USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 671 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 50 CYS SG : rot 165:sc= -1.43! USER MOD Set 1.2: A 87 CYS SG : rot 180:sc= -1.65 USER MOD Set 2.1: A 7 THR OG1 : rot 180:sc= 0.987 USER MOD Set 2.2: A 17 THR OG1 : rot 115:sc= 1.23 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0.148 USER MOD Single : A 15 GLN : amide:sc= 0.16 X(o=0.16,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 150:sc= 1.19 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 33 HIS :FLIP no HD1:sc= -0.653 F(o=-2.1,f=-0.65) USER MOD Single : A 34 ASN :FLIP amide:sc= -0.0498 F(o=-0.64,f=-0.05) USER MOD Single : A 37 MET CE :methyl 177:sc= 0 (180deg=-0.0166) USER MOD Single : A 51 HIS : no HD1:sc= -0.597 X(o=-0.6,f=-1) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 108:sc= 0.988 USER MOD Single : A 70 ASN : amide:sc= -0.0359 K(o=-0.036,f=-3.5!) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot -130:sc= 0.00507 USER MOD Single : A 82 THR OG1 : rot 128:sc= 0.861 USER MOD Single : A 83 SER OG : rot 21:sc= 0.324! USER MOD Single : A 88 GLN : amide:sc= 1.1 K(o=1.1,f=-0.094) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -175:sc= -2.26 (180deg=-2.32) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 25 N GLU A 3 42.563 18.941 19.752 1.00 0.00 N ATOM 26 CA GLU A 3 41.347 18.897 18.926 1.00 0.00 C ATOM 27 C GLU A 3 40.141 18.239 19.619 1.00 0.00 C ATOM 28 O GLU A 3 39.502 17.314 19.098 1.00 0.00 O ATOM 29 CB GLU A 3 41.616 18.344 17.521 1.00 0.00 C ATOM 30 CG GLU A 3 42.787 19.020 16.801 1.00 0.00 C ATOM 31 CD GLU A 3 42.638 18.862 15.289 1.00 0.00 C ATOM 32 OE1 GLU A 3 42.792 17.732 14.761 1.00 0.00 O ATOM 33 OE2 GLU A 3 42.300 19.871 14.620 1.00 0.00 O ATOM 0 HA GLU A 3 41.047 19.937 18.794 1.00 0.00 H new ATOM 0 HB2 GLU A 3 41.816 17.275 17.594 1.00 0.00 H new ATOM 0 HB3 GLU A 3 40.716 18.459 16.917 1.00 0.00 H new ATOM 0 HG2 GLU A 3 42.822 20.078 17.062 1.00 0.00 H new ATOM 0 HG3 GLU A 3 43.728 18.579 17.129 1.00 0.00 H new ATOM 40 N LEU A 4 39.812 18.751 20.807 1.00 0.00 N ATOM 41 CA LEU A 4 38.491 18.604 21.424 1.00 0.00 C ATOM 42 C LEU A 4 37.546 19.669 20.821 1.00 0.00 C ATOM 43 O LEU A 4 38.021 20.679 20.300 1.00 0.00 O ATOM 44 CB LEU A 4 38.614 18.788 22.950 1.00 0.00 C ATOM 45 CG LEU A 4 39.694 17.963 23.683 1.00 0.00 C ATOM 46 CD1 LEU A 4 39.842 18.451 25.126 1.00 0.00 C ATOM 47 CD2 LEU A 4 39.378 16.467 23.737 1.00 0.00 C ATOM 0 H LEU A 4 40.466 19.288 21.377 1.00 0.00 H new ATOM 0 HA LEU A 4 38.086 17.611 21.229 1.00 0.00 H new ATOM 0 HB2 LEU A 4 38.805 19.843 23.147 1.00 0.00 H new ATOM 0 HB3 LEU A 4 37.648 18.550 23.396 1.00 0.00 H new ATOM 0 HG LEU A 4 40.612 18.104 23.112 1.00 0.00 H new ATOM 0 HD11 LEU A 4 40.606 17.862 25.633 1.00 0.00 H new ATOM 0 HD12 LEU A 4 40.134 19.501 25.127 1.00 0.00 H new ATOM 0 HD13 LEU A 4 38.892 18.338 25.648 1.00 0.00 H new ATOM 0 HD21 LEU A 4 40.176 15.945 24.265 1.00 0.00 H new ATOM 0 HD22 LEU A 4 38.435 16.313 24.261 1.00 0.00 H new ATOM 0 HD23 LEU A 4 39.297 16.075 22.723 1.00 0.00 H new ATOM 59 N LYS A 5 36.220 19.515 20.929 1.00 0.00 N ATOM 60 CA LYS A 5 35.265 20.568 20.526 1.00 0.00 C ATOM 61 C LYS A 5 34.158 20.813 21.548 1.00 0.00 C ATOM 62 O LYS A 5 33.801 19.908 22.295 1.00 0.00 O ATOM 63 CB LYS A 5 34.724 20.335 19.107 1.00 0.00 C ATOM 64 CG LYS A 5 33.646 19.248 18.983 1.00 0.00 C ATOM 65 CD LYS A 5 32.964 19.398 17.619 1.00 0.00 C ATOM 66 CE LYS A 5 31.744 18.483 17.464 1.00 0.00 C ATOM 67 NZ LYS A 5 32.126 17.111 17.054 1.00 0.00 N ATOM 0 H LYS A 5 35.778 18.671 21.293 1.00 0.00 H new ATOM 0 HA LYS A 5 35.834 21.497 20.501 1.00 0.00 H new ATOM 0 HB2 LYS A 5 34.314 21.274 18.734 1.00 0.00 H new ATOM 0 HB3 LYS A 5 35.558 20.071 18.457 1.00 0.00 H new ATOM 0 HG2 LYS A 5 34.093 18.258 19.077 1.00 0.00 H new ATOM 0 HG3 LYS A 5 32.915 19.345 19.786 1.00 0.00 H new ATOM 0 HD2 LYS A 5 32.655 20.435 17.484 1.00 0.00 H new ATOM 0 HD3 LYS A 5 33.683 19.174 16.831 1.00 0.00 H new ATOM 0 HE2 LYS A 5 31.200 18.441 18.408 1.00 0.00 H new ATOM 0 HE3 LYS A 5 31.065 18.907 16.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 31.271 16.526 16.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 32.622 17.147 16.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 32.753 16.696 17.772 1.00 0.00 H new ATOM 81 N ILE A 6 33.629 22.034 21.543 1.00 0.00 N ATOM 82 CA ILE A 6 32.562 22.555 22.410 1.00 0.00 C ATOM 83 C ILE A 6 31.431 23.099 21.542 1.00 0.00 C ATOM 84 O ILE A 6 31.630 24.033 20.767 1.00 0.00 O ATOM 85 CB ILE A 6 33.100 23.623 23.404 1.00 0.00 C ATOM 86 CG1 ILE A 6 32.008 24.414 24.186 1.00 0.00 C ATOM 87 CG2 ILE A 6 34.062 24.606 22.718 1.00 0.00 C ATOM 88 CD1 ILE A 6 32.523 25.256 25.365 1.00 0.00 C ATOM 0 H ILE A 6 33.956 22.742 20.886 1.00 0.00 H new ATOM 0 HA ILE A 6 32.172 21.742 23.023 1.00 0.00 H new ATOM 0 HB ILE A 6 33.637 23.036 24.149 1.00 0.00 H new ATOM 0 HG12 ILE A 6 31.491 25.073 23.489 1.00 0.00 H new ATOM 0 HG13 ILE A 6 31.269 23.706 24.562 1.00 0.00 H new ATOM 0 HG21 ILE A 6 34.416 25.336 23.446 1.00 0.00 H new ATOM 0 HG22 ILE A 6 34.912 24.059 22.310 1.00 0.00 H new ATOM 0 HG23 ILE A 6 33.541 25.121 21.911 1.00 0.00 H new ATOM 0 HD11 ILE A 6 31.686 25.766 25.841 1.00 0.00 H new ATOM 0 HD12 ILE A 6 33.012 24.606 26.090 1.00 0.00 H new ATOM 0 HD13 ILE A 6 33.237 25.994 25.000 1.00 0.00 H new ATOM 100 N THR A 7 30.239 22.536 21.706 1.00 0.00 N ATOM 101 CA THR A 7 28.992 23.093 21.189 1.00 0.00 C ATOM 102 C THR A 7 28.355 23.972 22.242 1.00 0.00 C ATOM 103 O THR A 7 28.123 23.544 23.370 1.00 0.00 O ATOM 104 CB THR A 7 28.005 21.992 20.766 1.00 0.00 C ATOM 105 OG1 THR A 7 28.599 21.066 19.890 1.00 0.00 O ATOM 106 CG2 THR A 7 26.771 22.573 20.072 1.00 0.00 C ATOM 0 H THR A 7 30.109 21.661 22.213 1.00 0.00 H new ATOM 0 HA THR A 7 29.231 23.682 20.304 1.00 0.00 H new ATOM 0 HB THR A 7 27.709 21.490 21.687 1.00 0.00 H new ATOM 0 HG1 THR A 7 27.943 20.381 19.644 1.00 0.00 H new ATOM 0 HG21 THR A 7 26.098 21.764 19.789 1.00 0.00 H new ATOM 0 HG22 THR A 7 26.256 23.251 20.753 1.00 0.00 H new ATOM 0 HG23 THR A 7 27.078 23.119 19.180 1.00 0.00 H new ATOM 114 N PHE A 8 28.012 25.188 21.846 1.00 0.00 N ATOM 115 CA PHE A 8 27.170 26.080 22.617 1.00 0.00 C ATOM 116 C PHE A 8 25.862 26.333 21.874 1.00 0.00 C ATOM 117 O PHE A 8 25.858 26.675 20.689 1.00 0.00 O ATOM 118 CB PHE A 8 27.898 27.391 22.957 1.00 0.00 C ATOM 119 CG PHE A 8 29.413 27.397 23.138 1.00 0.00 C ATOM 120 CD1 PHE A 8 30.249 27.178 22.022 1.00 0.00 C ATOM 121 CD2 PHE A 8 30.004 27.785 24.366 1.00 0.00 C ATOM 122 CE1 PHE A 8 31.633 27.315 22.130 1.00 0.00 C ATOM 123 CE2 PHE A 8 31.385 28.009 24.446 1.00 0.00 C ATOM 124 CZ PHE A 8 32.193 27.764 23.329 1.00 0.00 C ATOM 0 H PHE A 8 28.320 25.588 20.960 1.00 0.00 H new ATOM 0 HA PHE A 8 26.935 25.600 23.567 1.00 0.00 H new ATOM 0 HB2 PHE A 8 27.663 28.106 22.169 1.00 0.00 H new ATOM 0 HB3 PHE A 8 27.460 27.776 23.878 1.00 0.00 H new ATOM 0 HD1 PHE A 8 29.812 26.901 21.074 1.00 0.00 H new ATOM 0 HD2 PHE A 8 29.387 27.909 25.244 1.00 0.00 H new ATOM 0 HE1 PHE A 8 32.269 27.075 21.291 1.00 0.00 H new ATOM 0 HE2 PHE A 8 31.824 28.369 25.365 1.00 0.00 H new ATOM 0 HZ PHE A 8 33.259 27.924 23.395 1.00 0.00 H new ATOM 134 N ILE A 9 24.759 26.189 22.607 1.00 0.00 N ATOM 135 CA ILE A 9 23.460 26.732 22.201 1.00 0.00 C ATOM 136 C ILE A 9 23.407 28.191 22.644 1.00 0.00 C ATOM 137 O ILE A 9 23.605 28.493 23.821 1.00 0.00 O ATOM 138 CB ILE A 9 22.261 25.962 22.780 1.00 0.00 C ATOM 139 CG1 ILE A 9 22.460 24.431 22.721 1.00 0.00 C ATOM 140 CG2 ILE A 9 20.975 26.443 22.064 1.00 0.00 C ATOM 141 CD1 ILE A 9 21.192 23.590 22.927 1.00 0.00 C ATOM 0 H ILE A 9 24.739 25.694 23.498 1.00 0.00 H new ATOM 0 HA ILE A 9 23.377 26.634 21.119 1.00 0.00 H new ATOM 0 HB ILE A 9 22.167 26.180 23.844 1.00 0.00 H new ATOM 0 HG12 ILE A 9 22.891 24.175 21.753 1.00 0.00 H new ATOM 0 HG13 ILE A 9 23.190 24.148 23.479 1.00 0.00 H new ATOM 0 HG21 ILE A 9 20.114 25.907 22.463 1.00 0.00 H new ATOM 0 HG22 ILE A 9 20.845 27.512 22.230 1.00 0.00 H new ATOM 0 HG23 ILE A 9 21.060 26.249 20.995 1.00 0.00 H new ATOM 0 HD11 ILE A 9 21.444 22.531 22.866 1.00 0.00 H new ATOM 0 HD12 ILE A 9 20.767 23.806 23.907 1.00 0.00 H new ATOM 0 HD13 ILE A 9 20.464 23.835 22.154 1.00 0.00 H new ATOM 153 N LEU A 10 23.159 29.085 21.700 1.00 0.00 N ATOM 154 CA LEU A 10 23.163 30.530 21.862 1.00 0.00 C ATOM 155 C LEU A 10 21.828 31.011 22.442 1.00 0.00 C ATOM 156 O LEU A 10 20.810 30.336 22.304 1.00 0.00 O ATOM 157 CB LEU A 10 23.456 31.166 20.491 1.00 0.00 C ATOM 158 CG LEU A 10 24.746 30.714 19.763 1.00 0.00 C ATOM 159 CD1 LEU A 10 25.222 31.893 18.912 1.00 0.00 C ATOM 160 CD2 LEU A 10 25.914 30.359 20.687 1.00 0.00 C ATOM 0 H LEU A 10 22.937 28.805 20.745 1.00 0.00 H new ATOM 0 HA LEU A 10 23.937 30.832 22.568 1.00 0.00 H new ATOM 0 HB2 LEU A 10 22.609 30.962 19.836 1.00 0.00 H new ATOM 0 HB3 LEU A 10 23.504 32.247 20.623 1.00 0.00 H new ATOM 0 HG LEU A 10 24.485 29.816 19.203 1.00 0.00 H new ATOM 0 HD11 LEU A 10 26.132 31.614 18.381 1.00 0.00 H new ATOM 0 HD12 LEU A 10 24.448 32.158 18.192 1.00 0.00 H new ATOM 0 HD13 LEU A 10 25.425 32.748 19.556 1.00 0.00 H new ATOM 0 HD21 LEU A 10 26.772 30.054 20.088 1.00 0.00 H new ATOM 0 HD22 LEU A 10 26.181 31.229 21.287 1.00 0.00 H new ATOM 0 HD23 LEU A 10 25.622 29.540 21.345 1.00 0.00 H new ATOM 172 N LYS A 11 21.784 32.210 23.030 1.00 0.00 N ATOM 173 CA LYS A 11 20.524 32.800 23.527 1.00 0.00 C ATOM 174 C LYS A 11 19.588 33.277 22.406 1.00 0.00 C ATOM 175 O LYS A 11 18.397 33.483 22.637 1.00 0.00 O ATOM 176 CB LYS A 11 20.792 33.909 24.551 1.00 0.00 C ATOM 177 CG LYS A 11 21.843 33.543 25.617 1.00 0.00 C ATOM 178 CD LYS A 11 21.776 34.517 26.797 1.00 0.00 C ATOM 179 CE LYS A 11 20.640 34.124 27.751 1.00 0.00 C ATOM 180 NZ LYS A 11 20.143 35.281 28.523 1.00 0.00 N ATOM 0 H LYS A 11 22.605 32.797 23.177 1.00 0.00 H new ATOM 0 HA LYS A 11 19.992 31.994 24.033 1.00 0.00 H new ATOM 0 HB2 LYS A 11 21.122 34.804 24.023 1.00 0.00 H new ATOM 0 HB3 LYS A 11 19.857 34.161 25.050 1.00 0.00 H new ATOM 0 HG2 LYS A 11 21.673 32.525 25.968 1.00 0.00 H new ATOM 0 HG3 LYS A 11 22.839 33.566 25.176 1.00 0.00 H new ATOM 0 HD2 LYS A 11 22.726 34.516 27.332 1.00 0.00 H new ATOM 0 HD3 LYS A 11 21.618 35.531 26.431 1.00 0.00 H new ATOM 0 HE2 LYS A 11 19.820 33.690 27.179 1.00 0.00 H new ATOM 0 HE3 LYS A 11 20.993 33.354 28.