USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=15 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 55 THR OG1 : rot 117:sc= 0.34 USER MOD Set 1.2: A 57 SER OG : rot 180:sc= 0.32 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -165:sc= 0.605 (180deg=0.496) USER MOD Single : A 2 GLN : amide:sc= -1.04 K(o=-1,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot -87:sc= 1.18 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 1.22 (180deg=1.22) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.0299 USER MOD Single : A 14 THR OG1 : rot -72:sc= 0.647! USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -1.81! K(o=-1.8!,f=-0.8) USER MOD Single : A 27 LYS NZ :NH3+ 176:sc= 1.08 (180deg=0.982) USER MOD Single : A 29 LYS NZ :NH3+ -159:sc= 1.52 (180deg=1.2) USER MOD Single : A 31 GLN : amide:sc= -0.893! K(o=-0.89!,f=-0.036) USER MOD Single : A 33 LYS NZ :NH3+ -132:sc= -0.0586 (180deg=-0.512) USER MOD Single : A 40 GLN : amide:sc= -0.013 K(o=-0.013,f=-0.96) USER MOD Single : A 41 GLN : amide:sc= 0.544 K(o=0.54,f=-5.1!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 59 TYR OH : rot 30:sc= 0.559 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 62 GLN : amide:sc=-0.00402 K(o=-0.004,f=-0.64) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -110:sc= -0.347 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 13.775 31.153 15.590 1.00 0.00 N ATOM 2 CA MET A 1 13.905 30.841 17.019 1.00 0.00 C ATOM 3 C MET A 1 15.221 31.535 17.364 1.00 0.00 C ATOM 4 O MET A 1 16.210 31.228 16.705 1.00 0.00 O ATOM 5 CB MET A 1 13.953 29.324 17.228 1.00 0.00 C ATOM 6 CG MET A 1 13.710 29.039 18.706 1.00 0.00 C ATOM 7 SD MET A 1 13.376 27.303 19.088 1.00 0.00 S ATOM 8 CE MET A 1 15.072 26.691 19.214 1.00 0.00 C ATOM 0 H1 MET A 1 12.802 30.959 15.279 1.00 0.00 H new ATOM 0 H2 MET A 1 13.995 32.157 15.433 1.00 0.00 H new ATOM 0 H3 MET A 1 14.436 30.564 15.045 1.00 0.00 H new ATOM 0 HA MET A 1 13.078 31.173 17.647 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.197 28.832 16.617 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.920 28.928 16.918 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.583 29.362 19.274 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.868 29.642 19.046 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.058 25.626 19.447 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.587 26.848 18.266 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.595 27.229 20.005 1.00 0.00 H new ATOM 20 N GLN A 2 15.285 32.257 18.481 1.00 0.00 N ATOM 21 CA GLN A 2 16.514 32.655 19.142 1.00 0.00 C ATOM 22 C GLN A 2 16.943 31.591 20.161 1.00 0.00 C ATOM 23 O GLN A 2 16.115 31.147 20.949 1.00 0.00 O ATOM 24 CB GLN A 2 16.314 33.943 19.930 1.00 0.00 C ATOM 25 CG GLN A 2 16.038 35.164 19.042 1.00 0.00 C ATOM 26 CD GLN A 2 15.664 36.437 19.774 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.718 37.535 19.230 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.223 36.318 21.023 1.00 0.00 N ATOM 0 H GLN A 2 14.450 32.590 18.963 1.00 0.00 H new ATOM 0 HA GLN A 2 17.264 32.786 18.362 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.483 33.811 20.622 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.203 34.134 20.532 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.925 35.360 18.440 1.00 0.00 H new ATOM 0 HG3 GLN A 2 15.233 34.914 18.351 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.183 35.399 21.464 1.00 0.00 H new ATOM 0 HE22 GLN A 2 14.925 37.145 21.540 1.00 0.00 H new ATOM 37 N ILE A 3 18.254 31.520 20.361 1.00 0.00 N ATOM 38 CA ILE A 3 18.994 30.901 21.440 1.00 0.00 C ATOM 39 C ILE A 3 20.104 31.839 21.918 1.00 0.00 C ATOM 40 O ILE A 3 20.385 32.893 21.354 1.00 0.00 O ATOM 41 CB ILE A 3 19.405 29.445 21.195 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.290 29.136 19.974 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.129 28.614 21.027 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.861 27.734 19.787 1.00 0.00 C ATOM 0 H ILE A 3 18.892 31.946 19.689 1.00 0.00 H new ATOM 0 HA ILE A 3 18.311 30.772 22.280 1.00 0.00 H new ATOM 0 HB ILE A 3 20.019 29.204 22.062 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.708 29.372 19.083 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.131 29.829 19.998 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.394 27.572 20.851 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.525 28.687 21.932 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.558 28.991 20.179 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.458 27.703 18.875 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.489 27.480 20.641 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.045 27.016 19.711 1.00 0.00 H new ATOM 56 N PHE A 4 20.789 31.414 22.983 1.00 0.00 N ATOM 57 CA PHE A 4 22.062 31.869 23.487 1.00 0.00 C ATOM 58 C PHE A 4 23.107 30.753 23.420 1.00 0.00 C ATOM 59 O PHE A 4 22.948 29.706 24.032 1.00 0.00 O ATOM 60 CB PHE A 4 22.056 32.615 24.831 1.00 0.00 C ATOM 61 CG PHE A 4 21.284 33.915 24.881 1.00 0.00 C ATOM 62 CD1 PHE A 4 21.873 35.081 24.381 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.999 34.008 25.430 1.00 0.00 C ATOM 64 CE1 PHE A 4 21.217 36.309 24.507 1.00 0.00 C ATOM 65 CE2 PHE A 4 19.294 35.217 25.506 1.00 0.00 C ATOM 66 CZ PHE A 4 19.969 36.390 25.131 1.00 0.00 C ATOM 0 H PHE A 4 20.415 30.664 23.565 1.00 0.00 H new ATOM 0 HA PHE A 4 22.352 32.666 22.802 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.648 31.947 25.589 1.00 0.00 H new ATOM 0 HB3 PHE A 4 23.089 32.821 25.111 1.00 0.00 H new ATOM 0 HD1 PHE A 4 22.837 35.032 23.896 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.532 33.111 25.810 1.00 0.00 H new ATOM 0 HE1 PHE A 4 21.679 37.204 24.118 1.00 0.00 H new ATOM 0 HE2 PHE A 4 18.268 35.246 25.841 1.00 0.00 H new ATOM 0 HZ PHE A 4 19.524 37.355 25.325 1.00 0.00 H new ATOM 76 N VAL A 5 24.236 31.060 22.779 1.00 0.00 N ATOM 77 CA VAL A 5 25.465 30.393 23.153 1.00 0.00 C ATOM 78 C VAL A 5 26.073 31.300 24.222 1.00 0.00 C ATOM 79 O VAL A 5 26.042 32.517 24.033 1.00 0.00 O ATOM 80 CB VAL A 5 26.405 30.343 21.942 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.713 29.623 22.274 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.694 29.650 20.785 1.00 0.00 C ATOM 0 H VAL A 5 24.317 31.743 22.026 1.00 0.00 H new ATOM 0 HA VAL A 5 25.304 29.373 23.501 1.00 0.00 H new ATOM 0 HB VAL A 5 26.661 31.364 21.659 1.00 0.00 H new ATOM 0 HG11 VAL A 5 28.354 29.607 21.392 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.222 30.147 23.083 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.497 28.601 22.584 1.00 0.00 H new ATOM 0 HG21 VAL A 5 26.357 29.611 19.921 1.00 0.00 H new ATOM 0 HG22 VAL A 5 25.422 28.636 21.080 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.793 30.206 20.526 1.00 0.00 H new ATOM 92 N LYS A 6 26.638 30.667 25.243 1.00 0.00 N ATOM 93 CA LYS A 6 27.481 31.365 26.191 1.00 0.00 C ATOM 94 C LYS A 6 28.849 30.700 26.088 1.00 0.00 C ATOM 95 O LYS A 6 28.865 29.472 26.097 1.00 0.00 O ATOM 96 CB LYS A 6 26.834 31.217 27.574 1.00 0.00 C ATOM 97 CG LYS A 6 27.524 32.054 28.653 1.00 0.00 C ATOM 98 CD LYS A 6 26.726 32.005 29.956 1.00 0.00 C ATOM 99 CE LYS A 6 27.478 32.721 31.073 1.00 0.00 C ATOM 100 NZ LYS A 6 26.780 32.924 32.348 1.00 0.00 N ATOM 0 H LYS A 6 26.524 29.671 25.431 1.00 0.00 H new ATOM 0 HA LYS A 6 27.593 32.433 26.002 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.786 31.509 27.511 1.00 0.00 H new ATOM 0 HB3 LYS A 6 26.855 30.168 27.868 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.533 31.679 28.823 1.00 0.00 H new ATOM 0 HG3 LYS A 6 27.620 33.086 28.316 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.751 32.471 29.810 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.545 30.968 30.239 1.00 0.00 H new ATOM 0 HE2 LYS A 6 28.390 32.159 31.276 1.00 0.00 H new ATOM 0 HE3 LYS A 6 27.782 33.698 30.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 27.408 33.421 33.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.924 33.493 32.