) USER MOD Single : A 41 GLN : amide:sc= -0.36 K(o=-0.36,f=-4.2!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.192 X(o=-0.19,f=-0.021) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0.928 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 1.07 (180deg=1.07) USER MOD Single : A 65 SER OG : rot -120:sc= 0.21 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.904 31.635 16.034 1.00 0.00 N ATOM 2 CA MET A 1 13.950 31.199 17.435 1.00 0.00 C ATOM 3 C MET A 1 15.307 31.538 18.050 1.00 0.00 C ATOM 4 O MET A 1 16.342 31.213 17.475 1.00 0.00 O ATOM 5 CB MET A 1 13.663 29.701 17.486 1.00 0.00 C ATOM 6 CG MET A 1 13.184 29.086 18.804 1.00 0.00 C ATOM 7 SD MET A 1 13.079 27.311 19.094 1.00 0.00 S ATOM 8 CE MET A 1 14.863 27.011 19.113 1.00 0.00 C ATOM 0 H1 MET A 1 12.916 31.799 15.754 1.00 0.00 H new ATOM 0 H2 MET A 1 14.446 32.516 15.927 1.00 0.00 H new ATOM 0 H3 MET A 1 14.318 30.898 15.427 1.00 0.00 H new ATOM 0 HA MET A 1 13.194 31.722 18.021 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.911 29.483 16.728 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.574 29.180 17.191 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.833 29.486 19.583 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.186 29.486 18.984 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.130 26.350 18.288 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.392 27.958 19.005 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.143 26.544 20.057 1.00 0.00 H new ATOM 20 N GLN A 2 15.204 32.136 19.238 1.00 0.00 N ATOM 21 CA GLN A 2 16.310 32.391 20.142 1.00 0.00 C ATOM 22 C GLN A 2 16.802 31.141 20.879 1.00 0.00 C ATOM 23 O GLN A 2 16.029 30.339 21.398 1.00 0.00 O ATOM 24 CB GLN A 2 15.902 33.411 21.193 1.00 0.00 C ATOM 25 CG GLN A 2 15.826 34.846 20.663 1.00 0.00 C ATOM 26 CD GLN A 2 15.928 35.833 21.808 1.00 0.00 C ATOM 27 OE1 GLN A 2 16.213 37.008 21.593 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.779 35.450 23.076 1.00 0.00 N ATOM 0 H GLN A 2 14.311 32.466 19.604 1.00 0.00 H new ATOM 0 HA GLN A 2 17.122 32.758 19.514 1.00 0.00 H new ATOM 0 HB2 GLN A 2 14.930 33.131 21.599 1.00 0.00 H new ATOM 0 HB3 GLN A 2 16.614 33.375 22.017 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.631 35.021 19.950 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.888 34.995 20.128 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.542 34.482 23.292 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.902 36.125 23.831 1.00 0.00 H new ATOM 37 N ILE A 3 18.126 30.983 20.875 1.00 0.00 N ATOM 38 CA ILE A 3 19.003 30.205 21.715 1.00 0.00 C ATOM 39 C ILE A 3 20.129 31.137 22.167 1.00 0.00 C ATOM 40 O ILE A 3 20.606 31.991 21.422 1.00 0.00 O ATOM 41 CB ILE A 3 19.492 28.957 20.967 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.666 29.088 19.997 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.417 28.036 20.389 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.182 27.683 19.676 1.00 0.00 C ATOM 0 H ILE A 3 18.676 31.477 20.173 1.00 0.00 H new ATOM 0 HA ILE A 3 18.493 29.822 22.599 1.00 0.00 H new ATOM 0 HB ILE A 3 19.914 28.463 21.842 1.00 0.00 H new ATOM 0 HG12 ILE A 3 20.350 29.594 19.085 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.458 29.692 20.439 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.892 27.193 19.886 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.782 27.667 21.195 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.810 28.590 19.673 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.021 27.753 18.984 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.509 27.197 20.595 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.384 27.098 19.220 1.00 0.00 H new ATOM 56 N PHE A 4 20.649 30.955 23.382 1.00 0.00 N ATOM 57 CA PHE A 4 21.818 31.579 23.983 1.00 0.00 C ATOM 58 C PHE A 4 22.938 30.545 23.881 1.00 0.00 C ATOM 59 O PHE A 4 22.787 29.362 24.210 1.00 0.00 O ATOM 60 CB PHE A 4 21.534 32.019 25.419 1.00 0.00 C ATOM 61 CG PHE A 4 20.759 33.302 25.604 1.00 0.00 C ATOM 62 CD1 PHE A 4 21.055 34.532 24.985 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.626 33.205 26.412 1.00 0.00 C ATOM 64 CE1 PHE A 4 20.169 35.604 25.145 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.736 34.274 26.562 1.00 0.00 C ATOM 66 CZ PHE A 4 18.984 35.480 25.881 1.00 0.00 C ATOM 0 H PHE A 4 20.214 30.299 24.031 1.00 0.00 H new ATOM 0 HA PHE A 4 22.105 32.496 23.468 1.00 0.00 H new ATOM 0 HB2 PHE A 4 20.987 31.218 25.916 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.488 32.122 25.936 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.953 34.647 24.395 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.431 32.281 26.935 1.00 0.00 H new ATOM 0 HE1 PHE A 4 20.406 36.553 24.688 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.866 34.174 27.195 1.00 0.00 H new ATOM 0 HZ PHE A 4 18.275 36.293 25.925 1.00 0.00 H new ATOM 76 N VAL A 5 24.151 30.999 23.600 1.00 0.00 N ATOM 77 CA VAL A 5 25.333 30.175 23.817 1.00 0.00 C ATOM 78 C VAL A 5 26.298 31.039 24.638 1.00 0.00 C ATOM 79 O VAL A 5 26.556 32.140 24.175 1.00 0.00 O ATOM 80 CB VAL A 5 25.821 29.744 22.437 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.012 28.797 22.606 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.721 29.140 21.564 1.00 0.00 C ATOM 0 H VAL A 5 24.343 31.927 23.224 1.00 0.00 H new ATOM 0 HA VAL A 5 25.183 29.254 24.381 1.00 0.00 H new ATOM 0 HB VAL A 5 26.140 30.635 21.896 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.369 28.483 21.625 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.814 29.311 23.136 1.00 0.00 H new ATOM 0 HG13 VAL A 5 26.703 27.922 23.177 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.138 28.856 20.598 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.310 28.258 22.055 1.00 0.00 H new ATOM 0 HG23 VAL A 5 23.930 29.875 21.416 1.00 0.00 H new ATOM 92 N LYS A 6 26.756 30.511 25.766 1.00 0.00 N ATOM 93 CA LYS A 6 27.753 31.108 26.629 1.00 0.00 C ATOM 94 C LYS A 6 29.165 30.779 26.141 1.00 0.00 C ATOM 95 O LYS A 6 29.632 29.637 26.182 1.00 0.00 O ATOM 96 CB LYS A 6 27.478 30.536 28.016 1.00 0.00 C ATOM 97 CG LYS A 6 26.667 31.505 28.883 1.00 0.00 C ATOM 98 CD LYS A 6 26.197 30.858 30.185 1.00 0.00 C ATOM 99 CE LYS A 6 25.290 31.789 30.980 1.00 0.00 C ATOM 100 NZ LYS A 6 25.220 31.443 32.405 1.00 0.00 N ATOM 0 H LYS A 6 26.423 29.612 26.116 1.00 0.00 H new ATOM 0 HA LYS A 6 27.694 32.196 26.635 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.937 29.595 27.920 1.00 0.00 H new ATOM 0 HB3 LYS A 6 28.423 30.311 28.510 1.00 0.00 H new ATOM 0 HG2 LYS A 6 27.275 32.380 29.113 1.00 0.00 H new ATOM 0 HG3 LYS A 6 25.802 31.856 28.321 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.664 29.934 29.961 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.062 30.588 30.790 1.00 0.00 H new ATOM 0 HE2 LYS A 6 25.650 32.813 30.878 1.00 0.00 H new ATOM 0 HE3 LYS A 6 24.287 31.760 30.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 24.589 32.110 32.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 24.850 30.477 32.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.171 31.497 32.822 1.00 0.00 H new ATOM 114 N THR A 7 29.809 31.862 25.731 1.00 0.00 N ATOM 115 CA THR A 7 31.224 31.857 25.407 1.00 0.00 C ATOM 116 C THR A 7 32.087 31.544 26.637 1.00 0.00 C ATOM 117 O THR A 7 31.755 31.517 27.811 1.00 0.00 O ATOM 118 CB THR A 7 31.552 33.245 24.864 1.00 0.00 C ATOM 119 OG1 THR A 7 30.531 33.701 24.010 1.00 0.00 O ATOM 120 CG2 THR A 7 32.826 33.266 24.018 1.00 0.00 C ATOM 0 H THR A 7 29.361 32.771 25.614 1.00 0.00 H new ATOM 0 HA THR A 7 31.441 31.080 24.674 1.00 0.00 H new ATOM 0 HB THR A 7 31.670 33.873 25.747 1.00 0.00 H new ATOM 0 HG1 THR A 7 29.852 34.174 24.535 1.00 0.00 H new ATOM 0 HG21 THR A 7 33.008 34.279 23.659 1.00 0.00 H new ATOM 0 HG22 THR A 7 33.671 32.938 24.624 1.00 0.00 H new ATOM 0 HG23 THR A 7 32.709 32.596 23.167 1.00 0.00 H new ATOM 128 N LEU A 8 33.314 31.131 26.342 1.00 0.00 N ATOM 129 CA LEU A 8 34.297 30.708 27.316 1.00 0.00 C ATOM 130 C LEU A 8 34.749 31.705 28.375 1.00 0.00 C ATOM 131 O LEU A 8 35.316 31.390 29.429 1.00 0.00 O ATOM 132 CB LEU A 8 35.505 30.134 26.570 1.00 0.00 C ATOM 133 CG LEU A 8 35.237 28.969 25.604 1.00 0.00 C ATOM 134 CD1 LEU A 8 34.979 29.277 24.138 1.00 0.00 C ATOM 135 CD2 LEU A 8 36.343 27.933 25.801 1.00 0.00 C ATOM 0 H LEU A 8 33.658 31.082 25.383 1.00 0.00 H new ATOM 0 HA LEU A 8 33.771 29.967 27.918 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.971 30.942 26.006 1.00 0.00 H new ATOM 0 HB3 LEU A 8 36.233 29.801 27.309 1.00 0.00 H new ATOM 0 HG LEU A 8 34.255 28.588 25.883 1.00 0.00 H new ATOM 0 HD11 LEU A 8 