USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17 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= -0.0232 K(o=-0.023,f=-2.1) USER MOD Set 1.2: A 62 GLN : amide:sc= 0 K(o=-0.023,f=-1.6!) USER MOD Set 2.1: A 7 THR OG1 : rot -94:sc= 1.06 USER MOD Set 2.2: A 9 THR OG1 : rot 7:sc= 0.06 USER MOD Single : A 1 MET CE :methyl -175:sc= -0.0475 (180deg=-0.118) USER MOD Single : A 1 MET N :NH3+ -140:sc= 2.2 (180deg=2.17) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 146:sc= 1.07 (180deg=0.599) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 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= 0.725 K(o=0.72,f=-0.48) USER MOD Single : A 27 LYS NZ :NH3+ -167:sc= 2.36 (180deg=2.01) USER MOD Single : A 29 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00284) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.404 X(o=-0.4,f=0) USER MOD Single : A 41 GLN : amide:sc= 1.03 K(o=1,f=-1.5) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.455 X(o=-0.46,f=-0.019) USER MOD Single : A 55 THR OG1 : rot 180:sc=-0.00276 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 120:sc= 0.299 USER MOD Single : A 63 LYS NZ :NH3+ -154:sc= 1.22 (180deg=1.12) USER MOD Single : A 65 SER OG : rot 99:sc= 0.136 USER MOD Single : A 66 THR OG1 : rot -40:sc= 0.582 USER MOD Single : A 68 HIS : no HD1:sc= -0.157 X(o=-0.16,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.208 31.126 16.364 1.00 0.00 N ATOM 2 CA MET A 1 13.234 30.774 17.795 1.00 0.00 C ATOM 3 C MET A 1 14.536 31.240 18.436 1.00 0.00 C ATOM 4 O MET A 1 15.545 31.209 17.735 1.00 0.00 O ATOM 5 CB MET A 1 13.108 29.262 17.985 1.00 0.00 C ATOM 6 CG MET A 1 12.876 28.713 19.391 1.00 0.00 C ATOM 7 SD MET A 1 12.771 26.912 19.490 1.00 0.00 S ATOM 8 CE MET A 1 11.051 26.518 19.080 1.00 0.00 C ATOM 0 H1 MET A 1 12.255 31.450 16.103 1.00 0.00 H new ATOM 0 H2 MET A 1 13.894 31.886 16.181 1.00 0.00 H new ATOM 0 H3 MET A 1 13.457 30.291 15.796 1.00 0.00 H new ATOM 0 HA MET A 1 12.390 31.271 18.272 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.286 28.918 17.357 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.018 28.804 17.598 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.686 29.052 20.037 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.954 29.139 19.785 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.883 25.448 19.205 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.384 27.070 19.742 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.850 26.799 18.046 1.00 0.00 H new ATOM 20 N GLN A 2 14.559 31.790 19.654 1.00 0.00 N ATOM 21 CA GLN A 2 15.685 32.505 20.205 1.00 0.00 C ATOM 22 C GLN A 2 16.294 31.562 21.239 1.00 0.00 C ATOM 23 O GLN A 2 15.634 31.155 22.200 1.00 0.00 O ATOM 24 CB GLN A 2 15.123 33.770 20.874 1.00 0.00 C ATOM 25 CG GLN A 2 16.181 34.630 21.569 1.00 0.00 C ATOM 26 CD GLN A 2 15.760 35.261 22.894 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.682 34.612 23.936 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.672 36.588 22.897 1.00 0.00 N ATOM 0 H GLN A 2 13.765 31.741 20.292 1.00 0.00 H new ATOM 0 HA GLN A 2 16.436 32.797 19.470 1.00 0.00 H new ATOM 0 HB2 GLN A 2 14.618 34.373 20.120 1.00 0.00 H new ATOM 0 HB3 GLN A 2 14.370 33.477 21.606 1.00 0.00 H new ATOM 0 HG2 GLN A 2 17.063 34.015 21.746 1.00 0.00 H new ATOM 0 HG3 GLN A 2 16.479 35.427 20.888 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.739 37.106 22.021 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.537 37.088 23.776 1.00 0.00 H new ATOM 37 N ILE A 3 17.574 31.286 21.003 1.00 0.00 N ATOM 38 CA ILE A 3 18.424 30.629 21.979 1.00 0.00 C ATOM 39 C ILE A 3 19.745 31.388 22.082 1.00 0.00 C ATOM 40 O ILE A 3 20.055 32.242 21.252 1.00 0.00 O ATOM 41 CB ILE A 3 18.593 29.168 21.562 1.00 0.00 C ATOM 42 CG1 ILE A 3 19.424 28.925 20.303 1.00 0.00 C ATOM 43 CG2 ILE A 3 17.278 28.409 21.500 1.00 0.00 C ATOM 44 CD1 ILE A 3 19.757 27.455 20.036 1.00 0.00 C ATOM 0 H ILE A 3 18.047 31.514 20.128 1.00 0.00 H new ATOM 0 HA ILE A 3 17.981 30.636 22.975 1.00 0.00 H new ATOM 0 HB ILE A 3 19.188 28.758 22.378 1.00 0.00 H new ATOM 0 HG12 ILE A 3 18.884 29.324 19.444 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.355 29.486 20.383 1.00 0.00 H new ATOM 0 HG21 ILE A 3 17.466 27.379 21.198 1.00 0.00 H new ATOM 0 HG22 ILE A 3 16.806 28.419 22.482 1.00 0.00 H new ATOM 0 HG23 ILE A 3 16.617 28.884 20.775 1.00 0.00 H new ATOM 0 HD11 ILE A 3 20.348 27.376 19.124 1.00 0.00 H new ATOM 0 HD12 ILE A 3 20.327 27.053 20.874 1.00 0.00 H new ATOM 0 HD13 ILE A 3 18.833 26.888 19.920 1.00 0.00 H new ATOM 56 N PHE A 4 20.662 31.066 22.989 1.00 0.00 N ATOM 57 CA PHE A 4 21.859 31.857 23.258 1.00 0.00 C ATOM 58 C PHE A 4 22.980 30.938 23.741 1.00 0.00 C ATOM 59 O PHE A 4 22.683 29.835 24.196 1.00 0.00 O ATOM 60 CB PHE A 4 21.523 33.106 24.065 1.00 0.00 C ATOM 61 CG PHE A 4 20.555 33.189 25.215 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.961 32.943 26.533 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.247 33.624 24.945 1.00 0.00 C ATOM 64 CE1 PHE A 4 20.044 33.040 27.589 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.329 33.571 26.009 1.00 0.00 C ATOM 66 CZ PHE A 4 18.696 33.292 27.332 1.00 0.00 C ATOM 0 H PHE A 4 20.593 30.230 23.570 1.00 0.00 H new ATOM 0 HA PHE A 4 22.278 32.300 22.354 1.00 0.00 H new ATOM 0 HB2 PHE A 4 22.474 33.467 24.456 1.00 0.00 H new ATOM 0 HB3 PHE A 4 21.178 33.841 23.338 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.988 32.677 26.737 1.00 0.00 H new ATOM 0 HD2 PHE A 4 18.960 33.982 23.967 1.00 0.00 H new ATOM 0 HE1 PHE A 4 20.383 32.919 28.607 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.287 33.755 25.795 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.962 33.273 28.124 1.00 0.00 H new ATOM 76 N VAL A 5 24.226 31.302 23.437 1.00 0.00 N ATOM 77 CA VAL A 5 25.389 30.537 23.826 1.00 0.00 C ATOM 78 C VAL A 5 26.145 31.447 24.807 1.00 0.00 C ATOM 79 O VAL A 5 26.061 32.664 24.759 1.00 0.00 O ATOM 80 CB VAL A 5 26.308 30.169 22.657 1.00 0.00 C ATOM 81 CG1 VAL A 5 25.676 29.037 21.851 1.00 0.00 C ATOM 82 CG2 VAL A 5 26.542 31.389 21.762 1.00 0.00 C ATOM 0 H VAL A 5 24.448 32.146 22.909 1.00 0.00 H new ATOM 0 HA VAL A 5 25.078 29.583 24.252 1.00 0.00 H new ATOM 0 HB VAL A 5 27.271 29.839 23.048 1.00 0.00 H new ATOM 0 HG11 VAL A 5 26.329 28.774 21.019 1.00 0.00 H new ATOM 0 HG12 VAL A 5 25.538 28.167 22.493 1.00 0.00 H new ATOM 0 HG13 VAL A 5 24.709 29.361 21.465 1.00 0.00 H new ATOM 0 HG21 VAL A 5 27.197 31.114 20.935 1.00 0.00 H new ATOM 0 HG22 VAL A 5 25.588 31.740 21.368 1.00 0.00 H new ATOM 0 HG23 VAL A 5 27.008 32.184 22.345 1.00 0.00 H new ATOM 92 N LYS A 6 26.871 30.882 25.759 1.00 0.00 N ATOM 93 CA LYS A 6 27.715 31.587 26.708 1.00 0.00 C ATOM 94 C LYS A 6 29.144 31.252 26.288 1.00 0.00 C ATOM 95 O LYS A 6 29.410 30.057 26.168 1.00 0.00 O ATOM 96 CB LYS A 6 27.440 31.275 28.182 1.00 0.00 C ATOM 97 CG LYS A 6 28.127 32.060 29.294 1.00 0.00 C ATOM 98 CD LYS A 6 27.268 33.315 29.442 1.00 0.00 C ATOM 99 CE LYS A 6 27.305 33.826 30.883 1.00 0.00 C ATOM 100 NZ LYS A 6 26.427 34.990 31.067 1.00 0.00 N ATOM 0 H LYS A 6 26.888 29.871 25.896 1.00 0.00 H new ATOM 0 HA LYS A 6 27.508 32.657 26.668 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.366 31.379 28.335 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.684 30.224 28.336 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.164 31.489 30.222 1.00 0.00 H new ATOM 0 HG3 LYS A 6 29.155 32.308 29.031 1.00 0.00 H new ATOM 0 HD2 LYS A 6 27.628 34.091 28.766 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.240 33.094 29.155 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.000 33.029 31.560 1.00 0.00 H new ATOM 0 HE3 LYS A 6 28.327 34.095 31.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 26.477 35.310 32.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 26.734 35.759 30.