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 19.377 34.973 29.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 20.919 35.680 29.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 19.783 36.005 27.870 1.00 0.00 H new ATOM 194 N ASP A 12 20.098 33.385 21.179 1.00 0.00 N ATOM 195 CA ASP A 12 19.291 33.495 19.949 1.00 0.00 C ATOM 196 C ASP A 12 18.728 32.129 19.476 1.00 0.00 C ATOM 197 O ASP A 12 17.881 32.072 18.586 1.00 0.00 O ATOM 198 CB ASP A 12 20.153 34.165 18.865 1.00 0.00 C ATOM 199 CG ASP A 12 19.334 34.664 17.671 1.00 0.00 C ATOM 200 OD1 ASP A 12 18.502 35.583 17.865 1.00 0.00 O ATOM 201 OD2 ASP A 12 19.516 34.155 16.538 1.00 0.00 O ATOM 0 H ASP A 12 21.102 33.399 21.002 1.00 0.00 H new ATOM 0 HA ASP A 12 18.413 34.108 20.156 1.00 0.00 H new ATOM 0 HB2 ASP A 12 20.692 35.004 19.305 1.00 0.00 H new ATOM 0 HB3 ASP A 12 20.901 33.455 18.514 1.00 0.00 H new ATOM 206 N GLY A 13 19.180 31.024 20.085 1.00 0.00 N ATOM 207 CA GLY A 13 18.845 29.625 19.786 1.00 0.00 C ATOM 208 C GLY A 13 19.811 28.921 18.825 1.00 0.00 C ATOM 209 O GLY A 13 19.760 27.694 18.711 1.00 0.00 O ATOM 0 H GLY A 13 19.840 31.090 20.859 1.00 0.00 H new ATOM 0 HA2 GLY A 13 18.814 29.066 20.721 1.00 0.00 H new ATOM 0 HA3 GLY A 13 17.842 29.590 19.361 1.00 0.00 H new ATOM 213 N SER A 14 20.728 29.665 18.191 1.00 0.00 N ATOM 214 CA SER A 14 21.778 29.154 17.290 1.00 0.00 C ATOM 215 C SER A 14 22.630 28.085 17.969 1.00 0.00 C ATOM 216 O SER A 14 22.769 28.049 19.184 1.00 0.00 O ATOM 217 CB SER A 14 22.710 30.282 16.766 1.00 0.00 C ATOM 218 OG SER A 14 22.158 31.564 17.048 1.00 0.00 O ATOM 0 H SER A 14 20.763 30.679 18.294 1.00 0.00 H new ATOM 0 HA SER A 14 21.252 28.715 16.442 1.00 0.00 H new ATOM 0 HB2 SER A 14 23.692 30.194 17.230 1.00 0.00 H new ATOM 0 HB3 SER A 14 22.854 30.171 15.691 1.00 0.00 H new ATOM 0 HG SER A 14 22.760 32.260 16.712 1.00 0.00 H new ATOM 224 N GLN A 15 23.248 27.224 17.183 1.00 0.00 N ATOM 225 CA GLN A 15 24.329 26.350 17.570 1.00 0.00 C ATOM 226 C GLN A 15 25.612 26.808 16.925 1.00 0.00 C ATOM 227 O GLN A 15 25.666 27.205 15.757 1.00 0.00 O ATOM 228 CB GLN A 15 24.050 24.911 17.159 1.00 0.00 C ATOM 229 CG GLN A 15 22.777 24.371 17.821 1.00 0.00 C ATOM 230 CD GLN A 15 21.524 24.443 16.952 1.00 0.00 C ATOM 231 OE1 GLN A 15 21.263 23.557 16.146 1.00 0.00 O ATOM 232 NE2 GLN A 15 20.685 25.442 17.098 1.00 0.00 N ATOM 0 H GLN A 15 22.991 27.113 16.202 1.00 0.00 H new ATOM 0 HA GLN A 15 24.420 26.390 18.655 1.00 0.00 H new ATOM 0 HB2 GLN A 15 23.949 24.855 16.075 1.00 0.00 H new ATOM 0 HB3 GLN A 15 24.898 24.283 17.433 1.00 0.00 H new ATOM 0 HG2 GLN A 15 22.945 23.333 18.106 1.00 0.00 H new ATOM 0 HG3 GLN A 15 22.597 24.929 18.740 1.00 0.00 H new ATOM 0 HE21 GLN A 15 20.889 26.186 17.765 1.00 0.00 H new ATOM 0 HE22 GLN A 15 19.829 25.474 16.545 1.00 0.00 H new ATOM 241 N LYS A 16 26.658 26.714 17.727 1.00 0.00 N ATOM 242 CA LYS A 16 28.018 26.995 17.332 1.00 0.00 C ATOM 243 C LYS A 16 28.888 25.947 17.989 1.00 0.00 C ATOM 244 O LYS A 16 28.821 25.756 19.199 1.00 0.00 O ATOM 245 CB LYS A 16 28.376 28.388 17.814 1.00 0.00 C ATOM 246 CG LYS A 16 27.541 29.525 17.201 1.00 0.00 C ATOM 247 CD LYS A 16 27.834 29.934 15.751 1.00 0.00 C ATOM 248 CE LYS A 16 27.112 31.258 15.432 1.00 0.00 C ATOM 249 NZ LYS A 16 27.565 31.862 14.156 1.00 0.00 N ATOM 0 H LYS A 16 26.576 26.430 18.703 1.00 0.00 H new ATOM 0 HA LYS A 16 28.156 26.963 16.251 1.00 0.00 H new ATOM 0 HB2 LYS A 16 28.265 28.420 18.898 1.00 0.00 H new ATOM 0 HB3 LYS A 16 29.428 28.572 17.596 1.00 0.00 H new ATOM 0 HG2 LYS A 16 26.491 29.238 17.261 1.00 0.00 H new ATOM 0 HG3 LYS A 16 27.667 30.407 17.829 1.00 0.00 H new ATOM 0 HD2 LYS A 16 28.908 30.049 15.605 1.00 0.00 H new ATOM 0 HD3 LYS A 16 27.501 29.153 15.068 1.00 0.00 H new ATOM 0 HE2 LYS A 16 26.038 31.079 15.384 1.00 0.00 H new ATOM 0 HE3 LYS A 16 27.281 31.965 16.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 27.049 32.749 13.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 28.585 32.059 14.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 27.380 31.202 13.374 1.00 0.00 H new ATOM 263 N THR A 17 29.640 25.241 17.173 1.00 0.00 N ATOM 264 CA THR A 17 30.526 24.137 17.604 1.00 0.00 C ATOM 265 C THR A 17 31.979 24.303 17.153 1.00 0.00 C ATOM 266 O THR A 17 32.277 24.382 15.957 1.00 0.00 O ATOM 267 CB THR A 17 29.934 22.749 17.321 1.00 0.00 C ATOM 268 OG1 THR A 17 30.554 21.820 18.175 1.00 0.00 O ATOM 269 CG2 THR A 17 30.104 22.234 15.897 1.00 0.00 C ATOM 0 H THR A 17 29.666 25.407 16.167 1.00 0.00 H new ATOM 0 HA THR A 17 30.575 24.207 18.691 1.00 0.00 H new ATOM 0 HB THR A 17 28.862 22.857 17.484 1.00 0.00 H new ATOM 0 HG1 THR A 17 29.890 21.450 18.793 1.00 0.00 H new ATOM 0 HG21 THR A 17 29.649 21.247 15.810 1.00 0.00 H new ATOM 0 HG22 THR A 17 29.619 22.919 15.202 1.00 0.00 H new ATOM 0 HG23 THR A 17 31.166 22.167 15.659 1.00 0.00 H new ATOM 277 N TYR A 18 32.875 24.414 18.137 1.00 0.00 N ATOM 278 CA TYR A 18 34.170 25.107 18.055 1.00 0.00 C ATOM 279 C TYR A 18 35.328 24.265 18.611 1.00 0.00 C ATOM 280 O TYR A 18 35.154 23.592 19.625 1.00 0.00 O ATOM 281 CB TYR A 18 34.067 26.402 18.881 1.00 0.00 C ATOM 282 CG TYR A 18 33.184 27.527 18.337 1.00 0.00 C ATOM 283 CD1 TYR A 18 32.709 27.521 17.006 1.00 0.00 C ATOM 284 CD2 TYR A 18 32.908 28.648 19.147 1.00 0.00 C ATOM 285 CE1 TYR A 18 31.979 28.604 16.495 1.00 0.00 C ATOM 286 CE2 TYR A 18 32.220 29.759 18.619 1.00 0.00 C ATOM 287 CZ TYR A 18 31.766 29.746 17.286 1.00 0.00 C ATOM 288 OH TYR A 18 31.137 30.822 16.750 1.00 0.00 O ATOM 0 H TYR A 18 32.713 24.005 19.057 1.00 0.00 H new ATOM 0 HA TYR A 18 34.383 25.303 17.004 1.00 0.00 H new ATOM 0 HB2 TYR A 18 33.700 26.138 19.873 1.00 0.00 H new ATOM 0 HB3 TYR A 18 35.074 26.799 19.009 1.00 0.00 H new ATOM 0 HD1 TYR A 18 32.911 26.670 16.373 1.00 0.00 H new ATOM 0 HD2 TYR A 18 33.226 28.655 20.179 1.00 0.00 H new ATOM 0 HE1 TYR A 18 31.580 28.560 15.492 1.00 0.00 H new ATOM 0 HE2 TYR A 18 32.040 30.624 19.240 1.00 0.00 H new ATOM 0 HH TYR A 18 31.066 31.529 17.425 1.00 0.00 H new ATOM 298 N GLU A 19 36.523 24.325 18.004 1.00 0.00 N ATOM 299 CA GLU A 19 37.669 23.478 18.396 1.00 0.00 C ATOM 300 C GLU A 19 38.627 24.110 19.431 1.00 0.00 C ATOM 301 O GLU A 19 39.205 25.183 19.224 1.00 0.00 O ATOM 302 CB GLU A 19 38.419 22.911 17.178 1.00 0.00 C ATOM 303 CG GLU A 19 38.948 23.936 16.162 1.00 0.00 C ATOM 304 CD GLU A 19 37.857 24.403 15.194 1.00 0.00 C ATOM 305 OE1 GLU A 19 37.465 23.620 14.294 1.00 0.00 O ATOM 306 OE2 GLU A 19 37.366 25.549 15.330 1.00 0.00 O ATOM 0 H GLU A 19 36.726 24.958 17.230 1.00 0.00 H new ATOM 0 HA GLU A 19 37.215 22.640 18.925 1.00 0.00 H new ATOM 0 HB2 GLU A 19 39.262 22.322 17.540 1.00 0.00 H new ATOM 0 HB3 GLU A 19 37.752 22.225 16.655 1.00 0.00 H new ATOM 0 HG2 GLU A 19 39.353 24.797 16.694 1.00 0.00 H new ATOM 0 HG3 GLU A 19 39.769 23.495 15.597 1.00 0.00 H new ATOM 313 N VAL A 20 38.817 23.394 20.546 1.00 0.00 N ATOM 314 CA VAL A 20 39.545 23.793 21.759 1.00 0.00 C ATOM 315 C VAL A 20 40.513 22.693 22.235 1.00 0.00 C ATOM 316 O VAL A 20 40.775 21.701 21.545 1.00 0.00 O ATOM 317 CB VAL A 20 38.529 24.214 22.853 1.00 0.00 C ATOM 318 CG1 VAL A 20 37.569 25.303 22.351 1.00 0.00 C ATOM 319 CG2 VAL A 20 37.704 23.054 23.442 1.00 0.00 C ATOM 0 H VAL A 20 38.438 22.451 20.631 1.00 0.00 H new ATOM 0 HA VAL A 20 40.174 24.654 21.531 1.00 0.00 H new ATOM 0 HB VAL A 20 39.154 24.604 23.656 1.00 0.00 H new ATOM 0 HG11 VAL A 20 36.874 25.570 23.147 1.00 0.00 H new ATOM 0 HG12 VAL A 20 38.140 26.184 22.057 1.00 0.00 H new ATOM 0 HG13 VAL A 20 37.011 24.929 21.492 1.00 0.00 H new ATOM 0 HG21 VAL A 20 37.021 23.441 24.198 1.00 0.00 H new ATOM 0 HG22 VAL A 20 37.132 22.574 22.648 1.00 0.00 H new ATOM 0 HG23 VAL A 20 38.374 22.325 23.897 1.00 0.00 H new ATOM 329 N CYS A 21 41.079 22.899 23.419 1.00 0.00 N ATOM 330 CA CYS A 21 42.031 22.032 24.111 1.00 0.00 C ATOM 331 C CYS A 21 41.521 21.676 25.523 1.00 0.00 C ATOM 332 O CYS A 21 40.469 22.160 25.950 1.00 0.00 O ATOM 333 CB CYS A 21 43.344 22.811 24.179 1.00 0.00 C ATOM 334 SG CYS A 21 44.188 22.828 22.577 1.00 0.00 S ATOM 0 H CYS A 21 40.870 23.737 23.961 1.00 0.00 H new ATOM 0 HA CYS A 21 42.164 21.087 23.584 1.00 0.00 H new ATOM 0 HB2 CYS A 21 43.145 23.834 24.498 1.00 0.00 H new ATOM 0 HB3 CYS A 21 43.995 22.364 24.930 1.00 0.00 H new ATOM 0 HG CYS A 21 45.296 23.501 22.677 1.00 0.00 H new ATOM 340 N GLU A 22 42.247 20.840 26.270 1.00 0.00 N ATOM 341 CA GLU A 22 41.966 20.608 27.695 1.00 0.00 C ATOM 342 C GLU A 22 42.369 21.800 28.589 1.00 0.00 C ATOM 343 O GLU A 22 43.137 22.674 28.175 1.00 0.00 O ATOM 344 CB GLU A 22 42.488 19.247 28.160 1.00 0.00 C ATOM 345 CG GLU A 22 43.987 19.144 28.397 1.00 0.00 C ATOM 346 CD GLU A 22 44.436 19.734 29.747 1.00 0.00 C ATOM 347 OE1 GLU A 22 44.099 19.173 30.818 1.00 0.00 O ATOM 348 OE2 GLU A 22 45.164 20.753 29.781 1.00 0.00 O ATOM 0 H GLU A 22 43.040 20.308 25.911 1.00 0.00 H new ATOM 0 HA GLU A 22 40.884 20.553 27.812 1.00 0.00 H new ATOM 0 HB2 GLU A 22 41.977 18.983 29.086 1.00 0.00 H new ATOM 0 HB3 GLU A 22 42.207 18.501 27.417 1.00 0.00 H new ATOM 0 HG2 GLU A 22 44.283 