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.513 32.002 32.748 1.00 0.00 H new ATOM 114 N THR A 7 29.920 31.456 26.272 1.00 0.00 N ATOM 115 CA THR A 7 31.285 30.960 26.300 1.00 0.00 C ATOM 116 C THR A 7 31.692 30.804 27.765 1.00 0.00 C ATOM 117 O THR A 7 31.087 31.402 28.654 1.00 0.00 O ATOM 118 CB THR A 7 32.199 32.051 25.743 1.00 0.00 C ATOM 119 OG1 THR A 7 31.987 33.244 26.469 1.00 0.00 O ATOM 120 CG2 THR A 7 32.012 32.303 24.248 1.00 0.00 C ATOM 0 H THR A 7 29.860 32.465 26.410 1.00 0.00 H new ATOM 0 HA THR A 7 31.359 30.029 25.738 1.00 0.00 H new ATOM 0 HB THR A 7 33.225 31.702 25.861 1.00 0.00 H new ATOM 0 HG1 THR A 7 31.249 33.746 26.064 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.693 33.090 23.924 1.00 0.00 H new ATOM 0 HG22 THR A 7 32.225 31.388 23.695 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.984 32.612 24.057 1.00 0.00 H new ATOM 128 N LEU A 8 32.717 30.039 28.094 1.00 0.00 N ATOM 129 CA LEU A 8 33.169 29.711 29.431 1.00 0.00 C ATOM 130 C LEU A 8 33.373 30.896 30.384 1.00 0.00 C ATOM 131 O LEU A 8 33.464 30.719 31.595 1.00 0.00 O ATOM 132 CB LEU A 8 34.473 28.916 29.300 1.00 0.00 C ATOM 133 CG LEU A 8 34.353 27.600 28.535 1.00 0.00 C ATOM 134 CD1 LEU A 8 35.758 27.016 28.358 1.00 0.00 C ATOM 135 CD2 LEU A 8 33.369 26.624 29.169 1.00 0.00 C ATOM 0 H LEU A 8 33.297 29.599 27.380 1.00 0.00 H new ATOM 0 HA LEU A 8 32.366 29.137 29.894 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.214 29.542 28.802 1.00 0.00 H new ATOM 0 HB3 LEU A 8 34.854 28.705 30.299 1.00 0.00 H new ATOM 0 HG LEU A 8 33.924 27.796 27.552 1.00 0.00 H new ATOM 0 HD11 LEU A 8 35.695 26.074 27.813 1.00 0.00 H new ATOM 0 HD12 LEU A 8 36.376 27.718 27.798 1.00 0.00 H new ATOM 0 HD13 LEU A 8 36.205 26.840 29.337 1.00 0.00 H new ATOM 0 HD21 LEU A 8 33.331 25.710 28.577 1.00 0.00 H new ATOM 0 HD22 LEU A 8 33.694 26.387 30.182 1.00 0.00 H new ATOM 0 HD23 LEU A 8 32.378 27.077 29.202 1.00 0.00 H new ATOM 147 N THR A 9 33.718 32.026 29.771 1.00 0.00 N ATOM 148 CA THR A 9 34.306 33.218 30.342 1.00 0.00 C ATOM 149 C THR A 9 33.228 34.301 30.438 1.00 0.00 C ATOM 150 O THR A 9 33.543 35.446 30.749 1.00 0.00 O ATOM 151 CB THR A 9 35.574 33.657 29.602 1.00 0.00 C ATOM 152 OG1 THR A 9 35.376 34.191 28.313 1.00 0.00 O ATOM 153 CG2 THR A 9 36.688 32.616 29.659 1.00 0.00 C ATOM 0 H THR A 9 33.576 32.132 28.766 1.00 0.00 H new ATOM 0 HA THR A 9 34.657 33.007 31.352 1.00 0.00 H new ATOM 0 HB THR A 9 35.920 34.516 30.176 1.00 0.00 H new ATOM 0 HG1 THR A 9 36.241 34.442 27.926 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.559 32.985 29.117 1.00 0.00 H new ATOM 0 HG22 THR A 9 36.959 32.430 30.698 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.343 31.688 29.202 1.00 0.00 H new ATOM 161 N GLY A 10 31.952 34.011 30.207 1.00 0.00 N ATOM 162 CA GLY A 10 30.830 34.861 30.565 1.00 0.00 C ATOM 163 C GLY A 10 30.165 35.617 29.420 1.00 0.00 C ATOM 164 O GLY A 10 28.970 35.899 29.508 1.00 0.00 O ATOM 0 H GLY A 10 31.664 33.146 29.749 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.075 34.244 31.052 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.172 35.588 31.302 1.00 0.00 H new ATOM 168 N LYS A 11 30.932 35.817 28.357 1.00 0.00 N ATOM 169 CA LYS A 11 30.433 36.522 27.195 1.00 0.00 C ATOM 170 C LYS A 11 29.396 35.642 26.503 1.00 0.00 C ATOM 171 O LYS A 11 29.614 34.455 26.266 1.00 0.00 O ATOM 172 CB LYS A 11 31.505 36.901 26.161 1.00 0.00 C ATOM 173 CG LYS A 11 31.004 37.863 25.081 1.00 0.00 C ATOM 174 CD LYS A 11 32.044 38.012 23.969 1.00 0.00 C ATOM 175 CE LYS A 11 31.460 38.987 22.945 1.00 0.00 C ATOM 176 NZ LYS A 11 32.474 39.259 21.920 1.00 0.00 N ATOM 0 H LYS A 11 31.899 35.500 28.280 1.00 0.00 H new ATOM 0 HA LYS A 11 30.017 37.459 27.566 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.350 37.356 26.677 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.874 35.993 25.684 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.067 37.494 24.663 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.794 38.837 25.523 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.986 38.389 24.368 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.257 37.048 23.507 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.566 38.564 22.488 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.160 39.914 23.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 32.088 39.922 21.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.315 39.678 22.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.739 38.370 21.449 1.00 0.00 H new ATOM 190 N THR A 12 28.200 36.200 26.284 1.00 0.00 N ATOM 191 CA THR A 12 27.097 35.603 25.574 1.00 0.00 C ATOM 192 C THR A 12 26.969 36.282 24.208 1.00 0.00 C ATOM 193 O THR A 12 27.268 37.474 24.110 1.00 0.00 O ATOM 194 CB THR A 12 25.811 35.919 26.341 1.00 0.00 C ATOM 195 OG1 THR A 12 25.743 37.265 26.752 1.00 0.00 O ATOM 196 CG2 THR A 12 25.734 35.080 27.626 1.00 0.00 C ATOM 0 H THR A 12 27.978 37.136 26.624 1.00 0.00 H new ATOM 0 HA THR A 12 27.257 34.530 25.472 1.00 0.00 H new ATOM 0 HB THR A 12 24.996 35.696 25.652 1.00 0.00 H new ATOM 0 HG1 THR A 12 24.904 37.417 27.235 1.00 0.00 H new ATOM 0 HG21 THR A 12 24.814 35.316 28.160 1.00 0.00 H new ATOM 0 HG22 THR A 12 25.743 34.021 27.370 1.00 0.00 H new ATOM 0 HG23 THR A 12 26.591 35.307 28.261 1.00 0.00 H new ATOM 204 N ILE A 13 26.471 35.544 23.218 1.00 0.00 N ATOM 205 CA ILE A 13 26.012 35.851 21.884 1.00 0.00 C ATOM 206 C ILE A 13 24.635 35.282 21.561 1.00 0.00 C ATOM 207 O ILE A 13 24.422 34.071 21.665 1.00 0.00 O ATOM 208 CB ILE A 13 27.144 35.515 20.903 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.585 34.066 21.112 1.00 0.00 C ATOM 210 CG2 ILE A 13 28.326 36.502 20.996 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.522 33.451 20.078 1.00 0.00 C ATOM 0 H ILE A 13 26.368 34.542 23.377 1.00 0.00 H new ATOM 0 HA ILE A 13 25.810 36.918 21.787 1.00 0.00 H new ATOM 0 HB ILE A 13 26.759 35.623 19.889 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.072 34.001 22.085 1.00 0.00 H new ATOM 0 HG13 ILE A 13 26.689 33.447 21.162 1.00 0.00 H new ATOM 0 HG21 ILE A 13 29.096 36.216 20.280 1.00 0.00 H new ATOM 0 HG22 ILE A 13 27.977 37.510 20.770 1.00 0.00 H new ATOM 0 HG23 ILE A 13 28.741 36.479 22.004 1.00 0.00 H new ATOM 0 HD11 ILE A 13 28.747 32.422 20.358 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.043 33.464 19.099 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.447 34.027 20.037 1.00 0.00 H new ATOM 223 N THR A 14 23.706 36.067 21.008 1.00 0.00 N ATOM 224 CA THR A 14 22.374 35.680 20.602 1.00 0.00 C ATOM 225 C THR A 14 22.478 35.174 19.169 1.00 0.00 C ATOM 226 O THR A 14 22.958 35.840 18.259 1.00 0.00 O ATOM 227 CB THR A 14 21.398 36.854 20.640 1.00 0.00 C ATOM 228 OG1 THR A 14 21.670 37.652 21.762 1.00 0.00 O ATOM 229 CG2 THR A 14 19.943 36.373 20.643 1.00 0.00 C ATOM 0 H THR A 14 23.888 37.054 20.825 1.00 0.00 H new ATOM 0 HA THR A 14 21.996 34.921 21.287 1.00 0.00 H new ATOM 0 HB THR A 14 21.533 37.451 19.738 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.391 37.180 22.574 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.275 37.234 20.670 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.750 35.793 19.741 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.768 35.750 21.520 1.00 0.00 H new ATOM 237 N LEU A 15 22.128 33.899 18.967 1.00 0.00 N ATOM 238 CA LEU A 15 22.096 33.145 17.734 1.00 0.00 C ATOM 239 C LEU A 15 20.669 32.903 17.243 1.00 0.00 C ATOM 240 O LEU A 15 19.858 32.453 18.058 1.00 0.00 O ATOM 241 CB LEU A 15 22.780 31.812 18.040 1.00 0.00 C ATOM 242 CG LEU A 15 24.279 31.809 17.738 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.476 31.793 16.220 1.00 0.00 C ATOM 244 CD2 LEU A 15 25.139 32.849 18.452 1.00 0.00 C ATOM 0 H LEU A 15 21.831 33.320 19.753 1.00 0.00 H new ATOM 0 HA LEU A 15 22.600 33.697 16.940 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.629 31.569 19.092 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.299 31.025 17.459 1.00 0.00 H new ATOM 0 HG LEU A 15 24.671 30.894 18.182 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.542 31.791 15.991 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.013 30.899 15.802 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.013 32.678 15.784 1.00 0.00 H new ATOM 0 HD21 LEU A 15 26.179 32.733 18.146 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.793 33.849 18.191 1.00 0.00 H new ATOM 0 HD23 LEU A 15 25.060 32.708 19.530 1.00 0.00 H new ATOM 256 N GLU A 16 20.356 33.100 15.960 1.00 0.00 N ATOM 257 CA GLU A 16 19.103 32.771 15.320 1.00 0.00 C ATOM 258 C GLU A 16 19.147 31.445 14.555 1.00 0.00 C ATOM 259 O GLU A 16 20.107 31.241 13.811 1.00 0.00 O ATOM 260 CB GLU A 16 18.747 33.886 14.333 1.00 0.00 C ATOM 261 CG GLU A 16 19.477 34.149 13.017 1.00 0.00 C ATOM 262 CD GLU A 16 20.995 34.076 13.075 1.00 0.00 C ATOM 263 OE1 GLU A 16 21.624 34.537 14.051 1.00 0.00 O ATOM 264 OE2 GLU A 16 21.507 33.709 12.002 1.00 0.00 O ATOM 0 H GLU A 16 21.020 33.520 15.309 1.00 0.00 H new ATOM 0 HA GLU A 16 18.357 32.670 16.108 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.700 33.733 14.071 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.801 34.817 14.898 1.00 0.00 H new ATOM 0 HG2 GLU A 16 19.126 33.429 12.278 1.00 0.00 H new ATOM 0 HG3 GLU A 16 19.193 35.138 12.658 1.00 0.00 H new ATOM 271 N VAL A 17 18.117 30.617 14.634 1.00 0.00 N ATOM 272 CA VAL A 17 18.186 29.223 14.257 1.00 0.00 C ATOM 273 C VAL A 17 16.766 28.760 