34.809 28.347 23.595 1.00 0.00 H new ATOM 0 HD12 LEU A 8 34.100 29.915 24.050 1.00 0.00 H new ATOM 0 HD13 LEU A 8 35.843 29.790 23.716 1.00 0.00 H new ATOM 0 HD21 LEU A 8 36.179 27.092 25.127 1.00 0.00 H new ATOM 0 HD22 LEU A 8 37.310 28.388 25.585 1.00 0.00 H new ATOM 0 HD23 LEU A 8 36.331 27.579 26.832 1.00 0.00 H new ATOM 147 N THR A 9 34.337 32.925 28.052 1.00 0.00 N ATOM 148 CA THR A 9 34.499 34.117 28.854 1.00 0.00 C ATOM 149 C THR A 9 33.257 34.386 29.702 1.00 0.00 C ATOM 150 O THR A 9 33.293 35.333 30.482 1.00 0.00 O ATOM 151 CB THR A 9 34.625 35.292 27.884 1.00 0.00 C ATOM 152 OG1 THR A 9 33.605 35.266 26.911 1.00 0.00 O ATOM 153 CG2 THR A 9 35.863 35.242 26.985 1.00 0.00 C ATOM 0 H THR A 9 33.855 33.112 27.173 1.00 0.00 H new ATOM 0 HA THR A 9 35.364 33.994 29.505 1.00 0.00 H new ATOM 0 HB THR A 9 34.622 36.150 28.557 1.00 0.00 H new ATOM 0 HG1 THR A 9 33.710 36.030 26.306 1.00 0.00 H new ATOM 0 HG21 THR A 9 35.872 36.113 26.330 1.00 0.00 H new ATOM 0 HG22 THR A 9 36.761 35.243 27.602 1.00 0.00 H new ATOM 0 HG23 THR A 9 35.838 34.334 26.382 1.00 0.00 H new ATOM 161 N GLY A 10 32.116 33.711 29.588 1.00 0.00 N ATOM 162 CA GLY A 10 30.958 33.996 30.408 1.00 0.00 C ATOM 163 C GLY A 10 29.858 34.722 29.645 1.00 0.00 C ATOM 164 O GLY A 10 28.663 34.677 29.967 1.00 0.00 O ATOM 0 H GLY A 10 31.975 32.952 28.922 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.562 33.062 30.806 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.263 34.602 31.261 1.00 0.00 H new ATOM 168 N LYS A 11 30.284 35.331 28.542 1.00 0.00 N ATOM 169 CA LYS A 11 29.375 36.139 27.741 1.00 0.00 C ATOM 170 C LYS A 11 28.436 35.339 26.833 1.00 0.00 C ATOM 171 O LYS A 11 28.981 34.381 26.280 1.00 0.00 O ATOM 172 CB LYS A 11 30.209 37.019 26.812 1.00 0.00 C ATOM 173 CG LYS A 11 31.185 37.977 27.501 1.00 0.00 C ATOM 174 CD LYS A 11 31.640 39.042 26.501 1.00 0.00 C ATOM 175 CE LYS A 11 32.458 40.131 27.209 1.00 0.00 C ATOM 176 NZ LYS A 11 32.549 41.330 26.360 1.00 0.00 N ATOM 0 H LYS A 11 31.239 35.281 28.188 1.00 0.00 H new ATOM 0 HA LYS A 11 28.763 36.689 28.456 1.00 0.00 H new ATOM 0 HB2 LYS A 11 30.776 36.373 26.142 1.00 0.00 H new ATOM 0 HB3 LYS A 11 29.531 37.605 26.192 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.705 38.449 28.359 1.00 0.00 H new ATOM 0 HG3 LYS A 11 32.046 37.427 27.880 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.240 38.580 25.717 1.00 0.00 H new ATOM 0 HD3 LYS A 11 30.772 39.489 26.016 1.00 0.00 H new ATOM 0 HE2 LYS A 11 31.992 40.385 28.161 1.00 0.00 H new ATOM 0 HE3 LYS A 11 33.457 39.758 27.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.105 42.060 26.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.013 41.085 25.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 31.593 41.693 26.168 1.00 0.00 H new ATOM 190 N THR A 12 27.171 35.624 26.583 1.00 0.00 N ATOM 191 CA THR A 12 26.242 35.096 25.603 1.00 0.00 C ATOM 192 C THR A 12 26.143 35.844 24.269 1.00 0.00 C ATOM 193 O THR A 12 26.232 37.069 24.202 1.00 0.00 O ATOM 194 CB THR A 12 24.819 34.975 26.170 1.00 0.00 C ATOM 195 OG1 THR A 12 24.553 36.167 26.873 1.00 0.00 O ATOM 196 CG2 THR A 12 24.622 33.786 27.106 1.00 0.00 C ATOM 0 H THR A 12 26.707 36.336 27.147 1.00 0.00 H new ATOM 0 HA THR A 12 26.682 34.123 25.384 1.00 0.00 H new ATOM 0 HB THR A 12 24.136 34.812 25.336 1.00 0.00 H new ATOM 0 HG1 THR A 12 23.649 36.130 27.250 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.592 33.771 27.463 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.833 32.861 26.569 1.00 0.00 H new ATOM 0 HG23 THR A 12 25.299 33.875 27.955 1.00 0.00 H new ATOM 204 N ILE A 13 26.203 35.066 23.185 1.00 0.00 N ATOM 205 CA ILE A 13 25.745 35.477 21.877 1.00 0.00 C ATOM 206 C ILE A 13 24.384 34.868 21.512 1.00 0.00 C ATOM 207 O ILE A 13 24.161 33.699 21.789 1.00 0.00 O ATOM 208 CB ILE A 13 26.796 35.193 20.810 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.216 33.722 20.662 1.00 0.00 C ATOM 210 CG2 ILE A 13 27.882 36.271 20.854 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.085 33.347 19.464 1.00 0.00 C ATOM 0 H ILE A 13 26.580 34.118 23.204 1.00 0.00 H new ATOM 0 HA ILE A 13 25.596 36.556 21.918 1.00 0.00 H new ATOM 0 HB ILE A 13 26.340 35.297 19.826 1.00 0.00 H new ATOM 0 HG12 ILE A 13 27.751 33.434 21.567 1.00 0.00 H new ATOM 0 HG13 ILE A 13 26.310 33.117 20.621 1.00 0.00 H new ATOM 0 HG21 ILE A 13 28.631 36.064 20.090 1.00 0.00 H new ATOM 0 HG22 ILE A 13 27.434 37.247 20.668 1.00 0.00 H new ATOM 0 HG23 ILE A 13 28.356 36.271 21.836 1.00 0.00 H new ATOM 0 HD11 ILE A 13 28.301 32.279 19.492 1.00 0.00 H new ATOM 0 HD12 ILE A 13 27.556 33.586 18.542 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.019 33.907 19.502 1.00 0.00 H new ATOM 223 N THR A 14 23.414 35.675 21.075 1.00 0.00 N ATOM 224 CA THR A 14 22.063 35.252 20.797 1.00 0.00 C ATOM 225 C THR A 14 22.122 34.812 19.334 1.00 0.00 C ATOM 226 O THR A 14 22.478 35.590 18.449 1.00 0.00 O ATOM 227 CB THR A 14 21.084 36.426 20.843 1.00 0.00 C ATOM 228 OG1 THR A 14 21.282 36.863 22.163 1.00 0.00 O ATOM 229 CG2 THR A 14 19.621 35.967 20.928 1.00 0.00 C ATOM 0 H THR A 14 23.564 36.669 20.904 1.00 0.00 H new ATOM 0 HA THR A 14 21.736 34.498 21.513 1.00 0.00 H new ATOM 0 HB THR A 14 21.235 37.091 19.993 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.827 36.253 22.781 1.00 0.00 H new ATOM 0 HG21 THR A 14 18.967 36.839 20.958 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.378 35.361 20.055 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.477 35.375 21.832 1.00 0.00 H new ATOM 237 N LEU A 15 21.623 33.601 19.066 1.00 0.00 N ATOM 238 CA LEU A 15 21.591 33.075 17.712 1.00 0.00 C ATOM 239 C LEU A 15 20.087 32.964 17.410 1.00 0.00 C ATOM 240 O LEU A 15 19.380 32.305 18.163 1.00 0.00 O ATOM 241 CB LEU A 15 22.239 31.701 17.607 1.00 0.00 C ATOM 242 CG LEU A 15 23.760 31.616 17.734 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.187 30.148 17.649 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.547 32.397 16.674 1.00 0.00 C ATOM 0 H LEU A 15 21.238 32.973 19.772 1.00 0.00 H new ATOM 0 HA LEU A 15 22.142 33.711 17.019 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.803 31.066 18.378 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.959 31.272 16.645 1.00 0.00 H new ATOM 0 HG LEU A 15 23.995 32.073 18.695 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.271 30.079 17.739 1.00 0.00 H new ATOM 0 HD12 LEU A 15 23.719 29.586 18.457 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.875 29.733 16.690 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.616 32.274 16.850 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.296 32.019 15.683 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.289 33.454 16.735 1.00 0.00 H new ATOM 256 N GLU A 16 19.644 33.471 16.259 1.00 0.00 N ATOM 257 CA GLU A 16 18.262 33.381 15.842 1.00 0.00 C ATOM 258 C GLU A 16 18.210 32.240 14.821 1.00 0.00 C ATOM 259 O GLU A 16 18.566 32.349 13.657 1.00 0.00 O ATOM 260 CB GLU A 16 17.734 34.657 15.181 1.00 0.00 C ATOM 261 CG GLU A 16 16.709 35.473 15.969 1.00 0.00 C ATOM 262 CD GLU A 16 15.359 34.779 15.928 1.00 0.00 C ATOM 263 OE1 GLU A 16 15.200 33.626 15.452 1.00 0.00 O ATOM 264 OE2 GLU A 16 14.395 35.412 16.428 1.00 0.00 O ATOM 0 H GLU A 16 20.245 33.957 15.593 1.00 0.00 H new ATOM 0 HA GLU A 16 17.637 33.217 16.720 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.585 35.302 14.962 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.287 34.384 14.225 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.038 35.588 17.002 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.626 36.475 15.548 1.00 0.00 H new ATOM 271 N VAL A 17 17.798 31.058 15.284 1.00 0.00 N ATOM 272 CA VAL A 17 17.757 29.846 14.494 1.00 0.00 C ATOM 273 C VAL A 17 16.338 29.346 14.234 1.00 0.00 C ATOM 274 O VAL A 17 15.343 29.693 14.876 1.00 0.00 O ATOM 275 CB VAL A 17 18.661 28.860 15.247 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.050 29.467 15.388 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.107 28.390 16.601 1.00 0.00 C ATOM 0 H VAL A 17 17.478 30.924 16.243 1.00 0.00 H new ATOM 0 HA VAL A 17 18.123 30.001 13.479 1.00 0.00 H new ATOM 0 HB VAL A 17 18.707 27.950 14.649 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.698 28.772 15.922 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.464 29.662 14.399 1.00 0.00 H new ATOM 0 HG13 VAL A 17 19.984 30.402 15.944 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.811 27.697 17.061 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.965 29.251 17.255 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.151 27.889 16.449 1.00 0.00 H new ATOM 287 N GLU