18.096 28.351 1.00 0.00 H new ATOM 0 HG3 GLU A 22 44.511 19.659 27.592 1.00 0.00 H new ATOM 355 N GLY A 23 41.796 21.890 29.796 1.00 0.00 N ATOM 356 CA GLY A 23 42.019 22.997 30.735 1.00 0.00 C ATOM 357 C GLY A 23 41.311 24.307 30.357 1.00 0.00 C ATOM 358 O GLY A 23 41.173 25.192 31.206 1.00 0.00 O ATOM 0 H GLY A 23 41.153 21.183 30.154 1.00 0.00 H new ATOM 0 HA2 GLY A 23 41.683 22.690 31.725 1.00 0.00 H new ATOM 0 HA3 GLY A 23 43.090 23.186 30.807 1.00 0.00 H new ATOM 362 N GLU A 24 40.833 24.434 29.116 1.00 0.00 N ATOM 363 CA GLU A 24 39.971 25.530 28.667 1.00 0.00 C ATOM 364 C GLU A 24 38.633 25.519 29.433 1.00 0.00 C ATOM 365 O GLU A 24 38.117 24.461 29.810 1.00 0.00 O ATOM 366 CB GLU A 24 39.716 25.441 27.150 1.00 0.00 C ATOM 367 CG GLU A 24 40.974 25.308 26.269 1.00 0.00 C ATOM 368 CD GLU A 24 41.867 26.549 26.236 1.00 0.00 C ATOM 369 OE1 GLU A 24 41.350 27.682 26.092 1.00 0.00 O ATOM 370 OE2 GLU A 24 43.110 26.397 26.311 1.00 0.00 O ATOM 0 H GLU A 24 41.040 23.761 28.378 1.00 0.00 H new ATOM 0 HA GLU A 24 40.484 26.468 28.876 1.00 0.00 H new ATOM 0 HB2 GLU A 24 39.068 24.586 26.958 1.00 0.00 H new ATOM 0 HB3 GLU A 24 39.169 26.331 26.839 1.00 0.00 H new ATOM 0 HG2 GLU A 24 41.563 24.463 26.626 1.00 0.00 H new ATOM 0 HG3 GLU A 24 40.664 25.073 25.251 1.00 0.00 H new ATOM 377 N THR A 25 38.066 26.700 29.663 1.00 0.00 N ATOM 378 CA THR A 25 36.927 26.929 30.569 1.00 0.00 C ATOM 379 C THR A 25 35.710 27.393 29.766 1.00 0.00 C ATOM 380 O THR A 25 35.842 28.130 28.802 1.00 0.00 O ATOM 381 CB THR A 25 37.327 27.966 31.630 1.00 0.00 C ATOM 382 OG1 THR A 25 38.600 28.555 31.441 1.00 0.00 O ATOM 383 CG2 THR A 25 37.410 27.304 32.999 1.00 0.00 C ATOM 0 H THR A 25 38.391 27.556 29.213 1.00 0.00 H new ATOM 0 HA THR A 25 36.659 26.002 31.075 1.00 0.00 H new ATOM 0 HB THR A 25 36.558 28.734 31.547 1.00 0.00 H new ATOM 0 HG1 THR A 25 38.595 29.467 31.801 1.00 0.00 H new ATOM 0 HG21 THR A 25 37.694 28.046 33.745 1.00 0.00 H new ATOM 0 HG22 THR A 25 36.439 26.882 33.258 1.00 0.00 H new ATOM 0 HG23 THR A 25 38.156 26.510 32.975 1.00 0.00 H new ATOM 391 N ILE A 26 34.498 26.991 30.135 1.00 0.00 N ATOM 392 CA ILE A 26 33.286 27.213 29.314 1.00 0.00 C ATOM 393 C ILE A 26 32.951 28.696 29.046 1.00 0.00 C ATOM 394 O ILE A 26 32.683 29.043 27.893 1.00 0.00 O ATOM 395 CB ILE A 26 32.105 26.446 29.937 1.00 0.00 C ATOM 396 CG1 ILE A 26 32.386 24.944 30.129 1.00 0.00 C ATOM 397 CG2 ILE A 26 30.823 26.633 29.118 1.00 0.00 C ATOM 398 CD1 ILE A 26 32.743 24.176 28.862 1.00 0.00 C ATOM 0 H ILE A 26 34.315 26.501 31.011 1.00 0.00 H new ATOM 0 HA ILE A 26 33.495 26.817 28.320 1.00 0.00 H new ATOM 0 HB ILE A 26 31.967 26.878 30.928 1.00 0.00 H new ATOM 0 HG12 ILE A 26 33.203 24.833 30.842 1.00 0.00 H new ATOM 0 HG13 ILE A 26 31.506 24.482 30.577 1.00 0.00 H new ATOM 0 HG21 ILE A 26 30.009 26.079 29.585 1.00 0.00 H new ATOM 0 HG22 ILE A 26 30.566 27.692 29.080 1.00 0.00 H new ATOM 0 HG23 ILE A 26 30.981 26.262 28.105 1.00 0.00 H new ATOM 0 HD11 ILE A 26 32.921 23.129 29.109 1.00 0.00 H new ATOM 0 HD12 ILE A 26 31.920 24.246 28.150 1.00 0.00 H new ATOM 0 HD13 ILE A 26 33.643 24.603 28.419 1.00 0.00 H new ATOM 410 N LEU A 27 33.002 29.588 30.047 1.00 0.00 N ATOM 411 CA LEU A 27 32.775 31.031 29.817 1.00 0.00 C ATOM 412 C LEU A 27 33.980 31.678 29.116 1.00 0.00 C ATOM 413 O LEU A 27 33.819 32.525 28.237 1.00 0.00 O ATOM 414 CB LEU A 27 32.433 31.758 31.139 1.00 0.00 C ATOM 415 CG LEU A 27 30.960 32.168 31.342 1.00 0.00 C ATOM 416 CD1 LEU A 27 30.520 33.221 30.320 1.00 0.00 C ATOM 417 CD2 LEU A 27 29.980 30.995 31.262 1.00 0.00 C ATOM 0 H LEU A 27 33.197 29.343 31.018 1.00 0.00 H new ATOM 0 HA LEU A 27 31.916 31.133 29.153 1.00 0.00 H new ATOM 0 HB2 LEU A 27 32.724 31.112 31.968 1.00 0.00 H new ATOM 0 HB3 LEU A 27 33.048 32.656 31.203 1.00 0.00 H new ATOM 0 HG LEU A 27 30.927 32.577 32.352 1.00 0.00 H new ATOM 0 HD11 LEU A 27 29.477 33.484 30.495 1.00 0.00 H new ATOM 0 HD12 LEU A 27 31.141 34.111 30.424 1.00 0.00 H new ATOM 0 HD13 LEU A 27 30.628 32.818 29.313 1.00 0.00 H new ATOM 0 HD21 LEU A 27 28.964 31.359 31.414 1.00 0.00 H new ATOM 0 HD22 LEU A 27 30.054 30.525 30.281 1.00 0.00 H new ATOM 0 HD23 LEU A 27 30.223 30.265 32.034 1.00 0.00 H new ATOM 429 N ASP A 28 35.180 31.206 29.446 1.00 0.00 N ATOM 430 CA ASP A 28 36.434 31.580 28.793 1.00 0.00 C ATOM 431 C ASP A 28 36.492 31.177 27.312 1.00 0.00 C ATOM 432 O ASP A 28 37.097 31.907 26.532 1.00 0.00 O ATOM 433 CB ASP A 28 37.590 30.947 29.568 1.00 0.00 C ATOM 434 CG ASP A 28 37.906 31.698 30.866 1.00 0.00 C ATOM 435 OD1 ASP A 28 38.161 32.927 30.821 1.00 0.00 O ATOM 436 OD2 ASP A 28 37.899 31.066 31.949 1.00 0.00 O ATOM 0 H ASP A 28 35.311 30.531 30.199 1.00 0.00 H new ATOM 0 HA ASP A 28 36.508 32.667 28.806 1.00 0.00 H new ATOM 0 HB2 ASP A 28 37.343 29.912 29.802 1.00 0.00 H new ATOM 0 HB3 ASP A 28 38.479 30.928 28.937 1.00 0.00 H new ATOM 441 N ILE A 29 35.857 30.084 26.869 1.00 0.00 N ATOM 442 CA ILE A 29 35.703 29.787 25.435 1.00 0.00 C ATOM 443 C ILE A 29 34.610 30.683 24.869 1.00 0.00 C ATOM 444 O ILE A 29 34.804 31.250 23.804 1.00 0.00 O ATOM 445 CB ILE A 29 35.478 28.288 25.092 1.00 0.00 C ATOM 446 CG1 ILE A 29 36.516 27.345 25.764 1.00 0.00 C ATOM 447 CG2 ILE A 29 35.710 28.166 23.568 1.00 0.00 C ATOM 448 CD1 ILE A 29 35.959 25.971 26.137 1.00 0.00 C ATOM 0 H ILE A 29 35.439 29.387 27.485 1.00 0.00 H new ATOM 0 HA ILE A 29 36.657 30.006 24.955 1.00 0.00 H new ATOM 0 HB ILE A 29 34.485 28.000 25.435 1.00 0.00 H new ATOM 0 HG12 ILE A 29 37.361 27.212 25.089 1.00 0.00 H new ATOM 0 HG13 ILE A 29 36.900 27.826 26.664 1.00 0.00 H new ATOM 0 HG21 ILE A 29 35.566 27.130 23.260 1.00 0.00 H new ATOM 0 HG22 ILE A 29 35.001 28.803 23.040 1.00 0.00 H new ATOM 0 HG23 ILE A 29 36.727 28.478 23.329 1.00 0.00 H new ATOM 0 HD11 ILE A 29 36.744 25.374 26.600 1.00 0.00 H new ATOM 0 HD12 ILE A 29 35.133 26.091 26.838 1.00 0.00 H new ATOM 0 HD13 ILE A 29 35.602 25.467 25.239 1.00 0.00 H new ATOM 460 N ALA A 30 33.506 30.932 25.574 1.00 0.00 N ATOM 461 CA ALA A 30 32.458 31.787 25.022 1.00 0.00 C ATOM 462 C ALA A 30 32.986 33.197 24.668 1.00 0.00 C ATOM 463 O ALA A 30 32.770 33.679 23.556 1.00 0.00 O ATOM 464 CB ALA A 30 31.268 31.816 25.990 1.00 0.00 C ATOM 0 H ALA A 30 33.317 30.563 26.506 1.00 0.00 H new ATOM 0 HA ALA A 30 32.115 31.368 24.076 1.00 0.00 H new ATOM 0 HB1 ALA A 30 30.483 32.453 25.583 1.00 0.00 H new ATOM 0 HB2 ALA A 30 30.883 30.805 26.123 1.00 0.00 H new ATOM 0 HB3 ALA A 30 31.592 32.211 26.953 1.00 0.00 H new ATOM 470 N GLN A 31 33.762 33.820 25.560 1.00 0.00 N ATOM 471 CA GLN A 31 34.456 35.095 25.314 1.00 0.00 C ATOM 472 C GLN A 31 35.840 35.006 24.675 1.00 0.00 C ATOM 473 O GLN A 31 36.303 36.011 24.145 1.00 0.00 O ATOM 474 CB GLN A 31 34.487 35.924 26.593 1.00 0.00 C ATOM 475 CG GLN A 31 33.074 36.328 27.042 1.00 0.00 C ATOM 476 CD GLN A 31 33.089 37.506 28.008 1.00 0.00 C ATOM 477 OE1 GLN A 31 33.925 37.611 28.896 1.00 0.00 O ATOM 478 NE2 GLN A 31 32.179 38.440 27.854 1.00 0.00 N ATOM 0 H GLN A 31 33.931 33.447 26.494 1.00 0.00 H new ATOM 0 HA GLN A 31 33.862 35.592 24.547 1.00 0.00 H new ATOM 0 HB2 GLN A 31 34.971 35.353 27.385 1.00 0.00 H new ATOM 0 HB3 GLN A 31 35.088 36.819 26.432 1.00 0.00 H new ATOM 0 HG2 GLN A 31 32.477 36.586 26.167 1.00 0.00 H new ATOM 0 HG3 GLN A 31 32.589 35.476 27.519 1.00 0.00 H new ATOM 0 HE21 GLN A 31 31.481 38.355 27.115 1.00 0.00 H new ATOM 0 HE22 GLN A 31 32.170 39.250 28.473 1.00 0.00 H new ATOM 487 N GLY A 32 36.498 33.852 24.656 1.00 0.00 N ATOM 488 CA GLY A 32 37.726 33.652 23.885 1.00 0.00 C ATOM 489 C GLY A 32 37.479 33.351 22.406 1.00 0.00 C ATOM 490 O GLY A 32 38.324 33.671 21.569 1.00 0.00 O ATOM 0 H GLY A 32 36.197 33.026 25.174 1.00 0.00 H new ATOM 0 HA2 GLY A 32 38.346 34.545 23.967 1.00 0.00 H new ATOM 0 HA3 GLY A 32 38.291 32.830 24.325 1.00 0.00 H new ATOM 494 N HIS A 33 36.304 32.810 22.073 1.00 0.00 N ATOM 495 CA HIS A 33 35.860 32.500 20.707 1.00 0.00 C ATOM 496 C HIS A 33 34.853 33.536 20.185 1.00 0.00 C ATOM 497 O HIS A 33 34.391 33.467 19.044 1.00 0.00 O ATOM 498 CB HIS A 33 35.279 31.083 20.708 1.00 0.00 C ATOM 499 CG HIS A 33 35.882 30.171 19.671 1.00 0.00 C ATOM 500 ND1 HIS A 33 35.527 30.061 18.353 1.00 0.00 N flip ATOM 501 CD2 HIS A 33 36.889 29.259 19.897 1.00 0.00 C flip ATOM 502 CE1 HIS A 33 36.293 29.036 17.783 1.00 0.00 C flip ATOM 503 NE2 HIS A 33 37.101 28.586 18.756 1.00 0.00 N flip ATOM 0 H HIS A 33 35.606 32.565 22.775 1.00 0.00 H new ATOM 0 HA HIS A 33 36.708 32.546 20.024 1.00 0.00 H new ATOM 0 HB2 HIS A 33 35.426 30.642 21.694 1.00 0.00 H new ATOM 0 HB3 HIS A 33 34.203 31.143 20.543 1.00 0.00 H new ATOM 0 HD2 HIS A 33 37.415 29.112 20.829 1.00 0.00 H new ATOM 0 HE1 HIS A 33 36.243 28.679 16.765 1.00 0.00 H new ATOM 0 HE2 HIS A 33 37.782 27.835 18.643 1.00 0.00 H new ATOM 511 N ASN A 34 34.531 34.510 21.040 1.00 0.00 N ATOM 512 CA ASN A 34 33.736 35.702 20.777 1.00 0.00 C ATOM 513 C ASN A 34 32.289 35.431 20.362 1.00 0.00 C ATOM 514 O ASN A 34 31.747 36.122 19.494 1.00 0.00 O ATOM 515 CB ASN A 34 34.528 36.673 19.883 1.00 0.00 C ATOM 516 CG ASN A 34 35.948 36.885 20.379 1.00 0.00 C ATOM 517 OD1 ASN A 34 36.117 37.114 21.659 1.00 0.00 O flip ATOM 518 ND2 ASN A 34 36.920 36.814 19.639 1.00 0.00 N flip ATOM 0 H ASN A 34 34.847 34.478 22.009 1.00 0.00 H new ATOM 0 HA ASN A 34 33.575 36.216 21.724 1.00 0.00 H new ATOM 0 HB2 ASN A 34 34.555 36.286 18.865 1.00 0.00 H new ATOM 0 HB3 ASN A 34 34.012 37.632 19.845 1.00 0.00 H new ATOM 0 HD21 ASN A 34 36.791 36.636 18.643 1.00 0.00 H new ATOM 0 HD22 ASN A 34 37.859 36.933 20.018 1.00 0.00 H new ATOM 525 N LEU A 35 31.656 34.475 21.049 1.00 0.00 N ATOM 526 CA LEU A 35 30.217 34.214 20.919 1.00 0.00 C ATOM 527 C LEU A 35 29.387 35.466 21.231 1.00 0.00 C ATOM 528 