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 25.448 34.726 30.838 1.00 0.00 H new ATOM 114 N THR A 7 30.048 32.195 25.988 1.00 0.00 N ATOM 115 CA THR A 7 31.447 32.028 25.637 1.00 0.00 C ATOM 116 C THR A 7 32.247 31.537 26.840 1.00 0.00 C ATOM 117 O THR A 7 31.796 31.625 27.974 1.00 0.00 O ATOM 118 CB THR A 7 31.871 33.390 25.079 1.00 0.00 C ATOM 119 OG1 THR A 7 31.701 34.369 26.076 1.00 0.00 O ATOM 120 CG2 THR A 7 31.135 33.805 23.802 1.00 0.00 C ATOM 0 H THR A 7 29.784 33.180 25.988 1.00 0.00 H new ATOM 0 HA THR A 7 31.630 31.259 24.887 1.00 0.00 H new ATOM 0 HB THR A 7 32.919 33.298 24.794 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.822 34.790 25.974 1.00 0.00 H new ATOM 0 HG21 THR A 7 31.495 34.780 23.475 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.320 33.069 23.020 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.065 33.862 24.001 1.00 0.00 H new ATOM 128 N LEU A 8 33.513 31.211 26.582 1.00 0.00 N ATOM 129 CA LEU A 8 34.488 30.983 27.629 1.00 0.00 C ATOM 130 C LEU A 8 34.784 32.294 28.355 1.00 0.00 C ATOM 131 O LEU A 8 35.152 32.285 29.529 1.00 0.00 O ATOM 132 CB LEU A 8 35.767 30.327 27.116 1.00 0.00 C ATOM 133 CG LEU A 8 35.800 28.847 26.752 1.00 0.00 C ATOM 134 CD1 LEU A 8 35.352 28.073 27.988 1.00 0.00 C ATOM 135 CD2 LEU A 8 35.089 28.452 25.460 1.00 0.00 C ATOM 0 H LEU A 8 33.884 31.099 25.639 1.00 0.00 H new ATOM 0 HA LEU A 8 34.054 30.275 28.335 1.00 0.00 H new ATOM 0 HB2 LEU A 8 36.076 30.881 26.229 1.00 0.00 H new ATOM 0 HB3 LEU A 8 36.534 30.486 27.874 1.00 0.00 H new ATOM 0 HG LEU A 8 36.823 28.579 26.487 1.00 0.00 H new ATOM 0 HD11 LEU A 8 35.361 27.005 27.771 1.00 0.00 H new ATOM 0 HD12 LEU A 8 36.032 28.281 28.814 1.00 0.00 H new ATOM 0 HD13 LEU A 8 34.343 28.379 28.263 1.00 0.00 H new ATOM 0 HD21 LEU A 8 35.181 27.377 25.308 1.00 0.00 H new ATOM 0 HD22 LEU A 8 34.035 28.720 25.528 1.00 0.00 H new ATOM 0 HD23 LEU A 8 35.543 28.977 24.620 1.00 0.00 H new ATOM 147 N THR A 9 34.619 33.437 27.701 1.00 0.00 N ATOM 148 CA THR A 9 34.888 34.706 28.352 1.00 0.00 C ATOM 149 C THR A 9 33.684 35.306 29.095 1.00 0.00 C ATOM 150 O THR A 9 33.752 36.381 29.679 1.00 0.00 O ATOM 151 CB THR A 9 35.363 35.732 27.324 1.00 0.00 C ATOM 152 OG1 THR A 9 34.546 35.890 26.185 1.00 0.00 O ATOM 153 CG2 THR A 9 36.748 35.344 26.798 1.00 0.00 C ATOM 0 H THR A 9 34.304 33.509 26.733 1.00 0.00 H new ATOM 0 HA THR A 9 35.655 34.487 29.095 1.00 0.00 H new ATOM 0 HB THR A 9 35.346 36.671 27.877 1.00 0.00 H new ATOM 0 HG1 THR A 9 33.723 35.370 26.298 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.079 36.081 26.066 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.456 35.312 27.626 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.696 34.362 26.327 1.00 0.00 H new ATOM 161 N GLY A 10 32.513 34.687 29.013 1.00 0.00 N ATOM 162 CA GLY A 10 31.377 34.960 29.872 1.00 0.00 C ATOM 163 C GLY A 10 30.353 35.866 29.189 1.00 0.00 C ATOM 164 O GLY A 10 29.354 36.049 29.882 1.00 0.00 O ATOM 0 H GLY A 10 32.326 33.959 28.324 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.901 34.021 30.154 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.722 35.431 30.792 1.00 0.00 H new ATOM 168 N LYS A 11 30.528 36.411 27.987 1.00 0.00 N ATOM 169 CA LYS A 11 29.631 37.255 27.208 1.00 0.00 C ATOM 170 C LYS A 11 28.646 36.410 26.411 1.00 0.00 C ATOM 171 O LYS A 11 29.069 35.357 25.929 1.00 0.00 O ATOM 172 CB LYS A 11 30.431 38.182 26.300 1.00 0.00 C ATOM 173 CG LYS A 11 31.233 37.516 25.174 1.00 0.00 C ATOM 174 CD LYS A 11 31.964 38.419 24.186 1.00 0.00 C ATOM 175 CE LYS A 11 32.346 37.776 22.846 1.00 0.00 C ATOM 176 NZ LYS A 11 33.265 38.620 22.083 1.00 0.00 N ATOM 0 H LYS A 11 31.400 36.253 27.481 1.00 0.00 H new ATOM 0 HA LYS A 11 29.051 37.872 27.894 1.00 0.00 H new ATOM 0 HB2 LYS A 11 29.742 38.897 25.851 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.123 38.752 26.920 1.00 0.00 H new ATOM 0 HG2 LYS A 11 31.970 36.858 25.633 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.550 36.884 24.607 1.00 0.00 H new ATOM 0 HD2 LYS A 11 31.337 39.287 23.984 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.873 38.786 24.663 1.00 0.00 H new ATOM 0 HE2 LYS A 11 32.808 36.806 23.027 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.445 37.596 22.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.924 38.020 21.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.724 39.215 21.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 33.802 39.227 22.735 1.00 0.00 H new ATOM 190 N THR A 12 27.378 36.777 26.256 1.00 0.00 N ATOM 191 CA THR A 12 26.374 35.880 25.718 1.00 0.00 C ATOM 192 C THR A 12 26.130 36.338 24.282 1.00 0.00 C ATOM 193 O THR A 12 26.215 37.536 24.023 1.00 0.00 O ATOM 194 CB THR A 12 25.129 36.166 26.553 1.00 0.00 C ATOM 195 OG1 THR A 12 25.390 35.780 27.892 1.00 0.00 O ATOM 196 CG2 THR A 12 23.983 35.209 26.209 1.00 0.00 C ATOM 0 H THR A 12 27.023 37.702 26.500 1.00 0.00 H new ATOM 0 HA THR A 12 26.644 34.824 25.739 1.00 0.00 H new ATOM 0 HB THR A 12 24.885 37.215 26.386 1.00 0.00 H new ATOM 0 HG1 THR A 12 24.600 35.959 28.444 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.115 35.445 26.824 1.00 0.00 H new ATOM 0 HG22 THR A 12 23.722 35.318 25.156 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.296 34.183 26.401 1.00 0.00 H new ATOM 204 N ILE A 13 25.791 35.435 23.353 1.00 0.00 N ATOM 205 CA ILE A 13 25.464 35.697 21.965 1.00 0.00 C ATOM 206 C ILE A 13 24.123 35.017 21.659 1.00 0.00 C ATOM 207 O ILE A 13 23.976 33.844 22.001 1.00 0.00 O ATOM 208 CB ILE A 13 26.640 35.095 21.198 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.045 35.528 21.610 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.425 35.104 19.690 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.152 34.912 20.754 1.00 0.00 C ATOM 0 H ILE A 13 25.737 34.441 23.576 1.00 0.00 H new ATOM 0 HA ILE A 13 25.339 36.747 21.701 1.00 0.00 H new ATOM 0 HB ILE A 13 26.626 34.057 21.529 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.113 36.614 21.550 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.209 35.255 22.652 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.292 34.665 19.196 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.535 34.523 19.446 1.00 0.00 H new ATOM 0 HG23 ILE A 13 26.294 36.130 19.347 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.122 35.265 21.105 1.00 0.00 H new ATOM 0 HD12 ILE A 13 29.111 33.826 20.833 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.014 35.206 19.714 1.00 0.00 H new ATOM 223 N THR A 14 23.116 35.763 21.238 1.00 0.00 N ATOM 224 CA THR A 14 21.768 35.313 20.954 1.00 0.00 C ATOM 225 C THR A 14 21.725 34.973 19.464 1.00 0.00 C ATOM 226 O THR A 14 22.109 35.792 18.634 1.00 0.00 O ATOM 227 CB THR A 14 20.847 36.444 21.416 1.00 0.00 C ATOM 228 OG1 THR A 14 21.052 36.725 22.774 1.00 0.00 O ATOM 229 CG2 THR A 14 19.365 36.115 21.247 1.00 0.00 C ATOM 0 H THR A 14 23.228 36.764 21.076 1.00 0.00 H new ATOM 0 HA THR A 14 21.441 34.412 21.473 1.00 0.00 H new ATOM 0 HB THR A 14 21.098 37.298 20.787 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.456 37.452 23.051 1.00 0.00 H new ATOM 0 HG21 THR A 14 18.764 36.956 21.592 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.152 35.925 20.195 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.120 35.229 21.833 1.00 0.00 H new ATOM 237 N LEU A 15 21.209 33.767 19.226 1.00 0.00 N ATOM 238 CA LEU A 15 21.091 33.070 17.954 1.00 0.00 C ATOM 239 C LEU A 15 19.591 33.001 17.635 1.00 0.00 C ATOM 240 O LEU A 15 18.797 32.856 18.562 1.00 0.00 O ATOM 241 CB LEU A 15 21.620 31.642 17.874 1.00 0.00 C ATOM 242 CG LEU A 15 23.123 31.421 18.009 1.00 0.00 C ATOM 243 CD1 LEU A 15 23.989 32.342 17.139 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.785 31.462 19.392 1.00 0.00 C ATOM 0 H LEU A 15 20.830 33.207 19.990 1.00 0.00 H new ATOM 0 HA LEU A 15 21.711 33.638 17.261 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.127 31.060 18.653 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.307 31.224 16.917 1.00 0.00 H new ATOM 0 HG LEU A 15 23.109 30.383 17.678 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.042 32.112 17.302 1.00 0.00 H new ATOM 0 HD12 LEU A 15 23.742 32.188 16.089 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.799 33.381 17.408 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.855 31.284 19.288 1.00 0.00 H new ATOM 0 HD22 LEU A 15 23.622 32.440 19.844 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.349 30.691 20.027 1.00 0.00 H new ATOM 256 N GLU A 16 19.106 33.192 16.407 1.00 0.00 N ATOM 257 CA GLU A 16 17.826 32.777 15.880 1.00 0.00 C ATOM 258 C GLU A 16 18.046 31.451 15.148 1.00 0.00 C ATOM 259 O GLU A 16 18.946 31.352 14.312 1.00 0.00 O ATOM 260 CB GLU A 16 17.499 33.960 14.965 1.00 0.00 C ATOM 261 CG GLU A 16 16.035 34.034 14.520 1.00 0.00 C ATOM 262 CD GLU A 16 15.111 34.291 15.708 1.00 0.00 C ATOM 263 OE1 GLU A 16 15.423 35.152 16.552 1.00 0.00 O ATOM 264 OE2 GLU A 16 14.123 33.544 15.848 1.00 0.00 O ATOM 0 H GLU A 16 19.655 33.685 15.703 1.00 0.00 H new ATOM 0 HA GLU A 16 17.017 32.585 16.585 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.755 34.885 15.482 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.132 33.904 14.080 1.00 0.00 H new ATOM 0 HG2 GLU A 16 15.915 34.829 13.784 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.753 33.102 14.031 1.00 0.00 H new ATOM 271 N VAL A 17 17.248 30.455 15.511 1.00 0.00 N ATOM 272 CA VAL A 17 17.259 29.134 14.914 1.00 0.00 C ATOM 273 C VAL A 17 15.767 28.804 14.745 1.00 0.00 C ATOM 274 O VAL A 17 14.875 29.425 15.325 1.00 0.00 O ATOM 275 