13.935 1.00 0.00 C ATOM 274 O VAL A 17 15.851 29.276 14.564 1.00 0.00 O ATOM 275 CB VAL A 17 19.018 28.304 15.167 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.507 28.566 14.960 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.555 28.283 16.617 1.00 0.00 C ATOM 0 H VAL A 17 17.197 30.904 14.968 1.00 0.00 H new ATOM 0 HA VAL A 17 18.797 29.134 13.358 1.00 0.00 H new ATOM 0 HB VAL A 17 18.840 27.273 14.860 1.00 0.00 H new ATOM 0 HG11 VAL A 17 21.086 27.909 15.610 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.770 28.371 13.920 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.731 29.605 15.202 1.00 0.00 H new ATOM 0 HG21 VAL A 17 19.192 27.612 17.193 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.617 29.288 17.033 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.524 27.934 16.665 1.00 0.00 H new ATOM 287 N GLU A 18 16.578 27.897 12.935 1.00 0.00 N ATOM 288 CA GLU A 18 15.282 27.402 12.499 1.00 0.00 C ATOM 289 C GLU A 18 14.927 26.105 13.219 1.00 0.00 C ATOM 290 O GLU A 18 15.832 25.368 13.579 1.00 0.00 O ATOM 291 CB GLU A 18 15.502 27.139 11.005 1.00 0.00 C ATOM 292 CG GLU A 18 14.225 26.899 10.199 1.00 0.00 C ATOM 293 CD GLU A 18 14.367 26.837 8.685 1.00 0.00 C ATOM 294 OE1 GLU A 18 15.446 26.498 8.154 1.00 0.00 O ATOM 295 OE2 GLU A 18 13.427 27.177 7.932 1.00 0.00 O ATOM 0 H GLU A 18 17.352 27.514 12.392 1.00 0.00 H new ATOM 0 HA GLU A 18 14.466 28.095 12.705 1.00 0.00 H new ATOM 0 HB2 GLU A 18 16.031 27.990 10.575 1.00 0.00 H new ATOM 0 HB3 GLU A 18 16.152 26.271 10.896 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.782 25.962 10.537 1.00 0.00 H new ATOM 0 HG3 GLU A 18 13.517 27.692 10.441 1.00 0.00 H new ATOM 302 N PRO A 19 13.672 25.755 13.520 1.00 0.00 N ATOM 303 CA PRO A 19 13.273 24.462 14.023 1.00 0.00 C ATOM 304 C PRO A 19 13.755 23.146 13.397 1.00 0.00 C ATOM 305 O PRO A 19 13.448 22.077 13.926 1.00 0.00 O ATOM 306 CB PRO A 19 11.749 24.419 14.078 1.00 0.00 C ATOM 307 CG PRO A 19 11.401 25.900 14.093 1.00 0.00 C ATOM 308 CD PRO A 19 12.544 26.660 13.415 1.00 0.00 C ATOM 0 HA PRO A 19 13.811 24.449 14.971 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.322 23.907 13.216 1.00 0.00 H new ATOM 0 HB3 PRO A 19 11.386 23.904 14.967 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.462 26.076 13.569 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.265 26.249 15.116 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.311 26.889 12.375 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.745 27.609 13.913 1.00 0.00 H new ATOM 316 N SER A 20 14.571 23.130 12.351 1.00 0.00 N ATOM 317 CA SER A 20 15.001 21.963 11.600 1.00 0.00 C ATOM 318 C SER A 20 16.506 21.983 11.337 1.00 0.00 C ATOM 319 O SER A 20 17.028 21.237 10.516 1.00 0.00 O ATOM 320 CB SER A 20 14.225 21.780 10.304 1.00 0.00 C ATOM 321 OG SER A 20 14.318 22.907 9.464 1.00 0.00 O ATOM 0 H SER A 20 14.976 23.991 11.982 1.00 0.00 H new ATOM 0 HA SER A 20 14.779 21.100 12.228 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.603 20.904 9.777 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.177 21.586 10.534 1.00 0.00 H new ATOM 0 HG SER A 20 13.807 22.746 8.643 1.00 0.00 H new ATOM 327 N ASP A 21 17.220 22.826 12.084 1.00 0.00 N ATOM 328 CA ASP A 21 18.656 22.986 11.966 1.00 0.00 C ATOM 329 C ASP A 21 19.248 21.895 12.864 1.00 0.00 C ATOM 330 O ASP A 21 18.659 21.626 13.909 1.00 0.00 O ATOM 331 CB ASP A 21 19.113 24.333 12.531 1.00 0.00 C ATOM 332 CG ASP A 21 18.949 25.492 11.554 1.00 0.00 C ATOM 333 OD1 ASP A 21 19.222 25.211 10.368 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.794 26.682 11.902 1.00 0.00 O ATOM 0 H ASP A 21 16.803 23.423 12.798 1.00 0.00 H new ATOM 0 HA ASP A 21 18.964 22.928 10.922 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.546 24.549 13.436 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.161 24.259 12.821 1.00 0.00 H new ATOM 339 N THR A 22 20.430 21.370 12.583 1.00 0.00 N ATOM 340 CA THR A 22 21.177 20.371 13.331 1.00 0.00 C ATOM 341 C THR A 22 22.272 21.130 14.092 1.00 0.00 C ATOM 342 O THR A 22 22.674 22.218 13.686 1.00 0.00 O ATOM 343 CB THR A 22 21.728 19.309 12.376 1.00 0.00 C ATOM 344 OG1 THR A 22 22.663 19.787 11.432 1.00 0.00 O ATOM 345 CG2 THR A 22 20.644 18.455 11.722 1.00 0.00 C ATOM 0 H THR A 22 20.938 21.660 11.747 1.00 0.00 H new ATOM 0 HA THR A 22 20.555 19.829 14.044 1.00 0.00 H new ATOM 0 HB THR A 22 22.295 18.651 13.034 1.00 0.00 H new ATOM 0 HG1 THR A 22 22.964 19.046 10.866 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.107 17.724 11.059 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.075 17.936 12.493 1.00 0.00 H new ATOM 0 HG23 THR A 22 19.975 19.095 11.146 1.00 0.00 H new ATOM 353 N ILE A 23 22.695 20.648 15.252 1.00 0.00 N ATOM 354 CA ILE A 23 23.752 21.176 16.100 1.00 0.00 C ATOM 355 C ILE A 23 25.061 21.469 15.373 1.00 0.00 C ATOM 356 O ILE A 23 25.753 22.420 15.718 1.00 0.00 O ATOM 357 CB ILE A 23 23.912 20.165 17.239 1.00 0.00 C ATOM 358 CG1 ILE A 23 22.864 20.397 18.324 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.285 20.337 17.878 1.00 0.00 C ATOM 360 CD1 ILE A 23 21.394 20.041 18.065 1.00 0.00 C ATOM 0 H ILE A 23 22.274 19.811 15.656 1.00 0.00 H new ATOM 0 HA ILE A 23 23.473 22.161 16.474 1.00 0.00 H new ATOM 0 HB ILE A 23 23.793 19.165 16.821 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.181 19.839 19.205 1.00 0.00 H new ATOM 0 HG13 ILE A 23 22.899 21.454 18.587 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.401 19.618 18.689 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.059 20.167 17.129 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.378 21.349 18.273 1.00 0.00 H new ATOM 0 HD11 ILE A 23 20.802 20.276 18.949 1.00 0.00 H new ATOM 0 HD12 ILE A 23 21.024 20.617 17.217 1.00 0.00 H new ATOM 0 HD13 ILE A 23 21.311 18.977 17.845 1.00 0.00 H new ATOM 372 N GLU A 24 25.385 20.785 14.270 1.00 0.00 N ATOM 373 CA GLU A 24 26.361 21.165 13.264 1.00 0.00 C ATOM 374 C GLU A 24 26.215 22.581 12.725 1.00 0.00 C ATOM 375 O GLU A 24 27.218 23.269 12.528 1.00 0.00 O ATOM 376 CB GLU A 24 26.323 20.084 12.180 1.00 0.00 C ATOM 377 CG GLU A 24 27.225 20.251 10.949 1.00 0.00 C ATOM 378 CD GLU A 24 27.593 18.949 10.273 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.660 17.882 10.924 1.00 0.00 O ATOM 380 OE2 GLU A 24 27.927 18.917 9.066 1.00 0.00 O ATOM 0 H GLU A 24 24.939 19.895 14.050 1.00 0.00 H new ATOM 0 HA GLU A 24 27.348 21.211 13.724 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.576 19.134 12.650 1.00 0.00 H new ATOM 0 HB3 GLU A 24 25.294 20.002 11.829 1.00 0.00 H new ATOM 0 HG2 GLU A 24 26.721 20.893 10.227 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.139 20.764 11.248 1.00 0.00 H new ATOM 387 N ASN A 25 24.997 23.011 12.418 1.00 0.00 N ATOM 388 CA ASN A 25 24.598 24.319 11.936 1.00 0.00 C ATOM 389 C ASN A 25 24.922 25.401 12.965 1.00 0.00 C ATOM 390 O ASN A 25 25.504 26.446 12.670 1.00 0.00 O ATOM 391 CB ASN A 25 23.123 24.389 11.532 1.00 0.00 C ATOM 392 CG ASN A 25 22.832 25.524 10.573 1.00 0.00 C ATOM 393 OD1 ASN A 25 23.639 25.778 9.681 1.00 0.00 O ATOM 394 ND2 ASN A 25 21.818 26.349 10.788 1.00 0.00 N ATOM 0 H ASN A 25 24.192 22.391 12.510 1.00 0.00 H new ATOM 0 HA ASN A 25 25.179 24.500 11.031 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.832 23.445 11.070 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.511 24.509 12.426 1.00 0.00 H new ATOM 0 HD21 ASN A 25 21.712 27.187 10.216 1.00 0.00 H new ATOM 0 HD22 ASN A 25 21.143 26.147 11.526 1.00 0.00 H new ATOM 401 N VAL A 26 24.649 25.081 14.227 1.00 0.00 N ATOM 402 CA VAL A 26 24.931 25.923 15.375 1.00 0.00 C ATOM 403 C VAL A 26 26.404 26.294 15.551 1.00 0.00 C ATOM 404 O VAL A 26 26.660 27.435 15.924 1.00 0.00 O ATOM 405 CB VAL A 26 24.297 25.398 16.662 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.059 26.483 17.708 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.944 24.771 16.329 1.00 0.00 C ATOM 0 H VAL A 26 24.210 24.196 14.482 1.00 0.00 H new ATOM 0 HA VAL A 26 24.440 26.868 15.144 1.00 0.00 H new ATOM 0 HB VAL A 26 24.998 24.677 17.082 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.607 26.040 18.595 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.009 26.944 17.977 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.390 27.241 17.300 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.484 24.393 17.242 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.295 25.523 15.880 1.00 0.00 H new ATOM 0 HG23 VAL A 26 23.087 23.949 15.628 1.00 0.00 H new ATOM 417 N LYS A 27 27.316 25.363 15.281 1.00 0.00 N ATOM 418 CA LYS A 27 28.758 25.489 15.277 1.00 0.00 C ATOM 419 C LYS A 27 29.306 26.407 14.181 1.00 0.00 C ATOM 420 O LYS A 27 30.222 27.188 14.424 1.00 0.00 O ATOM 421 CB LYS A 27 29.391 24.103 15.250 1.00 0.00 C ATOM 422 CG LYS A 27 29.155 23.356 16.559 1.00 0.00 C ATOM 423 CD LYS A 27 30.123 22.182 16.736 1.00 0.00 C ATOM 424 CE LYS A 27 29.835 21.166 17.840 1.00 0.00 C ATOM 425 NZ LYS A 27 30.387 19.829 17.600 1.00 0.00 N ATOM 0 H LYS A 27 27.029 24.415 15.038 1.00 0.00 H new ATOM 0 HA LYS A 27 29.040 25.992 16.202 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.976 23.528 14.422 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.462 24.194 15.070 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.267 24.046 17.395 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.130 22.987 16.585 1.00 0.00 H new ATOM 0 HD2 LYS A 27 30.167 21.642 15.790 1.00 0.00 H new ATOM 0 HD3 LYS A 27 31.116 22.594 16.914 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.236 21.547 18.779 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.755 21.082 17.