O LEU A 35 29.594 36.148 22.239 1.00 0.00 O ATOM 529 CB LEU A 35 29.780 33.090 21.886 1.00 0.00 C ATOM 530 CG LEU A 35 30.257 31.695 21.427 1.00 0.00 C ATOM 531 CD1 LEU A 35 30.046 30.602 22.482 1.00 0.00 C ATOM 532 CD2 LEU A 35 29.536 31.271 20.148 1.00 0.00 C ATOM 0 H LEU A 35 32.127 33.859 21.712 1.00 0.00 H new ATOM 0 HA LEU A 35 30.041 33.914 19.886 1.00 0.00 H new ATOM 0 HB2 LEU A 35 30.176 33.297 22.880 1.00 0.00 H new ATOM 0 HB3 LEU A 35 28.693 33.089 21.969 1.00 0.00 H new ATOM 0 HG LEU A 35 31.328 31.796 21.254 1.00 0.00 H new ATOM 0 HD11 LEU A 35 30.403 29.648 22.094 1.00 0.00 H new ATOM 0 HD12 LEU A 35 30.600 30.856 23.385 1.00 0.00 H new ATOM 0 HD13 LEU A 35 28.985 30.524 22.718 1.00 0.00 H new ATOM 0 HD21 LEU A 35 29.887 30.285 19.842 1.00 0.00 H new ATOM 0 HD22 LEU A 35 28.462 31.233 20.331 1.00 0.00 H new ATOM 0 HD23 LEU A 35 29.744 31.992 19.357 1.00 0.00 H new ATOM 544 N ASP A 36 28.413 35.735 20.365 1.00 0.00 N ATOM 545 CA ASP A 36 27.445 36.822 20.495 1.00 0.00 C ATOM 546 C ASP A 36 26.380 36.452 21.518 1.00 0.00 C ATOM 547 O ASP A 36 25.330 35.885 21.204 1.00 0.00 O ATOM 548 CB ASP A 36 26.877 37.133 19.110 1.00 0.00 C ATOM 549 CG ASP A 36 25.960 38.361 19.076 1.00 0.00 C ATOM 550 OD1 ASP A 36 25.871 39.114 20.078 1.00 0.00 O ATOM 551 OD2 ASP A 36 25.336 38.584 18.013 1.00 0.00 O ATOM 0 H ASP A 36 28.271 35.181 19.521 1.00 0.00 H new ATOM 0 HA ASP A 36 27.918 37.730 20.869 1.00 0.00 H new ATOM 0 HB2 ASP A 36 27.703 37.289 18.416 1.00 0.00 H new ATOM 0 HB3 ASP A 36 26.321 36.266 18.753 1.00 0.00 H new ATOM 556 N MET A 37 26.739 36.712 22.771 1.00 0.00 N ATOM 557 CA MET A 37 26.118 36.130 23.945 1.00 0.00 C ATOM 558 C MET A 37 26.079 37.181 25.065 1.00 0.00 C ATOM 559 O MET A 37 27.113 37.732 25.451 1.00 0.00 O ATOM 560 CB MET A 37 26.859 34.799 24.234 1.00 0.00 C ATOM 561 CG MET A 37 28.145 34.891 25.067 1.00 0.00 C ATOM 562 SD MET A 37 27.906 34.976 26.867 1.00 0.00 S ATOM 563 CE MET A 37 29.628 35.136 27.405 1.00 0.00 C ATOM 0 H MET A 37 27.496 37.356 23.000 1.00 0.00 H new ATOM 0 HA MET A 37 25.070 35.860 23.819 1.00 0.00 H new ATOM 0 HB2 MET A 37 26.168 34.130 24.748 1.00 0.00 H new ATOM 0 HB3 MET A 37 27.105 34.333 23.280 1.00 0.00 H new ATOM 0 HG2 MET A 37 28.767 34.025 24.841 1.00 0.00 H new ATOM 0 HG3 MET A 37 28.701 35.773 24.750 1.00 0.00 H new ATOM 0 HE1 MET A 37 29.661 35.254 28.488 1.00 0.00 H new ATOM 0 HE2 MET A 37 30.183 34.242 27.121 1.00 0.00 H new ATOM 0 HE3 MET A 37 30.078 36.008 26.931 1.00 0.00 H new ATOM 573 N GLU A 38 24.868 37.516 25.519 1.00 0.00 N ATOM 574 CA GLU A 38 24.613 38.460 26.628 1.00 0.00 C ATOM 575 C GLU A 38 25.400 38.050 27.883 1.00 0.00 C ATOM 576 O GLU A 38 25.049 37.078 28.562 1.00 0.00 O ATOM 577 CB GLU A 38 23.114 38.534 26.972 1.00 0.00 C ATOM 578 CG GLU A 38 22.282 39.356 25.987 1.00 0.00 C ATOM 579 CD GLU A 38 20.806 39.369 26.416 1.00 0.00 C ATOM 580 OE1 GLU A 38 20.409 40.164 27.301 1.00 0.00 O ATOM 581 OE2 GLU A 38 20.016 38.550 25.893 1.00 0.00 O ATOM 0 H GLU A 38 24.011 37.132 25.120 1.00 0.00 H new ATOM 0 HA GLU A 38 24.945 39.444 26.295 1.00 0.00 H new ATOM 0 HB2 GLU A 38 22.712 37.522 27.012 1.00 0.00 H new ATOM 0 HB3 GLU A 38 23.003 38.961 27.969 1.00 0.00 H new ATOM 0 HG2 GLU A 38 22.663 40.376 25.941 1.00 0.00 H new ATOM 0 HG3 GLU A 38 22.373 38.936 24.985 1.00 0.00 H new ATOM 696 N CYS A 50 27.435 33.541 35.594 1.00 0.00 N ATOM 697 CA CYS A 50 27.899 32.357 34.827 1.00 0.00 C ATOM 698 C CYS A 50 26.793 31.409 34.273 1.00 0.00 C ATOM 699 O CYS A 50 26.471 30.388 34.880 1.00 0.00 O ATOM 700 CB CYS A 50 28.926 31.618 35.712 1.00 0.00 C ATOM 701 SG CYS A 50 30.414 30.909 34.959 1.00 0.00 S ATOM 0 HA CYS A 50 28.348 32.721 33.903 1.00 0.00 H new ATOM 0 HB2 CYS A 50 29.252 32.315 36.484 1.00 0.00 H new ATOM 0 HB3 CYS A 50 28.399 30.808 36.216 1.00 0.00 H new ATOM 0 HG CYS A 50 31.279 30.628 35.888 1.00 0.00 H new ATOM 706 N HIS A 51 26.200 31.707 33.104 1.00 0.00 N ATOM 707 CA HIS A 51 25.050 30.934 32.597 1.00 0.00 C ATOM 708 C HIS A 51 25.512 29.800 31.670 1.00 0.00 C ATOM 709 O HIS A 51 25.800 30.021 30.493 1.00 0.00 O ATOM 710 CB HIS A 51 24.090 31.830 31.789 1.00 0.00 C ATOM 711 CG HIS A 51 23.328 32.903 32.517 1.00 0.00 C ATOM 712 ND1 HIS A 51 23.493 33.335 33.810 1.00 0.00 N ATOM 713 CD2 HIS A 51 22.375 33.702 31.947 1.00 0.00 C ATOM 714 CE1 HIS A 51 22.684 34.386 34.003 1.00 0.00 C ATOM 715 NE2 HIS A 51 21.968 34.641 32.898 1.00 0.00 N ATOM 0 H HIS A 51 26.494 32.471 32.496 1.00 0.00 H new ATOM 0 HA HIS A 51 24.541 30.526 33.470 1.00 0.00 H new ATOM 0 HB2 HIS A 51 24.669 32.311 31.001 1.00 0.00 H new ATOM 0 HB3 HIS A 51 23.364 31.181 31.300 1.00 0.00 H new ATOM 0 HD2 HIS A 51 22.002 33.621 30.937 1.00 0.00 H new ATOM 0 HE1 HIS A 51 22.618 34.950 34.922 1.00 0.00 H new ATOM 0 HE2 HIS A 51 21.268 35.373 32.776 1.00 0.00 H new ATOM 723 N VAL A 52 25.568 28.574 32.196 1.00 0.00 N ATOM 724 CA VAL A 52 25.582 27.328 31.414 1.00 0.00 C ATOM 725 C VAL A 52 24.843 26.137 32.025 1.00 0.00 C ATOM 726 O VAL A 52 24.820 25.918 33.236 1.00 0.00 O ATOM 727 CB VAL A 52 26.981 26.905 30.907 1.00 0.00 C ATOM 728 CG1 VAL A 52 27.093 27.144 29.408 1.00 0.00 C ATOM 729 CG2 VAL A 52 28.172 27.681 31.512 1.00 0.00 C ATOM 0 H VAL A 52 25.606 28.413 33.202 1.00 0.00 H new ATOM 0 HA VAL A 52 24.991 27.623 30.547 1.00 0.00 H new ATOM 0 HB VAL A 52 27.048 25.859 31.205 1.00 0.00 H new ATOM 0 HG11 VAL A 52 28.082 26.842 29.064 1.00 0.00 H new ATOM 0 HG12 VAL A 52 26.334 26.559 28.889 1.00 0.00 H new ATOM 0 HG13 VAL A 52 26.943 28.203 29.196 1.00 0.00 H new ATOM 0 HG21 VAL A 52 29.104 27.305 31.089 1.00 0.00 H new ATOM 0 HG22 VAL A 52 28.070 28.741 31.281 1.00 0.00 H new ATOM 0 HG23 VAL A 52 28.184 27.544 32.593 1.00 0.00 H new ATOM 739 N ILE A 53 24.333 25.282 31.142 1.00 0.00 N ATOM 740 CA ILE A 53 23.882 23.922 31.394 1.00 0.00 C ATOM 741 C ILE A 53 24.560 22.972 30.391 1.00 0.00 C ATOM 742 O ILE A 53 24.742 23.321 29.239 1.00 0.00 O ATOM 743 CB ILE A 53 22.345 23.892 31.381 1.00 0.00 C ATOM 744 CG1 ILE A 53 21.938 22.460 31.751 1.00 0.00 C ATOM 745 CG2 ILE A 53 21.761 24.422 30.061 1.00 0.00 C ATOM 746 CD1 ILE A 53 20.719 21.942 31.059 1.00 0.00 C ATOM 0 H ILE A 53 24.217 25.543 30.163 1.00 0.00 H new ATOM 0 HA ILE A 53 24.177 23.569 32.382 1.00 0.00 H new ATOM 0 HB ILE A 53 21.918 24.577 32.114 1.00 0.00 H new ATOM 0 HG12 ILE A 53 22.772 21.794 31.529 1.00 0.00 H new ATOM 0 HG13 ILE A 53 21.772 22.414 32.827 1.00 0.00 H new ATOM 0 HG21 ILE A 53 20.673 24.380 30.102 1.00 0.00 H new ATOM 0 HG22 ILE A 53 22.079 25.454 29.911 1.00 0.00 H new ATOM 0 HG23 ILE A 53 22.117 23.808 29.233 1.00 0.00 H new ATOM 0 HD11 ILE A 53 20.518 20.923 31.390 1.00 0.00 H new ATOM 0 HD12 ILE A 53 19.866 22.577 31.300 1.00 0.00 H new ATOM 0 HD13 ILE A 53 20.882 21.947 29.981 1.00 0.00 H new ATOM 758 N VAL A 54 24.909 21.752 30.791 1.00 0.00 N ATOM 759 CA VAL A 54 25.485 20.689 29.961 1.00 0.00 C ATOM 760 C VAL A 54 24.458 19.673 29.473 1.00 0.00 C ATOM 761 O VAL A 54 23.430 19.437 30.110 1.00 0.00 O ATOM 762 CB VAL A 54 26.602 20.036 30.779 1.00 0.00 C ATOM 763 CG1 VAL A 54 26.141 19.031 31.771 1.00 0.00 C ATOM 764 CG2 VAL A 54 27.711 19.347 29.968 1.00 0.00 C ATOM 0 H VAL A 54 24.792 21.458 31.761 1.00 0.00 H new ATOM 0 HA VAL A 54 25.881 21.122 29.043 1.00 0.00 H new ATOM 0 HB VAL A 54 27.004 20.918 31.277 1.00 0.00 H new ATOM 0 HG11 VAL A 54 27.001 18.623 32.302 1.00 0.00 H new ATOM 0 HG12 VAL A 54 25.466 19.506 32.483 1.00 0.00 H new ATOM 0 HG13 VAL A 54 25.617 18.226 31.256 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.448 18.920 30.649 1.00 0.00 H new ATOM 0 HG22 VAL A 54 27.277 18.554 29.359 1.00 0.00 H new ATOM 0 HG23 VAL A 54 28.196 20.078 29.321 1.00 0.00 H new ATOM 774 N ASP A 55 24.809 19.022 28.365 1.00 0.00 N ATOM 775 CA ASP A 55 24.203 17.760 27.939 1.00 0.00 C ATOM 776 C ASP A 55 24.252 16.729 29.101 1.00 0.00 C ATOM 777 O ASP A 55 25.334 16.546 29.683 1.00 0.00 O ATOM 778 CB ASP A 55 25.113 17.236 26.818 1.00 0.00 C ATOM 779 CG ASP A 55 24.557 16.082 25.971 1.00 0.00 C ATOM 780 OD1 ASP A 55 23.680 15.331 26.449 1.00 0.00 O ATOM 781 OD2 ASP A 55 25.000 15.940 24.805 1.00 0.00 O ATOM 0 H ASP A 55 25.532 19.360 27.729 1.00 0.00 H new ATOM 0 HA ASP A 55 23.167 17.902 27.631 1.00 0.00 H new ATOM 0 HB2 ASP A 55 25.348 18.066 26.152 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.052 16.910 27.265 1.00 0.00 H new ATOM 786 N PRO A 56 23.185 15.952 29.363 1.00 0.00 N ATOM 787 CA PRO A 56 23.204 14.842 30.323 1.00 0.00 C ATOM 788 C PRO A 56 24.218 13.729 30.008 1.00 0.00 C ATOM 789 O PRO A 56 24.490 12.894 30.870 1.00 0.00 O ATOM 790 CB PRO A 56 21.763 14.325 30.388 1.00 0.00 C ATOM 791 CG PRO A 56 20.937 15.554 30.013 1.00 0.00 C ATOM 792 CD PRO A 56 21.813 16.230 28.962 1.00 0.00 C ATOM 0 HA PRO A 56 23.553 15.203 31.291 1.00 0.00 H new ATOM 0 HB2 PRO A 56 21.598 13.501 29.693 1.00 0.00 H new ATOM 0 HB3 PRO A 56 21.511 13.958 31.383 1.00 0.00 H new ATOM 0 HG2 PRO A 56 19.961 15.281 29.613 1.00 0.00 H new ATOM 0 HG3 PRO A 56 20.760 16.202 30.872 1.00 0.00 H new ATOM 0 HD2 PRO A 56 21.607 15.836 27.967 1.00 0.00 H new ATOM 0 HD3 PRO A 56 21.625 17.303 28.925 1.00 0.00 H new ATOM 800 N ASP A 57 24.800 13.721 28.804 1.00 0.00 N ATOM 801 CA ASP A 57 25.905 12.844 28.415 1.00 0.00 C ATOM 802 C ASP A 57 27.258 13.315 28.952 1.00 0.00 C ATOM 803 O ASP A 57 28.053 12.481 29.380 1.00 0.00 O ATOM 804 CB ASP A 57 25.982 12.724 26.884 1.00 0.00 C ATOM 805 CG ASP A 57 25.359 11.416 26.405 1.00 0.00 C ATOM 806 OD1 ASP A 57 26.049 10.366 26.412 1.00 0.00 O ATOM 807 OD2 ASP A 57 24.167 11.428 26.026 1.00 0.00 O ATOM 0 H ASP A 57 24.505 14.344 28.052 1.00 0.00 H new ATOM 0 HA ASP A 57 25.695 11.871 28.860 1.00 0.00 H new ATOM 0 HB2 ASP A 57 25.466 13.567 26.423 