CB VAL A 17 17.974 28.157 15.850 1.00 0.00 C ATOM 276 CG1 VAL A 17 19.441 28.515 16.047 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.311 27.950 17.216 1.00 0.00 C ATOM 0 H VAL A 17 16.555 30.552 16.253 1.00 0.00 H new ATOM 0 HA VAL A 17 17.790 29.074 13.964 1.00 0.00 H new ATOM 0 HB VAL A 17 17.892 27.206 15.323 1.00 0.00 H new ATOM 0 HG11 VAL A 17 19.905 27.793 16.719 1.00 0.00 H new ATOM 0 HG12 VAL A 17 19.953 28.496 15.085 1.00 0.00 H new ATOM 0 HG13 VAL A 17 19.517 29.513 16.479 1.00 0.00 H new ATOM 0 HG21 VAL A 17 17.896 27.240 17.801 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.261 28.902 17.744 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.303 27.560 17.076 1.00 0.00 H new ATOM 287 N GLU A 18 15.515 27.827 13.887 1.00 0.00 N ATOM 288 CA GLU A 18 14.377 26.961 13.675 1.00 0.00 C ATOM 289 C GLU A 18 14.829 25.586 14.181 1.00 0.00 C ATOM 290 O GLU A 18 15.903 25.208 13.706 1.00 0.00 O ATOM 291 CB GLU A 18 13.900 27.012 12.225 1.00 0.00 C ATOM 292 CG GLU A 18 12.531 26.431 11.846 1.00 0.00 C ATOM 293 CD GLU A 18 11.325 27.353 11.796 1.00 0.00 C ATOM 294 OE1 GLU A 18 11.326 28.434 12.422 1.00 0.00 O ATOM 295 OE2 GLU A 18 10.330 26.918 11.183 1.00 0.00 O ATOM 0 H GLU A 18 16.239 27.590 13.208 1.00 0.00 H new ATOM 0 HA GLU A 18 13.486 27.267 14.223 1.00 0.00 H new ATOM 0 HB2 GLU A 18 13.904 28.058 11.919 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.648 26.500 11.620 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.631 25.968 10.864 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.305 25.633 12.554 1.00 0.00 H new ATOM 302 N PRO A 19 14.184 24.940 15.151 1.00 0.00 N ATOM 303 CA PRO A 19 14.696 23.870 15.980 1.00 0.00 C ATOM 304 C PRO A 19 15.041 22.551 15.294 1.00 0.00 C ATOM 305 O PRO A 19 15.553 21.612 15.892 1.00 0.00 O ATOM 306 CB PRO A 19 13.627 23.446 16.991 1.00 0.00 C ATOM 307 CG PRO A 19 12.359 24.115 16.447 1.00 0.00 C ATOM 308 CD PRO A 19 12.825 25.240 15.519 1.00 0.00 C ATOM 0 HA PRO A 19 15.608 24.314 16.380 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.523 22.362 17.039 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.865 23.788 17.998 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.743 23.397 15.907 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.750 24.510 17.260 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.190 25.300 14.635 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.765 26.205 16.021 1.00 0.00 H new ATOM 316 N SER A 20 14.784 22.497 13.992 1.00 0.00 N ATOM 317 CA SER A 20 14.986 21.320 13.168 1.00 0.00 C ATOM 318 C SER A 20 16.343 21.411 12.451 1.00 0.00 C ATOM 319 O SER A 20 16.695 20.454 11.760 1.00 0.00 O ATOM 320 CB SER A 20 13.819 21.064 12.223 1.00 0.00 C ATOM 321 OG SER A 20 13.460 22.214 11.495 1.00 0.00 O ATOM 0 H SER A 20 14.420 23.294 13.470 1.00 0.00 H new ATOM 0 HA SER A 20 15.014 20.444 13.815 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.084 20.266 11.530 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.960 20.716 12.796 1.00 0.00 H new ATOM 0 HG SER A 20 12.709 22.004 10.901 1.00 0.00 H new ATOM 327 N ASP A 21 17.142 22.436 12.703 1.00 0.00 N ATOM 328 CA ASP A 21 18.488 22.607 12.188 1.00 0.00 C ATOM 329 C ASP A 21 19.492 21.730 12.939 1.00 0.00 C ATOM 330 O ASP A 21 19.214 21.438 14.101 1.00 0.00 O ATOM 331 CB ASP A 21 18.847 24.053 12.510 1.00 0.00 C ATOM 332 CG ASP A 21 19.937 24.658 11.635 1.00 0.00 C ATOM 333 OD1 ASP A 21 20.260 24.041 10.600 1.00 0.00 O ATOM 334 OD2 ASP A 21 20.231 25.850 11.885 1.00 0.00 O ATOM 0 H ASP A 21 16.853 23.209 13.303 1.00 0.00 H new ATOM 0 HA ASP A 21 18.524 22.349 11.130 1.00 0.00 H new ATOM 0 HB2 ASP A 21 17.949 24.663 12.418 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.165 24.109 13.551 1.00 0.00 H new ATOM 339 N THR A 22 20.638 21.396 12.353 1.00 0.00 N ATOM 340 CA THR A 22 21.640 20.459 12.831 1.00 0.00 C ATOM 341 C THR A 22 22.727 21.342 13.440 1.00 0.00 C ATOM 342 O THR A 22 23.033 22.446 12.996 1.00 0.00 O ATOM 343 CB THR A 22 22.099 19.621 11.630 1.00 0.00 C ATOM 344 OG1 THR A 22 22.831 20.323 10.661 1.00 0.00 O ATOM 345 CG2 THR A 22 20.954 18.895 10.915 1.00 0.00 C ATOM 0 H THR A 22 20.908 21.809 11.460 1.00 0.00 H new ATOM 0 HA THR A 22 21.302 19.745 13.582 1.00 0.00 H new ATOM 0 HB THR A 22 22.762 18.897 12.104 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.083 19.713 9.936 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.353 18.323 10.077 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.459 18.219 11.613 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.234 19.626 10.546 1.00 0.00 H new ATOM 353 N ILE A 23 23.414 20.814 14.448 1.00 0.00 N ATOM 354 CA ILE A 23 24.466 21.384 15.260 1.00 0.00 C ATOM 355 C ILE A 23 25.650 22.005 14.508 1.00 0.00 C ATOM 356 O ILE A 23 26.051 23.043 15.032 1.00 0.00 O ATOM 357 CB ILE A 23 25.037 20.357 16.238 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.901 19.469 16.742 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.809 20.867 17.459 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.719 20.151 17.428 1.00 0.00 C ATOM 0 H ILE A 23 23.216 19.859 14.745 1.00 0.00 H new ATOM 0 HA ILE A 23 23.951 22.199 15.768 1.00 0.00 H new ATOM 0 HB ILE A 23 25.788 19.839 15.641 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.516 18.903 15.894 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.324 18.747 17.441 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.149 20.020 18.054 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.670 21.447 17.128 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.157 21.497 18.064 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.991 19.399 17.732 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.071 20.692 18.307 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.250 20.850 16.735 1.00 0.00 H new ATOM 372 N GLU A 24 26.080 21.555 13.337 1.00 0.00 N ATOM 373 CA GLU A 24 27.118 22.187 12.536 1.00 0.00 C ATOM 374 C GLU A 24 26.719 23.565 12.017 1.00 0.00 C ATOM 375 O GLU A 24 27.608 24.386 11.824 1.00 0.00 O ATOM 376 CB GLU A 24 27.428 21.258 11.366 1.00 0.00 C ATOM 377 CG GLU A 24 28.876 21.355 10.883 1.00 0.00 C ATOM 378 CD GLU A 24 29.938 20.712 11.775 1.00 0.00 C ATOM 379 OE1 GLU A 24 29.596 20.256 12.886 1.00 0.00 O ATOM 380 OE2 GLU A 24 31.052 20.637 11.228 1.00 0.00 O ATOM 0 H GLU A 24 25.703 20.712 12.905 1.00 0.00 H new ATOM 0 HA GLU A 24 27.993 22.345 13.167 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.219 20.230 11.662 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.760 21.493 10.538 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.937 20.897 9.896 1.00 0.00 H new ATOM 0 HG3 GLU A 24 29.125 22.409 10.762 1.00 0.00 H new ATOM 387 N ASN A 25 25.439 23.871 11.830 1.00 0.00 N ATOM 388 CA ASN A 25 24.967 25.163 11.371 1.00 0.00 C ATOM 389 C ASN A 25 24.878 26.197 12.500 1.00 0.00 C ATOM 390 O ASN A 25 25.086 27.374 12.236 1.00 0.00 O ATOM 391 CB ASN A 25 23.525 24.958 10.897 1.00 0.00 C ATOM 392 CG ASN A 25 23.010 25.849 9.783 1.00 0.00 C ATOM 393 OD1 ASN A 25 23.856 26.037 8.903 1.00 0.00 O ATOM 394 ND2 ASN A 25 21.872 26.535 9.800 1.00 0.00 N ATOM 0 H ASN A 25 24.685 23.206 12.000 1.00 0.00 H new ATOM 0 HA ASN A 25 25.658 25.523 10.609 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.424 23.923 10.571 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.869 25.086 11.758 1.00 0.00 H new ATOM 0 HD21 ASN A 25 21.685 27.231 9.078 1.00 0.00 H new ATOM 0 HD22 ASN A 25 21.185 26.366 10.535 1.00 0.00 H new ATOM 401 N VAL A 26 24.800 25.759 13.755 1.00 0.00 N ATOM 402 CA VAL A 26 24.928 26.396 15.048 1.00 0.00 C ATOM 403 C VAL A 26 26.386 26.773 15.305 1.00 0.00 C ATOM 404 O VAL A 26 26.747 27.949 15.433 1.00 0.00 O ATOM 405 CB VAL A 26 24.342 25.653 16.247 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.278 26.518 17.508 1.00 0.00 C ATOM 407 CG2 VAL A 26 23.015 24.913 16.104 1.00 0.00 C ATOM 0 H VAL A 26 24.611 24.767 13.899 1.00 0.00 H new ATOM 0 HA VAL A 26 24.299 27.283 14.970 1.00 0.00 H new ATOM 0 HB VAL A 26 25.083 24.857 16.324 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.853 25.937 18.327 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.283 26.844 17.777 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.652 27.390 17.319 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.755 24.446 17.054 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.234 25.618 15.821 1.00 0.00 H new ATOM 0 HG23 VAL A 26 23.107 24.146 15.335 1.00 0.00 H new ATOM 417 N LYS A 27 27.350 25.865 15.184 1.00 0.00 N ATOM 418 CA LYS A 27 28.770 26.120 15.162 1.00 0.00 C ATOM 419 C LYS A 27 29.305 27.139 14.151 1.00 0.00 C ATOM 420 O LYS A 27 30.222 27.921 14.395 1.00 0.00 O ATOM 421 CB LYS A 27 29.672 24.897 14.980 1.00 0.00 C ATOM 422 CG LYS A 27 29.499 23.721 15.934 1.00 0.00 C ATOM 423 CD LYS A 27 30.203 22.466 15.414 1.00 0.00 C ATOM 424 CE LYS A 27 30.145 21.178 16.230 1.00 0.00 C ATOM 425 NZ LYS A 27 30.612 20.118 15.320 1.00 0.00 N ATOM 0 H LYS A 27 27.137 24.872 15.094 1.00 0.00 H new ATOM 0 HA LYS A 27 28.830 26.530 16.170 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.527 24.526 13.965 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.706 25.234 15.052 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.899 23.984 16.913 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.437 23.514 16.069 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.793 22.247 14.428 1.00 0.00 H new ATOM 0 HD3 LYS A 27 31.255 22.716 15.273 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.779 21.244 17.114 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.132 20.979 16.