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.204 19.224 18.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 29.937 19.413 16.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.413 19.900 17.444 1.00 0.00 H new ATOM 439 N ALA A 28 28.741 26.335 12.979 1.00 0.00 N ATOM 440 CA ALA A 28 29.098 27.198 11.873 1.00 0.00 C ATOM 441 C ALA A 28 28.653 28.641 12.145 1.00 0.00 C ATOM 442 O ALA A 28 29.443 29.541 11.882 1.00 0.00 O ATOM 443 CB ALA A 28 28.368 26.750 10.609 1.00 0.00 C ATOM 0 H ALA A 28 28.010 25.661 12.749 1.00 0.00 H new ATOM 0 HA ALA A 28 30.180 27.144 11.752 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.641 27.403 9.780 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.650 25.724 10.370 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.292 26.802 10.773 1.00 0.00 H new ATOM 449 N LYS A 29 27.478 28.900 12.722 1.00 0.00 N ATOM 450 CA LYS A 29 26.963 30.190 13.121 1.00 0.00 C ATOM 451 C LYS A 29 27.832 31.061 14.040 1.00 0.00 C ATOM 452 O LYS A 29 28.033 32.255 13.818 1.00 0.00 O ATOM 453 CB LYS A 29 25.477 30.227 13.458 1.00 0.00 C ATOM 454 CG LYS A 29 24.470 29.884 12.352 1.00 0.00 C ATOM 455 CD LYS A 29 23.194 30.703 12.487 1.00 0.00 C ATOM 456 CE LYS A 29 22.442 30.793 11.155 1.00 0.00 C ATOM 457 NZ LYS A 29 21.045 31.221 11.036 1.00 0.00 N ATOM 0 H LYS A 29 26.820 28.150 12.934 1.00 0.00 H new ATOM 0 HA LYS A 29 27.055 30.716 12.171 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.307 29.540 14.287 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.244 31.228 13.821 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.921 30.069 11.377 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.228 28.822 12.395 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.549 30.252 13.241 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.439 31.706 12.836 1.00 0.00 H new ATOM 0 HE2 LYS A 29 23.022 31.464 10.521 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.497 29.802 10.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.651 30.875 10.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.494 30.832 11.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.997 32.260 11.058 1.00 0.00 H new ATOM 471 N ILE A 30 28.371 30.405 15.069 1.00 0.00 N ATOM 472 CA ILE A 30 29.373 30.948 15.956 1.00 0.00 C ATOM 473 C ILE A 30 30.575 31.510 15.210 1.00 0.00 C ATOM 474 O ILE A 30 30.955 32.633 15.530 1.00 0.00 O ATOM 475 CB ILE A 30 29.593 29.828 16.980 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.423 29.460 17.889 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.925 29.979 17.710 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.502 28.047 18.462 1.00 0.00 C ATOM 0 H ILE A 30 28.106 29.449 15.307 1.00 0.00 H new ATOM 0 HA ILE A 30 29.080 31.851 16.491 1.00 0.00 H new ATOM 0 HB ILE A 30 29.650 28.932 16.362 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.378 30.173 18.712 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.494 29.562 17.328 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.042 29.166 18.426 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.741 29.947 16.988 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.945 30.933 18.238 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.635 27.863 19.097 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.515 27.324 17.647 1.00 0.00 H new ATOM 0 HD13 ILE A 30 29.412 27.944 19.053 1.00 0.00 H new ATOM 490 N GLN A 31 31.156 30.765 14.275 1.00 0.00 N ATOM 491 CA GLN A 31 32.131 31.145 13.270 1.00 0.00 C ATOM 492 C GLN A 31 31.779 32.480 12.624 1.00 0.00 C ATOM 493 O GLN A 31 32.570 33.423 12.592 1.00 0.00 O ATOM 494 CB GLN A 31 32.470 30.015 12.290 1.00 0.00 C ATOM 495 CG GLN A 31 33.213 30.392 11.003 1.00 0.00 C ATOM 496 CD GLN A 31 32.407 30.741 9.753 1.00 0.00 C ATOM 497 OE1 GLN A 31 32.849 31.529 8.923 1.00 0.00 O ATOM 498 NE2 GLN A 31 31.202 30.196 9.682 1.00 0.00 N ATOM 0 H GLN A 31 30.927 29.774 14.199 1.00 0.00 H new ATOM 0 HA GLN A 31 33.077 31.315 13.784 1.00 0.00 H new ATOM 0 HB2 GLN A 31 33.072 29.278 12.822 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.539 29.523 12.009 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.852 31.245 11.231 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.871 29.561 10.748 1.00 0.00 H new ATOM 0 HE21 GLN A 31 30.893 29.547 10.405 1.00 0.00 H new ATOM 0 HE22 GLN A 31 30.583 30.426 8.904 1.00 0.00 H new ATOM 507 N ASP A 32 30.563 32.555 12.088 1.00 0.00 N ATOM 508 CA ASP A 32 30.141 33.682 11.287 1.00 0.00 C ATOM 509 C ASP A 32 29.873 34.916 12.164 1.00 0.00 C ATOM 510 O ASP A 32 29.915 36.012 11.612 1.00 0.00 O ATOM 511 CB ASP A 32 28.871 33.245 10.556 1.00 0.00 C ATOM 512 CG ASP A 32 28.355 34.206 9.500 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.102 34.489 8.536 1.00 0.00 O ATOM 514 OD2 ASP A 32 27.153 34.547 9.585 1.00 0.00 O ATOM 0 H ASP A 32 29.850 31.834 12.201 1.00 0.00 H new ATOM 0 HA ASP A 32 30.920 33.969 10.581 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.060 32.281 10.083 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.084 33.089 11.294 1.00 0.00 H new ATOM 519 N LYS A 33 29.455 34.779 13.420 1.00 0.00 N ATOM 520 CA LYS A 33 29.375 35.944 14.276 1.00 0.00 C ATOM 521 C LYS A 33 30.720 36.284 14.919 1.00 0.00 C ATOM 522 O LYS A 33 31.171 37.425 14.836 1.00 0.00 O ATOM 523 CB LYS A 33 28.378 35.525 15.350 1.00 0.00 C ATOM 524 CG LYS A 33 26.931 35.863 14.982 1.00 0.00 C ATOM 525 CD LYS A 33 26.263 34.834 14.057 1.00 0.00 C ATOM 526 CE LYS A 33 24.753 35.041 14.018 1.00 0.00 C ATOM 527 NZ LYS A 33 24.156 34.707 12.709 1.00 0.00 N ATOM 0 H LYS A 33 29.176 33.898 13.852 1.00 0.00 H new ATOM 0 HA LYS A 33 29.083 36.835 13.721 1.00 0.00 H new ATOM 0 HB2 LYS A 33 28.464 34.452 15.519 1.00 0.00 H new ATOM 0 HB3 LYS A 33 28.634 36.017 16.288 1.00 0.00 H new ATOM 0 HG2 LYS A 33 26.345 35.948 15.897 1.00 0.00 H new ATOM 0 HG3 LYS A 33 26.909 36.839 14.498 1.00 0.00 H new ATOM 0 HD2 LYS A 33 26.673 34.923 13.051 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.488 33.826 14.405 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.288 34.427 14.790 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.528 36.080 14.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.522 35.476 12.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 24.911 34.587 12.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 23.614 33.823 12.790 1.00 0.00 H new ATOM 541 N GLU A 34 31.437 35.323 15.496 1.00 0.00 N ATOM 542 CA GLU A 34 32.449 35.681 16.478 1.00 0.00 C ATOM 543 C GLU A 34 33.881 35.319 16.054 1.00 0.00 C ATOM 544 O GLU A 34 34.769 36.000 16.554 1.00 0.00 O ATOM 545 CB GLU A 34 32.019 34.896 17.725 1.00 0.00 C ATOM 546 CG GLU A 34 32.813 35.232 18.985 1.00 0.00 C ATOM 547 CD GLU A 34 32.486 36.549 19.673 1.00 0.00 C ATOM 548 OE1 GLU A 34 31.929 37.444 18.988 1.00 0.00 O ATOM 549 OE2 GLU A 34 32.985 36.721 20.810 1.00 0.00 O ATOM 0 H GLU A 34 31.341 34.325 15.308 1.00 0.00 H new ATOM 0 HA GLU A 34 32.497 36.760 16.628 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.963 35.087 17.914 1.00 0.00 H new ATOM 0 HB3 GLU A 34 32.118 33.830 17.521 1.00 0.00 H new ATOM 0 HG2 GLU A 34 32.664 34.427 19.705 1.00 0.00 H new ATOM 0 HG3 GLU A 34 33.872 35.237 18.727 1.00 0.00 H new ATOM 556 N GLY A 35 34.062 34.395 15.119 1.00 0.00 N ATOM 557 CA GLY A 35 35.388 34.146 14.584 1.00 0.00 C ATOM 558 C GLY A 35 35.979 32.773 14.921 1.00 0.00 C ATOM 559 O GLY A 35 37.163 32.562 14.666 1.00 0.00 O ATOM 0 H GLY A 35 33.321 33.817 14.723 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.351 34.252 13.500 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.063 34.916 14.957 1.00 0.00 H new ATOM 563 N ILE A 36 35.178 32.007 15.656 1.00 0.00 N ATOM 564 CA ILE A 36 35.796 30.910 16.376 1.00 0.00 C ATOM 565 C ILE A 36 35.662 29.620 15.561 1.00 0.00 C ATOM 566 O ILE A 36 34.567 