1.00 0.00 H new ATOM 0 HB3 ASP A 57 27.023 12.774 26.564 1.00 0.00 H new ATOM 812 N TYR A 58 27.566 14.619 28.936 1.00 0.00 N ATOM 813 CA TYR A 58 28.921 15.074 29.216 1.00 0.00 C ATOM 814 C TYR A 58 29.152 15.547 30.643 1.00 0.00 C ATOM 815 O TYR A 58 30.285 15.467 31.114 1.00 0.00 O ATOM 816 CB TYR A 58 29.255 16.161 28.223 1.00 0.00 C ATOM 817 CG TYR A 58 29.507 15.614 26.841 1.00 0.00 C ATOM 818 CD1 TYR A 58 30.781 15.154 26.463 1.00 0.00 C ATOM 819 CD2 TYR A 58 28.431 15.527 25.953 1.00 0.00 C ATOM 820 CE1 TYR A 58 30.985 14.655 25.161 1.00 0.00 C ATOM 821 CE2 TYR A 58 28.632 15.052 24.647 1.00 0.00 C ATOM 822 CZ TYR A 58 29.912 14.613 24.242 1.00 0.00 C ATOM 823 OH TYR A 58 30.113 14.154 22.979 1.00 0.00 O ATOM 0 H TYR A 58 26.899 15.364 28.734 1.00 0.00 H new ATOM 0 HA TYR A 58 29.586 14.217 29.111 1.00 0.00 H new ATOM 0 HB2 TYR A 58 28.436 16.879 28.184 1.00 0.00 H new ATOM 0 HB3 TYR A 58 30.137 16.703 28.564 1.00 0.00 H new ATOM 0 HD1 TYR A 58 31.599 15.183 27.167 1.00 0.00 H new ATOM 0 HD2 TYR A 58 27.443 15.826 26.272 1.00 0.00 H new ATOM 0 HE1 TYR A 58 31.963 14.304 24.865 1.00 0.00 H new ATOM 0 HE2 TYR A 58 27.807 15.022 23.951 1.00 0.00 H new ATOM 0 HH TYR A 58 29.271 14.192 22.479 1.00 0.00 H new ATOM 833 N TYR A 59 28.118 15.986 31.370 1.00 0.00 N ATOM 834 CA TYR A 59 28.310 16.186 32.821 1.00 0.00 C ATOM 835 C TYR A 59 28.633 14.873 33.525 1.00 0.00 C ATOM 836 O TYR A 59 29.204 14.851 34.609 1.00 0.00 O ATOM 837 CB TYR A 59 27.066 16.674 33.558 1.00 0.00 C ATOM 838 CG TYR A 59 27.255 17.928 34.433 1.00 0.00 C ATOM 839 CD1 TYR A 59 28.273 18.884 34.179 1.00 0.00 C ATOM 840 CD2 TYR A 59 26.407 18.137 35.536 1.00 0.00 C ATOM 841 CE1 TYR A 59 28.521 19.930 35.079 1.00 0.00 C ATOM 842 CE2 TYR A 59 26.645 19.200 36.433 1.00 0.00 C ATOM 843 CZ TYR A 59 27.751 20.061 36.246 1.00 0.00 C ATOM 844 OH TYR A 59 28.068 21.043 37.135 1.00 0.00 O ATOM 0 H TYR A 59 27.188 16.201 31.010 1.00 0.00 H new ATOM 0 HA TYR A 59 29.110 16.925 32.862 1.00 0.00 H new ATOM 0 HB2 TYR A 59 26.289 16.881 32.823 1.00 0.00 H new ATOM 0 HB3 TYR A 59 26.700 15.865 34.190 1.00 0.00 H new ATOM 0 HD1 TYR A 59 28.865 18.804 33.279 1.00 0.00 H new ATOM 0 HD2 TYR A 59 25.567 17.478 35.698 1.00 0.00 H new ATOM 0 HE1 TYR A 59 29.309 20.639 34.874 1.00 0.00 H new ATOM 0 HE2 TYR A 59 25.978 19.357 37.268 1.00 0.00 H new ATOM 0 HH TYR A 59 27.390 21.750 37.097 1.00 0.00 H new ATOM 854 N ASP A 60 28.119 13.778 32.969 1.00 0.00 N ATOM 855 CA ASP A 60 27.986 12.502 33.660 1.00 0.00 C ATOM 856 C ASP A 60 29.334 11.892 34.060 1.00 0.00 C ATOM 857 O ASP A 60 29.439 11.092 34.994 1.00 0.00 O ATOM 858 CB ASP A 60 27.215 11.598 32.703 1.00 0.00 C ATOM 859 CG ASP A 60 27.480 10.096 32.803 1.00 0.00 C ATOM 860 OD1 ASP A 60 26.847 9.415 33.644 1.00 0.00 O ATOM 861 OD2 ASP A 60 28.330 9.605 32.019 1.00 0.00 O ATOM 0 H ASP A 60 27.778 13.755 32.008 1.00 0.00 H new ATOM 0 HA ASP A 60 27.462 12.631 34.607 1.00 0.00 H new ATOM 0 HB2 ASP A 60 26.150 11.766 32.863 1.00 0.00 H new ATOM 0 HB3 ASP A 60 27.438 11.914 31.684 1.00 0.00 H new ATOM 866 N ALA A 61 30.359 12.329 33.338 1.00 0.00 N ATOM 867 CA ALA A 61 31.756 11.944 33.466 1.00 0.00 C ATOM 868 C ALA A 61 32.601 13.039 34.158 1.00 0.00 C ATOM 869 O ALA A 61 33.833 12.994 34.124 1.00 0.00 O ATOM 870 CB ALA A 61 32.217 11.588 32.051 1.00 0.00 C ATOM 0 H ALA A 61 30.223 13.012 32.593 1.00 0.00 H new ATOM 0 HA ALA A 61 31.887 11.084 34.123 1.00 0.00 H new ATOM 0 HB1 ALA A 61 33.265 11.288 32.074 1.00 0.00 H new ATOM 0 HB2 ALA A 61 31.613 10.766 31.667 1.00 0.00 H new ATOM 0 HB3 ALA A 61 32.103 12.456 31.402 1.00 0.00 H new ATOM 876 N LEU A 62 31.935 14.037 34.756 1.00 0.00 N ATOM 877 CA LEU A 62 32.544 15.247 35.338 1.00 0.00 C ATOM 878 C LEU A 62 32.076 15.558 36.781 1.00 0.00 C ATOM 879 O LEU A 62 30.979 15.155 37.189 1.00 0.00 O ATOM 880 CB LEU A 62 32.257 16.438 34.397 1.00 0.00 C ATOM 881 CG LEU A 62 33.119 16.477 33.119 1.00 0.00 C ATOM 882 CD1 LEU A 62 32.624 17.599 32.205 1.00 0.00 C ATOM 883 CD2 LEU A 62 34.609 16.738 33.375 1.00 0.00 C ATOM 0 H LEU A 62 30.920 14.026 34.852 1.00 0.00 H new ATOM 0 HA LEU A 62 33.616 15.067 35.424 1.00 0.00 H new ATOM 0 HB2 LEU A 62 31.206 16.409 34.108 1.00 0.00 H new ATOM 0 HB3 LEU A 62 32.411 17.365 34.950 1.00 0.00 H new ATOM 0 HG LEU A 62 33.019 15.488 32.671 1.00 0.00 H new ATOM 0 HD11 LEU A 62 33.233 17.627 31.301 1.00 0.00 H new ATOM 0 HD12 LEU A 62 31.584 17.417 31.936 1.00 0.00 H new ATOM 0 HD13 LEU A 62 32.702 18.554 32.725 1.00 0.00 H new ATOM 0 HD21 LEU A 62 35.145 16.750 32.426 1.00 0.00 H new ATOM 0 HD22 LEU A 62 34.730 17.701 33.872 1.00 0.00 H new ATOM 0 HD23 LEU A 62 35.013 15.949 34.009 1.00 0.00 H new ATOM 895 N PRO A 63 32.894 16.282 37.569 1.00 0.00 N ATOM 896 CA PRO A 63 32.540 16.770 38.901 1.00 0.00 C ATOM 897 C PRO A 63 31.640 18.018 38.848 1.00 0.00 C ATOM 898 O PRO A 63 31.453 18.638 37.801 1.00 0.00 O ATOM 899 CB PRO A 63 33.882 17.069 39.571 1.00 0.00 C ATOM 900 CG PRO A 63 34.723 17.568 38.400 1.00 0.00 C ATOM 901 CD PRO A 63 34.262 16.680 37.252 1.00 0.00 C ATOM 0 HA PRO A 63 31.956 16.036 39.455 1.00 0.00 H new ATOM 0 HB2 PRO A 63 33.787 17.821 40.354 1.00 0.00 H new ATOM 0 HB3 PRO A 63 34.313 16.181 40.033 1.00 0.00 H new ATOM 0 HG2 PRO A 63 34.543 18.623 38.193 1.00 0.00 H new ATOM 0 HG3 PRO A 63 35.790 17.459 38.593 1.00 0.00 H new ATOM 0 HD2 PRO A 63 34.301 17.217 36.304 1.00 0.00 H new ATOM 0 HD3 PRO A 63 34.908 15.808 37.151 1.00 0.00 H new ATOM 909 N GLU A 64 31.102 18.398 40.008 1.00 0.00 N ATOM 910 CA GLU A 64 30.225 19.564 40.208 1.00 0.00 C ATOM 911 C GLU A 64 30.858 20.535 41.228 1.00 0.00 C ATOM 912 O GLU A 64 31.550 20.058 42.134 1.00 0.00 O ATOM 913 CB GLU A 64 28.851 19.080 40.696 1.00 0.00 C ATOM 914 CG GLU A 64 28.143 18.195 39.652 1.00 0.00 C ATOM 915 CD GLU A 64 26.968 17.419 40.243 1.00 0.00 C ATOM 916 OE1 GLU A 64 27.139 16.763 41.297 1.00 0.00 O ATOM 917 OE2 GLU A 64 25.860 17.417 39.653 1.00 0.00 O ATOM 0 H GLU A 64 31.269 17.884 40.873 1.00 0.00 H new ATOM 0 HA GLU A 64 30.101 20.098 39.266 1.00 0.00 H new ATOM 0 HB2 GLU A 64 28.973 18.519 41.623 1.00 0.00 H new ATOM 0 HB3 GLU A 64 28.224 19.942 40.925 1.00 0.00 H new ATOM 0 HG2 GLU A 64 27.786 18.820 38.833 1.00 0.00 H new ATOM 0 HG3 GLU A 64 28.861 17.493 39.228 1.00 0.00 H new ATOM 924 N PRO A 65 30.675 21.870 41.127 1.00 0.00 N ATOM 925 CA PRO A 65 31.536 22.819 41.834 1.00 0.00 C ATOM 926 C PRO A 65 31.172 23.007 43.310 1.00 0.00 C ATOM 927 O PRO A 65 30.107 22.587 43.773 1.00 0.00 O ATOM 928 CB PRO A 65 31.449 24.141 41.050 1.00 0.00 C ATOM 929 CG PRO A 65 30.764 23.764 39.739 1.00 0.00 C ATOM 930 CD PRO A 65 29.867 22.624 40.181 1.00 0.00 C ATOM 0 HA PRO A 65 32.555 22.434 41.867 1.00 0.00 H new ATOM 0 HB2 PRO A 65 30.875 24.889 41.597 1.00 0.00 H new ATOM 0 HB3 PRO A 65 32.438 24.564 40.874 1.00 0.00 H new ATOM 0 HG2 PRO A 65 30.195 24.594 39.320 1.00 0.00 H new ATOM 0 HG3 PRO A 65 31.479 23.451 38.978 1.00 0.00 H new ATOM 0 HD2 PRO A 65 28.954 22.995 40.646 1.00 0.00 H new ATOM 0 HD3 PRO A 65 29.565 22.006 39.336 1.00 0.00 H new ATOM 938 N GLU A 66 32.041 23.714 44.033 1.00 0.00 N ATOM 939 CA GLU A 66 31.756 24.260 45.367 1.00 0.00 C ATOM 940 C GLU A 66 30.498 25.139 45.394 1.00 0.00 C ATOM 941 O GLU A 66 30.110 25.690 44.365 1.00 0.00 O ATOM 942 CB GLU A 66 32.935 25.130 45.813 1.00 0.00 C ATOM 943 CG GLU A 66 34.128 24.284 46.241 1.00 0.00 C ATOM 944 CD GLU A 66 35.289 25.158 46.716 1.00 0.00 C ATOM 945 OE1 GLU A 66 35.072 26.018 47.609 1.00 0.00 O ATOM 946 OE2 GLU A 66 36.418 24.978 46.199 1.00 0.00 O ATOM 0 H GLU A 66 32.982 23.929 43.704 1.00 0.00 H new ATOM 0 HA GLU A 66 31.597 23.409 46.030 1.00 0.00 H new ATOM 0 HB2 GLU A 66 33.230 25.789 44.997 1.00 0.00 H new ATOM 0 HB3 GLU A 66 32.625 25.767 46.641 1.00 0.00 H new ATOM 0 HG2 GLU A 66 33.828 23.608 47.042 1.00 0.00 H new ATOM 0 HG3 GLU A 66 34.455 23.664 45.406 1.00 0.00 H new ATOM 953 N ASP A 67 29.901 25.364 46.568 1.00 0.00 N ATOM 954 CA ASP A 67 28.719 26.233 46.672 1.00 0.00 C ATOM 955 C ASP A 67 29.030 27.688 46.296 1.00 0.00 C ATOM 956 O ASP A 67 28.197 28.337 45.682 1.00 0.00 O ATOM 957 CB ASP A 67 28.093 26.146 48.069 1.00 0.00 C ATOM 958 CG ASP A 67 26.669 26.719 48.084 1.00 0.00 C ATOM 959 OD1 ASP A 67 25.737 25.974 47.691 1.00 0.00 O ATOM 960 OD2 ASP A 67 26.474 27.877 48.530 1.00 0.00 O ATOM 0 H ASP A 67 30.211 24.962 47.453 1.00 0.00 H new ATOM 0 HA ASP A 67 27.991 25.867 45.948 1.00 0.00 H new ATOM 0 HB2 ASP A 67 28.071 25.106 48.395 1.00 0.00 H new ATOM 0 HB3 ASP A 67 28.713 26.690 48.781 1.00 0.00 H new ATOM 965 N ASP A 68 30.242 28.200 46.541 1.00 0.00 N ATOM 966 CA ASP A 68 30.586 29.567 46.136 1.00 0.00 C ATOM 967 C ASP A 68 30.720 29.686 44.614 1.00 0.00 C ATOM 968 O ASP A 68 30.637 30.780 44.053 1.00 0.00 O ATOM 969 CB ASP A 68 31.891 30.006 46.812 1.00 0.00 C ATOM 970 CG ASP A 68 32.016 31.528 46.768 1.00 0.00 C ATOM 971 OD1 ASP A 68 31.172 32.200 47.409 1.00 0.00 O ATOM 972 OD2 ASP A 68 32.890 32.053 46.037 1.00 0.00 O ATOM 0 H ASP A 68 30.993 27.695 47.012 1.00 0.00 H new ATOM 0 HA ASP A 68 29.775 30.222 46.454 1.00 0.00 H new ATOM 0 HB2 ASP A 68 31.908 29.661 47.846 1.00 0.00 H new ATOM 0 HB3 ASP A 68 32.743 29.548 46.309 1.00 0.00 H new ATOM 977 N GLU A 69 30.967 28.549 43.962 1.00 0.00 N ATOM 978 CA GLU A 69 31.187 28.418 42.531 1.00 0.00 C ATOM 979 C GLU A 69 29.844 28.156 41.791 1.00 0.00 C ATOM 980 O GLU A 69 29.496 28.887 40.864 1.00 0.00 O ATOM 981 CB GLU A 69 32.300 27.352 42.353 1.00 0.00 C ATOM 982 CG GLU A 69 33.646 27.829 42.944 1.00 0.00 C ATOM 983 CD GLU A 69 34.802 26.809 42.922 1.00 0.00 C ATOM 984 OE1 GLU A 69 34.620 25.620 42.561 1.00 0.00 O ATOM 985 OE2 GLU A 69 35.935 27.216 43.293 1.00 0.00 O ATOM 0 H GLU A 69 31.021 27.653 44.447 1.00 