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.394 19.187 15.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.133 20.213 14.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.640 20.204 15.185 1.00 0.00 H new ATOM 439 N ALA A 28 28.670 27.190 12.984 1.00 0.00 N ATOM 440 CA ALA A 28 29.034 28.058 11.880 1.00 0.00 C ATOM 441 C ALA A 28 28.466 29.463 12.045 1.00 0.00 C ATOM 442 O ALA A 28 28.860 30.423 11.379 1.00 0.00 O ATOM 443 CB ALA A 28 28.456 27.542 10.562 1.00 0.00 C ATOM 0 H ALA A 28 27.860 26.605 12.778 1.00 0.00 H new ATOM 0 HA ALA A 28 30.124 28.073 11.872 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.744 28.211 9.751 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.842 26.543 10.362 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.369 27.504 10.632 1.00 0.00 H new ATOM 449 N LYS A 29 27.448 29.685 12.878 1.00 0.00 N ATOM 450 CA LYS A 29 27.015 30.998 13.301 1.00 0.00 C ATOM 451 C LYS A 29 27.947 31.769 14.242 1.00 0.00 C ATOM 452 O LYS A 29 27.719 32.936 14.558 1.00 0.00 O ATOM 453 CB LYS A 29 25.625 30.824 13.922 1.00 0.00 C ATOM 454 CG LYS A 29 24.484 31.021 12.934 1.00 0.00 C ATOM 455 CD LYS A 29 23.304 30.420 13.718 1.00 0.00 C ATOM 456 CE LYS A 29 22.030 30.367 12.873 1.00 0.00 C ATOM 457 NZ LYS A 29 22.107 29.322 11.844 1.00 0.00 N ATOM 0 H LYS A 29 26.894 28.930 13.282 1.00 0.00 H new ATOM 0 HA LYS A 29 27.014 31.631 12.414 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.552 29.826 14.353 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.511 31.534 14.741 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.325 32.072 12.693 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.660 30.501 11.992 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.562 29.414 14.050 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.122 31.014 14.613 1.00 0.00 H new ATOM 0 HE2 LYS A 29 21.172 30.180 13.519 1.00 0.00 H new ATOM 0 HE3 LYS A 29 21.867 31.335 12.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.214 29.292 11.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 22.890 29.533 11.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 22.272 28.400 12.297 1.00 0.00 H new ATOM 471 N ILE A 30 28.868 31.038 14.853 1.00 0.00 N ATOM 472 CA ILE A 30 29.756 31.585 15.857 1.00 0.00 C ATOM 473 C ILE A 30 30.953 32.228 15.156 1.00 0.00 C ATOM 474 O ILE A 30 31.350 33.295 15.610 1.00 0.00 O ATOM 475 CB ILE A 30 30.332 30.489 16.754 1.00 0.00 C ATOM 476 CG1 ILE A 30 29.300 29.488 17.290 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.259 31.000 17.863 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.089 30.077 18.021 1.00 0.00 C ATOM 0 H ILE A 30 29.017 30.047 14.663 1.00 0.00 H new ATOM 0 HA ILE A 30 29.181 32.295 16.452 1.00 0.00 H new ATOM 0 HB ILE A 30 30.962 29.926 16.066 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.936 28.892 16.453 1.00 0.00 H new ATOM 0 HG13 ILE A 30 29.809 28.805 17.970 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.622 30.157 18.451 1.00 0.00 H new ATOM 0 HG22 ILE A 30 32.105 31.523 17.418 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.710 31.684 18.510 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.435 29.270 18.351 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.428 30.646 18.887 1.00 0.00 H new ATOM 0 HD13 ILE A 30 27.541 30.735 17.346 1.00 0.00 H new ATOM 490 N GLN A 31 31.470 31.713 14.046 1.00 0.00 N ATOM 491 CA GLN A 31 32.724 32.008 13.390 1.00 0.00 C ATOM 492 C GLN A 31 32.899 33.504 13.145 1.00 0.00 C ATOM 493 O GLN A 31 33.981 33.996 13.437 1.00 0.00 O ATOM 494 CB GLN A 31 32.859 31.218 12.088 1.00 0.00 C ATOM 495 CG GLN A 31 34.097 31.413 11.217 1.00 0.00 C ATOM 496 CD GLN A 31 35.431 31.069 11.874 1.00 0.00 C ATOM 497 OE1 GLN A 31 35.552 30.023 12.513 1.00 0.00 O ATOM 498 NE2 GLN A 31 36.468 31.900 11.790 1.00 0.00 N ATOM 0 H GLN A 31 30.956 30.998 13.532 1.00 0.00 H new ATOM 0 HA GLN A 31 33.523 31.696 14.062 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.800 30.159 12.341 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.988 31.448 11.474 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.987 30.803 10.320 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.130 32.453 10.893 1.00 0.00 H new ATOM 0 HE21 GLN A 31 36.383 32.770 11.264 1.00 0.00 H new ATOM 0 HE22 GLN A 31 37.347 31.667 12.251 1.00 0.00 H new ATOM 507 N ASP A 32 31.915 34.281 12.688 1.00 0.00 N ATOM 508 CA ASP A 32 32.023 35.702 12.444 1.00 0.00 C ATOM 509 C ASP A 32 32.121 36.528 13.724 1.00 0.00 C ATOM 510 O ASP A 32 32.698 37.618 13.778 1.00 0.00 O ATOM 511 CB ASP A 32 30.812 36.085 11.591 1.00 0.00 C ATOM 512 CG ASP A 32 30.999 37.501 11.045 1.00 0.00 C ATOM 513 OD1 ASP A 32 32.046 37.803 10.433 1.00 0.00 O ATOM 514 OD2 ASP A 32 29.994 38.236 10.937 1.00 0.00 O ATOM 0 H ASP A 32 30.988 33.913 12.472 1.00 0.00 H new ATOM 0 HA ASP A 32 32.954 35.924 11.922 1.00 0.00 H new ATOM 0 HB2 ASP A 32 30.696 35.379 10.769 1.00 0.00 H new ATOM 0 HB3 ASP A 32 29.902 36.032 12.188 1.00 0.00 H new ATOM 519 N LYS A 33 31.538 36.066 14.826 1.00 0.00 N ATOM 520 CA LYS A 33 31.687 36.694 16.121 1.00 0.00 C ATOM 521 C LYS A 33 33.070 36.384 16.694 1.00 0.00 C ATOM 522 O LYS A 33 33.788 37.303 17.085 1.00 0.00 O ATOM 523 CB LYS A 33 30.565 36.267 17.075 1.00 0.00 C ATOM 524 CG LYS A 33 29.091 36.380 16.690 1.00 0.00 C ATOM 525 CD LYS A 33 28.692 37.758 16.171 1.00 0.00 C ATOM 526 CE LYS A 33 27.179 37.818 15.962 1.00 0.00 C ATOM 527 NZ LYS A 33 26.536 39.138 16.118 1.00 0.00 N ATOM 0 H LYS A 33 30.944 35.237 14.838 1.00 0.00 H new ATOM 0 HA LYS A 33 31.604 37.774 16.001 1.00 0.00 H new ATOM 0 HB2 LYS A 33 30.746 35.222 17.325 1.00 0.00 H new ATOM 0 HB3 LYS A 33 30.696 36.842 17.992 1.00 0.00 H new ATOM 0 HG2 LYS A 33 28.867 35.636 15.926 1.00 0.00 H new ATOM 0 HG3 LYS A 33 28.479 36.139 17.559 1.00 0.00 H new ATOM 0 HD2 LYS A 33 29.001 38.526 16.880 1.00 0.00 H new ATOM 0 HD3 LYS A 33 29.206 37.965 15.232 1.00 0.00 H new ATOM 0 HE2 LYS A 33 26.960 37.450 14.960 1.00 0.00 H new ATOM 0 HE3 LYS A 33 26.712 37.128 16.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 25.513 39.048 15.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 26.700 39.492 17.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 26.941 39.805 15.430 1.00 0.00 H new ATOM 541 N GLU A 34 33.344 35.089 16.805 1.00 0.00 N ATOM 542 CA GLU A 34 34.427 34.518 17.570 1.00 0.00 C ATOM 543 C GLU A 34 35.029 33.488 16.616 1.00 0.00 C ATOM 544 O GLU A 34 34.214 32.833 15.973 1.00 0.00 O ATOM 545 CB GLU A 34 33.970 33.974 18.918 1.00 0.00 C ATOM 546 CG GLU A 34 33.724 35.017 20.006 1.00 0.00 C ATOM 547 CD GLU A 34 34.890 35.805 20.604 1.00 0.00 C ATOM 548 OE1 GLU A 34 35.931 35.152 20.858 1.00 0.00 O ATOM 549 OE2 GLU A 34 34.747 37.028 20.770 1.00 0.00 O ATOM 0 H GLU A 34 32.782 34.379 16.336 1.00 0.00 H new ATOM 0 HA GLU A 34 35.178 35.246 17.879 1.00 0.00 H new ATOM 0 HB2 GLU A 34 33.050 33.409 18.768 1.00 0.00 H new ATOM 0 HB3 GLU A 34 34.721 33.271 19.278 1.00 0.00 H new ATOM 0 HG2 GLU A 34 33.019 35.743 19.602 1.00 0.00 H new ATOM 0 HG3 GLU A 34 33.222 34.510 20.830 1.00 0.00 H new ATOM 556 N GLY A 35 36.346 33.355 16.497 1.00 0.00 N ATOM 557 CA GLY A 35 36.955 32.927 15.248 1.00 0.00 C ATOM 558 C GLY A 35 37.402 31.473 15.430 1.00 0.00 C ATOM 559 O GLY A 35 38.489 31.055 15.038 1.00 0.00 O ATOM 0 H GLY A 35 37.009 33.538 17.250 1.00 0.00 H new ATOM 0 HA2 GLY A 35 36.244 33.010 14.426 1.00 0.00 H new ATOM 0 HA3 GLY A 35 37.805 33.562 14.999 1.00 0.00 H new ATOM 563 N ILE A 36 36.586 30.656 16.086 1.00 0.00 N ATOM 564 CA ILE A 36 36.777 29.274 16.498 1.00 0.00 C ATOM 565 C ILE A 36 36.276 28.251 15.478 1.00 0.00 C ATOM 566 O ILE A 36 35.100 28.334 15.150 1.00 0.00 O ATOM 567 CB ILE A 36 36.039 29.192 17.836 1.00 0.00 C ATOM 568 CG1 ILE A 36 36.437 30.279 18.835 