A 18 16.195 28.391 13.322 1.00 0.00 N ATOM 288 CA GLU A 18 15.010 27.589 13.095 1.00 0.00 C ATOM 289 C GLU A 18 15.204 26.324 13.930 1.00 0.00 C ATOM 290 O GLU A 18 16.327 25.875 14.108 1.00 0.00 O ATOM 291 CB GLU A 18 15.073 27.003 11.684 1.00 0.00 C ATOM 292 CG GLU A 18 14.589 28.023 10.649 1.00 0.00 C ATOM 293 CD GLU A 18 13.078 28.144 10.531 1.00 0.00 C ATOM 294 OE1 GLU A 18 12.421 27.093 10.385 1.00 0.00 O ATOM 295 OE2 GLU A 18 12.617 29.284 10.758 1.00 0.00 O ATOM 0 H GLU A 18 16.953 28.145 12.685 1.00 0.00 H new ATOM 0 HA GLU A 18 14.118 28.184 13.294 1.00 0.00 H new ATOM 0 HB2 GLU A 18 16.096 26.703 11.455 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.458 26.105 11.631 1.00 0.00 H new ATOM 0 HG2 GLU A 18 14.999 29.000 10.904 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.995 27.751 9.675 1.00 0.00 H new ATOM 302 N PRO A 19 14.153 25.690 14.441 1.00 0.00 N ATOM 303 CA PRO A 19 14.274 24.526 15.301 1.00 0.00 C ATOM 304 C PRO A 19 14.690 23.236 14.595 1.00 0.00 C ATOM 305 O PRO A 19 15.002 22.294 15.320 1.00 0.00 O ATOM 306 CB PRO A 19 12.972 24.192 16.024 1.00 0.00 C ATOM 307 CG PRO A 19 11.973 24.994 15.195 1.00 0.00 C ATOM 308 CD PRO A 19 12.740 26.021 14.366 1.00 0.00 C ATOM 0 HA PRO A 19 15.061 24.836 15.989 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.755 23.124 16.013 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.987 24.504 17.068 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.404 24.331 14.543 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.256 25.493 15.846 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.399 26.007 13.331 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.563 27.027 14.746 1.00 0.00 H new ATOM 316 N SER A 20 14.592 23.180 13.268 1.00 0.00 N ATOM 317 CA SER A 20 14.914 22.068 12.405 1.00 0.00 C ATOM 318 C SER A 20 16.396 22.056 12.009 1.00 0.00 C ATOM 319 O SER A 20 16.957 21.147 11.413 1.00 0.00 O ATOM 320 CB SER A 20 13.934 22.077 11.224 1.00 0.00 C ATOM 321 OG SER A 20 13.922 23.385 10.715 1.00 0.00 O ATOM 0 H SER A 20 14.257 23.982 12.735 1.00 0.00 H new ATOM 0 HA SER A 20 14.786 21.124 12.934 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.246 21.367 10.458 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.937 21.779 11.547 1.00 0.00 H new ATOM 0 HG SER A 20 13.307 23.434 9.954 1.00 0.00 H new ATOM 327 N ASP A 21 17.089 23.112 12.419 1.00 0.00 N ATOM 328 CA ASP A 21 18.466 23.369 12.036 1.00 0.00 C ATOM 329 C ASP A 21 19.320 22.393 12.853 1.00 0.00 C ATOM 330 O ASP A 21 19.000 22.001 13.971 1.00 0.00 O ATOM 331 CB ASP A 21 18.815 24.812 12.402 1.00 0.00 C ATOM 332 CG ASP A 21 19.841 25.532 11.539 1.00 0.00 C ATOM 333 OD1 ASP A 21 20.293 25.046 10.484 1.00 0.00 O ATOM 334 OD2 ASP A 21 20.117 26.729 11.806 1.00 0.00 O ATOM 0 H ASP A 21 16.700 23.824 13.037 1.00 0.00 H new ATOM 0 HA ASP A 21 18.634 23.235 10.967 1.00 0.00 H new ATOM 0 HB2 ASP A 21 17.894 25.395 12.385 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.177 24.819 13.430 1.00 0.00 H new ATOM 339 N THR A 22 20.500 22.018 12.377 1.00 0.00 N ATOM 340 CA THR A 22 21.503 21.178 12.990 1.00 0.00 C ATOM 341 C THR A 22 22.591 22.025 13.662 1.00 0.00 C ATOM 342 O THR A 22 22.631 23.248 13.538 1.00 0.00 O ATOM 343 CB THR A 22 22.121 20.236 11.961 1.00 0.00 C ATOM 344 OG1 THR A 22 22.875 20.837 10.934 1.00 0.00 O ATOM 345 CG2 THR A 22 21.111 19.240 11.400 1.00 0.00 C ATOM 0 H THR A 22 20.803 22.332 11.455 1.00 0.00 H new ATOM 0 HA THR A 22 21.015 20.578 13.758 1.00 0.00 H new ATOM 0 HB THR A 22 22.861 19.692 12.548 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.224 20.144 10.336 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.603 18.594 10.673 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.709 18.633 12.211 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.298 19.780 10.914 1.00 0.00 H new ATOM 353 N ILE A 23 23.523 21.420 14.395 1.00 0.00 N ATOM 354 CA ILE A 23 24.428 22.021 15.352 1.00 0.00 C ATOM 355 C ILE A 23 25.662 22.535 14.618 1.00 0.00 C ATOM 356 O ILE A 23 26.115 23.655 14.853 1.00 0.00 O ATOM 357 CB ILE A 23 24.977 21.002 16.359 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.894 20.059 16.883 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.760 21.770 17.422 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.808 20.806 17.661 1.00 0.00 C ATOM 0 H ILE A 23 23.671 20.413 14.323 1.00 0.00 H new ATOM 0 HA ILE A 23 23.860 22.799 15.862 1.00 0.00 H new ATOM 0 HB ILE A 23 25.671 20.312 15.879 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.440 19.528 16.046 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.349 19.307 17.528 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.163 21.070 18.154 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.579 22.313 16.950 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.098 22.476 17.923 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.060 20.096 18.014 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.257 21.315 18.514 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.333 21.540 17.009 1.00 0.00 H new ATOM 372 N GLU A 24 25.956 21.948 13.457 1.00 0.00 N ATOM 373 CA GLU A 24 26.984 22.271 12.483 1.00 0.00 C ATOM 374 C GLU A 24 26.649 23.607 11.823 1.00 0.00 C ATOM 375 O GLU A 24 27.613 24.346 11.612 1.00 0.00 O ATOM 376 CB GLU A 24 27.018 21.141 11.456 1.00 0.00 C ATOM 377 CG GLU A 24 28.160 21.451 10.482 1.00 0.00 C ATOM 378 CD GLU A 24 28.667 20.198 9.795 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.850 19.294 9.529 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.901 20.039 9.626 1.00 0.00 O ATOM 0 H GLU A 24 25.413 21.142 13.147 1.00 0.00 H new ATOM 0 HA GLU A 24 27.963 22.366 12.953 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.179 20.181 11.945 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.068 21.073 10.926 1.00 0.00 H new ATOM 0 HG2 GLU A 24 27.815 22.163 9.732 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.979 21.927 11.021 1.00 0.00 H new ATOM 387 N ASN A 25 25.420 24.058 11.634 1.00 0.00 N ATOM 388 CA ASN A 25 25.045 25.391 11.194 1.00 0.00 C ATOM 389 C ASN A 25 24.934 26.400 12.346 1.00 0.00 C ATOM 390 O ASN A 25 24.930 27.604 12.122 1.00 0.00 O ATOM 391 CB ASN A 25 23.645 25.343 10.570 1.00 0.00 C ATOM 392 CG ASN A 25 23.325 26.444 9.577 1.00 0.00 C ATOM 393 OD1 ASN A 25 24.150 27.001 8.848 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.051 26.794 9.471 1.00 0.00 N ATOM 0 H ASN A 25 24.606 23.465 11.794 1.00 0.00 H new ATOM 0 HA ASN A 25 25.825 25.704 10.500 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.524 24.382 10.070 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.909 25.379 11.373 1.00 0.00 H new ATOM 0 HD21 ASN A 25 21.773 27.509 8.798 1.00 0.00 H new ATOM 0 HD22 ASN A 25 21.349 26.349 10.062 1.00 0.00 H new ATOM 401 N VAL A 26 24.823 25.939 13.597 1.00 0.00 N ATOM 402 CA VAL A 26 24.924 26.672 14.839 1.00 0.00 C ATOM 403 C VAL A 26 26.415 27.009 14.912 1.00 0.00 C ATOM 404 O VAL A 26 26.743 28.187 15.117 1.00 0.00 O ATOM 405 CB VAL A 26 24.309 25.983 16.057 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.830 26.455 17.408 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.786 26.147 16.021 1.00 0.00 C ATOM 0 H VAL A 26 24.644 24.950 13.768 1.00 0.00 H new ATOM 0 HA VAL A 26 24.311 27.573 14.857 1.00 0.00 H new ATOM 0 HB VAL A 26 24.609 24.938 15.977 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.329 25.903 18.204 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.904 26.280 17.465 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.630 27.520 17.523 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.347 25.656 16.889 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.534 27.207 16.037 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.393 25.695 15.111 1.00 0.00 H new ATOM 417 N LYS A 27 27.336 26.072 14.755 1.00 0.00 N ATOM 418 CA LYS A 27 28.735 26.346 15.010 1.00 0.00 C ATOM 419 C LYS A 27 29.288 27.199 13.861 1.00 0.00 C ATOM 420 O LYS A 27 30.094 28.095 14.100 1.00 0.00 O ATOM 421 CB LYS A 27 29.509 25.030 15.048 1.00 0.00 C ATOM 422 CG LYS A 27 29.264 24.055 16.190 1.00 0.00 C ATOM 423 CD LYS A 27 29.951 22.720 15.900 1.00 0.00 C ATOM 424 CE LYS A 27 29.725 21.692 17.015 1.00 0.00 C ATOM 425 NZ LYS A 27 30.524 20.503 16.680 1.00 0.00 N ATOM 0 H LYS A 27 27.138 25.118 14.453 1.00 0.00 H new ATOM 0 HA LYS A 27 28.839 26.869 15.961 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.304 24.502 14.117 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.571 25.275 15.048 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.644 24.473 17.122 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.193 23.900 16.323 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.576 22.319 14.958 1.00 0.00 H new ATOM 0 HD3 LYS A 27 31.021 22.885 15.773 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.027 22.099 17.980 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.668 21.436 17.