USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 783 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 Single : A 1 HIS : no HD1:sc= -0.144 X(o=-0.14,f=-0.33) USER MOD Single : A 1 HIS N :NH3+ 175:sc= -0.205 (180deg=-0.244) USER MOD Single : A 2 MET CE :methyl -159:sc=-0.00164 (180deg=-0.593) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= -0.0249 K(o=-0.025,f=-0.7) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 51:sc= 0.396 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot -60:sc= 0.207 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot -123:sc= 0.674 USER MOD Single : A 72 SER OG : rot -43:sc= -0.835 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 GLN : amide:sc= -0.0744 X(o=-0.074,f=0) USER MOD Single : A 79 THR OG1 : rot -149:sc= -0.195 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot -49:sc= 0.968 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot -131:sc= 0.77 USER MOD Single : A 92 GLN : amide:sc= -0.278 K(o=-0.28,f=-2.7!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 95:sc= 1.04 USER MOD Single : A 102 GLN : amide:sc= -0.152 K(o=-0.15,f=-1.9!) USER MOD Single : A 108 GLN : amide:sc= -0.963 K(o=-0.96,f=-4.5!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 8.703 23.912 -30.953 1.00 0.00 N ATOM 2 CA HIS A 1 8.349 22.689 -31.733 1.00 0.00 C ATOM 3 C HIS A 1 6.986 22.152 -31.286 1.00 0.00 C ATOM 4 O HIS A 1 6.747 20.960 -31.289 1.00 0.00 O ATOM 5 CB HIS A 1 9.454 21.681 -31.412 1.00 0.00 C ATOM 6 CG HIS A 1 10.727 22.097 -32.095 1.00 0.00 C ATOM 7 ND1 HIS A 1 10.744 22.603 -33.384 1.00 0.00 N ATOM 8 CD2 HIS A 1 12.036 22.088 -31.679 1.00 0.00 C ATOM 9 CE1 HIS A 1 12.024 22.876 -33.696 1.00 0.00 C ATOM 10 NE2 HIS A 1 12.853 22.579 -32.692 1.00 0.00 N ATOM 0 H1 HIS A 1 9.665 24.218 -31.205 1.00 0.00 H new ATOM 0 H2 HIS A 1 8.029 24.672 -31.174 1.00 0.00 H new ATOM 0 H3 HIS A 1 8.663 23.699 -29.936 1.00 0.00 H new ATOM 0 HA HIS A 1 8.276 22.888 -32.802 1.00 0.00 H new ATOM 0 HB2 HIS A 1 9.608 21.626 -30.334 1.00 0.00 H new ATOM 0 HB3 HIS A 1 9.160 20.685 -31.743 1.00 0.00 H new ATOM 0 HD2 HIS A 1 12.379 21.751 -30.712 1.00 0.00 H new ATOM 0 HE1 HIS A 1 12.342 23.286 -34.643 1.00 0.00 H new ATOM 0 HE2 HIS A 1 13.867 22.689 -32.672 1.00 0.00 H new ATOM 18 N MET A 2 6.093 23.023 -30.898 1.00 0.00 N ATOM 19 CA MET A 2 4.745 22.564 -30.449 1.00 0.00 C ATOM 20 C MET A 2 3.800 23.761 -30.317 1.00 0.00 C ATOM 21 O MET A 2 4.108 24.859 -30.738 1.00 0.00 O ATOM 22 CB MET A 2 4.979 21.918 -29.079 1.00 0.00 C ATOM 23 CG MET A 2 4.650 20.425 -29.152 1.00 0.00 C ATOM 24 SD MET A 2 4.067 19.857 -27.535 1.00 0.00 S ATOM 25 CE MET A 2 5.527 20.345 -26.583 1.00 0.00 C ATOM 0 H MET A 2 6.238 24.032 -30.872 1.00 0.00 H new ATOM 0 HA MET A 2 4.290 21.870 -31.155 1.00 0.00 H new ATOM 0 HB2 MET A 2 6.016 22.058 -28.772 1.00 0.00 H new ATOM 0 HB3 MET A 2 4.356 22.402 -28.327 1.00 0.00 H new ATOM 0 HG2 MET A 2 3.887 20.246 -29.909 1.00 0.00 H new ATOM 0 HG3 MET A 2 5.534 19.861 -29.451 1.00 0.00 H new