1.00 0.00 C ATOM 569 CG2 ILE A 36 36.360 27.849 18.477 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.526 30.436 20.053 1.00 0.00 C ATOM 0 H ILE A 36 35.666 30.989 16.375 1.00 0.00 H new ATOM 0 HA ILE A 36 37.833 29.019 16.583 1.00 0.00 H new ATOM 0 HB ILE A 36 34.980 29.323 17.614 1.00 0.00 H new ATOM 0 HG12 ILE A 36 37.447 30.069 19.186 1.00 0.00 H new ATOM 0 HG13 ILE A 36 36.474 31.233 18.308 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.843 27.770 19.433 1.00 0.00 H new ATOM 0 HG22 ILE A 36 36.032 27.044 17.819 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.435 27.770 18.638 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.905 31.235 20.691 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.517 30.683 19.723 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.505 29.502 20.615 1.00 0.00 H new ATOM 582 N PRO A 37 37.101 27.365 14.926 1.00 0.00 N ATOM 583 CA PRO A 37 36.650 26.586 13.783 1.00 0.00 C ATOM 584 C PRO A 37 35.675 25.478 14.164 1.00 0.00 C ATOM 585 O PRO A 37 35.859 24.917 15.249 1.00 0.00 O ATOM 586 CB PRO A 37 37.946 26.092 13.134 1.00 0.00 C ATOM 587 CG PRO A 37 38.956 26.057 14.278 1.00 0.00 C ATOM 588 CD PRO A 37 38.500 27.177 15.220 1.00 0.00 C ATOM 0 HA PRO A 37 36.058 27.175 13.082 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.816 25.106 12.689 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.271 26.761 12.337 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.955 25.090 14.780 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.971 26.228 13.918 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.650 26.901 16.264 1.00 0.00 H new ATOM 0 HD3 PRO A 37 39.066 28.092 15.048 1.00 0.00 H new ATOM 596 N PRO A 38 34.592 25.167 13.461 1.00 0.00 N ATOM 597 CA PRO A 38 33.728 24.067 13.846 1.00 0.00 C ATOM 598 C PRO A 38 34.414 22.719 14.078 1.00 0.00 C ATOM 599 O PRO A 38 33.689 21.947 14.705 1.00 0.00 O ATOM 600 CB PRO A 38 32.823 24.049 12.614 1.00 0.00 C ATOM 601 CG PRO A 38 32.621 25.520 12.241 1.00 0.00 C ATOM 602 CD PRO A 38 34.059 26.026 12.426 1.00 0.00 C ATOM 0 HA PRO A 38 33.251 24.209 14.816 1.00 0.00 H new ATOM 0 HB2 PRO A 38 33.283 23.495 11.796 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.871 23.564 12.832 1.00 0.00 H new ATOM 0 HG2 PRO A 38 32.260 25.648 11.221 1.00 0.00 H new ATOM 0 HG3 PRO A 38 31.911 26.025 12.896 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.634 25.946 11.503 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.080 27.074 12.725 1.00 0.00 H new ATOM 610 N ASP A 39 35.613 22.348 13.650 1.00 0.00 N ATOM 611 CA ASP A 39 36.218 21.075 14.015 1.00 0.00 C ATOM 612 C ASP A 39 37.019 21.165 15.305 1.00 0.00 C ATOM 613 O ASP A 39 37.893 20.371 15.678 1.00 0.00 O ATOM 614 CB ASP A 39 37.028 20.560 12.820 1.00 0.00 C ATOM 615 CG ASP A 39 36.277 19.891 11.671 1.00 0.00 C ATOM 616 OD1 ASP A 39 35.040 19.779 11.687 1.00 0.00 O ATOM 617 OD2 ASP A 39 36.943 19.346 10.761 1.00 0.00 O ATOM 0 H ASP A 39 36.194 22.922 13.039 1.00 0.00 H new ATOM 0 HA ASP A 39 35.438 20.346 14.237 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.585 21.402 12.408 1.00 0.00 H new ATOM 0 HB3 ASP A 39 37.761 19.847 13.198 1.00 0.00 H new ATOM 622 N GLN A 40 36.819 22.283 15.987 1.00 0.00 N ATOM 623 CA GLN A 40 37.487 22.675 17.213 1.00 0.00 C ATOM 624 C GLN A 40 36.478 23.037 18.301 1.00 0.00 C ATOM 625 O GLN A 40 36.808 22.976 19.490 1.00 0.00 O ATOM 626 CB GLN A 40 38.672 23.627 17.009 1.00 0.00 C ATOM 627 CG GLN A 40 39.615 24.027 18.138 1.00 0.00 C ATOM 628 CD GLN A 40 40.732 25.004 17.815 1.00 0.00 C ATOM 629 OE1 GLN A 40 41.145 25.701 18.740 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.190 25.027 16.572 1.00 0.00 N ATOM 0 H GLN A 40 36.144 22.982 15.677 1.00 0.00 H new ATOM 0 HA GLN A 40 38.005 21.802 17.609 1.00 0.00 H new ATOM 0 HB2 GLN A 40 39.292 23.187 16.228 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.261 24.552 16.606 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.014 24.458 18.939 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.069 23.118 18.533 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.785 24.410 15.868 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.948 25.661 16.319 1.00 0.00 H new ATOM 639 N GLN A 41 35.234 23.326 17.926 1.00 0.00 N ATOM 640 CA GLN A 41 34.157 23.673 18.833 1.00 0.00 C ATOM 641 C GLN A 41 33.411 22.380 19.180 1.00 0.00 C ATOM 642 O GLN A 41 33.427 21.391 18.456 1.00 0.00 O ATOM 643 CB GLN A 41 33.045 24.493 18.169 1.00 0.00 C ATOM 644 CG GLN A 41 33.494 25.857 17.655 1.00 0.00 C ATOM 645 CD GLN A 41 32.379 26.676 17.020 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.297 26.823 17.592 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.639 27.247 15.849 1.00 0.00 N ATOM 0 H GLN A 41 34.944 23.323 16.948 1.00 0.00 H new ATOM 0 HA GLN A 41 34.622 24.215 19.656 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.635 23.921 17.337 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.237 24.636 18.886 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.921 26.423 18.483 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.289 25.715 16.923 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.545 27.105 15.402 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.933 27.827 15.397 1.00 0.00 H new ATOM 656 N ARG A 42 32.723 22.372 20.324 1.00 0.00 N ATOM 657 CA ARG A 42 31.791 21.367 20.791 1.00 0.00 C ATOM 658 C ARG A 42 30.735 22.188 21.535 1.00 0.00 C ATOM 659 O ARG A 42 31.068 23.211 22.121 1.00 0.00 O ATOM 660 CB ARG A 42 32.568 20.415 21.705 1.00 0.00 C ATOM 661 CG ARG A 42 31.571 19.535 22.468 1.00 0.00 C ATOM 662 CD ARG A 42 32.204 18.523 23.424 1.00 0.00 C ATOM 663 NE ARG A 42 31.883 17.129 23.097 1.00 0.00 N ATOM 664 CZ ARG A 42 32.492 16.096 23.696 1.00 0.00 C ATOM 665 NH1 ARG A 42 33.550 16.315 24.486 1.00 0.00 N ATOM 666 NH2 ARG A 42 32.261 14.808 23.402 1.00 0.00 N ATOM 0 H ARG A 42 32.818 23.134 20.995 1.00 0.00 H new ATOM 0 HA ARG A 42 31.325 20.751 20.022 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.244 19.795 21.116 1.00 0.00 H new ATOM 0 HB3 ARG A 42 33.183 20.982 22.404 1.00 0.00 H new ATOM 0 HG2 ARG A 42 30.901 20.180 23.037 1.00 0.00 H new ATOM 0 HG3 ARG A 42 30.958 18.996 21.746 1.00 0.00 H new ATOM 0 HD2 ARG A 42 33.286 18.651 23.411 1.00 0.00 H new ATOM 0 HD3 ARG A 42 31.870 18.736 24.439 1.00 0.00 H new ATOM 0 HE ARG A 42 31.173 16.940 22.390 1.00 0.00 H new ATOM 0 HH11 ARG A 42 33.890 17.266 24.631 1.00 0.00 H new ATOM 0 HH12 ARG A 42 34.016 15.531 24.943 1.00 0.00 H new ATOM 0 HH21 ARG A 42 31.583 14.563 22.680 1.00 0.00 H new ATOM 0 HH22 ARG A 42 32.763 14.073 23.900 1.00 0.00 H new ATOM 680 N LEU A 43 29.466 21.792 21.553 1.00 0.00 N ATOM 681 CA LEU A 43 28.336 22.478 22.145 1.00 0.00 C ATOM 682 C LEU A 43 27.727 21.623 23.259 1.00 0.00 C ATOM 683 O LEU A 43 27.575 20.421 23.016 1.00 0.00 O ATOM 684 CB LEU A 43 27.303 22.943 21.114 1.00 0.00 C ATOM 685 CG LEU A 43 27.698 24.173 20.299 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.644 24.456 19.213 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.834 25.363 21.246 1.00 0.00 C ATOM 0 H LEU A 43 29.186 20.913 21.118 1.00 0.00 H new ATOM 0 HA LEU A 43 28.706 23.400 22.593 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.106 22.121 20.426 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.368 23.157 21.632 1.00 0.00 H new ATOM 0 HG LEU A 43 28.650 23.997 19.799 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.939 25.335 18.640 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.569 23.597 18.546 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.677 24.636 19.683 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.116 26.250 20.678 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.882 25.540 21.747 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.601 25.150 21.990 1.00 0.00 H new ATOM 699 N ILE A 44 27.365 22.128 24.429 1.00 0.00 N ATOM 700 CA ILE A 44 26.654 21.487 25.522 1.00 0.00 C ATOM 701 C ILE A 44 25.433 22.388 25.682 1.00 0.00 C ATOM 702 O ILE A 44 25.492 23.614 25.692 1.00 0.00 O ATOM 703 CB ILE A 44 27.557 21.374 26.753 1.00 0.00 C ATOM 704 CG1 ILE A 44 28.671 20.326 26.720 1.00 0.00 C ATOM 705 CG2 ILE A 44 26.776 21.109 28.043 1.00 0.00 C ATOM 706 CD1 ILE A 44 29.724 20.523 27.801 1.00 0.00 C ATOM 0 H ILE A 44 27.586 23.097 24.658 1.00 0.00 H new ATOM 0 HA ILE A 44 26.353 20.453 25.353 1.00 0.00 H new ATOM 0 HB ILE A 44 28.024 22.359 26.732 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.230 19.335 26.830 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.155 20.353 25.744 1.00 0.00 H new ATOM 0 HG21 ILE A 44 27.470 21.039 28.881 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.076 21.926 