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 29.946 19.648 16.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.836 20.562 15.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.356 20.457 17.303 1.00 0.00 H new ATOM 439 N ALA A 28 28.813 27.116 12.625 1.00 0.00 N ATOM 440 CA ALA A 28 29.121 28.057 11.555 1.00 0.00 C ATOM 441 C ALA A 28 28.589 29.478 11.755 1.00 0.00 C ATOM 442 O ALA A 28 29.307 30.455 11.580 1.00 0.00 O ATOM 443 CB ALA A 28 28.624 27.433 10.249 1.00 0.00 C ATOM 0 H ALA A 28 28.184 26.369 12.330 1.00 0.00 H new ATOM 0 HA ALA A 28 30.200 28.209 11.541 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.836 28.108 9.420 1.00 0.00 H new ATOM 0 HB2 ALA A 28 29.132 26.483 10.083 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.549 27.263 10.313 1.00 0.00 H new ATOM 449 N LYS A 29 27.504 29.682 12.487 1.00 0.00 N ATOM 450 CA LYS A 29 27.141 31.040 12.857 1.00 0.00 C ATOM 451 C LYS A 29 28.084 31.767 13.819 1.00 0.00 C ATOM 452 O LYS A 29 28.282 32.973 13.666 1.00 0.00 O ATOM 453 CB LYS A 29 25.717 31.051 13.398 1.00 0.00 C ATOM 454 CG LYS A 29 24.593 31.038 12.353 1.00 0.00 C ATOM 455 CD LYS A 29 23.195 31.267 12.908 1.00 0.00 C ATOM 456 CE LYS A 29 22.172 31.478 11.800 1.00 0.00 C ATOM 457 NZ LYS A 29 21.992 30.267 10.978 1.00 0.00 N ATOM 0 H LYS A 29 26.878 28.951 12.827 1.00 0.00 H new ATOM 0 HA LYS A 29 27.228 31.613 11.934 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.591 30.184 14.047 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.595 31.937 14.021 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.802 31.805 11.608 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.609 30.079 11.836 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.901 30.411 13.516 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.203 32.137 13.565 1.00 0.00 H new ATOM 0 HE2 LYS A 29 21.216 31.764 12.239 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.491 32.304 11.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.275 30.448 10.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 22.894 30.018 10.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 21.679 29.481 11.582 1.00 0.00 H new ATOM 471 N ILE A 30 28.590 30.989 14.773 1.00 0.00 N ATOM 472 CA ILE A 30 29.630 31.339 15.712 1.00 0.00 C ATOM 473 C ILE A 30 31.025 31.377 15.080 1.00 0.00 C ATOM 474 O ILE A 30 31.850 32.185 15.494 1.00 0.00 O ATOM 475 CB ILE A 30 29.523 30.362 16.886 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.106 30.164 17.416 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.535 30.683 17.991 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.817 28.912 18.252 1.00 0.00 C ATOM 0 H ILE A 30 28.256 30.035 14.912 1.00 0.00 H new ATOM 0 HA ILE A 30 29.486 32.360 16.065 1.00 0.00 H new ATOM 0 HB ILE A 30 29.792 29.388 16.477 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.851 31.035 18.020 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.428 30.159 16.562 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.425 29.966 18.805 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.546 30.622 17.588 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.355 31.690 18.368 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.770 28.911 18.556 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.023 28.022 17.657 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.452 28.911 19.138 1.00 0.00 H new ATOM 490 N GLN A 31 31.250 30.735 13.942 1.00 0.00 N ATOM 491 CA GLN A 31 32.300 31.114 13.010 1.00 0.00 C ATOM 492 C GLN A 31 32.119 32.463 12.325 1.00 0.00 C ATOM 493 O GLN A 31 33.142 33.065 12.027 1.00 0.00 O ATOM 494 CB GLN A 31 32.550 29.981 12.015 1.00 0.00 C ATOM 495 CG GLN A 31 33.699 30.229 11.033 1.00 0.00 C ATOM 496 CD GLN A 31 34.026 29.024 10.173 1.00 0.00 C ATOM 497 OE1 GLN A 31 33.169 28.212 9.830 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.300 28.756 9.861 1.00 0.00 N ATOM 0 H GLN A 31 30.703 29.929 13.638 1.00 0.00 H new ATOM 0 HA GLN A 31 33.193 31.268 13.616 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.758 29.067 12.572 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.636 29.808 11.447 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.440 31.068 10.387 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.589 30.520 11.592 1.00 0.00 H new ATOM 0 HE21 GLN A 31 36.038 29.407 10.129 1.00 0.00 H new ATOM 0 HE22 GLN A 31 35.532 27.901 9.355 1.00 0.00 H new ATOM 507 N ASP A 32 30.903 32.956 12.062 1.00 0.00 N ATOM 508 CA ASP A 32 30.650 34.172 11.322 1.00 0.00 C ATOM 509 C ASP A 32 30.774 35.319 12.333 1.00 0.00 C ATOM 510 O ASP A 32 31.579 36.213 12.100 1.00 0.00 O ATOM 511 CB ASP A 32 29.225 34.151 10.769 1.00 0.00 C ATOM 512 CG ASP A 32 28.978 34.947 9.495 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.769 34.693 8.554 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.107 35.845 9.485 1.00 0.00 O ATOM 0 H ASP A 32 30.048 32.495 12.374 1.00 0.00 H new ATOM 0 HA ASP A 32 31.345 34.282 10.490 1.00 0.00 H new ATOM 0 HB2 ASP A 32 28.947 33.114 10.582 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.554 34.527 11.541 1.00 0.00 H new ATOM 519 N LYS A 33 29.966 35.253 13.386 1.00 0.00 N ATOM 520 CA LYS A 33 30.045 36.056 14.583 1.00 0.00 C ATOM 521 C LYS A 33 31.403 36.280 15.253 1.00 0.00 C ATOM 522 O LYS A 33 31.972 37.361 15.225 1.00 0.00 O ATOM 523 CB LYS A 33 28.904 35.690 15.539 1.00 0.00 C ATOM 524 CG LYS A 33 27.532 36.260 15.163 1.00 0.00 C ATOM 525 CD LYS A 33 26.449 35.897 16.172 1.00 0.00 C ATOM 526 CE LYS A 33 25.075 36.389 15.718 1.00 0.00 C ATOM 527 NZ LYS A 33 25.017 37.856 15.802 1.00 0.00 N ATOM 0 H LYS A 33 29.191 34.591 13.420 1.00 0.00 H new ATOM 0 HA LYS A 33 29.907 37.074 14.219 1.00 0.00 H new ATOM 0 HB2 LYS A 33 28.827 34.604 15.589 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.163 36.038 16.539 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.602 37.345 15.086 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.246 35.888 14.179 1.00 0.00 H new ATOM 0 HD2 LYS A 33 26.423 34.816 16.307 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.691 36.334 17.141 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.883 36.067 14.695 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.297 35.949 16.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.040 38.175 15.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.329 38.162 16.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.640 38.270 15.080 1.00 0.00 H new ATOM 541 N GLU A 34 31.894 35.205 15.861 1.00 0.00 N ATOM 542 CA GLU A 34 32.967 35.097 16.828 1.00 0.00 C ATOM 543 C GLU A 34 34.308 34.584 16.289 1.00 0.00 C ATOM 544 O GLU A 34 35.444 34.828 16.688 1.00 0.00 O ATOM 545 CB GLU A 34 32.558 34.390 18.120 1.00 0.00 C ATOM 546 CG GLU A 34 31.665 35.224 19.050 1.00 0.00 C ATOM 547 CD GLU A 34 32.357 36.454 19.613 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.318 36.204 20.366 1.00 0.00 O ATOM 549 OE2 GLU A 34 31.984 37.635 19.430 1.00 0.00 O ATOM 0 H GLU A 34 31.500 34.286 15.660 1.00 0.00 H new ATOM 0 HA GLU A 34 33.160 36.140 17.079 1.00 0.00 H new ATOM 0 HB2 GLU A 34 32.034 33.469 17.864 1.00 0.00 H new ATOM 0 HB3 GLU A 34 33.459 34.104 18.663 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.775 35.536 18.503 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.328 34.597 19.875 1.00 0.00 H new ATOM 556 N GLY A 35 34.157 33.780 15.247 1.00 0.00 N ATOM 557 CA GLY A 35 35.297 33.418 14.434 1.00 0.00 C ATOM 558 C GLY A 35 35.906 32.019 14.590 1.00 0.00 C ATOM 559 O GLY A 35 36.821 31.665 13.849 1.00 0.00 O ATOM 0 H GLY A 35 33.269 33.374 14.952 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.008 33.537 13.390 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.086 34.144 14.631 1.00 0.00 H new ATOM 563 N ILE A 36 35.491 31.247 15.589 1.00 0.00 N ATOM 564 CA ILE A 36 36.060 30.017 16.095 1.00 0.00 C ATOM 565 C ILE A 36 35.528 28.928 15.164 1.00 0.00 C ATOM 566 O ILE A 36 34.304 28.920 15.038 1.00 0.00 O ATOM 567 CB ILE A 36 35.544 29.884 17.526 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.727 31.135 18.392 1.00 0.00 C ATOM 569 CG2 ILE A 36 36.041 28.617 18.221 1.00 0.00 C ATOM 570 CD1 ILE A 36 37.158 31.665 18.570 1.00 0.00 C ATOM 0 H ILE A 36 34.656 31.502 16.117 1.00 0.00 H new ATOM 0 HA ILE A 36 37.149 29.966 16.117 