ATOM 0 HE1 MET A 2 5.562 19.777 -25.654 1.00 0.00 H new ATOM 0 HE2 MET A 2 6.426 20.143 -27.166 1.00 0.00 H new ATOM 0 HE3 MET A 2 5.474 21.410 -26.355 1.00 0.00 H new ATOM 35 N LEU A 3 2.656 23.556 -29.722 1.00 0.00 N ATOM 36 CA LEU A 3 1.693 24.679 -29.543 1.00 0.00 C ATOM 37 C LEU A 3 1.633 25.066 -28.064 1.00 0.00 C ATOM 38 O LEU A 3 0.673 25.649 -27.601 1.00 0.00 O ATOM 39 CB LEU A 3 0.345 24.127 -30.010 1.00 0.00 C ATOM 40 CG LEU A 3 0.337 24.020 -31.536 1.00 0.00 C ATOM 41 CD1 LEU A 3 -0.468 22.790 -31.958 1.00 0.00 C ATOM 42 CD2 LEU A 3 -0.302 25.276 -32.131 1.00 0.00 C ATOM 0 H LEU A 3 2.347 22.657 -29.352 1.00 0.00 H new ATOM 0 HA LEU A 3 1.977 25.570 -30.103 1.00 0.00 H new ATOM 0 HB2 LEU A 3 0.168 23.148 -29.565 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -0.462 24.779 -29.677 1.00 0.00 H new ATOM 0 HG LEU A 3 1.361 23.925 -31.899 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.473 22.714 -33.045 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -0.013 21.895 -31.534 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -1.492 22.883 -31.596 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -0.308 25.201 -33.218 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -1.325 25.370 -31.768 1.00 0.00 H new ATOM 0 HD23 LEU A 3 0.272 26.153 -31.831 1.00 0.00 H new ATOM 54 N GLY A 4 2.657 24.737 -27.322 1.00 0.00 N ATOM 55 CA GLY A 4 2.674 25.072 -25.873 1.00 0.00 C ATOM 56 C GLY A 4 3.623 26.246 -25.629 1.00 0.00 C ATOM 57 O GLY A 4 4.473 26.198 -24.760 1.00 0.00 O ATOM 0 H GLY A 4 3.485 24.248 -27.662 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.669 25.328 -25.537 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.994 24.206 -25.293 1.00 0.00 H new ATOM 61 N LEU A 5 3.487 27.300 -26.388 1.00 0.00 N ATOM 62 CA LEU A 5 4.382 28.479 -26.201 1.00 0.00 C ATOM 63 C LEU A 5 3.979 29.256 -24.943 1.00 0.00 C ATOM 64 O LEU A 5 3.588 30.405 -25.010 1.00 0.00 O ATOM 65 CB LEU A 5 4.177 29.338 -27.450 1.00 0.00 C ATOM 66 CG LEU A 5 4.593 28.544 -28.690 1.00 0.00 C ATOM 67 CD1 LEU A 5 4.250 29.343 -29.948 1.00 0.00 C ATOM 68 CD2 LEU A 5 6.101 28.287 -28.647 1.00 0.00 C ATOM 0 H LEU A 5 2.794 27.396 -27.130 1.00 0.00 H new ATOM 0 HA LEU A 5 5.425 28.188 -26.074 1.00 0.00 H new ATOM 0 HB2 LEU A 5 3.132 29.638 -27.531 1.00 0.00 H new ATOM 0 HB3 LEU A 5 4.766 30.252 -27.376 1.00 0.00 H new ATOM 0 HG LEU A 5 4.060 27.593 -28.707 1.00 0.00 H new ATOM 0 HD11 LEU A 5 4.547 28.777 -30.831 1.00 0.00 H new ATOM 0 HD12 LEU A 5 3.176 29.529 -29.980 1.00 0.00 H new ATOM 0 HD13 LEU A 5 4.782 30.294 -29.931 1.00 0.00 H new ATOM 0 HD21 LEU A 5 6.399 27.721 -29.530 1.00 0.00 H new ATOM 0 HD22 LEU A 5 6.632 29.239 -28.630 1.00 0.00 H new ATOM 0 HD23 LEU A 5 6.348 27.718 -27.751 1.00 0.00 H new ATOM 80 N GLY A 6 4.072 28.636 -23.796 1.00 0.00 N ATOM 81 CA GLY A 6 3.695 29.336 -22.536 1.00 0.00 C ATOM 82 C GLY A 6 4.125 28.492 -21.334 1.00 0.00 C ATOM 83 O GLY A 6 3.319 27.825 -20.714 1.00 0.00 O ATOM 0 H GLY A 6 4.393 27.675 -23.679 1.00 