0.00 H new ATOM 0 HA GLU A 69 31.543 29.334 42.060 1.00 0.00 H new ATOM 0 HB2 GLU A 69 31.997 26.425 42.839 1.00 0.00 H new ATOM 0 HB3 GLU A 69 32.426 27.130 41.293 1.00 0.00 H new ATOM 0 HG2 GLU A 69 33.963 28.718 42.398 1.00 0.00 H new ATOM 0 HG3 GLU A 69 33.477 28.133 43.977 1.00 0.00 H new ATOM 992 N ASN A 70 29.041 27.173 42.241 1.00 0.00 N ATOM 993 CA ASN A 70 27.712 26.774 41.734 1.00 0.00 C ATOM 994 C ASN A 70 26.506 27.657 42.111 1.00 0.00 C ATOM 995 O ASN A 70 25.457 27.569 41.472 1.00 0.00 O ATOM 996 CB ASN A 70 27.503 25.282 42.060 1.00 0.00 C ATOM 997 CG ASN A 70 26.993 24.958 43.459 1.00 0.00 C ATOM 998 OD1 ASN A 70 26.059 25.557 43.970 1.00 0.00 O ATOM 999 ND2 ASN A 70 27.536 23.951 44.101 1.00 0.00 N ATOM 0 H ASN A 70 29.326 26.592 43.029 1.00 0.00 H new ATOM 0 HA ASN A 70 27.737 26.942 40.657 1.00 0.00 H new ATOM 0 HB2 ASN A 70 26.800 24.870 41.336 1.00 0.00 H new ATOM 0 HB3 ASN A 70 28.451 24.765 41.914 1.00 0.00 H new ATOM 0 HD21 ASN A 70 27.178 23.677 45.016 1.00 0.00 H new ATOM 0 HD22 ASN A 70 28.316 23.442 43.685 1.00 0.00 H new ATOM 1006 N ASP A 71 26.640 28.508 43.118 1.00 0.00 N ATOM 1007 CA ASP A 71 25.611 29.490 43.511 1.00 0.00 C ATOM 1008 C ASP A 71 25.557 30.654 42.523 1.00 0.00 C ATOM 1009 O ASP A 71 24.485 31.200 42.297 1.00 0.00 O ATOM 1010 CB ASP A 71 25.876 30.014 44.923 1.00 0.00 C ATOM 1011 CG ASP A 71 24.757 30.883 45.485 1.00 0.00 C ATOM 1012 OD1 ASP A 71 23.687 30.321 45.815 1.00 0.00 O ATOM 1013 OD2 ASP A 71 25.001 32.084 45.764 1.00 0.00 O ATOM 0 H ASP A 71 27.476 28.545 43.701 1.00 0.00 H new ATOM 0 HA ASP A 71 24.646 28.983 43.499 1.00 0.00 H new ATOM 0 HB2 ASP A 71 26.033 29.166 45.590 1.00 0.00 H new ATOM 0 HB3 ASP A 71 26.801 30.590 44.917 1.00 0.00 H new ATOM 1018 N MET A 72 26.685 30.967 41.868 1.00 0.00 N ATOM 1019 CA MET A 72 26.752 31.951 40.780 1.00 0.00 C ATOM 1020 C MET A 72 25.837 31.555 39.612 1.00 0.00 C ATOM 1021 O MET A 72 25.229 32.420 38.987 1.00 0.00 O ATOM 1022 CB MET A 72 28.202 32.120 40.303 1.00 0.00 C ATOM 1023 CG MET A 72 29.170 32.521 41.426 1.00 0.00 C ATOM 1024 SD MET A 72 28.696 33.943 42.455 1.00 0.00 S ATOM 1025 CE MET A 72 28.725 35.262 41.214 1.00 0.00 C ATOM 0 H MET A 72 27.586 30.539 42.082 1.00 0.00 H new ATOM 0 HA MET A 72 26.398 32.907 41.166 1.00 0.00 H new ATOM 0 HB2 MET A 72 28.541 31.185 39.857 1.00 0.00 H new ATOM 0 HB3 MET A 72 28.233 32.877 39.519 1.00 0.00 H new ATOM 0 HG2 MET A 72 29.306 31.660 42.080 1.00 0.00 H new ATOM 0 HG3 MET A 72 30.140 32.736 40.977 1.00 0.00 H new ATOM 0 HE1 MET A 72 28.456 36.209 41.683 1.00 0.00 H new ATOM 0 HE2 MET A 72 29.726 35.339 40.789 1.00 0.00 H new ATOM 0 HE3 MET A 72 28.011 35.033 40.423 1.00 0.00 H new ATOM 1035 N LEU A 73 25.681 30.245 39.386 1.00 0.00 N ATOM 1036 CA LEU A 73 24.728 29.655 38.445 1.00 0.00 C ATOM 1037 C LEU A 73 23.291 29.948 38.896 1.00 0.00 C ATOM 1038 O LEU A 73 22.483 30.466 38.134 1.00 0.00 O ATOM 1039 CB LEU A 73 24.935 28.126 38.371 1.00 0.00 C ATOM 1040 CG LEU A 73 26.375 27.613 38.307 1.00 0.00 C ATOM 1041 CD1 LEU A 73 26.385 26.081 38.331 1.00 0.00 C ATOM 1042 CD2 LEU A 73 27.018 28.053 37.003 1.00 0.00 C ATOM 0 H LEU A 73 26.237 29.542 39.873 1.00 0.00 H new ATOM 0 HA LEU A 73 24.896 30.093 37.461 1.00 0.00 H new ATOM 0 HB2 LEU A 73 24.456 27.679 39.242 1.00 0.00 H new ATOM 0 HB3 LEU A 73 24.406 27.757 37.492 1.00 0.00 H new ATOM 0 HG LEU A 73 26.921 28.013 39.162 1.00 0.00 H new ATOM 0 HD11 LEU A 73 27.414 25.723 38.285 1.00 0.00 H new ATOM 0 HD12 LEU A 73 25.919 25.728 39.251 1.00 0.00 H new ATOM 0 HD13 LEU A 73 25.830 25.700 37.474 1.00 0.00 H new ATOM 0 HD21 LEU A 73 28.043 27.686 36.961 1.00 0.00 H new ATOM 0 HD22 LEU A 73 26.453 27.648 36.164 1.00 0.00 H new ATOM 0 HD23 LEU A 73 27.020 29.142 36.947 1.00 0.00 H new ATOM 1054 N ASP A 74 22.984 29.625 40.159 1.00 0.00 N ATOM 1055 CA ASP A 74 21.675 29.853 40.808 1.00 0.00 C ATOM 1056 C ASP A 74 21.159 31.306 40.783 1.00 0.00 C ATOM 1057 O ASP A 74 19.981 31.553 41.065 1.00 0.00 O ATOM 1058 CB ASP A 74 21.730 29.349 42.262 1.00 0.00 C ATOM 1059 CG ASP A 74 20.484 28.533 42.604 1.00 0.00 C ATOM 1060 OD1 ASP A 74 20.395 27.361 42.168 1.00 0.00 O ATOM 1061 OD2 ASP A 74 19.569 29.064 43.277 1.00 0.00 O ATOM 0 H ASP A 74 23.659 29.183 40.783 1.00 0.00 H new ATOM 0 HA ASP A 74 20.958 29.290 40.210 1.00 0.00 H new ATOM 0 HB2 ASP A 74 22.621 28.737 42.406 1.00 0.00 H new ATOM 0 HB3 ASP A 74 21.812 30.197 42.942 1.00 0.00 H new ATOM 1066 N LEU A 75 22.002 32.278 40.427 1.00 0.00 N ATOM 1067 CA LEU A 75 21.596 33.666 40.212 1.00 0.00 C ATOM 1068 C LEU A 75 20.856 33.858 38.872 1.00 0.00 C ATOM 1069 O LEU A 75 20.065 34.796 38.734 1.00 0.00 O ATOM 1070 CB LEU A 75 22.828 34.574 40.341 1.00 0.00 C ATOM 1071 CG LEU A 75 23.714 34.320 41.581 1.00 0.00 C ATOM 1072 CD1 LEU A 75 24.696 35.476 41.720 1.00 0.00 C ATOM 1073 CD2 LEU A 75 22.946 34.124 42.892 1.00 0.00 C ATOM 0 H LEU A 75 22.999 32.120 40.278 1.00 0.00 H new ATOM 0 HA LEU A 75 20.874 33.947 40.979 1.00 0.00 H new ATOM 0 HB2 LEU A 75 23.441 34.455 39.448 1.00 0.00 H new ATOM 0 HB3 LEU A 75 22.493 35.611 40.362 1.00 0.00 H new ATOM 0 HG LEU A 75 24.226 33.373 41.409 1.00 0.00 H new ATOM 0 HD11 LEU A 75 25.330 35.312 42.592 1.00 0.00 H new ATOM 0 HD12 LEU A 75 25.317 35.536 40.826 1.00 0.00 H new ATOM 0 HD13 LEU A 75 24.145 36.409 41.842 1.00 0.00 H new ATOM 0 HD21 LEU A 75 23.652 33.952 43.705 1.00 0.00 H new ATOM 0 HD22 LEU A 75 22.357 35.016 43.105 1.00 0.00 H new ATOM 0 HD23 LEU A 75 22.282 33.264 42.800 1.00 0.00 H new ATOM 1085 N ALA A 76 21.033 32.941 37.916 1.00 0.00 N ATOM 1086 CA ALA A 76 20.204 32.812 36.716 1.00 0.00 C ATOM 1087 C ALA A 76 18.787 32.297 37.039 1.00 0.00 C ATOM 1088 O ALA A 76 18.533 31.726 38.107 1.00 0.00 O ATOM 1089 CB ALA A 76 20.911 31.874 35.731 1.00 0.00 C ATOM 0 H ALA A 76 21.780 32.248 37.958 1.00 0.00 H new ATOM 0 HA ALA A 76 20.079 33.799 36.271 1.00 0.00 H new ATOM 0 HB1 ALA A 76 20.305 31.768 34.831 1.00 0.00 H new ATOM 0 HB2 ALA A 76 21.883 32.290 35.467 1.00 0.00 H new ATOM 0 HB3 ALA A 76 21.048 30.897 36.194 1.00 0.00 H new ATOM 1095 N TYR A 77 17.851 32.474 36.107 1.00 0.00 N ATOM 1096 CA TYR A 77 16.527 31.843 36.173 1.00 0.00 C ATOM 1097 C TYR A 77 16.603 30.337 35.890 1.00 0.00 C ATOM 1098 O TYR A 77 17.476 29.886 35.148 1.00 0.00 O ATOM 1099 CB TYR A 77 15.611 32.541 35.159 1.00 0.00 C ATOM 1100 CG TYR A 77 14.229 31.948 35.001 1.00 0.00 C ATOM 1101 CD1 TYR A 77 13.241 32.198 35.971 1.00 0.00 C ATOM 1102 CD2 TYR A 77 13.925 31.169 33.869 1.00 0.00 C ATOM 1103 CE1 TYR A 77 11.953 31.650 35.819 1.00 0.00 C ATOM 1104 CE2 TYR A 77 12.640 30.624 33.710 1.00 0.00 C ATOM 1105 CZ TYR A 77 11.652 30.861 34.689 1.00 0.00 C ATOM 1106 OH TYR A 77 10.418 30.308 34.569 1.00 0.00 O ATOM 0 H TYR A 77 17.987 33.059 35.283 1.00 0.00 H new ATOM 0 HA TYR A 77 16.126 31.953 37.181 1.00 0.00 H new ATOM 0 HB2 TYR A 77 15.506 33.586 35.452 1.00 0.00 H new ATOM 0 HB3 TYR A 77 16.103 32.531 34.187 1.00 0.00 H new ATOM 0 HD1 TYR A 77 13.470 32.810 36.831 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.682 30.990 33.120 1.00 0.00 H new ATOM 0 HE1 TYR A 77 11.196 31.834 36.567 1.00 0.00 H new ATOM 0 HE2 TYR A 77 12.409 30.026 32.841 1.00 0.00 H new ATOM 0 HH TYR A 77 10.369 29.795 33.735 1.00 0.00 H new ATOM 1116 N GLY A 78 15.645 29.570 36.416 1.00 0.00 N ATOM 1117 CA GLY A 78 15.267 28.278 35.847 1.00 0.00 C ATOM 1118 C GLY A 78 16.381 27.233 35.763 1.00 0.00 C ATOM 1119 O GLY A 78 16.477 26.501 34.774 1.00 0.00 O ATOM 0 H GLY A 78 15.112 29.828 37.246 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.452 27.865 36.442 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.876 28.445 34.843 1.00 0.00 H new ATOM 1123 N LEU A 79 17.253 27.192 36.772 1.00 0.00 N ATOM 1124 CA LEU A 79 18.447 26.355 36.783 1.00 0.00 C ATOM 1125 C LEU A 79 18.158 24.842 36.873 1.00 0.00 C ATOM 1126 O LEU A 79 17.306 24.391 37.640 1.00 0.00 O ATOM 1127 CB LEU A 79 19.431 26.943 37.806 1.00 0.00 C ATOM 1128 CG LEU A 79 20.774 26.219 37.757 1.00 0.00 C ATOM 1129 CD1 LEU A 79 21.863 27.124 38.260 1.00 0.00 C ATOM 1130 CD2 LEU A 79 20.830 25.009 38.675 1.00 0.00 C ATOM 0 H LEU A 79 17.144 27.751 37.618 1.00 0.00 H new ATOM 0 HA LEU A 79 18.942 26.387 35.813 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.579 28.004 37.604 1.00 0.00 H new ATOM 0 HB3 LEU A 79 19.009 26.865 38.808 1.00 0.00 H new ATOM 0 HG LEU A 79 20.901 25.919 36.717 1.00 0.00 H new ATOM 0 HD11 LEU A 79 22.818 26.600 38.222 1.00 0.00 H new ATOM 0 HD12 LEU A 79 21.913 28.015 37.635 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.649 27.414 39.289 1.00 0.00 H new ATOM 0 HD21 LEU A 79 21.809 24.537 38.596 1.00 0.00 H new ATOM 0 HD22 LEU A 79 20.662 25.325 39.704 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.059 24.296 38.384 1.00 0.00 H new ATOM 1142 N THR A 80 18.903 24.069 36.077 1.00 0.00 N ATOM 1143 CA THR A 80 18.673 22.661 35.703 1.00 0.00 C ATOM 1144 C THR A 80 19.523 21.663 36.506 1.00 0.00 C ATOM 1145 O THR A 80 20.534 22.028 37.111 1.00 0.00 O ATOM 1146 CB THR A 80 19.000 22.473 34.200 1.00 0.00 C ATOM 1147 OG1 THR A 80 19.191 23.699 33.525 1.00 0.00 O ATOM 1148 CG2 THR A 80 17.929 21.690 33.452 1.00 0.00 C ATOM 0 H THR A 80 19.749 24.435 35.641 1.00 0.00 H new ATOM 0 HA THR A 80 17.626 22.451 35.924 1.00 0.00 H new ATOM 0 HB THR A 80 19.931 21.905 34.199 1.00 0.00 H new ATOM 0 HG1 THR A 80 18.648 23.711 32.709 1.00 0.00 H new ATOM 0 HG21 THR A 80 18.215 21.592 32.405 1.00 0.00 H new ATOM 0 HG22 THR A 80 17.827 20.699 33.895 1.00 0.00 H new ATOM 0 HG23 THR A 80 16.978 22.218 33.520 1.00 0.00 H new ATOM 1156 N GLU A 81 19.195 20.369 36.442 1.00 0.00 N ATOM 1157 CA GLU A 81 19.944 19.290 37.120 1.00 0.00 C ATOM 1158 C GLU A 81 21.414 19.181 36.669 1.00 