1.00 0.00 H new ATOM 0 HB ILE A 36 34.465 29.781 17.412 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.122 31.934 17.963 1.00 0.00 H new ATOM 0 HG13 ILE A 36 35.320 30.923 19.381 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.642 28.577 19.234 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.706 27.742 17.665 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.130 28.627 18.260 1.00 0.00 H new ATOM 0 HD11 ILE A 36 37.141 32.551 19.204 1.00 0.00 H new ATOM 0 HD12 ILE A 36 37.775 30.897 19.036 1.00 0.00 H new ATOM 0 HD13 ILE A 36 37.574 31.923 17.596 1.00 0.00 H new ATOM 582 N PRO A 37 36.317 28.086 14.507 1.00 0.00 N ATOM 583 CA PRO A 37 35.844 27.148 13.518 1.00 0.00 C ATOM 584 C PRO A 37 35.105 25.953 14.136 1.00 0.00 C ATOM 585 O PRO A 37 35.482 25.634 15.260 1.00 0.00 O ATOM 586 CB PRO A 37 37.070 26.705 12.715 1.00 0.00 C ATOM 587 CG PRO A 37 38.302 27.050 13.539 1.00 0.00 C ATOM 588 CD PRO A 37 37.770 28.072 14.541 1.00 0.00 C ATOM 0 HA PRO A 37 35.105 27.625 12.874 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.030 25.635 12.513 1.00 0.00 H new ATOM 0 HB3 PRO A 37 37.100 27.210 11.750 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.713 26.172 14.038 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.097 27.467 12.921 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.117 27.825 15.544 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.158 29.063 14.304 1.00 0.00 H new ATOM 596 N PRO A 38 34.091 25.354 13.517 1.00 0.00 N ATOM 597 CA PRO A 38 33.219 24.342 14.061 1.00 0.00 C ATOM 598 C PRO A 38 33.911 23.008 14.342 1.00 0.00 C ATOM 599 O PRO A 38 33.335 22.197 15.061 1.00 0.00 O ATOM 600 CB PRO A 38 32.077 24.269 13.052 1.00 0.00 C ATOM 601 CG PRO A 38 32.811 24.431 11.710 1.00 0.00 C ATOM 602 CD PRO A 38 34.000 25.320 12.069 1.00 0.00 C ATOM 0 HA PRO A 38 32.859 24.597 15.058 1.00 0.00 H new ATOM 0 HB2 PRO A 38 31.543 23.321 13.111 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.343 25.059 13.211 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.133 23.470 11.308 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.175 24.894 10.956 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.919 24.926 11.635 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.864 26.325 11.669 1.00 0.00 H new ATOM 610 N ASP A 39 35.128 22.794 13.837 1.00 0.00 N ATOM 611 CA ASP A 39 35.828 21.586 14.225 1.00 0.00 C ATOM 612 C ASP A 39 36.566 21.699 15.553 1.00 0.00 C ATOM 613 O ASP A 39 36.966 20.691 16.136 1.00 0.00 O ATOM 614 CB ASP A 39 36.768 21.069 13.127 1.00 0.00 C ATOM 615 CG ASP A 39 38.034 21.889 12.943 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.043 22.943 12.273 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.063 21.254 13.260 1.00 0.00 O ATOM 0 H ASP A 39 35.622 23.411 13.192 1.00 0.00 H new ATOM 0 HA ASP A 39 35.037 20.850 14.369 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.047 20.041 13.359 1.00 0.00 H new ATOM 0 HB3 ASP A 39 36.225 21.046 12.182 1.00 0.00 H new ATOM 622 N GLN A 40 36.599 22.885 16.153 1.00 0.00 N ATOM 623 CA GLN A 40 37.045 23.149 17.507 1.00 0.00 C ATOM 624 C GLN A 40 35.866 23.510 18.426 1.00 0.00 C ATOM 625 O GLN A 40 35.989 23.563 19.641 1.00 0.00 O ATOM 626 CB GLN A 40 38.351 23.939 17.561 1.00 0.00 C ATOM 627 CG GLN A 40 39.216 23.905 18.822 1.00 0.00 C ATOM 628 CD GLN A 40 39.729 22.552 19.309 1.00 0.00 C ATOM 629 OE1 GLN A 40 38.950 21.693 19.701 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.012 22.218 19.205 1.00 0.00 N ATOM 0 H GLN A 40 36.296 23.734 15.675 1.00 0.00 H new ATOM 0 HA GLN A 40 37.396 22.236 17.989 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.972 23.596 16.733 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.106 24.983 17.364 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.080 24.546 18.650 1.00 0.00 H new ATOM 0 HG3 GLN A 40 38.642 24.354 19.632 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.693 22.905 18.882 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.315 21.275 19.448 1.00 0.00 H new ATOM 639 N GLN A 41 34.671 23.704 17.868 1.00 0.00 N ATOM 640 CA GLN A 41 33.524 24.037 18.703 1.00 0.00 C ATOM 641 C GLN A 41 32.814 22.729 19.061 1.00 0.00 C ATOM 642 O GLN A 41 32.403 21.876 18.279 1.00 0.00 O ATOM 643 CB GLN A 41 32.467 24.862 17.972 1.00 0.00 C ATOM 644 CG GLN A 41 32.904 26.281 17.620 1.00 0.00 C ATOM 645 CD GLN A 41 31.760 27.111 17.037 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.633 26.921 17.497 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.024 28.067 16.163 1.00 0.00 N ATOM 0 H GLN A 41 34.477 23.638 16.869 1.00 0.00 H new ATOM 0 HA GLN A 41 33.907 24.601 19.553 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.189 24.343 17.055 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.572 24.914 18.592 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.288 26.773 18.514 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.723 26.239 16.902 1.00 0.00 H new ATOM 0 HE21 GLN A 41 32.973 28.187 15.809 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.278 28.685 15.842 1.00 0.00 H new ATOM 656 N ARG A 42 32.707 22.574 20.379 1.00 0.00 N ATOM 657 CA ARG A 42 31.972 21.555 21.091 1.00 0.00 C ATOM 658 C ARG A 42 31.026 22.248 22.073 1.00 0.00 C ATOM 659 O ARG A 42 31.433 23.194 22.739 1.00 0.00 O ATOM 660 CB ARG A 42 32.819 20.378 21.564 1.00 0.00 C ATOM 661 CG ARG A 42 33.458 19.635 20.391 1.00 0.00 C ATOM 662 CD ARG A 42 34.023 18.265 20.770 1.00 0.00 C ATOM 663 NE ARG A 42 35.171 17.968 19.902 1.00 0.00 N ATOM 664 CZ ARG A 42 35.567 16.751 19.511 1.00 0.00 C ATOM 665 NH1 ARG A 42 34.727 15.714 19.643 1.00 0.00 N ATOM 666 NH2 ARG A 42 36.690 16.465 18.853 1.00 0.00 N ATOM 0 H ARG A 42 33.174 23.215 21.020 1.00 0.00 H new ATOM 0 HA ARG A 42 31.322 20.991 20.422 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.599 20.737 22.236 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.198 19.689 22.136 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.715 19.507 19.604 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.259 20.247 19.977 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.330 18.260 21.816 1.00 0.00 H new ATOM 0 HD3 ARG A 42 33.257 17.497 20.659 1.00 0.00 H new ATOM 0 HE ARG A 42 35.716 18.762 19.567 1.00 0.00 H new ATOM 0 HH11 ARG A 42 33.798 15.858 20.038 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.018 14.782 19.349 1.00 0.00 H new ATOM 0 HH21 ARG A 42 37.339 17.211 18.603 1.00 0.00 H new ATOM 0 HH22 ARG A 42 36.901 15.500 18.600 1.00 0.00 H new ATOM 680 N LEU A 43 29.791 21.761 22.204 1.00 0.00 N ATOM 681 CA LEU A 43 28.873 22.288 23.210 1.00 0.00 C ATOM 682 C LEU A 43 28.699 21.338 24.394 1.00 0.00 C ATOM 683 O LEU A 43 28.889 20.135 24.256 1.00 0.00 O ATOM 684 CB LEU A 43 27.479 22.542 22.631 1.00 0.00 C ATOM 685 CG LEU A 43 27.499 23.671 21.609 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.366 23.565 20.583 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.541 25.092 22.169 1.00 0.00 C ATOM 0 H LEU A 43 29.408 21.009 21.631 1.00 0.00 H new ATOM 0 HA LEU A 43 29.326 23.222 23.544 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.107 21.631 22.162 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.788 22.791 23.437 1.00 0.00 H new ATOM 0 HG LEU A 43 28.461 23.512 21.121 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.432 24.396 19.881 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.454 22.624 20.040 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.405 23.599 21.097 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.552 25.807 21.346 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.661 25.265 22.788 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.440 25.219 22.772 1.00 0.00 H new ATOM 699 N ILE A 44 28.415 21.868 25.578 1.00 0.00 N ATOM 700 CA ILE A 44 27.708 21.378 26.744 1.00 0.00 C ATOM 701 C ILE A 44 26.289 21.944 26.761 1.00 0.00 C ATOM 702 O ILE A 44 26.086 23.157 26.688 1.00 0.00 O ATOM 703 CB ILE A 44 28.583 21.522 27.994 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.918 20.808 27.797 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.861 21.033 29.245 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.875 21.071 28.954 1.00 0.00 C ATOM 0 H ILE A 44 28.736 22.818 25.764 1.00 0.00 H new ATOM 0 HA ILE A 44 27.534 20.302 26.714 1.00 0.00 H new ATOM 0 HB ILE A 44 28.787 22.582 28.143 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.747 19.736 27.703 1.00 0.00 H new ATOM 0 HG13 ILE A 44 30.374 21.141 26.865 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.513 21.151 30.111 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.953 