29.388 15.046 1.00 0.00 O ATOM 567 CB ILE A 36 34.992 30.799 17.665 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.085 32.094 18.487 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.460 29.620 18.512 1.00 0.00 C ATOM 570 CD1 ILE A 36 34.119 32.048 19.669 1.00 0.00 C ATOM 0 H ILE A 36 34.169 32.115 15.764 1.00 0.00 H new ATOM 0 HA ILE A 36 36.858 31.072 16.562 1.00 0.00 H new ATOM 0 HB ILE A 36 33.953 30.633 17.382 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.104 32.230 18.848 1.00 0.00 H new ATOM 0 HG13 ILE A 36 34.854 32.951 17.854 1.00 0.00 H new ATOM 0 HG21 ILE A 36 34.866 29.569 19.425 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.338 28.695 17.948 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.511 29.752 18.770 1.00 0.00 H new ATOM 0 HD11 ILE A 36 34.198 32.973 20.240 1.00 0.00 H new ATOM 0 HD12 ILE A 36 33.099 31.935 19.301 1.00 0.00 H new ATOM 0 HD13 ILE A 36 34.369 31.203 20.311 1.00 0.00 H new ATOM 582 N PRO A 37 36.630 28.731 15.390 1.00 0.00 N ATOM 583 CA PRO A 37 36.490 27.760 14.316 1.00 0.00 C ATOM 584 C PRO A 37 35.762 26.505 14.789 1.00 0.00 C ATOM 585 O PRO A 37 35.995 26.150 15.945 1.00 0.00 O ATOM 586 CB PRO A 37 37.940 27.370 14.064 1.00 0.00 C ATOM 587 CG PRO A 37 38.832 27.882 15.200 1.00 0.00 C ATOM 588 CD PRO A 37 37.988 28.972 15.843 1.00 0.00 C ATOM 0 HA PRO A 37 35.938 28.157 13.464 1.00 0.00 H new ATOM 0 HB2 PRO A 37 38.024 26.286 13.986 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.276 27.785 13.113 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.075 27.090 15.909 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.777 28.274 14.824 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.052 28.928 16.930 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.332 29.962 15.543 1.00 0.00 H new ATOM 596 N PRO A 38 34.891 25.843 14.028 1.00 0.00 N ATOM 597 CA PRO A 38 34.125 24.670 14.409 1.00 0.00 C ATOM 598 C PRO A 38 34.956 23.521 14.989 1.00 0.00 C ATOM 599 O PRO A 38 34.490 22.992 15.989 1.00 0.00 O ATOM 600 CB PRO A 38 33.318 24.303 13.164 1.00 0.00 C ATOM 601 CG PRO A 38 33.193 25.587 12.345 1.00 0.00 C ATOM 602 CD PRO A 38 34.481 26.320 12.723 1.00 0.00 C ATOM 0 HA PRO A 38 33.470 24.890 15.252 1.00 0.00 H new ATOM 0 HB2 PRO A 38 33.819 23.523 12.591 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.336 23.917 13.436 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.135 25.386 11.275 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.303 26.158 12.611 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.260 26.131 11.984 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.316 27.397 12.744 1.00 0.00 H new ATOM 610 N ASP A 39 36.078 23.181 14.358 1.00 0.00 N ATOM 611 CA ASP A 39 37.132 22.272 14.754 1.00 0.00 C ATOM 612 C ASP A 39 37.668 22.453 16.179 1.00 0.00 C ATOM 613 O ASP A 39 38.230 21.490 16.695 1.00 0.00 O ATOM 614 CB ASP A 39 38.280 22.289 13.743 1.00 0.00 C ATOM 615 CG ASP A 39 39.543 21.433 13.880 1.00 0.00 C ATOM 616 OD1 ASP A 39 39.534 20.185 13.956 1.00 0.00 O ATOM 617 OD2 ASP A 39 40.637 22.026 13.980 1.00 0.00 O ATOM 0 H ASP A 39 36.287 23.591 13.448 1.00 0.00 H new ATOM 0 HA ASP A 39 36.652 21.293 14.761 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.842 22.036 12.778 1.00 0.00 H new ATOM 0 HB3 ASP A 39 38.617 23.324 13.679 1.00 0.00 H new ATOM 622 N GLN A 40 37.485 23.659 16.704 1.00 0.00 N ATOM 623 CA GLN A 40 37.994 24.042 18.006 1.00 0.00 C ATOM 624 C GLN A 40 36.889 24.482 18.974 1.00 0.00 C ATOM 625 O GLN A 40 37.229 24.964 20.056 1.00 0.00 O ATOM 626 CB GLN A 40 39.161 25.026 17.878 1.00 0.00 C ATOM 627 CG GLN A 40 40.221 24.509 16.894 1.00 0.00 C ATOM 628 CD GLN A 40 41.551 25.234 17.020 1.00 0.00 C ATOM 629 OE1 GLN A 40 41.893 25.844 18.030 1.00 0.00 O ATOM 630 NE2 GLN A 40 42.298 25.198 15.927 1.00 0.00 N ATOM 0 H GLN A 40 36.973 24.403 16.229 1.00 0.00 H new ATOM 0 HA GLN A 40 38.409 23.151 18.476 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.789 25.993 17.540 1.00 0.00 H new ATOM 0 HB3 GLN A 40 39.616 25.184 18.856 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.377 23.443 17.063 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.848 24.619 15.876 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.979 24.680 15.108 1.00 0.00 H new ATOM 0 HE22 GLN A 40 43.192 25.688 15.904 1.00 0.00 H new ATOM 639 N GLN A 41 35.618 24.221 18.689 1.00 0.00 N ATOM 640 CA GLN A 41 34.538 24.410 19.641 1.00 0.00 C ATOM 641 C GLN A 41 34.201 23.003 20.141 1.00 0.00 C ATOM 642 O GLN A 41 34.670 21.994 19.616 1.00 0.00 O ATOM 643 CB GLN A 41 33.296 24.854 18.878 1.00 0.00 C ATOM 644 CG GLN A 41 33.395 26.178 18.124 1.00 0.00 C ATOM 645 CD GLN A 41 32.269 26.451 17.126 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.196 25.858 17.176 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.483 27.271 16.103 1.00 0.00 N ATOM 0 H GLN A 41 35.309 23.870 17.783 1.00 0.00 H new ATOM 0 HA GLN A 41 34.812 25.122 20.420 1.00 0.00 H new ATOM 0 HB2 GLN A 41 33.038 24.073 18.163 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.469 24.925 19.585 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.418 26.990 18.851 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.345 26.202 17.590 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.365 27.779 16.032 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.766 27.393 15.388 1.00 0.00 H new ATOM 656 N ARG A 42 33.504 22.937 21.272 1.00 0.00 N ATOM 657 CA ARG A 42 32.739 21.855 21.861 1.00 0.00 C ATOM 658 C ARG A 42 31.540 22.521 22.544 1.00 0.00 C ATOM 659 O ARG A 42 31.605 23.458 23.328 1.00 0.00 O ATOM 660 CB ARG A 42 33.615 20.991 22.768 1.00 0.00 C ATOM 661 CG ARG A 42 32.864 19.910 23.528 1.00 0.00 C ATOM 662 CD ARG A 42 33.816 18.846 24.088 1.00 0.00 C ATOM 663 NE ARG A 42 34.518 19.079 25.354 1.00 0.00 N ATOM 664 CZ ARG A 42 35.819 19.272 25.597 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.580 19.378 24.501 1.00 0.00 N ATOM 666 NH2 ARG A 42 36.399 19.476 26.797 1.00 0.00 N ATOM 0 H ARG A 42 33.461 23.759 21.875 1.00 0.00 H new ATOM 0 HA ARG A 42 32.370 21.140 21.126 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.389 20.520 22.162 1.00 0.00 H new ATOM 0 HB3 ARG A 42 34.121 21.637 23.486 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.303 20.363 24.345 1.00 0.00 H new ATOM 0 HG3 ARG A 42 32.138 19.437 22.866 1.00 0.00 H new ATOM 0 HD2 ARG A 42 33.242 17.926 24.201 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.574 18.658 23.328 1.00 0.00 H new ATOM 0 HE ARG A 42 33.920 19.097 26.180 1.00 0.00 H new ATOM 0 HH11 ARG A 42 36.155 19.310 23.576 1.00 0.00 H new ATOM 0 HH12 ARG A 42 37.585 19.527 24.590 1.00 0.00 H new ATOM 0 HH21 ARG A 42 35.829 19.494 27.643 1.00 0.00 H new ATOM 0 HH22 ARG A 42 37.408 19.612 26.859 1.00 0.00 H new ATOM 680 N LEU A 43 30.320 22.027 22.328 1.00 0.00 N ATOM 681 CA LEU A 43 29.038 22.528 22.764 1.00 0.00 C ATOM 682 C LEU A 43 28.430 21.590 23.801 1.00 0.00 C ATOM 683 O LEU A 43 28.286 20.376 23.687 1.00 0.00 O ATOM 684 CB LEU A 43 28.153 22.799 21.536 1.00 0.00 C ATOM 685 CG LEU A 43 28.320 24.133 20.819 1.00 0.00 C ATOM 686 CD1 LEU A 43 27.466 24.133 19.545 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.902 25.289 21.721 1.00 0.00 C ATOM 0 H LEU A 43 30.206 21.173 21.783 1.00 0.00 H new ATOM 0 HA LEU A 43 29.143 23.485 23.276 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.333 22.005 20.812 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.112 22.715 21.848 1.00 0.00 H new ATOM 0 HG LEU A 43 29.371 24.264 20.560 1.00 0.00 H new ATOM 0 HD11 LEU A 43 27.583 25.086 19.029 1.00 0.00 H new ATOM 0 HD12 LEU A 43 27.789 23.324 18.890 1.00 0.00 H new ATOM 0 HD13 LEU A 43 26.418 23.989 19.809 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.030 26.231 21.188 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.856 25.171 22.003 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.521 25.293 22.618 1.00 0.00 H new ATOM 699 N ILE A 44 27.912 22.188 24.868 1.00 0.00 N ATOM 700 CA ILE A 44 27.259 21.541 25.994 1.00 0.00 C ATOM 701 C ILE A 44 25.885 22.180 26.202 1.00 0.00 C ATOM 702 O ILE A 44 25.730 23.369 25.947 1.00 0.00 O ATOM 703 CB ILE A 44 28.262 21.543 27.147 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.427 20.583 26.892 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.621 21.315 28.515 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.485 20.458 27.994 1.00 0.00 C ATOM 0 H ILE A 44 27.940 23.202 24.974 1.00 0.00 H new ATOM 0 HA ILE A 44 27.007 20.490 25.853 1.00 0.00 H new ATOM 0 HB ILE A 44 28.671 22.553 27.180 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.014 19.592 26.706 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.928 20.896 25.976 