0.00 C ATOM 1159 O GLU A 81 22.268 18.758 37.456 1.00 0.00 O ATOM 1160 CB GLU A 81 19.245 17.940 36.867 1.00 0.00 C ATOM 1161 CG GLU A 81 17.903 17.769 37.595 1.00 0.00 C ATOM 1162 CD GLU A 81 18.086 17.473 39.089 1.00 0.00 C ATOM 1163 OE1 GLU A 81 18.346 18.426 39.863 1.00 0.00 O ATOM 1164 OE2 GLU A 81 17.974 16.288 39.491 1.00 0.00 O ATOM 0 H GLU A 81 18.392 20.030 35.912 1.00 0.00 H new ATOM 0 HA GLU A 81 19.952 19.541 38.181 1.00 0.00 H new ATOM 0 HB2 GLU A 81 19.079 17.827 35.796 1.00 0.00 H new ATOM 0 HB3 GLU A 81 19.914 17.136 37.173 1.00 0.00 H new ATOM 0 HG2 GLU A 81 17.309 18.676 37.476 1.00 0.00 H new ATOM 0 HG3 GLU A 81 17.342 16.958 37.132 1.00 0.00 H new ATOM 1171 N THR A 82 21.721 19.599 35.434 1.00 0.00 N ATOM 1172 CA THR A 82 23.053 19.551 34.813 1.00 0.00 C ATOM 1173 C THR A 82 23.600 20.940 34.517 1.00 0.00 C ATOM 1174 O THR A 82 24.313 21.164 33.537 1.00 0.00 O ATOM 1175 CB THR A 82 23.094 18.674 33.560 1.00 0.00 C ATOM 1176 OG1 THR A 82 22.107 19.050 32.620 1.00 0.00 O ATOM 1177 CG2 THR A 82 22.884 17.195 33.860 1.00 0.00 C ATOM 0 H THR A 82 21.017 19.998 34.812 1.00 0.00 H new ATOM 0 HA THR A 82 23.704 19.085 35.553 1.00 0.00 H new ATOM 0 HB THR A 82 24.094 18.826 33.153 1.00 0.00 H new ATOM 0 HG1 THR A 82 22.526 19.193 31.746 1.00 0.00 H new ATOM 0 HG21 THR A 82 22.924 16.626 32.931 1.00 0.00 H new ATOM 0 HG22 THR A 82 23.667 16.846 34.533 1.00 0.00 H new ATOM 0 HG23 THR A 82 21.911 17.054 34.330 1.00 0.00 H new ATOM 1185 N SER A 83 23.265 21.920 35.349 1.00 0.00 N ATOM 1186 CA SER A 83 23.884 23.222 35.267 1.00 0.00 C ATOM 1187 C SER A 83 25.406 23.109 35.416 1.00 0.00 C ATOM 1188 O SER A 83 25.855 22.492 36.376 1.00 0.00 O ATOM 1189 CB SER A 83 23.319 24.074 36.390 1.00 0.00 C ATOM 1190 OG SER A 83 23.756 23.588 37.652 1.00 0.00 O ATOM 0 H SER A 83 22.566 21.829 36.086 1.00 0.00 H new ATOM 0 HA SER A 83 23.676 23.672 34.296 1.00 0.00 H new ATOM 0 HB2 SER A 83 23.635 25.109 36.263 1.00 0.00 H new ATOM 0 HB3 SER A 83 22.230 24.066 36.348 1.00 0.00 H new ATOM 0 HG SER A 83 24.563 23.045 37.532 1.00 0.00 H new ATOM 1196 N ARG A 84 26.197 23.690 34.515 1.00 0.00 N ATOM 1197 CA ARG A 84 27.654 23.474 34.396 1.00 0.00 C ATOM 1198 C ARG A 84 28.354 24.810 34.369 1.00 0.00 C ATOM 1199 O ARG A 84 27.892 25.721 33.706 1.00 0.00 O ATOM 1200 CB ARG A 84 27.892 22.606 33.151 1.00 0.00 C ATOM 1201 CG ARG A 84 29.172 22.653 32.315 1.00 0.00 C ATOM 1202 CD ARG A 84 30.549 22.327 32.888 1.00 0.00 C ATOM 1203 NE ARG A 84 31.296 21.408 31.997 1.00 0.00 N ATOM 1204 CZ ARG A 84 32.566 21.463 31.630 1.00 0.00 C ATOM 1205 NH1 ARG A 84 33.374 22.429 31.942 1.00 0.00 N ATOM 1206 NH2 ARG A 84 33.096 20.503 30.934 1.00 0.00 N ATOM 0 H ARG A 84 25.838 24.346 33.822 1.00 0.00 H new ATOM 0 HA ARG A 84 28.073 22.941 35.250 1.00 0.00 H new ATOM 0 HB2 ARG A 84 27.775 21.571 33.473 1.00 0.00 H new ATOM 0 HB3 ARG A 84 27.072 22.822 32.466 1.00 0.00 H new ATOM 0 HG2 ARG A 84 29.018 21.976 31.474 1.00 0.00 H new ATOM 0 HG3 ARG A 84 29.238 23.661 31.905 1.00 0.00 H new ATOM 0 HD2 ARG A 84 31.117 23.248 33.024 1.00 0.00 H new ATOM 0 HD3 ARG A 84 30.438 21.873 33.873 1.00 0.00 H new ATOM 0 HE ARG A 84 30.759 20.629 31.616 1.00 0.00 H new ATOM 0 HH11 ARG A 84 33.040 23.211 32.505 1.00 0.00 H new ATOM 0 HH12 ARG A 84 34.343 22.406 31.624 1.00 0.00 H new ATOM 0 HH21 ARG A 84 32.532 19.697 30.665 1.00 0.00 H new ATOM 0 HH22 ARG A 84 34.076 20.555 30.656 1.00 0.00 H new ATOM 1220 N LEU A 85 29.462 24.917 35.087 1.00 0.00 N ATOM 1221 CA LEU A 85 30.074 26.204 35.406 1.00 0.00 C ATOM 1222 C LEU A 85 31.104 26.663 34.365 1.00 0.00 C ATOM 1223 O LEU A 85 31.746 25.843 33.705 1.00 0.00 O ATOM 1224 CB LEU A 85 30.596 26.086 36.845 1.00 0.00 C ATOM 1225 CG LEU A 85 31.286 27.324 37.422 1.00 0.00 C ATOM 1226 CD1 LEU A 85 30.351 28.518 37.578 1.00 0.00 C ATOM 1227 CD2 LEU A 85 31.809 26.967 38.802 1.00 0.00 C ATOM 0 H LEU A 85 29.965 24.115 35.467 1.00 0.00 H new ATOM 0 HA LEU A 85 29.346 27.014 35.356 1.00 0.00 H new ATOM 0 HB2 LEU A 85 29.758 25.829 37.493 1.00 0.00 H new ATOM 0 HB3 LEU A 85 31.298 25.253 36.887 1.00 0.00 H new ATOM 0 HG LEU A 85 32.075 27.610 36.727 1.00 0.00 H new ATOM 0 HD11 LEU A 85 30.904 29.361 37.992 1.00 0.00 H new ATOM 0 HD12 LEU A 85 29.946 28.792 36.604 1.00 0.00 H new ATOM 0 HD13 LEU A 85 29.534 28.255 38.250 1.00 0.00 H new ATOM 0 HD21 LEU A 85 32.307 27.833 39.238 1.00 0.00 H new ATOM 0 HD22 LEU A 85 30.978 26.667 39.440 1.00 0.00 H new ATOM 0 HD23 LEU A 85 32.519 26.144 38.720 1.00 0.00 H new ATOM 1239 N GLY A 86 31.255 27.986 34.243 1.00 0.00 N ATOM 1240 CA GLY A 86 32.152 28.645 33.302 1.00 0.00 C ATOM 1241 C GLY A 86 33.642 28.469 33.574 1.00 0.00 C ATOM 1242 O GLY A 86 34.410 28.396 32.622 1.00 0.00 O ATOM 0 H GLY A 86 30.735 28.647 34.820 1.00 0.00 H new ATOM 0 HA2 GLY A 86 31.938 28.270 32.301 1.00 0.00 H new ATOM 0 HA3 GLY A 86 31.926 29.711 33.299 1.00 0.00 H new ATOM 1246 N CYS A 87 34.030 28.396 34.847 1.00 0.00 N ATOM 1247 CA CYS A 87 35.328 28.865 35.339 1.00 0.00 C ATOM 1248 C CYS A 87 36.090 27.883 36.232 1.00 0.00 C ATOM 1249 O CYS A 87 37.317 27.791 36.172 1.00 0.00 O ATOM 1250 CB CYS A 87 34.955 30.062 36.193 1.00 0.00 C ATOM 1251 SG CYS A 87 33.366 29.901 37.044 1.00 0.00 S ATOM 0 H CYS A 87 33.441 28.002 35.580 1.00 0.00 H new ATOM 0 HA CYS A 87 35.990 29.045 34.492 1.00 0.00 H new ATOM 0 HB2 CYS A 87 35.737 30.222 36.935 1.00 0.00 H new ATOM 0 HB3 CYS A 87 34.928 30.950 35.562 1.00 0.00 H new ATOM 0 HG CYS A 87 33.140 30.971 37.747 1.00 0.00 H new ATOM 1256 N GLN A 88 35.365 27.164 37.087 1.00 0.00 N ATOM 1257 CA GLN A 88 35.928 26.187 38.029 1.00 0.00 C ATOM 1258 C GLN A 88 35.562 24.742 37.653 1.00 0.00 C ATOM 1259 O GLN A 88 35.638 23.849 38.491 1.00 0.00 O ATOM 1260 CB GLN A 88 35.574 26.586 39.473 1.00 0.00 C ATOM 1261 CG GLN A 88 36.216 27.919 39.890 1.00 0.00 C ATOM 1262 CD GLN A 88 37.698 27.763 40.205 1.00 0.00 C ATOM 1263 OE1 GLN A 88 38.558 27.837 39.339 1.00 0.00 O ATOM 1264 NE2 GLN A 88 38.053 27.513 41.446 1.00 0.00 N ATOM 0 H GLN A 88 34.350 27.243 37.149 1.00 0.00 H new ATOM 0 HA GLN A 88 37.016 26.207 37.962 1.00 0.00 H new ATOM 0 HB2 GLN A 88 34.491 26.662 39.570 1.00 0.00 H new ATOM 0 HB3 GLN A 88 35.901 25.800 40.154 1.00 0.00 H new ATOM 0 HG2 GLN A 88 36.090 28.648 39.090 1.00 0.00 H new ATOM 0 HG3 GLN A 88 35.699 28.313 40.765 1.00 0.00 H new ATOM 0 HE21 GLN A 88 37.344 27.449 42.176 1.00 0.00 H new ATOM 0 HE22 GLN A 88 39.038 27.383 41.678 1.00 0.00 H new ATOM 1273 N ILE A 89 35.165 24.521 36.393 1.00 0.00 N ATOM 1274 CA ILE A 89 35.191 23.222 35.714 1.00 0.00 C ATOM 1275 C ILE A 89 35.391 23.418 34.201 1.00 0.00 C ATOM 1276 O ILE A 89 34.875 24.363 33.601 1.00 0.00 O ATOM 1277 CB ILE A 89 33.973 22.354 36.092 1.00 0.00 C ATOM 1278 CG1 ILE A 89 34.389 20.884 35.855 1.00 0.00 C ATOM 1279 CG2 ILE A 89 32.639 22.798 35.450 1.00 0.00 C ATOM 1280 CD1 ILE A 89 33.556 20.082 34.876 1.00 0.00 C ATOM 0 H ILE A 89 34.805 25.268 35.799 1.00 0.00 H new ATOM 0 HA ILE A 89 36.051 22.650 36.063 1.00 0.00 H new ATOM 0 HB ILE A 89 33.720 22.484 37.144 1.00 0.00 H new ATOM 0 HG12 ILE A 89 35.422 20.876 35.507 1.00 0.00 H new ATOM 0 HG13 ILE A 89 34.373 20.368 36.815 1.00 0.00 H new ATOM 0 HG21 ILE A 89 31.840 22.130 35.772 1.00 0.00 H new ATOM 0 HG22 ILE A 89 32.407 23.817 35.760 1.00 0.00 H new ATOM 0 HG23 ILE A 89 32.727 22.760 34.364 1.00 0.00 H new ATOM 0 HD11 ILE A 89 33.955 19.070 34.803 1.00 0.00 H new ATOM 0 HD12 ILE A 89 32.524 20.041 35.224 1.00 0.00 H new ATOM 0 HD13 ILE A 89 33.589 20.557 33.895 1.00 0.00 H new ATOM 1292 N LYS A 90 36.171 22.529 33.582 1.00 0.00 N ATOM 1293 CA LYS A 90 36.945 22.775 32.346 1.00 0.00 C ATOM 1294 C LYS A 90 36.805 21.651 31.298 1.00 0.00 C ATOM 1295 O LYS A 90 35.835 20.896 31.363 1.00 0.00 O ATOM 1296 CB LYS A 90 38.409 23.058 32.766 1.00 0.00 C ATOM 1297 CG LYS A 90 39.002 22.186 33.884 1.00 0.00 C ATOM 1298 CD LYS A 90 39.017 20.711 33.494 1.00 0.00 C ATOM 1299 CE LYS A 90 39.925 19.907 34.425 1.00 0.00 C ATOM 1300 NZ LYS A 90 39.711 18.451 34.264 1.00 0.00 N ATOM 0 H LYS A 90 36.291 21.580 33.935 1.00 0.00 H new ATOM 0 HA LYS A 90 36.542 23.643 31.825 1.00 0.00 H new ATOM 0 HB2 LYS A 90 39.040 22.951 31.884 1.00 0.00 H new ATOM 0 HB3 LYS A 90 38.475 24.100 33.080 1.00 0.00 H new ATOM 0 HG2 LYS A 90 40.017 22.516 34.104 1.00 0.00 H new ATOM 0 HG3 LYS A 90 38.420 22.316 34.796 1.00 0.00 H new ATOM 0 HD2 LYS A 90 38.004 20.311 33.533 1.00 0.00 H new ATOM 0 HD3 LYS A 90 39.361 20.607 32.465 1.00 0.00 H new ATOM 0 HE2 LYS A 90 40.967 20.148 34.217 1.00 0.00 H new ATOM 0 HE3 LYS A 90 39.732 20.192 35.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 40.342 17.934 34.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 38.722 18.219 34.