0.00 H new ATOM 0 HA2 GLY A 6 4.172 30.315 -22.495 1.00 0.00 H new ATOM 0 HA3 GLY A 6 2.618 29.504 -22.509 1.00 0.00 H new ATOM 87 N ALA A 7 5.387 28.517 -21.001 1.00 0.00 N ATOM 88 CA ALA A 7 5.869 27.715 -19.837 1.00 0.00 C ATOM 89 C ALA A 7 5.195 28.196 -18.549 1.00 0.00 C ATOM 90 O ALA A 7 4.348 27.525 -17.994 1.00 0.00 O ATOM 91 CB ALA A 7 7.378 27.966 -19.779 1.00 0.00 C ATOM 0 H ALA A 7 6.105 29.057 -21.483 1.00 0.00 H new ATOM 0 HA ALA A 7 5.636 26.655 -19.941 1.00 0.00 H new ATOM 0 HB1 ALA A 7 7.808 27.409 -18.946 1.00 0.00 H new ATOM 0 HB2 ALA A 7 7.838 27.637 -20.711 1.00 0.00 H new ATOM 0 HB3 ALA A 7 7.565 29.031 -19.638 1.00 0.00 H new ATOM 97 N SER A 8 5.566 29.355 -18.072 1.00 0.00 N ATOM 98 CA SER A 8 4.948 29.882 -16.821 1.00 0.00 C ATOM 99 C SER A 8 3.648 30.625 -17.144 1.00 0.00 C ATOM 100 O SER A 8 2.766 30.739 -16.314 1.00 0.00 O ATOM 101 CB SER A 8 5.984 30.843 -16.241 1.00 0.00 C ATOM 102 OG SER A 8 6.000 30.716 -14.824 1.00 0.00 O ATOM 0 H SER A 8 6.270 29.959 -18.495 1.00 0.00 H new ATOM 0 HA SER A 8 4.693 29.087 -16.121 1.00 0.00 H new ATOM 0 HB2 SER A 8 6.970 30.622 -16.649 1.00 0.00 H new ATOM 0 HB3 SER A 8 5.744 31.868 -16.523 1.00 0.00 H new ATOM 0 HG SER A 8 6.665 31.330 -14.448 1.00 0.00 H new ATOM 108 N ASP A 9 3.522 31.129 -18.343 1.00 0.00 N ATOM 109 CA ASP A 9 2.279 31.866 -18.720 1.00 0.00 C ATOM 110 C ASP A 9 1.065 30.937 -18.626 1.00 0.00 C ATOM 111 O ASP A 9 0.002 31.332 -18.185 1.00 0.00 O ATOM 112 CB ASP A 9 2.501 32.310 -20.166 1.00 0.00 C ATOM 113 CG ASP A 9 1.653 33.549 -20.456 1.00 0.00 C ATOM 114 OD1 ASP A 9 0.460 33.393 -20.658 1.00 0.00 O ATOM 115 OD2 ASP A 9 2.211 34.635 -20.470 1.00 0.00 O ATOM 0 H ASP A 9 4.226 31.062 -19.078 1.00 0.00 H new ATOM 0 HA ASP A 9 2.086 32.712 -18.060 1.00 0.00 H new ATOM 0 HB2 ASP A 9 3.555 32.531 -20.332 1.00 0.00 H new ATOM 0 HB3 ASP A 9 2.233 31.505 -20.850 1.00 0.00 H new ATOM 120 N PHE A 10 1.215 29.706 -19.037 1.00 0.00 N ATOM 121 CA PHE A 10 0.070 28.751 -18.974 1.00 0.00 C ATOM 122 C PHE A 10 0.153 27.909 -17.697 1.00 0.00 C ATOM 123 O PHE A 10 0.592 26.775 -17.718 1.00 0.00 O ATOM 124 CB PHE A 10 0.222 27.869 -20.214 1.00 0.00 C ATOM 125 CG PHE A 10 -1.133 27.638 -20.840 1.00 0.00 C ATOM 126 CD1 PHE A 10 -1.991 26.664 -20.313 1.00 0.00 C ATOM 127 CD2 PHE A 10 -1.532 28.397 -21.946 1.00 0.00 C ATOM 128 CE1 PHE A 10 -3.247 26.451 -20.893 1.00 0.00 C ATOM 129 CE2 PHE A 10 -2.788 28.183 -22.525 1.00 0.00 C ATOM 130 CZ PHE A 10 -3.646 27.210 -21.998 1.00 0.00 C ATOM 0 H PHE A 10 2.081 29.320 -19.414 1.00 0.00 H new ATOM 0 HA PHE A 10 -0.894 29.260 -18.954 1.00 0.00 H new ATOM 0 HB2 PHE A 10 0.889 28.346 -20.932 1.00 0.00 H new ATOM 0 HB3 PHE A 10 0.675 26.916 -19.942 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -1.684 26.078 -19.460 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -0.871 29.148 -22.353 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -3.908 25.700 -20.487 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -3.096 28.769 -23.379 1.00 0.00 H new ATOM 0 HZ PHE A 10 -4.616 27.046 -22.445 1.00 0.00 H new ATOM 140 N GLU A 11 -0.264 28.456 -16.586 1.00 0.00 N ATOM 141 CA GLU A 11 -0.209 27.690 -15.307 1.00 0.00 C ATOM 142 C GLU A 11 -1.487 26.864 -15.133 1.00 0.00 C ATOM 143 O GLU A 11 -2.377 27.228 -14.388 1.00 0.00 O ATOM 144 CB GLU A 11 -0.099 28.752 -14.211 1.00 0.00 C ATOM 145 CG GLU A 11 1.286 28.682 -13.564 1.00 0.00 C ATOM 146 CD GLU A 11 1.455 29.849 -12.590 1.00 0.00 C ATOM 147 OE1 GLU A 11 1.662 30.958 -13.055 1.00 0.00 O ATOM 148 OE2 GLU A 11 1.375 29.615 -11.395 1.00 0.00 O ATOM 0 H GLU A 11 -0.641 29.401 -16.509 1.00 0.00 H new ATOM 0 HA GLU A 11 0.627 26.991 -15.278 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -0.264 29.743 -14.633 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.871 28.593 -13.458 1.00 0.00 H new ATOM 0 HG2 GLU A 11 1.405 27.735 -13.037 1.00 0.00 H new ATOM 0 HG3 GLU A 11 2.060 28.720 -14.331 1.00 0.00 H new ATOM 155 N PHE A 12 -1.583 25.753 -15.813 1.00 0.00 N ATOM 156 CA PHE A 12 -2.801 24.899 -15.688 1.00 0.00 C ATOM 157 C PHE A 12 -2.450 23.438 -15.972 1.00 0.00 C ATOM 158 O PHE A 12 -2.761 22.553 -15.199 1.00 0.00 O ATOM 159 CB PHE A 12 -3.768 25.435 -16.744 1.00 0.00 C ATOM 160 CG PHE A 12 -4.420 26.698 -16.234 1.00 0.00 C ATOM 161 CD1 PHE A 12 -5.154 26.675 -15.042 1.00 0.00 C ATOM 162 CD2 PHE A 12 -4.288 27.893 -16.953 1.00 0.00 C ATOM 163 CE1 PHE A 12 -5.757 27.847 -14.570 1.00 0.00 C ATOM 164 CE2 PHE A 12 -4.891 29.064 -16.480 1.00 0.00 C ATOM 165 CZ PHE A 12 -5.626 29.041 -15.289 1.00 0.00 C ATOM 0 H PHE A 12 -0.870 25.399 -16.451 1.00 0.00 H new ATOM 0 HA PHE A 12 -3.231 24.933 -14.687 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.234 25.638 -17.672 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -4.528 24.687 -16.970 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -5.255 25.754 -14.487 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -3.721 27.911 -17.872 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -6.324 27.830 -13.651 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -4.789 29.985 -17.034 1.00 0.00 H new ATOM 0 HZ PHE A 12 -6.092 29.945 -14.925 1.00 0.00 H new ATOM 175 N GLY A 13 -1.801 23.178 -17.076 1.00 0.00 N ATOM 176 CA GLY A 13 -1.425 21.776 -17.412 1.00 0.00 C ATOM 177 C GLY A 13 0.096 21.631 -17.357 1.00 0.00 C ATOM 178 O GLY A 13 0.680 20.832 -18.064 1.00 0.00 O ATOM 0 H GLY A 13 -1.515 23.878 -17.760 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -1.893 21.084 -16.711 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -1.790 21.518 -18.406 1.00 0.00 H new ATOM 182 N VAL A 14 0.744 22.399 -16.521 1.00 0.00 N ATOM 183 CA VAL A 14 2.230 22.308 -16.417 1.00 0.00 C ATOM 184 C VAL A 14 2.653 22.139 -14.953 1.00 0.00 C ATOM 185 O VAL A 14 3.576 21.410 -14.647 1.00 0.00 O ATOM 186 CB VAL A 14 2.756 23.631 -16.983 1.00 0.00 C ATOM 187 CG1 VAL A 14 2.342 23.756 -18.450 1.00 0.00 C ATOM 188 CG2 VAL A 14 2.175 24.806 -16.191 1.00 0.00 C ATOM 0 H VAL A 14 0.308 23.086 -15.905 1.00 0.00 H new ATOM 0 HA VAL A 14 2.627 21.450 -16.960 1.00 0.00 H new ATOM 0 HB VAL A 14 3.843 23.647 -16.904 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.715 24.697 -18.855 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.760 22.925 -19.018 1.00 0.00 H new ATOM 0 HG13 VAL A 14 1.255 23.735 -18.524 1.00 0.00 H new ATOM 0 HG21 VAL A 14 2.554 25.743 -16.600 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.088 24.792 -16.264 1.00 0.00 H new ATOM 0 HG23 VAL A 14 2.470 24.721 -15.145 1.00 0.00 H new ATOM 198 N ASP A 15 1.985 22.805 -14.049 1.00 0.00 N ATOM 199 CA ASP A 15 2.351 22.679 -12.607 1.00 0.00 C ATOM 200 C ASP A 15 1.102 22.365 -11.770 1.00 0.00 C ATOM 201 O ASP A 15 0.032 22.870 -12.046 1.00 0.00 O ATOM 202 CB ASP A 15 2.926 24.044 -12.225 1.00 0.00 C ATOM 203 CG ASP A 15 4.367 24.149 -12.727 1.00 0.00 C ATOM 204 OD1 ASP A 15 4.633 23.655 -13.810 1.00 0.00 O ATOM 205 OD2 ASP A 15 5.179 24.722 -12.020 1.00 0.00 O ATOM 0 H ASP A 15 1.203 23.430 -14.246 1.00 0.00 H new ATOM 0 HA ASP A 15 3.063 21.873 -12.428 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.320 24.840 -12.658 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.896 24.173 -11.143 1.00 0.00 H new ATOM 210 N PRO A 16 1.278 21.536 -10.770 1.00 0.00 N ATOM 211 CA PRO A 16 0.143 21.156 -9.892 1.00 0.00 C ATOM 212 C PRO A 16 -0.283 22.338 -9.016 1.00 0.00 C ATOM 213 O PRO A 16 -1.351 22.336 -8.436 1.00 0.00 O ATOM 214 CB PRO A 16 0.708 20.020 -9.043 1.00 0.00 C ATOM 215 CG PRO A 16 2.187 20.240 -9.043 1.00 0.00 C ATOM 216 CD PRO A 16 2.531 20.884 -10.360 1.00 0.00 C ATOM 0 HA PRO A 16 -0.746 20.862 -10.449 1.00 0.00 H new ATOM 0 HB2 PRO A 16 0.305 20.045 -8.031 1.00 0.00 H new ATOM 0 HB3 PRO A 16 0.453 19.047 -9.464 1.00 0.00 H new ATOM 0 HG2 PRO A 16 2.483 20.879 -8.211 1.00 0.00 H new ATOM 0 HG3 PRO A 16 2.718 19.296 -8.924 1.00 0.00 H new ATOM 0 HD2 PRO A 16 3.341 21.606 -10.253 1.00 0.00 H new ATOM 0 HD3 PRO A 16 2.856 20.146 -11.093 1.00 0.00 H new ATOM 224 N SER A 17 0.540 23.349 -8.919 1.00 0.00 N ATOM 225 CA SER A 17 0.176 24.530 -8.082 1.00 0.00 C ATOM 226 C SER A 17 -1.067 25.221 -8.650 1.00 0.00 C ATOM 227 O SER A 17 -1.712 26.003 -7.979 1.00 0.00 O ATOM 228 CB SER A 17 1.386 25.460 -8.158 1.00 0.00 C ATOM 229 OG SER A 17 2.548 24.753 -7.743 1.00 0.00 O ATOM 0 H SER A 17 1.447 23.408 -9.382 1.00 0.00 H new ATOM 0 HA SER A 17 -0.058 24.249 -7.055 1.00 0.00 H new ATOM 0 HB2 SER A 17 1.514 25.827 -9.176 1.00 0.00 H new ATOM 0 HB3 SER A 17 1.230 26.332 -7.522 1.00 0.00 H new ATOM 0 HG SER A 17 3.327 25.346 -7.792 1.00 0.00 H new ATOM 235 N ALA A 18 -1.411 24.941 -9.882 1.00 0.00 N ATOM 236 CA ALA A 18 -2.615 25.585 -10.489 1.00 0.00 C ATOM 237 C ALA A 18 -3.860 25.275 -9.655 1.00 0.00 C ATOM 238 O ALA A 18 -4.724 26.113 -9.477 1.00 0.00 O ATOM 239 CB ALA A 18 -2.736 24.966 -11.883 1.00 0.00 C ATOM 0 H ALA A 18 -0.911 24.295 -10.493 1.00 0.00 H new ATOM 0 HA ALA A 18 -2.524 26.670 -10.531 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -3.600 