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.392 21.329 29.285 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.896 22.104 28.713 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.117 20.349 28.524 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.251 19.747 27.684 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.943 21.431 28.171 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.014 20.107 28.912 1.00 0.00 H new ATOM 718 N PHE A 45 24.896 21.449 26.695 1.00 0.00 N ATOM 719 CA PHE A 45 23.638 21.812 27.321 1.00 0.00 C ATOM 720 C PHE A 45 23.622 21.414 28.795 1.00 0.00 C ATOM 721 O PHE A 45 23.272 22.204 29.681 1.00 0.00 O ATOM 722 CB PHE A 45 22.523 21.226 26.458 1.00 0.00 C ATOM 723 CG PHE A 45 21.141 21.721 26.802 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.895 23.098 26.907 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.091 20.828 27.053 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.619 23.537 27.285 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.864 21.270 27.575 1.00 0.00 C ATOM 728 CZ PHE A 45 18.591 22.640 27.595 1.00 0.00 C ATOM 0 H PHE A 45 24.975 20.433 26.657 1.00 0.00 H new ATOM 0 HA PHE A 45 23.486 22.891 27.359 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.729 21.459 25.413 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.540 20.140 26.552 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.679 23.811 26.699 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.228 19.778 26.841 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.424 24.598 27.339 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.143 20.562 27.955 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.604 23.000 27.845 1.00 0.00 H new ATOM 738 N ALA A 46 24.093 20.205 29.082 1.00 0.00 N ATOM 739 CA ALA A 46 24.120 19.539 30.363 1.00 0.00 C ATOM 740 C ALA A 46 25.566 19.058 30.497 1.00 0.00 C ATOM 741 O ALA A 46 26.412 19.867 30.863 1.00 0.00 O ATOM 742 CB ALA A 46 23.018 18.487 30.372 1.00 0.00 C ATOM 0 H ALA A 46 24.501 19.620 28.352 1.00 0.00 H new ATOM 0 HA ALA A 46 23.895 20.142 31.243 1.00 0.00 H new ATOM 0 HB1 ALA A 46 23.018 17.969 31.331 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.053 18.970 30.220 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.194 17.769 29.571 1.00 0.00 H new ATOM 748 N GLY A 47 25.793 17.764 30.296 1.00 0.00 N ATOM 749 CA GLY A 47 26.880 17.085 30.975 1.00 0.00 C ATOM 750 C GLY A 47 27.833 16.230 30.140 1.00 0.00 C ATOM 751 O GLY A 47 29.026 16.110 30.438 1.00 0.00 O ATOM 0 H GLY A 47 25.242 17.173 29.674 1.00 0.00 H new ATOM 0 HA2 GLY A 47 27.474 17.840 31.489 1.00 0.00 H new ATOM 0 HA3 GLY A 47 26.445 16.445 31.743 1.00 0.00 H new ATOM 755 N LYS A 48 27.379 15.594 29.071 1.00 0.00 N ATOM 756 CA LYS A 48 28.075 15.172 27.865 1.00 0.00 C ATOM 757 C LYS A 48 27.987 16.212 26.740 1.00 0.00 C ATOM 758 O LYS A 48 27.403 17.272 26.977 1.00 0.00 O ATOM 759 CB LYS A 48 27.588 13.788 27.432 1.00 0.00 C ATOM 760 CG LYS A 48 28.686 12.723 27.453 1.00 0.00 C ATOM 761 CD LYS A 48 28.206 11.350 27.008 1.00 0.00 C ATOM 762 CE LYS A 48 29.300 10.278 27.102 1.00 0.00 C ATOM 763 NZ LYS A 48 28.810 8.981 26.602 1.00 0.00 N ATOM 0 H LYS A 48 26.395 15.330 29.023 1.00 0.00 H new ATOM 0 HA LYS A 48 29.137 15.094 28.098 1.00 0.00 H new ATOM 0 HB2 LYS A 48 26.776 13.475 28.088 1.00 0.00 H new ATOM 0 HB3 LYS A 48 27.176 13.855 26.425 1.00 0.00 H new ATOM 0 HG2 LYS A 48 29.503 13.041 26.805 1.00 0.00 H new ATOM 0 HG3 LYS A 48 29.090 12.649 28.463 1.00 0.00 H new ATOM 0 HD2 LYS A 48 27.357 11.051 27.622 1.00 0.00 H new ATOM 0 HD3 LYS A 48 27.850 11.410 25.979 1.00 0.00 H new ATOM 0 HE2 LYS A 48 30.170 10.589 26.525 1.00 0.00 H new ATOM 0 HE3 LYS A 48 29.625 10.174 28.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 29.567 8.272 26.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 27.994 8.676 27.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 28.523 9.079 25.607 1.00 0.00 H new ATOM 777 N GLN A 49 28.564 15.929 25.587 1.00 0.00 N ATOM 778 CA GLN A 49 28.539 16.762 24.405 1.00 0.00 C ATOM 779 C GLN A 49 27.436 16.284 23.460 1.00 0.00 C ATOM 780 O GLN A 49 27.070 15.116 23.386 1.00 0.00 O ATOM 781 CB GLN A 49 29.918 16.595 23.772 1.00 0.00 C ATOM 782 CG GLN A 49 30.191 15.353 22.914 1.00 0.00 C ATOM 783 CD GLN A 49 31.659 15.329 22.498 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.195 16.351 22.061 1.00 0.00 O ATOM 785 NE2 GLN A 49 32.301 14.170 22.544 1.00 0.00 N ATOM 0 H GLN A 49 29.089 15.066 25.445 1.00 0.00 H new ATOM 0 HA GLN A 49 28.330 17.808 24.631 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.105 17.472 23.152 1.00 0.00 H new ATOM 0 HB3 GLN A 49 30.654 16.609 24.576 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.947 14.451 23.475 1.00 0.00 H new ATOM 0 HG3 GLN A 49 29.553 15.362 22.031 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.832 13.342 22.911 1.00 0.00 H new ATOM 0 HE22 GLN A 49 33.264 14.107 22.213 1.00 0.00 H new ATOM 794 N LEU A 50 26.924 17.240 22.680 1.00 0.00 N ATOM 795 CA LEU A 50 25.837 17.087 21.738 1.00 0.00 C ATOM 796 C LEU A 50 26.344 16.347 20.491 1.00 0.00 C ATOM 797 O LEU A 50 27.397 16.648 19.926 1.00 0.00 O ATOM 798 CB LEU A 50 25.189 18.420 21.354 1.00 0.00 C ATOM 799 CG LEU A 50 24.288 19.091 22.397 1.00 0.00 C ATOM 800 CD1 LEU A 50 25.053 19.915 23.431 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.149 19.962 21.867 1.00 0.00 C ATOM 0 H LEU A 50 27.286 18.194 22.698 1.00 0.00 H new ATOM 0 HA LEU A 50 25.057 16.501 22.225 1.00 0.00 H new ATOM 0 HB2 LEU A 50 25.984 19.119 21.096 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.599 18.260 20.451 1.00 0.00 H new ATOM 0 HG LEU A 50 23.838 18.211 22.856 1.00 0.00 H new ATOM 0 HD11 LEU A 50 24.349 20.359 24.135 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.747 19.270 23.970 1.00 0.00 H new ATOM 0 HD13 LEU A 50 25.609 20.705 22.927 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.588 20.377 22.705 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.561 20.774 21.268 1.00 0.00 H new ATOM 0 HD23 LEU A 50 22.485 19.357 21.250 1.00 0.00 H new ATOM 813 N GLU A 51 25.607 15.371 19.963 1.00 0.00 N ATOM 814 CA GLU A 51 25.784 14.701 18.692 1.00 0.00 C ATOM 815 C GLU A 51 25.271 15.598 17.569 1.00 0.00 C ATOM 816 O GLU A 51 24.091 15.955 17.516 1.00 0.00 O ATOM 817 CB GLU A 51 24.992 13.392 18.671 1.00 0.00 C ATOM 818 CG GLU A 51 25.625 12.467 17.638 1.00 0.00 C ATOM 819 CD GLU A 51 24.566 11.494 17.141 1.00 0.00 C ATOM 820 OE1 GLU A 51 23.668 11.143 17.935 1.00 0.00 O ATOM 821 OE2 GLU A 51 24.627 10.997 16.003 1.00 0.00 O ATOM 0 H GLU A 51 24.800 15.002 20.466 1.00 0.00 H new ATOM 0 HA GLU A 51 26.844 14.489 18.553 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.003 12.925 19.656 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.949 13.583 18.421 1.00 0.00 H new ATOM 0 HG2 GLU A 51 26.025 13.047 16.806 1.00 0.00 H new ATOM 0 HG3 GLU A 51 26.460 11.923 18.079 1.00 0.00 H new ATOM 828 N ASP A 52 26.159 16.095 16.705 1.00 0.00 N ATOM 829 CA ASP A 52 26.019 17.157 15.742 1.00 0.00 C ATOM 830 C ASP A 52 24.948 17.039 14.651 1.00 0.00 C ATOM 831 O ASP A 52 24.379 18.036 14.216 1.00 0.00 O ATOM 832 CB ASP A 52 27.365 17.193 15.007 1.00 0.00 C ATOM 833 CG ASP A 52 28.518 17.663 15.892 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.099 16.835 16.629 1.00 0.00 O ATOM 835 OD2 ASP A 52 28.712 18.899 15.913 1.00 0.00 O ATOM 0 H ASP A 52 27.101 15.706 16.671 1.00 0.00 H new ATOM 0 HA ASP A 52 25.714 18.030 16.319 1.00 0.00 H new ATOM 0 HB2 ASP A 52 27.590 16.197 14.625 1.00 0.00 H new ATOM 0 HB3 ASP A 52 27.284 17.854 14.144 1.00 0.00 H new ATOM 840 N GLY A 53 24.461 15.834 14.368 1.00 0.00 N ATOM 841 CA GLY A 53 23.490 15.510 13.345 1.00 0.00 C ATOM 842 C GLY A 53 22.142 15.147 13.993 1.00 0.00 C ATOM 843 O GLY A 53 21.256 14.697 13.270 1.00 0.00 O ATOM 0 H GLY A 53 24.759 15.007 14.886 1.00 0.00 H new ATOM 0 HA2 GLY A 53 23.362 16.358 12.672 1.00 0.00 H new ATOM 0 HA3 GLY A 53 23.849 14.676 12.742 1.00 0.00 H new ATOM 847 N ARG A 54 21.937 15.441 15.267 1.00 0.00 N ATOM 848 CA ARG A 54 20.590 15.575 15.784 1.00 0.00 C ATOM 849 C ARG A 54 20.163 17.039 15.653 1.00 0.00 C ATOM 850 O ARG A 54 20.934 17.969 15.411 1.00 0.00 O ATOM 851 CB ARG A 54 20.677 15.190 17.267 1.00 0.00 C ATOM 852 CG ARG A 54 21.138 13.757 17.532 1.00 0.00 C ATOM 853 CD ARG A 54 20.935 13.355 18.992 1.00 0.00 C ATOM 854 NE ARG A 54 21.614 12.140 19.443 1.00 0.00 N ATOM 855 CZ ARG A 54 21.521 11.681 20.702 1.00 0.00 C ATOM 856 NH1 ARG A 54 20.826 12.330 21.635 1.00 0.00 N ATOM 857 NH2 ARG A 54 22.127 10.495 20.910 1.00 0.00 N ATOM 0 H ARG A 54 22.678 15.589 15.953 1.00 0.00 H new ATOM 0 HA ARG A 54 19.871 14.952 15.252 1.00 0.00 H new ATOM 0 HB2 ARG