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 39.919 18.176 33.283 1.00 0.00 H new ATOM 1314 N MET A 91 37.689 21.595 30.297 1.00 0.00 N ATOM 1315 CA MET A 91 37.797 20.518 29.298 1.00 0.00 C ATOM 1316 C MET A 91 38.896 19.468 29.574 1.00 0.00 C ATOM 1317 O MET A 91 39.903 19.772 30.205 1.00 0.00 O ATOM 1318 CB MET A 91 38.017 21.161 27.923 1.00 0.00 C ATOM 1319 CG MET A 91 36.929 22.153 27.523 1.00 0.00 C ATOM 1320 SD MET A 91 35.233 21.703 27.987 1.00 0.00 S ATOM 1321 CE MET A 91 34.432 22.473 26.575 1.00 0.00 C ATOM 0 H MET A 91 38.381 22.330 30.151 1.00 0.00 H new ATOM 0 HA MET A 91 36.864 19.956 29.345 1.00 0.00 H new ATOM 0 HB2 MET A 91 38.980 21.673 27.922 1.00 0.00 H new ATOM 0 HB3 MET A 91 38.073 20.375 27.170 1.00 0.00 H new ATOM 0 HG2 MET A 91 37.163 23.119 27.971 1.00 0.00 H new ATOM 0 HG3 MET A 91 36.966 22.286 26.442 1.00 0.00 H new ATOM 0 HE1 MET A 91 33.350 22.402 26.687 1.00 0.00 H new ATOM 0 HE2 MET A 91 34.723 23.522 26.519 1.00 0.00 H new ATOM 0 HE3 MET A 91 34.736 21.963 25.661 1.00 0.00 H new ATOM 1331 N SER A 92 38.725 18.252 29.036 1.00 0.00 N ATOM 1332 CA SER A 92 39.635 17.083 29.099 1.00 0.00 C ATOM 1333 C SER A 92 39.297 16.058 27.998 1.00 0.00 C ATOM 1334 O SER A 92 38.298 16.211 27.302 1.00 0.00 O ATOM 1335 CB SER A 92 39.471 16.380 30.450 1.00 0.00 C ATOM 1336 OG SER A 92 38.125 15.947 30.586 1.00 0.00 O ATOM 0 H SER A 92 37.883 18.036 28.502 1.00 0.00 H new ATOM 0 HA SER A 92 40.654 17.446 28.963 1.00 0.00 H new ATOM 0 HB2 SER A 92 40.149 15.529 30.516 1.00 0.00 H new ATOM 0 HB3 SER A 92 39.732 17.059 31.262 1.00 0.00 H new ATOM 0 HG SER A 92 38.012 15.494 31.448 1.00 0.00 H new ATOM 1342 N LYS A 93 40.051 14.961 27.857 1.00 0.00 N ATOM 1343 CA LYS A 93 39.837 13.922 26.831 1.00 0.00 C ATOM 1344 C LYS A 93 38.454 13.251 26.849 1.00 0.00 C ATOM 1345 O LYS A 93 38.051 12.699 25.829 1.00 0.00 O ATOM 1346 CB LYS A 93 40.995 12.909 26.874 1.00 0.00 C ATOM 1347 CG LYS A 93 41.055 12.036 28.141 1.00 0.00 C ATOM 1348 CD LYS A 93 42.382 11.261 28.261 1.00 0.00 C ATOM 1349 CE LYS A 93 42.658 10.250 27.137 1.00 0.00 C ATOM 1350 NZ LYS A 93 41.869 9.004 27.288 1.00 0.00 N ATOM 0 H LYS A 93 40.846 14.763 28.465 1.00 0.00 H new ATOM 0 HA LYS A 93 39.840 14.434 25.869 1.00 0.00 H new ATOM 0 HB2 LYS A 93 40.917 12.255 26.005 1.00 0.00 H new ATOM 0 HB3 LYS A 93 41.935 13.452 26.781 1.00 0.00 H new ATOM 0 HG2 LYS A 93 40.926 12.668 29.020 1.00 0.00 H new ATOM 0 HG3 LYS A 93 40.225 11.330 28.131 1.00 0.00 H new ATOM 0 HD2 LYS A 93 43.201 11.979 28.290 1.00 0.00 H new ATOM 0 HD3 LYS A 93 42.389 10.731 29.213 1.00 0.00 H new ATOM 0 HE2 LYS A 93 42.427 10.708 26.176 1.00 0.00 H new ATOM 0 HE3 LYS A 93 43.720 10.005 27.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 42.091 8.356 26.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 42.107 8.550 28.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 40.854 9.231 27.272 1.00 0.00 H new ATOM 1364 N ASP A 94 37.709 13.351 27.954 1.00 0.00 N ATOM 1365 CA ASP A 94 36.327 12.853 28.060 1.00 0.00 C ATOM 1366 C ASP A 94 35.307 13.719 27.291 1.00 0.00 C ATOM 1367 O ASP A 94 34.240 13.232 26.920 1.00 0.00 O ATOM 1368 CB ASP A 94 35.883 12.766 29.535 1.00 0.00 C ATOM 1369 CG ASP A 94 36.366 11.521 30.286 1.00 0.00 C ATOM 1370 OD1 ASP A 94 36.002 10.384 29.897 1.00 0.00 O ATOM 1371 OD2 ASP A 94 37.049 11.680 31.325 1.00 0.00 O ATOM 0 H ASP A 94 38.049 13.785 28.812 1.00 0.00 H new ATOM 0 HA ASP A 94 36.339 11.862 27.606 1.00 0.00 H new ATOM 0 HB2 ASP A 94 36.244 13.651 30.060 1.00 0.00 H new ATOM 0 HB3 ASP A 94 34.794 12.795 29.573 1.00 0.00 H new ATOM 1376 N ILE A 95 35.611 14.995 27.035 1.00 0.00 N ATOM 1377 CA ILE A 95 34.673 15.996 26.492 1.00 0.00 C ATOM 1378 C ILE A 95 34.561 15.964 24.963 1.00 0.00 C ATOM 1379 O ILE A 95 34.135 16.951 24.379 1.00 0.00 O ATOM 1380 CB ILE A 95 35.025 17.420 26.985 1.00 0.00 C ATOM 1381 CG1 ILE A 95 36.262 18.010 26.266 1.00 0.00 C ATOM 1382 CG2 ILE A 95 35.165 17.465 28.517 1.00 0.00 C ATOM 1383 CD1 ILE A 95 36.008 19.253 25.411 1.00 0.00 C ATOM 0 H ILE A 95 36.542 15.376 27.203 1.00 0.00 H new ATOM 0 HA ILE A 95 33.691 15.722 26.878 1.00 0.00 H new ATOM 0 HB ILE A 95 34.188 18.064 26.717 1.00 0.00 H new ATOM 0 HG12 ILE A 95 37.012 18.257 27.018 1.00 0.00 H new ATOM 0 HG13 ILE A 95 36.691 17.236 25.629 1.00 0.00 H new ATOM 0 HG21 ILE A 95 35.413 18.479 28.830 1.00 0.00 H new ATOM 0 HG22 ILE A 95 34.224 17.162 28.977 1.00 0.00 H new ATOM 0 HG23 ILE A 95 35.957 16.785 28.830 1.00 0.00 H new ATOM 0 HD11 ILE A 95 36.943 19.579 24.956 1.00 0.00 H new ATOM 0 HD12 ILE A 95 35.287 19.015 24.629 1.00 0.00 H new ATOM 0 HD13 ILE A 95 35.612 20.052 26.039 1.00 0.00 H new ATOM 1395 N ASP A 96 35.007 14.899 24.303 1.00 0.00 N ATOM 1396 CA ASP A 96 35.304 14.825 22.865 1.00 0.00 C ATOM 1397 C ASP A 96 34.044 14.939 21.963 1.00 0.00 C ATOM 1398 O ASP A 96 33.603 13.993 21.304 1.00 0.00 O ATOM 1399 CB ASP A 96 36.166 13.569 22.666 1.00 0.00 C ATOM 1400 CG ASP A 96 36.558 13.270 21.218 1.00 0.00 C ATOM 1401 OD1 ASP A 96 36.912 14.231 20.496 1.00 0.00 O ATOM 1402 OD2 ASP A 96 36.575 12.077 20.827 1.00 0.00 O ATOM 0 H ASP A 96 35.182 14.013 24.778 1.00 0.00 H new ATOM 0 HA ASP A 96 35.870 15.694 22.529 1.00 0.00 H new ATOM 0 HB2 ASP A 96 37.076 13.675 23.257 1.00 0.00 H new ATOM 0 HB3 ASP A 96 35.625 12.710 23.064 1.00 0.00 H new ATOM 1407 N GLY A 97 33.487 16.155 21.926 1.00 0.00 N ATOM 1408 CA GLY A 97 32.186 16.521 21.330 1.00 0.00 C ATOM 1409 C GLY A 97 31.149 17.202 22.246 1.00 0.00 C ATOM 1410 O GLY A 97 29.989 17.314 21.844 1.00 0.00 O ATOM 0 H GLY A 97 33.957 16.963 22.335 1.00 0.00 H new ATOM 0 HA2 GLY A 97 32.377 17.185 20.487 1.00 0.00 H new ATOM 0 HA3 GLY A 97 31.734 15.615 20.926 1.00 0.00 H new ATOM 1414 N ILE A 98 31.532 17.651 23.447 1.00 0.00 N ATOM 1415 CA ILE A 98 30.668 18.208 24.507 1.00 0.00 C ATOM 1416 C ILE A 98 29.740 19.349 24.066 1.00 0.00 C ATOM 1417 O ILE A 98 30.147 20.258 23.346 1.00 0.00 O ATOM 1418 CB ILE A 98 31.549 18.626 25.711 1.00 0.00 C ATOM 1419 CG1 ILE A 98 30.783 19.000 26.999 1.00 0.00 C ATOM 1420 CG2 ILE A 98 32.569 19.721 25.359 1.00 0.00 C ATOM 1421 CD1 ILE A 98 30.584 20.496 27.292 1.00 0.00 C ATOM 0 H ILE A 98 32.513 17.636 23.727 1.00 0.00 H new ATOM 0 HA ILE A 98 29.980 17.412 24.792 1.00 0.00 H new ATOM 0 HB ILE A 98 32.087 17.707 25.942 1.00 0.00 H new ATOM 0 HG12 ILE A 98 29.800 18.531 26.955 1.00 0.00 H new ATOM 0 HG13 ILE A 98 31.309 18.558 27.845 1.00 0.00 H new ATOM 0 HG21 ILE A 98 33.155 19.970 26.244 1.00 0.00 H new ATOM 0 HG22 ILE A 98 33.233 19.361 24.573 1.00 0.00 H new ATOM 0 HG23 ILE A 98 32.043 20.610 25.010 1.00 0.00 H new ATOM 0 HD11 ILE A 98 30.032 20.614 28.225 1.00 0.00 H new ATOM 0 HD12 ILE A 98 31.556 20.982 27.382 1.00 0.00 H new ATOM 0 HD13 ILE A 98 30.023 20.955 26.478 1.00 0.00 H new ATOM 1433 N ARG A 99 28.507 19.355 24.589 1.00 0.00 N ATOM 1434 CA ARG A 99 27.579 20.498 24.519 1.00 0.00 C ATOM 1435 C ARG A 99 27.426 21.187 25.853 1.00 0.00 C ATOM 1436 O ARG A 99 27.364 20.543 26.903 1.00 0.00 O ATOM 1437 CB ARG A 99 26.147 20.037 24.171 1.00 0.00 C ATOM 1438 CG ARG A 99 25.281 21.005 23.350 1.00 0.00 C ATOM 1439 CD ARG A 99 23.789 20.711 23.603 1.00 0.00 C ATOM 1440 NE ARG A 99 23.318 21.238 24.905 1.00 0.00 N ATOM 1441 CZ ARG A 99 22.427 20.665 25.700 1.00 0.00 C ATOM 1442 NH1 ARG A 99 21.757 19.606 25.350 1.00 0.00 N ATOM 1443 NH2 ARG A 99 22.196 21.144 26.887 1.00 0.00 N ATOM 0 H ARG A 99 28.117 18.552 25.082 1.00 0.00 H new ATOM 0 HA ARG A 99 28.006 21.158 23.764 1.00 0.00 H new ATOM 0 HB2 ARG A 99 26.218 19.098 23.622 1.00 0.00 H new ATOM 0 HB3 ARG A 99 25.624 19.823 25.103 1.00 0.00 H new ATOM 0 HG2 ARG A 99 25.510 22.035 23.624 1.00 0.00 H new ATOM 0 HG3 ARG A 99 25.507 20.900 22.289 1.00 0.00 H new ATOM 0 HD2 ARG A 99 23.195 21.150 22.801 1.00 0.00 H new ATOM 0 HD3 ARG A 99 23.624 19.634 23.570 1.00 0.00 H new ATOM 0 HE ARG A 99 23.716 22.123 25.218 1.00 0.00 H new ATOM 0 HH11 ARG A 99 21.909 19.186 24.433 1.00 0.00 H new ATOM 0 HH12 ARG A 99 21.080 19.196 25.993 1.00 0.00 H new ATOM 0 HH21 ARG A 99 22.703 21.967 27.212 1.00 0.00 H new ATOM 0 HH22 ARG A 99 21.508 20.696 27.493 1.00 0.00 H new ATOM 1457 N VAL A 100 27.105 22.463 25.753 1.00 0.00 N ATOM 1458 CA VAL A 100 26.339 23.198 26.744 1.00 0.00 C ATOM 1459 C VAL A 100 25.264 24.057 26.083 1.00 0.00 C ATOM 1460 O VAL A 100 25.340 24.345 24.891 1.00 0.00 O ATOM 1461 CB VAL A 100 27.275 24.071 27.606 1.00 0.00 C ATOM 1462 CG1 VAL A 100 28.143 23.243 28.565 1.00 0.00 C ATOM 1463 CG2 VAL A 100 28.155 24.993 26.741 1.00 0.00 C ATOM 0 H VAL A 100 27.379 23.036 24.954 1.00 0.00 H new ATOM 0 HA VAL A 100 25.840 22.476 27.390 1.00 0.00 H new ATOM 0 HB VAL A 100 26.622 24.695 28.217 1.00 0.00 H new ATOM 0 HG11 VAL A 100 28.781 23.909 29.146 1.00 0.00 H new ATOM 0 HG12 VAL A 100 27.501 22.676 29.239 1.00 0.00 H new ATOM 0 HG13 VAL A 100 28.764 22.555 27.991 1.00 0.00 H new ATOM 0 HG21 VAL A 100 28.799 25.591 27.386 1.00 0.00 H new ATOM 0 HG22 VAL A 100 28.770 24.388 26.074 1.00 0.00 H new ATOM 0 HG23 VAL A 100 27.520 25.653 26.150 1.00 0.00 H new ATOM 1473 N ALA A 101 24.244 24.461 26.836 1.00 0.00 N ATOM 1474 CA ALA A 101 23.329 25.519 26.416 1.00 0.00 C ATOM 1475 C ALA A 101 23.561 26.758 27.294 1.00 0.00 C ATOM 1476 O ALA A 101 23.818 26.628 28.492 1.00 0.00 O ATOM 1477 CB ALA A 101 21.890 25.013 26.466 1.00 0.00 C ATOM 0 H ALA A 101 24.029 24.066 27.751 1.00 0.00 H new ATOM 0 HA ALA A 101 23.521 25.808 25.383 1.00 0.00 H new ATOM 0 HB1 ALA A 101 21.214 25.808 26.151 1.00 0.00 H new ATOM 0 HB2 ALA A 101 21.781 24.159 25.798 1.00 0.00 H new ATOM 0 HB3 ALA A 101 21.646 24.711 27.484 1.00 0.00 H new ATOM 1483 N LEU A 102 23.520 27.938 26.681 1.00 0.00 N ATOM 1484 CA LEU A 102 23.825 29.233 27.292 1.00 0.00 C ATOM 1485 C LEU A 102 22.553 29.986 27.772 1.00 0.00 C ATOM 1486 O LEU A 102 22.618 30.634 28.818 1.00 0.00 O ATOM 1487 CB LEU A 102 24.722 29.977 26.276 1.00 0.00 C ATOM 1488 CG LEU A 102 25.826 30.886 26.842 1.00 0.00 C ATOM 1489 CD1 LEU A 102 26.795 31.228 25.702 1.00 0.00 C ATOM 1490 CD2 LEU A 102 25.287 32.187 27.432 1.00 0.00 C ATOM 0 H LEU A 102 23.261 28.024 25.698 1.00 0.00 H new ATOM 0 HA LEU A 102 24.372 29.134 28.230 1.00 0.00 H new ATOM 0 HB2 LEU A 102 25.194 29.233 25.635 1.00 0.00 H new ATOM 0 HB3 LEU A 102 24.078 30.584 25.639 1.00 0.00 H new ATOM 0 HG LEU A 102 26.317 30.345 27.651 1.00 0.00 H new ATOM 0 HD11 LEU A 102 27.588 31.873 26.080 1.00 0.00 H new ATOM 0 HD12 LEU A 102 27.231 30.310 25.307 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.255 31.744 24.908 1.00 0.00 H new ATOM 0 HD21 LEU A 102 26.115 32.784 27.814 1.00 0.00 H new ATOM 0 HD22 LEU A 102 24.763 32.748 26.658 1.00 0.00 H new ATOM 0 HD23 LEU A 102 24.598 31.960 28.245 1.00 0.00 H new