25.389 -12.395 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.834 25.180 -12.456 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -2.860 23.887 -11.792 1.00 0.00 H new ATOM 245 N ASP A 19 -3.960 24.077 -9.141 1.00 0.00 N ATOM 246 CA ASP A 19 -5.148 23.711 -8.317 1.00 0.00 C ATOM 247 C ASP A 19 -4.912 22.369 -7.621 1.00 0.00 C ATOM 248 O ASP A 19 -4.692 21.365 -8.269 1.00 0.00 O ATOM 249 CB ASP A 19 -6.310 23.609 -9.309 1.00 0.00 C ATOM 250 CG ASP A 19 -7.218 24.832 -9.161 1.00 0.00 C ATOM 251 OD1 ASP A 19 -7.988 24.863 -8.214 1.00 0.00 O ATOM 252 OD2 ASP A 19 -7.129 25.716 -9.997 1.00 0.00 O ATOM 0 H ASP A 19 -3.269 23.336 -9.257 1.00 0.00 H new ATOM 0 HA ASP A 19 -5.349 24.443 -7.535 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -5.928 23.548 -10.328 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -6.878 22.697 -9.127 1.00 0.00 H new ATOM 257 N PRO A 20 -4.963 22.399 -6.316 1.00 0.00 N ATOM 258 CA PRO A 20 -4.748 21.169 -5.523 1.00 0.00 C ATOM 259 C PRO A 20 -5.976 20.260 -5.600 1.00 0.00 C ATOM 260 O PRO A 20 -5.865 19.049 -5.610 1.00 0.00 O ATOM 261 CB PRO A 20 -4.546 21.693 -4.107 1.00 0.00 C ATOM 262 CG PRO A 20 -5.251 23.009 -4.069 1.00 0.00 C ATOM 263 CD PRO A 20 -5.220 23.568 -5.464 1.00 0.00 C ATOM 0 HA PRO A 20 -3.908 20.570 -5.876 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -4.959 21.004 -3.370 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -3.487 21.808 -3.877 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -6.278 22.886 -3.726 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -4.761 23.688 -3.371 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -6.164 24.048 -5.721 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -4.439 24.320 -5.574 1.00 0.00 H new ATOM 271 N GLU A 21 -7.149 20.835 -5.657 1.00 0.00 N ATOM 272 CA GLU A 21 -8.388 20.005 -5.735 1.00 0.00 C ATOM 273 C GLU A 21 -8.374 19.157 -7.009 1.00 0.00 C ATOM 274 O GLU A 21 -8.786 18.013 -7.008 1.00 0.00 O ATOM 275 CB GLU A 21 -9.541 21.009 -5.770 1.00 0.00 C ATOM 276 CG GLU A 21 -10.873 20.256 -5.760 1.00 0.00 C ATOM 277 CD GLU A 21 -12.027 21.260 -5.753 1.00 0.00 C ATOM 278 OE1 GLU A 21 -11.934 22.247 -6.466 1.00 0.00 O ATOM 279 OE2 GLU A 21 -12.984 21.027 -5.033 1.00 0.00 O ATOM 0 H GLU A 21 -7.303 21.843 -5.653 1.00 0.00 H new ATOM 0 HA GLU A 21 -8.477 19.316 -4.895 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -9.482 21.677 -4.911 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.469 21.631 -6.662 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.944 19.610 -6.635 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -10.932 19.612 -4.883 1.00 0.00 H new ATOM 286 N LEU A 22 -7.903 19.710 -8.095 1.00 0.00 N ATOM 287 CA LEU A 22 -7.860 18.936 -9.371 1.00 0.00 C ATOM 288 C LEU A 22 -6.749 17.884 -9.310 1.00 0.00 C ATOM 289 O LEU A 22 -6.842 16.833 -9.913 1.00 0.00 O ATOM 290 CB LEU A 22 -7.561 19.970 -10.458 1.00 0.00 C ATOM 291 CG LEU A 22 -8.824 20.227 -11.282 1.00 0.00 C ATOM 292 CD1 LEU A 22 -9.872 