A 54 21.362 15.875 17.766 1.00 0.00 H new ATOM 0 HB3 ARG A 54 19.697 15.331 17.723 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.587 13.073 16.887 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.192 13.661 17.272 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.265 14.182 19.621 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.866 13.230 19.164 1.00 0.00 H new ATOM 0 HE ARG A 54 22.181 11.620 18.774 1.00 0.00 H new ATOM 0 HH11 ARG A 54 20.347 13.200 21.401 1.00 0.00 H new ATOM 0 HH12 ARG A 54 20.773 11.957 22.583 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.604 10.024 20.141 1.00 0.00 H new ATOM 0 HH22 ARG A 54 22.108 10.068 21.836 1.00 0.00 H new ATOM 871 N THR A 55 18.863 17.232 15.829 1.00 0.00 N ATOM 872 CA THR A 55 18.207 18.527 15.888 1.00 0.00 C ATOM 873 C THR A 55 18.111 19.104 17.303 1.00 0.00 C ATOM 874 O THR A 55 18.377 18.411 18.285 1.00 0.00 O ATOM 875 CB THR A 55 16.822 18.465 15.253 1.00 0.00 C ATOM 876 OG1 THR A 55 15.919 17.634 15.962 1.00 0.00 O ATOM 877 CG2 THR A 55 16.997 18.205 13.747 1.00 0.00 C ATOM 0 H THR A 55 18.211 16.456 15.939 1.00 0.00 H new ATOM 0 HA THR A 55 18.842 19.205 15.317 1.00 0.00 H new ATOM 0 HB THR A 55 16.307 19.422 15.336 1.00 0.00 H new ATOM 0 HG1 THR A 55 15.176 18.174 16.303 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.018 18.156 13.270 1.00 0.00 H new ATOM 0 HG22 THR A 55 17.577 19.014 13.303 1.00 0.00 H new ATOM 0 HG23 THR A 55 17.520 17.260 13.599 1.00 0.00 H new ATOM 885 N LEU A 56 17.786 20.397 17.329 1.00 0.00 N ATOM 886 CA LEU A 56 17.305 21.193 18.434 1.00 0.00 C ATOM 887 C LEU A 56 16.207 20.611 19.325 1.00 0.00 C ATOM 888 O LEU A 56 16.143 20.728 20.544 1.00 0.00 O ATOM 889 CB LEU A 56 17.157 22.669 18.064 1.00 0.00 C ATOM 890 CG LEU A 56 18.368 23.424 17.516 1.00 0.00 C ATOM 891 CD1 LEU A 56 17.938 24.628 16.669 1.00 0.00 C ATOM 892 CD2 LEU A 56 19.254 23.916 18.664 1.00 0.00 C ATOM 0 H LEU A 56 17.865 20.961 16.483 1.00 0.00 H new ATOM 0 HA LEU A 56 18.122 21.136 19.153 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.361 22.744 17.323 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.815 23.198 18.954 1.00 0.00 H new ATOM 0 HG LEU A 56 18.927 22.731 16.887 1.00 0.00 H new ATOM 0 HD11 LEU A 56 18.822 25.144 16.294 1.00 0.00 H new ATOM 0 HD12 LEU A 56 17.335 24.285 15.829 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.351 25.313 17.281 1.00 0.00 H new ATOM 0 HD21 LEU A 56 20.112 24.452 18.258 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.680 24.584 19.306 1.00 0.00 H new ATOM 0 HD23 LEU A 56 19.602 23.063 19.247 1.00 0.00 H new ATOM 904 N SER A 57 15.360 19.808 18.703 1.00 0.00 N ATOM 905 CA SER A 57 14.276 19.169 19.433 1.00 0.00 C ATOM 906 C SER A 57 14.686 17.783 19.929 1.00 0.00 C ATOM 907 O SER A 57 14.068 17.354 20.899 1.00 0.00 O ATOM 908 CB SER A 57 13.118 19.246 18.426 1.00 0.00 C ATOM 909 OG SER A 57 13.383 18.394 17.336 1.00 0.00 O ATOM 0 H SER A 57 15.399 19.585 17.709 1.00 0.00 H new ATOM 0 HA SER A 57 13.983 19.640 20.371 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.184 18.957 18.908 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.993 20.271 18.077 1.00 0.00 H new ATOM 0 HG SER A 57 12.643 18.443 16.695 1.00 0.00 H new ATOM 915 N ASP A 58 15.800 17.210 19.491 1.00 0.00 N ATOM 916 CA ASP A 58 16.310 15.924 19.929 1.00 0.00 C ATOM 917 C ASP A 58 17.247 16.132 21.120 1.00 0.00 C ATOM 918 O ASP A 58 17.520 15.109 21.748 1.00 0.00 O ATOM 919 CB ASP A 58 17.114 15.247 18.813 1.00 0.00 C ATOM 920 CG ASP A 58 16.330 14.854 17.565 1.00 0.00 C ATOM 921 OD1 ASP A 58 15.241 14.249 17.629 1.00 0.00 O ATOM 922 OD2 ASP A 58 16.799 15.012 16.420 1.00 0.00 O ATOM 0 H ASP A 58 16.396 17.651 18.790 1.00 0.00 H new ATOM 0 HA ASP A 58 15.461 15.297 20.200 1.00 0.00 H new ATOM 0 HB2 ASP A 58 17.920 15.918 18.515 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.581 14.351 19.222 1.00 0.00 H new ATOM 927 N TYR A 59 17.534 17.377 21.501 1.00 0.00 N ATOM 928 CA TYR A 59 18.172 17.594 22.790 1.00 0.00 C ATOM 929 C TYR A 59 17.417 18.434 23.833 1.00 0.00 C ATOM 930 O TYR A 59 17.763 18.558 25.003 1.00 0.00 O ATOM 931 CB TYR A 59 19.440 18.400 22.503 1.00 0.00 C ATOM 932 CG TYR A 59 20.560 17.416 22.269 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.084 16.699 23.345 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.110 17.175 21.005 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.056 15.700 23.182 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.196 16.310 20.819 1.00 0.00 C ATOM 937 CZ TYR A 59 22.557 15.482 21.885 1.00 0.00 C ATOM 938 OH TYR A 59 23.349 14.396 21.651 1.00 0.00 O ATOM 0 H TYR A 59 17.342 18.218 20.957 1.00 0.00 H new ATOM 0 HA TYR A 59 18.281 16.597 23.217 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.300 19.036 21.629 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.675 19.056 23.341 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.728 16.921 24.340 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.684 17.672 20.146 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.407 15.119 24.022 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.736 16.284 19.884 1.00 0.00 H new ATOM 0 HH TYR A 59 23.099 13.671 22.261 1.00 0.00 H new ATOM 948 N ASN A 60 16.335 19.065 23.403 1.00 0.00 N ATOM 949 CA ASN A 60 15.375 19.778 24.229 1.00 0.00 C ATOM 950 C ASN A 60 15.803 21.225 24.454 1.00 0.00 C ATOM 951 O ASN A 60 15.558 21.824 25.498 1.00 0.00 O ATOM 952 CB ASN A 60 15.065 18.948 25.477 1.00 0.00 C ATOM 953 CG ASN A 60 13.754 19.317 26.153 1.00 0.00 C ATOM 954 OD1 ASN A 60 12.746 18.970 25.548 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.711 20.056 27.259 1.00 0.00 N ATOM 0 H ASN A 60 16.091 19.094 22.413 1.00 0.00 H new ATOM 0 HA ASN A 60 14.418 19.887 23.718 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.036 17.894 25.202 1.00 0.00 H new ATOM 0 HB3 ASN A 60 15.878 19.069 26.193 1.00 0.00 H new ATOM 0 HD21 ASN A 60 12.813 20.357 27.636 1.00 0.00 H new ATOM 0 HD22 ASN A 60 14.576 20.321 27.729 1.00 0.00 H new ATOM 962 N ILE A 61 16.318 21.795 23.361 1.00 0.00 N ATOM 963 CA ILE A 61 16.712 23.192 23.290 1.00 0.00 C ATOM 964 C ILE A 61 15.490 24.009 22.882 1.00 0.00 C ATOM 965 O ILE A 61 14.943 23.895 21.792 1.00 0.00 O ATOM 966 CB ILE A 61 17.834 23.438 22.277 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.003 22.444 22.330 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.360 24.864 22.474 1.00 0.00 C ATOM 969 CD1 ILE A 61 19.520 22.229 23.747 1.00 0.00 C ATOM 0 H ILE A 61 16.472 21.285 22.491 1.00 0.00 H new ATOM 0 HA ILE A 61 17.090 23.487 24.269 1.00 0.00 H new ATOM 0 HB ILE A 61 17.390 23.292 21.292 1.00 0.00 H new ATOM 0 HG12 ILE A 61 18.683 21.489 21.914 1.00 0.00 H new ATOM 0 HG13 ILE A 61 19.815 22.809 21.701 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.161 25.058 21.761 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.550 25.576 22.313 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.743 24.973 23.488 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.346 21.518 23.729 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.867 23.178 24.156 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.717 21.837 24.372 1.00 0.00 H new ATOM 981 N GLN A 62 14.933 24.747 23.833 1.00 0.00 N ATOM 982 CA GLN A 62 13.710 25.526 23.848 1.00 0.00 C ATOM 983 C GLN A 62 14.070 26.914 23.304 1.00 0.00 C ATOM 984 O GLN A 62 15.205 27.271 23.026 1.00 0.00 O ATOM 985 CB GLN A 62 13.066 25.530 25.229 1.00 0.00 C ATOM 986 CG GLN A 62 12.642 24.175 25.783 1.00 0.00 C ATOM 987 CD GLN A 62 11.470 23.519 25.060 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.735 24.157 24.316 1.00 0.00 O ATOM 989 NE2 GLN A 62 11.245 22.231 25.263 1.00 0.00 N ATOM 0 H GLN A 62 15.399 24.820 24.737 1.00 0.00 H new ATOM 0 HA GLN A 62 12.939 25.091 23.212 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.766 25.982 25.931 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.188 26.175 25.195 1.00 0.00 H new ATOM 0 HG2 GLN A 62 13.497 23.500 25.744 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.379 24.296 26.834 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.856 21.698 25.882 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.461 21.771 24.800 1.00 0.00 H new ATOM 998 N LYS A 63 13.024 27.742 23.260 1.00 0.00 N ATOM 999 CA LYS A 63 13.243 29.160 23.048 1.00 0.00 C ATOM 1000 C LYS A 63 14.130 29.867 24.068 1.00 0.00 C ATOM 1001 O LYS A 63 14.003 29.713 25.279 1.00 0.00 O ATOM 1002 CB LYS A 63 11.924 29.857 22.699 1.00 0.00 C ATOM 1003 CG LYS A 63 10.915 29.945 23.849 1.00 0.00 C ATOM 1004 CD LYS A 63 9.571 30.579 23.490 1.00 0.00 C ATOM 1005 CE LYS A 63 8.465 30.438 24.543 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.205 30.846 23.919 1.00 0.00 N ATOM 0 H LYS A 63 12.049 27.460 23.365 1.00 0.00 H new ATOM 0 HA LYS A 63 13.885 29.248 22.172 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.145 30.866 22.351 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.459 29.327 21.867 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.734 28.940 24.230 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.363 30.518 24.661 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.731 31.640 23.298 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.219 30.136 22.559 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.402 29.409 24.896 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.681 31.060 25.