28.219 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.225 20.173 27.949 1.00 0.00 H new ATOM 0 HD11 ILE A 44 30.482 19.744 27.717 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.192 21.500 27.679 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.253 20.466 28.782 1.00 0.00 H new ATOM 718 N PHE A 45 24.429 21.569 25.981 1.00 0.00 N ATOM 719 CA PHE A 45 23.215 21.897 26.710 1.00 0.00 C ATOM 720 C PHE A 45 23.085 21.104 28.005 1.00 0.00 C ATOM 721 O PHE A 45 22.671 19.954 28.123 1.00 0.00 O ATOM 722 CB PHE A 45 22.089 21.534 25.738 1.00 0.00 C ATOM 723 CG PHE A 45 20.647 21.558 26.183 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.104 22.652 26.873 1.00 0.00 C ATOM 725 CD2 PHE A 45 19.780 20.519 25.833 1.00 0.00 C ATOM 726 CE1 PHE A 45 18.773 22.713 27.312 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.425 20.648 26.179 1.00 0.00 C ATOM 728 CZ PHE A 45 17.895 21.674 26.969 1.00 0.00 C ATOM 0 H PHE A 45 24.447 20.589 25.698 1.00 0.00 H new ATOM 0 HA PHE A 45 23.200 22.943 27.015 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.172 22.208 24.885 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.294 20.528 25.371 1.00 0.00 H new ATOM 0 HD1 PHE A 45 20.747 23.495 27.078 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.141 19.644 25.313 1.00 0.00 H new ATOM 0 HE1 PHE A 45 18.429 23.547 27.905 1.00 0.00 H new ATOM 0 HE2 PHE A 45 17.741 19.899 25.808 1.00 0.00 H new ATOM 0 HZ PHE A 45 16.866 21.666 27.297 1.00 0.00 H new ATOM 738 N ALA A 46 23.282 21.686 29.185 1.00 0.00 N ATOM 739 CA ALA A 46 22.760 21.208 30.455 1.00 0.00 C ATOM 740 C ALA A 46 23.612 20.180 31.206 1.00 0.00 C ATOM 741 O ALA A 46 23.232 19.662 32.252 1.00 0.00 O ATOM 742 CB ALA A 46 21.249 21.007 30.446 1.00 0.00 C ATOM 0 H ALA A 46 23.833 22.539 29.283 1.00 0.00 H new ATOM 0 HA ALA A 46 22.894 22.044 31.141 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.924 20.650 31.423 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.757 21.954 30.224 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.984 20.273 29.685 1.00 0.00 H new ATOM 748 N GLY A 47 24.782 19.908 30.644 1.00 0.00 N ATOM 749 CA GLY A 47 25.619 18.830 31.140 1.00 0.00 C ATOM 750 C GLY A 47 25.589 17.578 30.267 1.00 0.00 C ATOM 751 O GLY A 47 26.302 16.632 30.558 1.00 0.00 O ATOM 0 H GLY A 47 25.169 20.417 29.849 1.00 0.00 H new ATOM 0 HA2 GLY A 47 26.647 19.185 31.215 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.298 18.567 32.148 1.00 0.00 H new ATOM 755 N LYS A 48 24.842 17.681 29.167 1.00 0.00 N ATOM 756 CA LYS A 48 24.832 16.821 28.007 1.00 0.00 C ATOM 757 C LYS A 48 25.792 17.328 26.933 1.00 0.00 C ATOM 758 O LYS A 48 25.595 18.478 26.528 1.00 0.00 O ATOM 759 CB LYS A 48 23.407 16.777 27.476 1.00 0.00 C ATOM 760 CG LYS A 48 23.041 15.673 26.472 1.00 0.00 C ATOM 761 CD LYS A 48 22.783 14.331 27.141 1.00 0.00 C ATOM 762 CE LYS A 48 21.494 14.244 27.956 1.00 0.00 C ATOM 763 NZ LYS A 48 20.205 14.310 27.252 1.00 0.00 N ATOM 0 H LYS A 48 24.171 18.442 29.067 1.00 0.00 H new ATOM 0 HA LYS A 48 25.167 15.821 28.284 1.00 0.00 H new ATOM 0 HB2 LYS A 48 22.736 16.686 28.330 1.00 0.00 H new ATOM 0 HB3 LYS A 48 23.197 17.738 27.006 1.00 0.00 H new ATOM 0 HG2 LYS A 48 22.153 15.974 25.916 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.849 15.564 25.748 1.00 0.00 H new ATOM 0 HD2 LYS A 48 22.760 13.559 26.372 1.00 0.00 H new ATOM 0 HD3 LYS A 48 23.624 14.103 27.796 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.518 13.307 28.513 1.00 0.00 H new ATOM 0 HE3 LYS A 48 21.512 15.051 28.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 19.429 14.238 27.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 20.133 15.214 26.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 20.140 13.525 26.573 1.00 0.00 H new ATOM 777 N GLN A 49 26.741 16.520 26.479 1.00 0.00 N ATOM 778 CA GLN A 49 27.512 16.874 25.299 1.00 0.00 C ATOM 779 C GLN A 49 26.622 16.597 24.087 1.00 0.00 C ATOM 780 O GLN A 49 26.074 15.499 23.966 1.00 0.00 O ATOM 781 CB GLN A 49 28.785 16.037 25.177 1.00 0.00 C ATOM 782 CG GLN A 49 29.793 16.493 26.235 1.00 0.00 C ATOM 783 CD GLN A 49 30.654 15.376 26.805 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.411 15.564 27.758 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.673 14.125 26.351 1.00 0.00 N ATOM 0 H GLN A 49 26.992 15.627 26.904 1.00 0.00 H new ATOM 0 HA GLN A 49 27.813 17.920 25.364 1.00 0.00 H new ATOM 0 HB2 GLN A 49 28.553 14.980 25.310 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.212 16.147 24.180 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.444 17.250 25.797 1.00 0.00 H new ATOM 0 HG3 GLN A 49 29.253 16.972 27.052 1.00 0.00 H new ATOM 0 HE21 GLN A 49 30.083 13.860 25.563 1.00 0.00 H new ATOM 0 HE22 GLN A 49 31.278 13.432 26.791 1.00 0.00 H new ATOM 794 N LEU A 50 26.502 17.603 23.226 1.00 0.00 N ATOM 795 CA LEU A 50 25.892 17.555 21.919 1.00 0.00 C ATOM 796 C LEU A 50 26.589 16.742 20.819 1.00 0.00 C ATOM 797 O LEU A 50 27.754 16.961 20.513 1.00 0.00 O ATOM 798 CB LEU A 50 25.462 18.901 21.335 1.00 0.00 C ATOM 799 CG LEU A 50 24.592 19.753 22.263 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.906 20.842 21.443 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.535 18.980 23.050 1.00 0.00 C ATOM 0 H LEU A 50 26.856 18.534 23.447 1.00 0.00 H new ATOM 0 HA LEU A 50 25.008 16.985 22.205 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.354 19.469 21.073 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.915 18.722 20.410 1.00 0.00 H new ATOM 0 HG LEU A 50 25.272 20.167 23.008 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.284 21.453 22.097 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.660 21.470 20.969 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.283 20.382 20.676 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.971 19.670 23.677 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.856 18.483 22.357 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.022 18.234 23.678 1.00 0.00 H new ATOM 813 N GLU A 51 25.873 15.814 20.175 1.00 0.00 N ATOM 814 CA GLU A 51 26.457 14.903 19.221 1.00 0.00 C ATOM 815 C GLU A 51 26.156 15.497 17.849 1.00 0.00 C ATOM 816 O GLU A 51 25.051 15.966 17.554 1.00 0.00 O ATOM 817 CB GLU A 51 25.774 13.534 19.353 1.00 0.00 C ATOM 818 CG GLU A 51 26.391 12.445 18.471 1.00 0.00 C ATOM 819 CD GLU A 51 27.712 11.980 19.055 1.00 0.00 C ATOM 820 OE1 GLU A 51 27.715 11.306 20.106 1.00 0.00 O ATOM 821 OE2 GLU A 51 28.776 12.463 18.608 1.00 0.00 O ATOM 0 H GLU A 51 24.870 15.684 20.311 1.00 0.00 H new ATOM 0 HA GLU A 51 27.528 14.771 19.377 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.821 13.214 20.394 1.00 0.00 H new ATOM 0 HB3 GLU A 51 24.719 13.639 19.099 1.00 0.00 H new ATOM 0 HG2 GLU A 51 25.705 11.602 18.389 1.00 0.00 H new ATOM 0 HG3 GLU A 51 26.546 12.829 17.463 1.00 0.00 H new ATOM 828 N ASP A 52 27.094 15.471 16.908 1.00 0.00 N ATOM 829 CA ASP A 52 26.964 15.927 15.536 1.00 0.00 C ATOM 830 C ASP A 52 25.896 15.085 14.829 1.00 0.00 C ATOM 831 O ASP A 52 25.962 13.867 14.865 1.00 0.00 O ATOM 832 CB ASP A 52 28.307 15.917 14.816 1.00 0.00 C ATOM 833 CG ASP A 52 29.483 16.364 15.674 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.659 17.598 15.789 1.00 0.00 O ATOM 835 OD2 ASP A 52 30.289 15.495 16.068 1.00 0.00 O ATOM 0 H ASP A 52 28.027 15.105 17.101 1.00 0.00 H new ATOM 0 HA ASP A 52 26.636 16.967 15.522 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.502 14.909 14.450 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.242 16.566 13.943 1.00 0.00 H new ATOM 840 N GLY A 53 25.080 15.665 13.947 1.00 0.00 N ATOM 841 CA GLY A 53 24.205 14.826 13.154 1.00 0.00 C ATOM 842 C GLY A 53 22.839 14.794 13.829 1.00 0.00 C ATOM 843 O GLY A 53 21.825 14.387 13.275 1.00 0.00 O ATOM 0 H GLY A 53 25.012 16.668 13.773 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.119 15.217 12.140 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.614 13.819 13.074 1.00 0.00 H new ATOM 847 N ARG A 54 22.686 15.132 15.114 1.00 0.00 N ATOM 848 CA ARG A 54 21.434 15.278 15.836 1.00 0.00 C ATOM 849 C ARG A 54 20.891 16.666 15.490 1.00 0.00 C ATOM 850 O ARG A 54 21.645 17.588 15.191 1.00 0.00 O ATOM 851 CB ARG A 54 21.765 15.096 17.316 1.00 0.00 C ATOM 852 CG ARG A 54 22.003 13.678 17.855 1.00 0.00 C ATOM 853 CD ARG A 54 20.813 12.768 17.596 1.00 0.00 C ATOM 854 NE ARG A 54 21.070 11.765 16.560 1.00 0.00 N ATOM 855 CZ ARG A 54 20.181 11.176 15.747 1.00 0.00 C ATOM 856 NH1 ARG A 54 18.887 11.521 15.659 1.00 0.00 N ATOM 857 NH2 ARG A 54 20.660 10.258 14.910 1.00 0.00 N ATOM 0 H ARG A 54 23.492 15.322 15.710 1.00 0.00 H new ATOM 0 HA ARG A 54 20.667 14.549 15.575 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.658 