21.617 29.393 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.601 19.981 29.127 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.813 20.546 28.777 1.00 0.00 H new ATOM 0 HD12 ILE A 44 31.067 22.141 29.031 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.430 20.714 29.883 1.00 0.00 H new ATOM 718 N PHE A 45 25.421 21.047 27.236 1.00 0.00 N ATOM 719 CA PHE A 45 24.088 21.353 27.719 1.00 0.00 C ATOM 720 C PHE A 45 23.549 20.395 28.791 1.00 0.00 C ATOM 721 O PHE A 45 23.446 19.183 28.601 1.00 0.00 O ATOM 722 CB PHE A 45 23.113 21.416 26.543 1.00 0.00 C ATOM 723 CG PHE A 45 21.693 21.864 26.774 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.376 22.941 27.612 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.761 21.435 25.823 1.00 0.00 C ATOM 726 CE1 PHE A 45 20.026 23.304 27.680 1.00 0.00 C ATOM 727 CE2 PHE A 45 19.409 21.789 25.907 1.00 0.00 C ATOM 728 CZ PHE A 45 19.042 22.767 26.839 1.00 0.00 C ATOM 0 H PHE A 45 25.643 20.053 27.293 1.00 0.00 H new ATOM 0 HA PHE A 45 24.173 22.321 28.212 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.547 22.080 25.796 1.00 0.00 H new ATOM 0 HB3 PHE A 45 23.073 20.421 26.100 1.00 0.00 H new ATOM 0 HD1 PHE A 45 22.134 23.464 28.176 1.00 0.00 H new ATOM 0 HD2 PHE A 45 21.093 20.815 25.003 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.728 24.034 28.417 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.671 21.322 25.272 1.00 0.00 H new ATOM 0 HZ PHE A 45 18.018 23.102 26.909 1.00 0.00 H new ATOM 738 N ALA A 46 23.257 20.972 29.954 1.00 0.00 N ATOM 739 CA ALA A 46 22.675 20.357 31.126 1.00 0.00 C ATOM 740 C ALA A 46 23.469 19.197 31.707 1.00 0.00 C ATOM 741 O ALA A 46 22.937 18.213 32.220 1.00 0.00 O ATOM 742 CB ALA A 46 21.261 19.972 30.684 1.00 0.00 C ATOM 0 H ALA A 46 23.440 21.964 30.105 1.00 0.00 H new ATOM 0 HA ALA A 46 22.674 21.049 31.969 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.738 19.495 31.513 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.719 20.867 30.380 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.318 19.279 29.844 1.00 0.00 H new ATOM 748 N GLY A 47 24.798 19.344 31.702 1.00 0.00 N ATOM 749 CA GLY A 47 25.696 18.543 32.506 1.00 0.00 C ATOM 750 C GLY A 47 26.587 17.738 31.558 1.00 0.00 C ATOM 751 O GLY A 47 27.528 17.095 32.016 1.00 0.00 O ATOM 0 H GLY A 47 25.277 20.037 31.126 1.00 0.00 H new ATOM 0 HA2 GLY A 47 26.302 19.180 33.150 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.132 17.876 33.158 1.00 0.00 H new ATOM 755 N LYS A 48 26.240 17.752 30.272 1.00 0.00 N ATOM 756 CA LYS A 48 26.696 16.735 29.347 1.00 0.00 C ATOM 757 C LYS A 48 27.172 17.465 28.086 1.00 0.00 C ATOM 758 O LYS A 48 26.571 18.420 27.606 1.00 0.00 O ATOM 759 CB LYS A 48 25.580 15.699 29.113 1.00 0.00 C ATOM 760 CG LYS A 48 25.992 14.400 28.422 1.00 0.00 C ATOM 761 CD LYS A 48 24.920 13.779 27.531 1.00 0.00 C ATOM 762 CE LYS A 48 25.591 12.646 26.761 1.00 0.00 C ATOM 763 NZ LYS A 48 24.616 11.870 25.974 1.00 0.00 N ATOM 0 H LYS A 48 25.641 18.463 29.853 1.00 0.00 H new ATOM 0 HA LYS A 48 27.533 16.154 29.733 1.00 0.00 H new ATOM 0 HB2 LYS A 48 25.140 15.448 30.078 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.797 16.169 28.518 1.00 0.00 H new ATOM 0 HG2 LYS A 48 26.879 14.592 27.818 1.00 0.00 H new ATOM 0 HG3 LYS A 48 26.276 13.674 29.184 1.00 0.00 H new ATOM 0 HD2 LYS A 48 24.091 13.402 28.129 1.00 0.00 H new ATOM 0 HD3 LYS A 48 24.508 14.521 26.847 1.00 0.00 H new ATOM 0 HE2 LYS A 48 26.350 13.058 26.096 1.00 0.00 H new ATOM 0 HE3 LYS A 48 26.104 11.985 27.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 25.108 11.109 25.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 23.906 11.457 26.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 24.145 12.496 25.290 1.00 0.00 H new ATOM 777 N GLN A 49 28.323 17.024 27.574 1.00 0.00 N ATOM 778 CA GLN A 49 28.742 17.315 26.229 1.00 0.00 C ATOM 779 C GLN A 49 28.004 16.550 25.123 1.00 0.00 C ATOM 780 O GLN A 49 27.846 15.338 25.238 1.00 0.00 O ATOM 781 CB GLN A 49 30.142 16.704 26.109 1.00 0.00 C ATOM 782 CG GLN A 49 30.927 17.251 24.916 1.00 0.00 C ATOM 783 CD GLN A 49 32.266 16.601 24.608 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.902 16.871 23.593 1.00 0.00 O ATOM 785 NE2 GLN A 49 32.719 15.593 25.348 1.00 0.00 N ATOM 0 H GLN A 49 28.986 16.451 28.097 1.00 0.00 H new ATOM 0 HA GLN A 49 28.604 18.388 26.097 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.699 16.900 27.025 1.00 0.00 H new ATOM 0 HB3 GLN A 49 30.054 15.622 26.015 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.298 17.165 24.030 1.00 0.00 H new ATOM 0 HG3 GLN A 49 31.098 18.314 25.083 1.00 0.00 H new ATOM 0 HE21 GLN A 49 32.229 15.326 26.202 1.00 0.00 H new ATOM 0 HE22 GLN A 49 33.557 15.087 25.062 1.00 0.00 H new ATOM 794 N LEU A 50 27.530 17.264 24.117 1.00 0.00 N ATOM 795 CA LEU A 50 26.683 16.724 23.072 1.00 0.00 C ATOM 796 C LEU A 50 27.593 15.879 22.172 1.00 0.00 C ATOM 797 O LEU A 50 28.765 16.184 21.986 1.00 0.00 O ATOM 798 CB LEU A 50 26.008 17.764 22.182 1.00 0.00 C ATOM 799 CG LEU A 50 25.410 18.930 22.978 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.558 19.881 22.134 1.00 0.00 C ATOM 801 CD2 LEU A 50 24.526 18.377 24.103 1.00 0.00 C ATOM 0 H LEU A 50 27.729 18.258 24.003 1.00 0.00 H new ATOM 0 HA LEU A 50 25.880 16.174 23.563 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.735 18.152 21.469 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.219 17.283 21.603 1.00 0.00 H new ATOM 0 HG LEU A 50 26.256 19.499 23.362 1.00 0.00 H new ATOM 0 HD11 LEU A 50 24.170 20.680 22.766 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.170 20.311 21.341 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.727 19.331 21.693 1.00 0.00 H new ATOM 0 HD21 LEU A 50 24.100 19.204 24.671 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.722 17.779 23.674 1.00 0.00 H new ATOM 0 HD23 LEU A 50 25.127 17.754 24.765 1.00 0.00 H new ATOM 813 N GLU A 51 27.096 14.682 21.865 1.00 0.00 N ATOM 814 CA GLU A 51 27.678 13.712 20.962 1.00 0.00 C ATOM 815 C GLU A 51 27.757 14.236 19.526 1.00 0.00 C ATOM 816 O GLU A 51 28.740 14.031 18.815 1.00 0.00 O ATOM 817 CB GLU A 51 26.781 12.480 21.073 1.00 0.00 C ATOM 818 CG GLU A 51 27.157 11.285 20.200 1.00 0.00 C ATOM 819 CD GLU A 51 26.275 10.074 20.467 1.00 0.00 C ATOM 820 OE1 GLU A 51 25.250 10.122 21.175 1.00 0.00 O ATOM 821 OE2 GLU A 51 26.569 9.062 19.790 1.00 0.00 O ATOM 0 H GLU A 51 26.221 14.351 22.270 1.00 0.00 H new ATOM 0 HA GLU A 51 28.710 13.485 21.228 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.775 12.155 22.113 1.00 0.00 H new ATOM 0 HB3 GLU A 51 25.762 12.776 20.826 1.00 0.00 H new ATOM 0 HG2 GLU A 51 27.077 11.566 19.150 1.00 0.00 H new ATOM 0 HG3 GLU A 51 28.199 11.020 20.380 1.00 0.00 H new ATOM 828 N ASP A 52 26.731 14.954 19.082 1.00 0.00 N ATOM 829 CA ASP A 52 26.552 15.737 17.874 1.00 0.00 C ATOM 830 C ASP A 52 25.625 15.076 16.853 1.00 0.00 C ATOM 831 O ASP A 52 25.722 13.859 16.702 1.00 0.00 O ATOM 832 CB ASP A 52 27.843 16.370 17.373 1.00 0.00 C ATOM 833 CG ASP A 52 27.681 17.536 16.406 1.00 0.00 C ATOM 834 OD1 ASP A 52 26.707 17.818 15.683 1.00 0.00 O ATOM 835 OD2 ASP A 52 28.763 18.151 16.327 1.00 0.00 O ATOM 0 H ASP A 52 25.885 15.003 19.650 1.00 0.00 H new ATOM 0 HA ASP A 52 25.971 16.622 18.135 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.414 16.715 18.235 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.438 15.598 16.885 1.00 0.00 H new ATOM 840 N GLY A 53 25.085 15.860 15.922 1.00 0.00 N ATOM 841 CA GLY A 53 24.634 15.506 14.597 1.00 0.00 C ATOM 842 C GLY A 53 23.117 15.309 14.472 1.00 0.00 C ATOM 843 O GLY A 53 22.660 14.666 13.525 1.00 0.00 O ATOM 0 H GLY A 53 24.943 16.853 16.104 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.945 16.285 13.901 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.133 14.587 14.291 1.00 0.00 H new ATOM 847 N ARG A 54 22.349 15.889 15.388 1.00 0.00 N ATOM 848 CA ARG A 54 20.910 15.886 15.353 1.00 0.00 C ATOM 849 C ARG A 54 20.473 17.337 15.131 1.00 0.00 C ATOM 850 O ARG A 54 21.233 18.301 15.111 1.00 0.00 O ATOM 851 CB ARG A 54 20.305 15.211 16.574 1.00 0.00 C ATOM 852 CG ARG A 54 21.021 13.888 16.887 1.00 0.00 C ATOM 853 CD ARG A 54 20.621 13.322 18.247 1.00 0.00 C ATOM 854 NE ARG A 54 21.610 12.286 18.551 1.00 0.00 N ATOM 855 CZ ARG A 54 22.243 11.940 19.686 1.00 0.00 C ATOM 856 NH1 ARG A 54 21.845 12.353 20.897 1.00 0.00 N ATOM 857 NH2 ARG A 54 23.254 11.059 19.597 1.00 0.00 N ATOM 0 H ARG A 54 22.731 16.385 16.193 1.00 0.00 H new ATOM 0 HA ARG A 54 20.529 15.278 14.532 1.00 0.00 H new ATOM 0 HB2 ARG A 54 20.374 15.878 17.434 1.00 0.00 H new ATOM 0 HB3 ARG