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.432 30.762 24.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.279 31.833 23.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.008 30.233 23.102 1.00 0.00 H new ATOM 1020 N GLU A 64 15.038 30.721 23.601 1.00 0.00 N ATOM 1021 CA GLU A 64 15.897 31.706 24.228 1.00 0.00 C ATOM 1022 C GLU A 64 16.824 31.088 25.269 1.00 0.00 C ATOM 1023 O GLU A 64 17.230 31.753 26.222 1.00 0.00 O ATOM 1024 CB GLU A 64 14.986 32.805 24.801 1.00 0.00 C ATOM 1025 CG GLU A 64 15.680 34.119 25.148 1.00 0.00 C ATOM 1026 CD GLU A 64 14.841 35.013 26.060 1.00 0.00 C ATOM 1027 OE1 GLU A 64 14.039 35.643 25.340 1.00 0.00 O ATOM 1028 OE2 GLU A 64 14.915 34.956 27.306 1.00 0.00 O ATOM 0 H GLU A 64 15.209 30.730 22.596 1.00 0.00 H new ATOM 0 HA GLU A 64 16.576 32.142 23.495 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.196 33.011 24.079 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.504 32.421 25.700 1.00 0.00 H new ATOM 0 HG2 GLU A 64 16.632 33.904 25.634 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.907 34.658 24.228 1.00 0.00 H new ATOM 1035 N SER A 65 17.078 29.814 25.011 1.00 0.00 N ATOM 1036 CA SER A 65 17.855 28.840 25.772 1.00 0.00 C ATOM 1037 C SER A 65 19.363 29.061 25.687 1.00 0.00 C ATOM 1038 O SER A 65 19.841 29.519 24.650 1.00 0.00 O ATOM 1039 CB SER A 65 17.554 27.469 25.149 1.00 0.00 C ATOM 1040 OG SER A 65 16.266 26.971 25.406 1.00 0.00 O ATOM 0 H SER A 65 16.702 29.386 24.165 1.00 0.00 H new ATOM 0 HA SER A 65 17.577 28.926 26.822 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.692 27.539 24.070 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.286 26.750 25.518 1.00 0.00 H new ATOM 0 HG SER A 65 16.327 26.204 26.013 1.00 0.00 H new ATOM 1046 N THR A 66 20.054 28.677 26.757 1.00 0.00 N ATOM 1047 CA THR A 66 21.492 28.750 26.901 1.00 0.00 C ATOM 1048 C THR A 66 22.016 27.345 26.580 1.00 0.00 C ATOM 1049 O THR A 66 21.635 26.352 27.189 1.00 0.00 O ATOM 1050 CB THR A 66 21.894 29.117 28.327 1.00 0.00 C ATOM 1051 OG1 THR A 66 21.256 30.362 28.550 1.00 0.00 O ATOM 1052 CG2 THR A 66 23.394 29.302 28.532 1.00 0.00 C ATOM 0 H THR A 66 19.598 28.289 27.583 1.00 0.00 H new ATOM 0 HA THR A 66 21.902 29.515 26.242 1.00 0.00 H new ATOM 0 HB THR A 66 21.609 28.314 29.006 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.461 30.677 29.455 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.590 29.561 29.573 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.912 28.375 28.285 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.754 30.102 27.885 1.00 0.00 H new ATOM 1060 N LEU A 67 22.850 27.272 25.544 1.00 0.00 N ATOM 1061 CA LEU A 67 23.863 26.249 25.416 1.00 0.00 C ATOM 1062 C LEU A 67 25.218 26.821 25.834 1.00 0.00 C ATOM 1063 O LEU A 67 25.408 28.028 25.715 1.00 0.00 O ATOM 1064 CB LEU A 67 23.881 25.930 23.914 1.00 0.00 C ATOM 1065 CG LEU A 67 23.015 24.753 23.498 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.619 25.195 23.082 1.00 0.00 C ATOM 1067 CD2 LEU A 67 23.629 23.710 22.560 1.00 0.00 C ATOM 0 H LEU A 67 22.834 27.932 24.767 1.00 0.00 H new ATOM 0 HA LEU A 67 23.666 25.373 26.034 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.554 26.814 23.366 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.909 25.730 23.612 1.00 0.00 H new ATOM 0 HG LEU A 67 22.934 24.175 24.419 1.00 0.00 H new ATOM 0 HD11 LEU A 67 21.033 24.323 22.792 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.132 25.698 23.918 1.00 0.00 H new ATOM 0 HD13 LEU A 67 21.691 25.881 22.238 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.895 22.932 22.351 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.925 24.189 21.627 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.505 23.266 23.033 1.00 0.00 H new ATOM 1079 N HIS A 68 26.152 25.991 26.288 1.00 0.00 N ATOM 1080 CA HIS A 68 27.418 26.379 26.870 1.00 0.00 C ATOM 1081 C HIS A 68 28.533 25.862 25.958 1.00 0.00 C ATOM 1082 O HIS A 68 28.672 24.674 25.684 1.00 0.00 O ATOM 1083 CB HIS A 68 27.503 25.839 28.305 1.00 0.00 C ATOM 1084 CG HIS A 68 26.314 26.053 29.194 1.00 0.00 C ATOM 1085 ND1 HIS A 68 26.148 27.286 29.816 1.00 0.00 N ATOM 1086 CD2 HIS A 68 25.478 25.133 29.774 1.00 0.00 C ATOM 1087 CE1 HIS A 68 25.171 27.071 30.697 1.00 0.00 C ATOM 1088 NE2 HIS A 68 24.612 25.855 30.561 1.00 0.00 N ATOM 0 H HIS A 68 26.033 24.978 26.255 1.00 0.00 H new ATOM 0 HA HIS A 68 27.521 27.462 26.942 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.695 24.767 28.251 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.369 26.294 28.785 1.00 0.00 H new ATOM 0 HD2 HIS A 68 25.496 24.062 29.640 1.00 0.00 H new ATOM 0 HE1 HIS A 68 24.862 27.793 31.438 1.00 0.00 H new ATOM 0 HE2 HIS A 68 23.729 25.535 30.959 1.00 0.00 H new ATOM 1096 N LEU A 69 29.301 26.829 25.469 1.00 0.00 N ATOM 1097 CA LEU A 69 30.415 26.605 24.565 1.00 0.00 C ATOM 1098 C LEU A 69 31.771 26.597 25.272 1.00 0.00 C ATOM 1099 O LEU A 69 32.217 27.543 25.920 1.00 0.00 O ATOM 1100 CB LEU A 69 30.533 27.822 23.642 1.00 0.00 C ATOM 1101 CG LEU A 69 31.647 27.792 22.590 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.453 26.552 21.711 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.767 29.010 21.677 1.00 0.00 C ATOM 0 H LEU A 69 29.160 27.813 25.698 1.00 0.00 H new ATOM 0 HA LEU A 69 30.216 25.651 24.077 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.582 27.948 23.125 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.678 28.706 24.263 1.00 0.00 H new ATOM 0 HG LEU A 69 32.571 27.782 23.168 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.238 26.515 20.956 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.502 25.656 22.330 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.481 26.602 21.221 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.592 28.862 20.980 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.840 29.139 21.119 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.955 29.899 22.279 1.00 0.00 H new ATOM 1115 N VAL A 70 32.454 25.470 25.083 1.00 0.00 N ATOM 1116 CA VAL A 70 33.870 25.281 25.282 1.00 0.00 C ATOM 1117 C VAL A 70 34.644 25.734 24.034 1.00 0.00 C ATOM 1118 O VAL A 70 34.146 25.524 22.931 1.00 0.00 O ATOM 1119 CB VAL A 70 34.098 23.815 25.646 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.498 23.286 25.373 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.616 23.405 27.038 1.00 0.00 C ATOM 0 H VAL A 70 31.994 24.616 24.767 1.00 0.00 H new ATOM 0 HA VAL A 70 34.248 25.894 26.100 1.00 0.00 H new ATOM 0 HB VAL A 70 33.439 23.318 24.934 1.00 0.00 H new ATOM 0 HG11 VAL A 70 35.554 22.238 25.666 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.721 23.378 24.310 1.00 0.00 H new ATOM 0 HG13 VAL A 70 36.223 23.863 25.947 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.824 22.347 27.198 1.00 0.00 H new ATOM 0 HG22 VAL A 70 34.137 23.995 27.792 1.00 0.00 H new ATOM 0 HG23 VAL A 70 32.543 23.580 27.118 1.00 0.00 H new ATOM 1131 N LEU A 71 35.841 26.309 24.126 1.00 0.00 N ATOM 1132 CA LEU A 71 36.744 26.657 23.055 1.00 0.00 C ATOM 1133 C LEU A 71 38.175 26.245 23.401 1.00 0.00 C ATOM 1134 O LEU A 71 38.679 26.336 24.522 1.00 0.00 O ATOM 1135 CB LEU A 71 36.631 28.088 22.528 1.00 0.00 C ATOM 1136 CG LEU A 71 36.623 29.183 23.601 1.00 0.00 C ATOM 1137 CD1 LEU A 71 37.433 30.375 23.087 1.00 0.00 C ATOM 1138 CD2 LEU A 71 35.225 29.463 24.147 1.00 0.00 C ATOM 0 H LEU A 71 36.228 26.561 25.035 1.00 0.00 H new ATOM 0 HA LEU A 71 36.418 26.071 22.196 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.463 28.274 21.849 1.00 0.00 H new ATOM 0 HB3 LEU A 71 35.716 28.170 21.942 1.00 0.00 H new ATOM 0 HG LEU A 71 37.132 28.852 24.506 1.00 0.00 H new ATOM 0 HD11 LEU A 71 37.437 31.164 23.839 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.457 30.060 22.886 1.00 0.00 H new ATOM 0 HD13 LEU A 71 36.983 30.752 22.169 1.00 0.00 H new ATOM 0 HD21 LEU A 71 35.280 30.246 24.903 1.00 0.00 H new ATOM 0 HD22 LEU A 71 34.575 29.788 23.334 1.00 0.00 H new ATOM 0 HD23 LEU A 71 34.820 28.555 24.594 1.00 0.00 H new