15.683 17.528 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.950 15.535 17.892 1.00 0.00 H new ATOM 0 HG2 ARG A 54 22.892 13.256 17.387 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.199 13.725 18.926 1.00 0.00 H new ATOM 0 HD2 ARG A 54 20.541 12.263 18.523 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.957 13.375 17.301 1.00 0.00 H new ATOM 0 HE ARG A 54 22.042 11.480 16.443 1.00 0.00 H new ATOM 0 HH11 ARG A 54 18.521 12.279 16.235 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.270 11.026 15.016 1.00 0.00 H new ATOM 0 HH21 ARG A 54 21.656 10.037 14.911 1.00 0.00 H new ATOM 0 HH22 ARG A 54 20.031 9.776 14.268 1.00 0.00 H new ATOM 871 N THR A 55 19.595 16.880 15.643 1.00 0.00 N ATOM 872 CA THR A 55 19.042 18.226 15.638 1.00 0.00 C ATOM 873 C THR A 55 18.978 18.770 17.067 1.00 0.00 C ATOM 874 O THR A 55 19.088 18.014 18.030 1.00 0.00 O ATOM 875 CB THR A 55 17.671 18.077 14.971 1.00 0.00 C ATOM 876 OG1 THR A 55 16.787 17.245 15.689 1.00 0.00 O ATOM 877 CG2 THR A 55 17.651 17.677 13.493 1.00 0.00 C ATOM 0 H THR A 55 18.905 16.140 15.772 1.00 0.00 H new ATOM 0 HA THR A 55 19.647 18.950 15.093 1.00 0.00 H new ATOM 0 HB THR A 55 17.322 19.109 14.999 1.00 0.00 H new ATOM 0 HG1 THR A 55 15.931 17.191 15.215 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.619 17.608 13.149 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.180 18.428 12.906 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.140 16.710 13.371 1.00 0.00 H new ATOM 885 N LEU A 56 18.773 20.069 17.287 1.00 0.00 N ATOM 886 CA LEU A 56 18.354 20.720 18.511 1.00 0.00 C ATOM 887 C LEU A 56 17.096 20.104 19.123 1.00 0.00 C ATOM 888 O LEU A 56 17.051 19.868 20.325 1.00 0.00 O ATOM 889 CB LEU A 56 18.067 22.175 18.178 1.00 0.00 C ATOM 890 CG LEU A 56 19.255 22.917 17.578 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.932 24.210 16.815 1.00 0.00 C ATOM 892 CD2 LEU A 56 20.399 23.111 18.580 1.00 0.00 C ATOM 0 H LEU A 56 18.911 20.748 16.538 1.00 0.00 H new ATOM 0 HA LEU A 56 19.152 20.604 19.244 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.232 22.220 17.478 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.750 22.690 19.085 1.00 0.00 H new ATOM 0 HG LEU A 56 19.600 22.236 16.800 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.855 24.648 16.435 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.267 23.984 15.981 1.00 0.00 H new ATOM 0 HD13 LEU A 56 18.445 24.917 17.487 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.218 23.645 18.098 1.00 0.00 H new ATOM 0 HD22 LEU A 56 20.042 23.688 19.433 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.752 22.138 18.922 1.00 0.00 H new ATOM 904 N SER A 57 16.098 19.859 18.270 1.00 0.00 N ATOM 905 CA SER A 57 14.900 19.107 18.556 1.00 0.00 C ATOM 906 C SER A 57 15.042 17.693 19.134 1.00 0.00 C ATOM 907 O SER A 57 14.263 17.218 19.958 1.00 0.00 O ATOM 908 CB SER A 57 14.126 18.959 17.238 1.00 0.00 C ATOM 909 OG SER A 57 12.750 18.647 17.255 1.00 0.00 O ATOM 0 H SER A 57 16.117 20.205 17.311 1.00 0.00 H new ATOM 0 HA SER A 57 14.415 19.683 19.344 1.00 0.00 H new ATOM 0 HB2 SER A 57 14.239 19.894 16.690 1.00 0.00 H new ATOM 0 HB3 SER A 57 14.626 18.186 16.655 1.00 0.00 H new ATOM 0 HG SER A 57 12.416 18.592 16.335 1.00 0.00 H new ATOM 915 N ASP A 58 16.105 16.942 18.866 1.00 0.00 N ATOM 916 CA ASP A 58 16.350 15.614 19.386 1.00 0.00 C ATOM 917 C ASP A 58 16.860 15.545 20.830 1.00 0.00 C ATOM 918 O ASP A 58 16.777 14.496 21.474 1.00 0.00 O ATOM 919 CB ASP A 58 17.422 14.956 18.516 1.00 0.00 C ATOM 920 CG ASP A 58 17.227 13.510 18.093 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.919 12.796 19.075 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.311 13.118 16.910 1.00 0.00 O ATOM 0 H ASP A 58 16.851 17.264 18.250 1.00 0.00 H new ATOM 0 HA ASP A 58 15.380 15.117 19.371 1.00 0.00 H new ATOM 0 HB2 ASP A 58 17.528 15.554 17.611 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.369 15.019 19.052 1.00 0.00 H new ATOM 927 N TYR A 59 17.477 16.627 21.291 1.00 0.00 N ATOM 928 CA TYR A 59 17.897 16.832 22.666 1.00 0.00 C ATOM 929 C TYR A 59 16.929 17.668 23.501 1.00 0.00 C ATOM 930 O TYR A 59 17.092 17.767 24.722 1.00 0.00 O ATOM 931 CB TYR A 59 19.144 17.727 22.640 1.00 0.00 C ATOM 932 CG TYR A 59 20.319 16.864 22.264 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.860 16.076 23.280 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.897 16.825 20.985 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.000 15.290 23.062 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.020 16.038 20.734 1.00 0.00 C ATOM 937 CZ TYR A 59 22.538 15.258 21.768 1.00 0.00 C ATOM 938 OH TYR A 59 23.649 14.501 21.526 1.00 0.00 O ATOM 0 H TYR A 59 17.706 17.417 20.688 1.00 0.00 H new ATOM 0 HA TYR A 59 18.009 15.833 23.087 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.019 18.537 21.921 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.304 18.188 23.615 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.392 16.071 24.253 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.467 17.411 20.187 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.450 14.727 23.866 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.480 16.032 19.757 1.00 0.00 H new ATOM 0 HH TYR A 59 23.442 13.824 20.848 1.00 0.00 H new ATOM 948 N ASN A 60 15.929 18.265 22.868 1.00 0.00 N ATOM 949 CA ASN A 60 14.888 19.136 23.372 1.00 0.00 C ATOM 950 C ASN A 60 15.439 20.515 23.728 1.00 0.00 C ATOM 951 O ASN A 60 15.130 21.014 24.803 1.00 0.00 O ATOM 952 CB ASN A 60 13.899 18.567 24.392 1.00 0.00 C ATOM 953 CG ASN A 60 12.523 19.227 24.469 1.00 0.00 C ATOM 954 OD1 ASN A 60 11.886 19.378 23.423 1.00 0.00 O ATOM 955 ND2 ASN A 60 11.984 19.470 25.654 1.00 0.00 N ATOM 0 H ASN A 60 15.820 18.129 21.863 1.00 0.00 H new ATOM 0 HA ASN A 60 14.218 19.245 22.519 1.00 0.00 H new ATOM 0 HB2 ASN A 60 13.755 17.509 24.170 1.00 0.00 H new ATOM 0 HB3 ASN A 60 14.359 18.626 25.379 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.018 19.791 25.719 1.00 0.00 H new ATOM 0 HD22 ASN A 60 12.535 19.336 26.502 1.00 0.00 H new ATOM 962 N ILE A 61 16.235 21.131 22.856 1.00 0.00 N ATOM 963 CA ILE A 61 16.602 22.528 22.977 1.00 0.00 C ATOM 964 C ILE A 61 15.452 23.345 22.378 1.00 0.00 C ATOM 965 O ILE A 61 15.324 23.460 21.164 1.00 0.00 O ATOM 966 CB ILE A 61 17.929 22.768 22.259 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.061 21.970 22.916 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.343 24.210 21.983 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.203 21.667 21.947 1.00 0.00 C ATOM 0 H ILE A 61 16.642 20.667 22.044 1.00 0.00 H new ATOM 0 HA ILE A 61 16.750 22.829 24.014 1.00 0.00 H new ATOM 0 HB ILE A 61 17.731 22.393 21.255 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.450 22.530 23.767 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.662 21.034 23.306 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.304 24.221 21.469 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.591 24.691 21.357 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.430 24.750 22.926 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.978 21.100 22.463 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.824 21.082 21.109 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.623 22.602 21.576 1.00 0.00 H new ATOM 981 N GLN A 62 14.636 23.941 23.250 1.00 0.00 N ATOM 982 CA GLN A 62 13.590 24.914 23.029 1.00 0.00 C ATOM 983 C GLN A 62 14.020 26.385 23.088 1.00 0.00 C ATOM 984 O GLN A 62 15.232 26.566 23.241 1.00 0.00 O ATOM 985 CB GLN A 62 12.511 24.509 24.029 1.00 0.00 C ATOM 986 CG GLN A 62 11.934 23.098 23.982 1.00 0.00 C ATOM 987 CD GLN A 62 11.008 22.839 22.805 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.942 23.568 21.817 1.00 0.00 O ATOM 989 NE2 GLN A 62 10.185 21.811 22.984 1.00 0.00 N ATOM 0 H GLN A 62 14.711 23.719 24.243 1.00 0.00 H new ATOM 0 HA GLN A 62 13.230 24.889 22.001 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.918 24.662 25.028 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.680 25.205 23.913 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.756 22.383 23.946 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.388 22.910 24.907 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.270 21.228 23.817 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.468 21.605 22.289 1.00 0.00 H new ATOM 998 N LYS A 63 13.138 27.369 22.998 1.00 0.00 N ATOM 999 CA LYS A 63 13.327 28.795 23.157 1.00 0.00 C ATOM 1000 C LYS A 63 13.973 29.165 24.492 1.00 0.00 C ATOM 1001 O LYS A 63 13.584 28.716 25.577 1.00 0.00 O ATOM 1002 CB LYS A 63 12.021 29.540 22.871 1.00 0.00 C ATOM 1003 CG LYS A 63 10.931 29.466 23.943 1.00 0.00 C ATOM 1004 CD LYS A 63 10.983 30.740 24.790 1.00 0.00 C ATOM 1005 CE LYS A 63 10.373 30.376 26.141 1.00 0.00 C ATOM 1006 NZ LYS A 63 10.370 31.486 27.109 1.00 0.00 N ATOM 0 H LYS A 63 12.163 27.158 22.788 1.00 0.00 H new ATOM 0 HA LYS A 63 14.051 29.126 22.413 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.260 30.590 22.702 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.607 29.153 21.940 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.951 29.362 23.478 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.080 28.588 24.572 1.00 0.00 H new ATOM 0 HD2 LYS A 63 12.009 31.088 24.907 1.00 0.00 H new ATOM 0 HD3 LYS A 63 10.425 31.547 24.315 1.00 0.00 H new ATOM 0 HE2 LYS A 63 9.348 30.037 25.987 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.926 29.538 26.