A 54 19.245 15.023 16.401 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.790 13.159 16.110 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.099 14.046 16.864 1.00 0.00 H new ATOM 0 HD2 ARG A 54 20.622 14.100 19.010 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.614 12.906 18.217 1.00 0.00 H new ATOM 0 HE ARG A 54 21.869 11.716 17.746 1.00 0.00 H new ATOM 0 HH11 ARG A 54 21.028 12.957 20.987 1.00 0.00 H new ATOM 0 HH12 ARG A 54 22.359 12.063 21.729 1.00 0.00 H new ATOM 0 HH21 ARG A 54 23.518 10.676 18.689 1.00 0.00 H new ATOM 0 HH22 ARG A 54 23.757 10.773 20.437 1.00 0.00 H new ATOM 871 N THR A 55 19.164 17.537 14.993 1.00 0.00 N ATOM 872 CA THR A 55 18.504 18.824 14.925 1.00 0.00 C ATOM 873 C THR A 55 18.123 19.246 16.340 1.00 0.00 C ATOM 874 O THR A 55 17.864 18.431 17.228 1.00 0.00 O ATOM 875 CB THR A 55 17.224 18.645 14.107 1.00 0.00 C ATOM 876 OG1 THR A 55 16.344 17.684 14.651 1.00 0.00 O ATOM 877 CG2 THR A 55 17.453 18.150 12.677 1.00 0.00 C ATOM 0 H THR A 55 18.507 16.760 14.923 1.00 0.00 H new ATOM 0 HA THR A 55 19.153 19.574 14.472 1.00 0.00 H new ATOM 0 HB THR A 55 16.811 19.654 14.123 1.00 0.00 H new ATOM 0 HG1 THR A 55 15.545 17.615 14.087 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.494 18.051 12.168 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.076 18.865 12.140 1.00 0.00 H new ATOM 0 HG23 THR A 55 17.952 17.181 12.703 1.00 0.00 H new ATOM 885 N LEU A 56 18.041 20.570 16.419 1.00 0.00 N ATOM 886 CA LEU A 56 17.611 21.293 17.599 1.00 0.00 C ATOM 887 C LEU A 56 16.408 20.695 18.345 1.00 0.00 C ATOM 888 O LEU A 56 16.527 20.406 19.526 1.00 0.00 O ATOM 889 CB LEU A 56 17.595 22.796 17.361 1.00 0.00 C ATOM 890 CG LEU A 56 18.858 23.596 17.703 1.00 0.00 C ATOM 891 CD1 LEU A 56 20.008 23.294 16.745 1.00 0.00 C ATOM 892 CD2 LEU A 56 18.432 25.062 17.719 1.00 0.00 C ATOM 0 H LEU A 56 18.280 21.182 15.639 1.00 0.00 H new ATOM 0 HA LEU A 56 18.383 21.138 18.353 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.369 22.964 16.308 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.769 23.216 17.935 1.00 0.00 H new ATOM 0 HG LEU A 56 19.263 23.317 18.676 1.00 0.00 H new ATOM 0 HD11 LEU A 56 20.881 23.884 17.027 1.00 0.00 H new ATOM 0 HD12 LEU A 56 20.255 22.234 16.796 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.711 23.549 15.728 1.00 0.00 H new ATOM 0 HD21 LEU A 56 19.292 25.688 17.958 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.043 25.339 16.739 1.00 0.00 H new ATOM 0 HD23 LEU A 56 17.657 25.207 18.471 1.00 0.00 H new ATOM 904 N SER A 57 15.223 20.563 17.765 1.00 0.00 N ATOM 905 CA SER A 57 13.971 19.980 18.201 1.00 0.00 C ATOM 906 C SER A 57 14.159 18.621 18.875 1.00 0.00 C ATOM 907 O SER A 57 13.616 18.365 19.948 1.00 0.00 O ATOM 908 CB SER A 57 12.960 19.998 17.053 1.00 0.00 C ATOM 909 OG SER A 57 11.632 19.581 17.294 1.00 0.00 O ATOM 0 H SER A 57 15.108 20.927 16.819 1.00 0.00 H new ATOM 0 HA SER A 57 13.547 20.596 18.994 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.919 21.017 16.669 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.360 19.373 16.255 1.00 0.00 H new ATOM 0 HG SER A 57 11.112 19.652 16.467 1.00 0.00 H new ATOM 915 N ASP A 58 14.859 17.754 18.139 1.00 0.00 N ATOM 916 CA ASP A 58 15.219 16.410 18.543 1.00 0.00 C ATOM 917 C ASP A 58 16.162 16.416 19.747 1.00 0.00 C ATOM 918 O ASP A 58 16.158 15.545 20.609 1.00 0.00 O ATOM 919 CB ASP A 58 15.802 15.500 17.453 1.00 0.00 C ATOM 920 CG ASP A 58 14.795 14.747 16.606 1.00 0.00 C ATOM 921 OD1 ASP A 58 13.580 14.767 16.908 1.00 0.00 O ATOM 922 OD2 ASP A 58 15.222 14.213 15.553 1.00 0.00 O ATOM 0 H ASP A 58 15.201 17.988 17.207 1.00 0.00 H new ATOM 0 HA ASP A 58 14.255 15.973 18.803 1.00 0.00 H new ATOM 0 HB2 ASP A 58 16.420 16.108 16.792 1.00 0.00 H new ATOM 0 HB3 ASP A 58 16.462 14.774 17.928 1.00 0.00 H new ATOM 927 N TYR A 59 17.156 17.301 19.718 1.00 0.00 N ATOM 928 CA TYR A 59 18.186 17.304 20.727 1.00 0.00 C ATOM 929 C TYR A 59 17.680 17.878 22.051 1.00 0.00 C ATOM 930 O TYR A 59 18.311 17.581 23.059 1.00 0.00 O ATOM 931 CB TYR A 59 19.402 18.151 20.354 1.00 0.00 C ATOM 932 CG TYR A 59 20.737 17.457 20.444 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.115 16.698 21.561 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.610 17.490 19.351 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.278 15.925 21.568 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.784 16.724 19.384 1.00 0.00 C ATOM 937 CZ TYR A 59 23.077 15.834 20.417 1.00 0.00 C ATOM 938 OH TYR A 59 24.249 15.130 20.445 1.00 0.00 O ATOM 0 H TYR A 59 17.261 18.021 19.003 1.00 0.00 H new ATOM 0 HA TYR A 59 18.468 16.255 20.815 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.270 18.513 19.334 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.424 19.026 21.003 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.489 16.712 22.441 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.382 18.100 18.490 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.564 15.394 22.464 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.492 16.828 18.575 1.00 0.00 H new ATOM 0 HH TYR A 59 24.176 14.400 21.094 1.00 0.00 H new ATOM 948 N ASN A 60 16.529 18.551 22.056 1.00 0.00 N ATOM 949 CA ASN A 60 15.809 19.184 23.139 1.00 0.00 C ATOM 950 C ASN A 60 16.138 20.662 23.380 1.00 0.00 C ATOM 951 O ASN A 60 15.836 21.120 24.480 1.00 0.00 O ATOM 952 CB ASN A 60 15.609 18.263 24.348 1.00 0.00 C ATOM 953 CG ASN A 60 14.242 18.291 25.016 1.00 0.00 C ATOM 954 OD1 ASN A 60 13.849 19.285 25.617 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.438 17.238 24.889 1.00 0.00 N ATOM 0 H ASN A 60 16.022 18.675 21.180 1.00 0.00 H new ATOM 0 HA ASN A 60 14.784 19.315 22.792 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.811 17.240 24.032 1.00 0.00 H new ATOM 0 HB3 ASN A 60 16.358 18.519 25.097 1.00 0.00 H new ATOM 0 HD21 ASN A 60 12.501 17.261 25.290 1.00 0.00 H new ATOM 0 HD22 ASN A 60 13.759 16.408 24.390 1.00 0.00 H new ATOM 962 N ILE A 61 16.630 21.402 22.391 1.00 0.00 N ATOM 963 CA ILE A 61 16.899 22.817 22.485 1.00 0.00 C ATOM 964 C ILE A 61 15.744 23.654 21.950 1.00 0.00 C ATOM 965 O ILE A 61 15.399 23.614 20.769 1.00 0.00 O ATOM 966 CB ILE A 61 18.114 23.056 21.591 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.279 22.184 22.087 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.550 24.527 21.585 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.585 22.290 21.315 1.00 0.00 C ATOM 0 H ILE A 61 16.857 21.012 21.476 1.00 0.00 H new ATOM 0 HA ILE A 61 17.054 23.102 23.526 1.00 0.00 H new ATOM 0 HB ILE A 61 17.836 22.791 20.571 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.477 22.440 23.128 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.957 21.143 22.070 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.417 24.647 20.935 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.733 25.147 21.217 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.810 24.833 22.598 1.00 0.00 H new ATOM 0 HD11 ILE A 61 21.327 21.628 21.762 1.00 0.00 H new ATOM 0 HD12 ILE A 61 20.419 22.001 20.277 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.947 23.317 21.352 1.00 0.00 H new ATOM 981 N GLN A 62 15.121 24.422 22.839 1.00 0.00 N ATOM 982 CA GLN A 62 13.988 25.281 22.570 1.00 0.00 C ATOM 983 C GLN A 62 14.264 26.770 22.774 1.00 0.00 C ATOM 984 O GLN A 62 15.436 27.140 22.659 1.00 0.00 O ATOM 985 CB GLN A 62 12.777 24.817 23.370 1.00 0.00 C ATOM 986 CG GLN A 62 12.227 23.410 23.136 1.00 0.00 C ATOM 987 CD GLN A 62 12.480 22.384 24.225 1.00 0.00 C ATOM 988 OE1 GLN A 62 13.052 22.825 25.226 1.00 0.00 O ATOM 989 NE2 GLN A 62 12.453 21.081 23.950 1.00 0.00 N ATOM 0 H GLN A 62 15.414 24.459 23.815 1.00 0.00 H new ATOM 0 HA GLN A 62 13.775 25.185 21.505 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.030 24.899 24.427 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.968 25.522 23.180 1.00 0.00 H new ATOM 0 HG2 GLN A 62 11.150 23.487 22.986 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.651 23.030 22.207 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.972 20.746 23.115 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.913 20.418 24.574 1.00 0.00 H new ATOM 998 N LYS A 63 13.229 27.569 23.020 1.00 0.00 N ATOM 999 CA LYS A 63 13.259 29.006 23.277 1.00 0.00 C ATOM 1000 C LYS A 63 14.159 29.383 24.449 1.00 0.00 C ATOM 1001 O LYS A 63 13.839 28.970 25.561 1.00 0.00 O ATOM 1002 CB LYS A 63 11.796 29.405 23.474 1.00 0.00 C ATOM 1003 CG LYS A 63 11.687 30.874 23.872 1.00 0.00 C ATOM 1004 CD LYS A 63 10.227 31.300 24.037 1.00 0.00 C ATOM 1005 CE LYS A 63 10.066 32.768 24.446 1.00 0.00 C ATOM 1006 NZ LYS A 63 10.281 32.917 25.887 1.00 0.00 N ATOM 0 H LYS A 63 12.278 27.202 23.047 1.00 0.00 H new ATOM 0 HA LYS A 63 13.705 29.554 22.447 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.239 29.230 22.554 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.344 28.780 24.244 1.00 0.00 H new ATOM 0 HG2 LYS A 63 12.224 31.040 24.806 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.165 31.494 23.114 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.698 31.131 23.099 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.754 30.667 24.788 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.778 33.386 23.899 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.069 33.120 24.