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 10.372 31.103 28.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 11.217 32.073 26.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 9.519 32.067 26.969 1.00 0.00 H new ATOM 1020 N GLU A 64 14.896 30.109 24.446 1.00 0.00 N ATOM 1021 CA GLU A 64 15.475 30.816 25.573 1.00 0.00 C ATOM 1022 C GLU A 64 16.630 30.090 26.254 1.00 0.00 C ATOM 1023 O GLU A 64 17.107 30.520 27.296 1.00 0.00 O ATOM 1024 CB GLU A 64 14.406 31.515 26.404 1.00 0.00 C ATOM 1025 CG GLU A 64 14.864 32.576 27.420 1.00 0.00 C ATOM 1026 CD GLU A 64 13.644 33.084 28.180 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.469 32.967 27.790 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.916 33.722 29.219 1.00 0.00 O ATOM 0 H GLU A 64 15.287 30.423 23.558 1.00 0.00 H new ATOM 0 HA GLU A 64 16.053 31.666 25.210 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.706 31.990 25.717 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.851 30.750 26.947 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.589 32.148 28.112 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.360 33.400 26.908 1.00 0.00 H new ATOM 1035 N SER A 65 17.042 28.926 25.759 1.00 0.00 N ATOM 1036 CA SER A 65 17.966 28.033 26.430 1.00 0.00 C ATOM 1037 C SER A 65 19.415 28.531 26.294 1.00 0.00 C ATOM 1038 O SER A 65 19.807 28.840 25.177 1.00 0.00 O ATOM 1039 CB SER A 65 17.921 26.659 25.745 1.00 0.00 C ATOM 1040 OG SER A 65 16.718 25.957 25.960 1.00 0.00 O ATOM 0 H SER A 65 16.730 28.573 24.854 1.00 0.00 H new ATOM 0 HA SER A 65 17.676 27.985 27.480 1.00 0.00 H new ATOM 0 HB2 SER A 65 18.067 26.793 24.673 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.753 26.055 26.107 1.00 0.00 H new ATOM 0 HG SER A 65 16.130 26.071 25.185 1.00 0.00 H new ATOM 1046 N THR A 66 20.134 28.516 27.411 1.00 0.00 N ATOM 1047 CA THR A 66 21.544 28.840 27.430 1.00 0.00 C ATOM 1048 C THR A 66 22.251 27.525 27.081 1.00 0.00 C ATOM 1049 O THR A 66 22.033 26.557 27.800 1.00 0.00 O ATOM 1050 CB THR A 66 21.901 29.332 28.830 1.00 0.00 C ATOM 1051 OG1 THR A 66 21.125 30.473 29.098 1.00 0.00 O ATOM 1052 CG2 THR A 66 23.380 29.660 29.028 1.00 0.00 C ATOM 0 H THR A 66 19.750 28.278 28.325 1.00 0.00 H new ATOM 0 HA THR A 66 21.833 29.625 26.731 1.00 0.00 H new ATOM 0 HB THR A 66 21.690 28.516 29.522 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.066 31.025 28.291 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.543 30.002 30.050 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.978 28.768 28.844 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.675 30.445 28.332 1.00 0.00 H new ATOM 1060 N LEU A 67 22.917 27.562 25.935 1.00 0.00 N ATOM 1061 CA LEU A 67 23.939 26.588 25.630 1.00 0.00 C ATOM 1062 C LEU A 67 25.282 27.197 26.036 1.00 0.00 C ATOM 1063 O LEU A 67 25.366 28.385 26.351 1.00 0.00 O ATOM 1064 CB LEU A 67 24.032 26.387 24.117 1.00 0.00 C ATOM 1065 CG LEU A 67 22.845 25.959 23.259 1.00 0.00 C ATOM 1066 CD1 LEU A 67 23.116 26.071 21.762 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.307 24.570 23.610 1.00 0.00 C ATOM 0 H LEU A 67 22.763 28.258 25.206 1.00 0.00 H new ATOM 0 HA LEU A 67 23.709 25.652 26.140 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.390 27.329 23.702 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.816 25.648 23.951 1.00 0.00 H new ATOM 0 HG LEU A 67 22.062 26.677 23.505 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.233 25.752 21.208 1.00 0.00 H new ATOM 0 HD12 LEU A 67 23.348 27.106 21.511 1.00 0.00 H new ATOM 0 HD13 LEU A 67 23.961 25.435 21.497 1.00 0.00 H new ATOM 0 HD21 LEU A 67 21.465 24.331 22.961 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.094 23.829 23.470 1.00 0.00 H new ATOM 0 HD23 LEU A 67 21.979 24.559 24.649 1.00 0.00 H new ATOM 1079 N HIS A 68 26.313 26.354 25.994 1.00 0.00 N ATOM 1080 CA HIS A 68 27.667 26.724 26.359 1.00 0.00 C ATOM 1081 C HIS A 68 28.660 26.281 25.279 1.00 0.00 C ATOM 1082 O HIS A 68 28.446 25.266 24.627 1.00 0.00 O ATOM 1083 CB HIS A 68 27.949 26.028 27.697 1.00 0.00 C ATOM 1084 CG HIS A 68 28.830 26.806 28.632 1.00 0.00 C ATOM 1085 ND1 HIS A 68 28.316 27.582 29.664 1.00 0.00 N ATOM 1086 CD2 HIS A 68 30.185 26.655 28.779 1.00 0.00 C ATOM 1087 CE1 HIS A 68 29.397 27.983 30.337 1.00 0.00 C ATOM 1088 NE2 HIS A 68 30.520 27.397 29.907 1.00 0.00 N ATOM 0 H HIS A 68 26.223 25.381 25.700 1.00 0.00 H new ATOM 0 HA HIS A 68 27.777 27.805 26.450 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.000 25.828 28.195 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.415 25.063 27.499 1.00 0.00 H new ATOM 0 HD2 HIS A 68 30.851 26.081 28.152 1.00 0.00 H new ATOM 0 HE1 HIS A 68 29.368 28.703 31.142 1.00 0.00 H new ATOM 0 HE2 HIS A 68 31.446 27.479 30.327 1.00 0.00 H new ATOM 1096 N LEU A 69 29.614 27.167 25.014 1.00 0.00 N ATOM 1097 CA LEU A 69 30.532 27.020 23.898 1.00 0.00 C ATOM 1098 C LEU A 69 31.816 26.512 24.557 1.00 0.00 C ATOM 1099 O LEU A 69 32.314 27.155 25.483 1.00 0.00 O ATOM 1100 CB LEU A 69 30.808 28.402 23.302 1.00 0.00 C ATOM 1101 CG LEU A 69 31.815 28.502 22.149 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.150 28.049 20.852 1.00 0.00 C ATOM 1103 CD2 LEU A 69 32.262 29.955 22.008 1.00 0.00 C ATOM 0 H LEU A 69 29.770 28.008 25.570 1.00 0.00 H new ATOM 0 HA LEU A 69 30.155 26.366 23.111 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.860 28.810 22.953 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.157 29.049 24.107 1.00 0.00 H new ATOM 0 HG LEU A 69 32.676 27.866 22.354 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.865 28.120 20.032 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.817 27.016 20.955 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.292 28.687 20.641 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.978 30.038 21.191 1.00 0.00 H new ATOM 0 HD22 LEU A 69 31.397 30.583 21.797 1.00 0.00 H new ATOM 0 HD23 LEU A 69 32.731 30.283 22.936 1.00 0.00 H new ATOM 1115 N VAL A 70 32.323 25.354 24.185 1.00 0.00 N ATOM 1116 CA VAL A 70 33.469 24.667 24.754 1.00 0.00 C ATOM 1117 C VAL A 70 34.269 24.132 23.569 1.00 0.00 C ATOM 1118 O VAL A 70 33.854 24.327 22.431 1.00 0.00 O ATOM 1119 CB VAL A 70 33.102 23.578 25.755 1.00 0.00 C ATOM 1120 CG1 VAL A 70 32.565 24.211 27.045 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.201 22.518 25.128 1.00 0.00 C ATOM 0 H VAL A 70 31.912 24.825 23.415 1.00 0.00 H new ATOM 0 HA VAL A 70 34.061 25.360 25.352 1.00 0.00 H new ATOM 0 HB VAL A 70 33.996 23.025 26.045 1.00 0.00 H new ATOM 0 HG11 VAL A 70 32.305 23.426 27.755 1.00 0.00 H new ATOM 0 HG12 VAL A 70 33.329 24.855 27.480 1.00 0.00 H new ATOM 0 HG13 VAL A 70 31.678 24.803 26.818 1.00 0.00 H new ATOM 0 HG21 VAL A 70 31.961 21.758 25.872 1.00 0.00 H new ATOM 0 HG22 VAL A 70 31.281 22.985 24.775 1.00 0.00 H new ATOM 0 HG23 VAL A 70 32.717 22.053 24.288 1.00 0.00 H new ATOM 1131 N LEU A 71 35.456 23.579 23.822 1.00 0.00 N ATOM 1132 CA LEU A 71 36.431 23.315 22.792 1.00 0.00 C ATOM 1133 C LEU A 71 36.921 21.864 22.869 1.00 0.00 C ATOM 1134 O LEU A 71 37.152 21.346 23.960 1.00 0.00 O ATOM 1135 CB LEU A 71 37.629 24.256 22.892 1.00 0.00 C ATOM 1136 CG LEU A 71 37.784 25.331 21.814 1.00 0.00 C ATOM 1137 CD1 LEU A 71 36.601 26.295 21.716 1.00 0.00 C ATOM 1138 CD2 LEU A 71 39.091 26.089 22.025 1.00 0.00 C ATOM 0 H LEU A 71 35.759 23.304 24.757 1.00 0.00 H new ATOM 0 HA LEU A 71 35.937 23.484 21.835 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.582 24.756 23.859 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.534 23.648 22.891 1.00 0.00 H new ATOM 0 HG LEU A 71 37.806 24.809 20.857 1.00 0.00 H new ATOM 0 HD11 LEU A 71 36.791 27.025 20.929 1.00 0.00 H new ATOM 0 HD12 LEU A 71 35.695 25.736 21.482 1.00 0.00 H new ATOM 0 HD13 LEU A 71 36.473 26.812 22.667 1.00 0.00 H new ATOM 0 HD21 LEU A 71 39.197 26.853 21.255 1.00 0.00 H new ATOM 0 HD22 LEU A 71 39.083 26.562 23.007 1.00 0.00 H new ATOM 0 HD23 LEU A 71 39.929 25.394 21.964 1.00 0.00 H new