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 10.169 33.916 26.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.585 32.341 26.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.241 32.599 26.129 1.00 0.00 H new ATOM 1020 N GLU A 64 15.276 30.066 24.233 1.00 0.00 N ATOM 1021 CA GLU A 64 16.113 30.698 25.222 1.00 0.00 C ATOM 1022 C GLU A 64 16.944 29.623 25.932 1.00 0.00 C ATOM 1023 O GLU A 64 17.420 29.911 27.029 1.00 0.00 O ATOM 1024 CB GLU A 64 15.423 31.672 26.182 1.00 0.00 C ATOM 1025 CG GLU A 64 15.071 33.020 25.559 1.00 0.00 C ATOM 1026 CD GLU A 64 13.607 33.440 25.525 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.796 32.896 26.312 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.302 34.171 24.554 1.00 0.00 O ATOM 0 H GLU A 64 15.640 30.197 23.289 1.00 0.00 H new ATOM 0 HA GLU A 64 16.771 31.376 24.679 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.511 31.209 26.558 1.00 0.00 H new ATOM 0 HB3 GLU A 64 16.073 31.840 27.041 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.625 33.789 26.097 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.440 33.019 24.534 1.00 0.00 H new ATOM 1035 N SER A 65 17.161 28.451 25.345 1.00 0.00 N ATOM 1036 CA SER A 65 18.014 27.427 25.907 1.00 0.00 C ATOM 1037 C SER A 65 19.444 27.968 25.970 1.00 0.00 C ATOM 1038 O SER A 65 19.867 28.564 24.973 1.00 0.00 O ATOM 1039 CB SER A 65 17.900 26.156 25.063 1.00 0.00 C ATOM 1040 OG SER A 65 16.550 25.748 25.096 1.00 0.00 O ATOM 0 H SER A 65 16.741 28.189 24.454 1.00 0.00 H new ATOM 0 HA SER A 65 17.709 27.167 26.921 1.00 0.00 H new ATOM 0 HB2 SER A 65 18.219 26.346 24.038 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.547 25.373 25.458 1.00 0.00 H new ATOM 0 HG SER A 65 16.489 24.848 25.480 1.00 0.00 H new ATOM 1046 N THR A 66 20.143 27.940 27.097 1.00 0.00 N ATOM 1047 CA THR A 66 21.555 28.225 27.219 1.00 0.00 C ATOM 1048 C THR A 66 22.402 26.964 27.053 1.00 0.00 C ATOM 1049 O THR A 66 22.399 26.071 27.909 1.00 0.00 O ATOM 1050 CB THR A 66 21.608 28.828 28.621 1.00 0.00 C ATOM 1051 OG1 THR A 66 21.012 30.093 28.397 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.966 29.279 29.157 1.00 0.00 C ATOM 0 H THR A 66 19.713 27.706 27.992 1.00 0.00 H new ATOM 0 HA THR A 66 21.964 28.886 26.455 1.00 0.00 H new ATOM 0 HB THR A 66 21.201 28.082 29.303 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.982 30.594 29.239 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.844 29.685 30.161 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.645 28.427 29.190 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.378 30.047 28.503 1.00 0.00 H new ATOM 1060 N LEU A 67 23.149 26.892 25.964 1.00 0.00 N ATOM 1061 CA LEU A 67 24.216 25.929 25.752 1.00 0.00 C ATOM 1062 C LEU A 67 25.551 26.508 26.216 1.00 0.00 C ATOM 1063 O LEU A 67 25.731 27.724 26.147 1.00 0.00 O ATOM 1064 CB LEU A 67 24.217 25.697 24.242 1.00 0.00 C ATOM 1065 CG LEU A 67 22.870 25.413 23.574 1.00 0.00 C ATOM 1066 CD1 LEU A 67 23.177 25.232 22.087 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.126 24.174 24.072 1.00 0.00 C ATOM 0 H LEU A 67 23.024 27.526 25.175 1.00 0.00 H new ATOM 0 HA LEU A 67 24.070 25.005 26.311 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.651 26.577 23.766 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.882 24.860 24.030 1.00 0.00 H new ATOM 0 HG LEU A 67 22.205 26.244 23.809 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.253 25.025 21.547 1.00 0.00 H new ATOM 0 HD12 LEU A 67 23.630 26.143 21.695 1.00 0.00 H new ATOM 0 HD13 LEU A 67 23.868 24.399 21.957 1.00 0.00 H new ATOM 0 HD21 LEU A 67 21.186 24.071 23.529 1.00 0.00 H new ATOM 0 HD22 LEU A 67 22.740 23.289 23.905 1.00 0.00 H new ATOM 0 HD23 LEU A 67 21.920 24.277 25.137 1.00 0.00 H new ATOM 1079 N HIS A 68 26.534 25.723 26.641 1.00 0.00 N ATOM 1080 CA HIS A 68 27.834 26.293 26.932 1.00 0.00 C ATOM 1081 C HIS A 68 28.750 25.816 25.799 1.00 0.00 C ATOM 1082 O HIS A 68 28.791 24.629 25.495 1.00 0.00 O ATOM 1083 CB HIS A 68 28.357 25.711 28.250 1.00 0.00 C ATOM 1084 CG HIS A 68 27.812 26.430 29.447 1.00 0.00 C ATOM 1085 ND1 HIS A 68 26.525 26.337 29.981 1.00 0.00 N ATOM 1086 CD2 HIS A 68 28.532 27.399 30.096 1.00 0.00 C ATOM 1087 CE1 HIS A 68 26.616 27.121 31.055 1.00 0.00 C ATOM 1088 NE2 HIS A 68 27.785 27.777 31.196 1.00 0.00 N ATOM 0 H HIS A 68 26.456 24.717 26.787 1.00 0.00 H new ATOM 0 HA HIS A 68 27.792 27.379 27.012 1.00 0.00 H new ATOM 0 HB2 HIS A 68 28.089 24.656 28.310 1.00 0.00 H new ATOM 0 HB3 HIS A 68 29.446 25.765 28.261 1.00 0.00 H new ATOM 0 HD2 HIS A 68 29.495 27.791 29.805 1.00 0.00 H new ATOM 0 HE1 HIS A 68 25.808 27.224 31.764 1.00 0.00 H new ATOM 0 HE2 HIS A 68 28.058 28.411 31.947 1.00 0.00 H new ATOM 1096 N LEU A 69 29.634 26.702 25.354 1.00 0.00 N ATOM 1097 CA LEU A 69 30.545 26.371 24.282 1.00 0.00 C ATOM 1098 C LEU A 69 31.893 26.144 24.963 1.00 0.00 C ATOM 1099 O LEU A 69 32.218 26.949 25.829 1.00 0.00 O ATOM 1100 CB LEU A 69 30.493 27.555 23.319 1.00 0.00 C ATOM 1101 CG LEU A 69 31.585 27.778 22.279 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.637 26.650 21.244 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.535 29.138 21.591 1.00 0.00 C ATOM 0 H LEU A 69 29.734 27.648 25.721 1.00 0.00 H new ATOM 0 HA LEU A 69 30.317 25.478 23.700 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.549 27.484 22.779 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.445 28.458 23.928 1.00 0.00 H new ATOM 0 HG LEU A 69 32.511 27.766 22.854 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.430 26.853 20.524 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.837 25.704 21.747 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.681 26.590 20.723 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.347 29.210 20.868 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.580 29.251 21.077 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.641 29.927 22.336 1.00 0.00 H new ATOM 1115 N VAL A 70 32.744 25.228 24.503 1.00 0.00 N ATOM 1116 CA VAL A 70 34.030 24.841 25.021 1.00 0.00 C ATOM 1117 C VAL A 70 34.936 24.557 23.814 1.00 0.00 C ATOM 1118 O VAL A 70 34.414 24.301 22.727 1.00 0.00 O ATOM 1119 CB VAL A 70 34.033 23.631 25.967 1.00 0.00 C ATOM 1120 CG1 VAL A 70 33.462 23.986 27.337 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.251 22.405 25.498 1.00 0.00 C ATOM 0 H VAL A 70 32.512 24.689 23.669 1.00 0.00 H new ATOM 0 HA VAL A 70 34.383 25.665 25.641 1.00 0.00 H new ATOM 0 HB VAL A 70 35.091 23.371 25.997 1.00 0.00 H new ATOM 0 HG11 VAL A 70 33.481 23.105 27.978 1.00 0.00 H new ATOM 0 HG12 VAL A 70 34.063 24.776 27.788 1.00 0.00 H new ATOM 0 HG13 VAL A 70 32.434 24.331 27.224 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.326 21.617 26.247 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.204 22.673 25.357 1.00 0.00 H new ATOM 0 HG23 VAL A 70 33.664 22.049 24.554 1.00 0.00 H new ATOM 1131 N LEU A 71 36.240 24.716 23.974 1.00 0.00 N ATOM 1132 CA LEU A 71 37.298 24.266 23.076 1.00 0.00 C ATOM 1133 C LEU A 71 37.850 22.941 23.606 1.00 0.00 C ATOM 1134 O LEU A 71 37.944 22.852 24.830 1.00 0.00 O ATOM 1135 CB LEU A 71 38.431 25.292 23.058 1.00 0.00 C ATOM 1136 CG LEU A 71 37.900 26.687 22.713 1.00 0.00 C ATOM 1137 CD1 LEU A 71 38.948 27.746 23.048 1.00 0.00 C ATOM 1138 CD2 LEU A 71 37.490 26.904 21.249 1.00 0.00 C ATOM 0 H LEU A 71 36.616 25.196 24.791 1.00 0.00 H new ATOM 0 HA LEU A 71 36.899 24.145 22.069 1.00 0.00 H new ATOM 0 HB2 LEU A 71 38.921 25.316 24.031 1.00 0.00 H new ATOM 0 HB3 LEU A 71 39.185 24.995 22.329 1.00 0.00 H new ATOM 0 HG LEU A 71 36.995 26.777 23.314 1.00 0.00 H new ATOM 0 HD11 LEU A 71 38.560 28.734 22.799 1.00 0.00 H new ATOM 0 HD12 LEU A 71 39.179 27.705 24.112 1.00 0.00 H new ATOM 0 HD13 LEU A 71 39.854 27.556 22.472 1.00 0.00 H new ATOM 0 HD21 LEU A 71 37.130 27.925 21.119 1.00 0.00 H new ATOM 0 HD22 LEU A 71 38.351 26.738 20.602 1.00 0.00 H new ATOM 0 HD23 LEU A 71 36.698 26.204 20.985 1.00 0.00 H new