20.921 -10.410 1.00 0.00 C ATOM 293 CD2 LEU A 22 -8.480 21.122 -12.474 1.00 0.00 C ATOM 0 H LEU A 22 -7.546 20.664 -8.154 1.00 0.00 H new ATOM 0 HA LEU A 22 -8.793 18.406 -9.563 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.215 20.899 -10.005 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.759 19.612 -11.104 1.00 0.00 H new ATOM 0 HG LEU A 22 -9.222 19.278 -11.641 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -10.771 21.104 -10.998 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -10.117 20.284 -9.560 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.475 21.870 -10.050 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -9.379 21.306 -13.062 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.082 22.070 -12.114 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.734 20.628 -13.097 1.00 0.00 H new ATOM 305 N ALA A 23 -5.700 18.159 -8.581 1.00 0.00 N ATOM 306 CA ALA A 23 -4.582 17.176 -8.476 1.00 0.00 C ATOM 307 C ALA A 23 -5.075 15.893 -7.802 1.00 0.00 C ATOM 308 O ALA A 23 -4.945 14.809 -8.337 1.00 0.00 O ATOM 309 CB ALA A 23 -3.523 17.864 -7.613 1.00 0.00 C ATOM 0 H ALA A 23 -5.569 19.022 -8.054 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.186 16.894 -9.452 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -2.667 17.201 -7.490 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.201 18.786 -8.098 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.945 18.096 -6.635 1.00 0.00 H new ATOM 315 N LEU A 24 -5.642 16.009 -6.631 1.00 0.00 N ATOM 316 CA LEU A 24 -6.147 14.798 -5.919 1.00 0.00 C ATOM 317 C LEU A 24 -7.282 14.154 -6.720 1.00 0.00 C ATOM 318 O LEU A 24 -7.430 12.948 -6.743 1.00 0.00 O ATOM 319 CB LEU A 24 -6.663 15.310 -4.574 1.00 0.00 C ATOM 320 CG LEU A 24 -7.089 14.124 -3.706 1.00 0.00 C ATOM 321 CD1 LEU A 24 -5.846 13.375 -3.220 1.00 0.00 C ATOM 322 CD2 LEU A 24 -7.880 14.635 -2.501 1.00 0.00 C ATOM 0 H LEU A 24 -5.778 16.890 -6.136 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.374 14.040 -5.793 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.886 15.884 -4.069 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -7.506 15.983 -4.728 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.713 13.449 -4.292 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.149 12.530 -2.602 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.281 13.012 -4.079 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.222 14.049 -2.633 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.184 13.792 -1.881 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -7.255 15.309 -1.915 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.765 15.169 -2.847 1.00 0.00 H new ATOM 334 N ALA A 25 -8.082 14.950 -7.379 1.00 0.00 N ATOM 335 CA ALA A 25 -9.208 14.386 -8.182 1.00 0.00 C ATOM 336 C ALA A 25 -8.669 13.422 -9.242 1.00 0.00 C ATOM 337 O ALA A 25 -9.137 12.308 -9.377 1.00 0.00 O ATOM 338 CB ALA A 25 -9.870 15.595 -8.845 1.00 0.00 C ATOM 0 H ALA A 25 -8.005 15.967 -7.396 1.00 0.00 H new ATOM 0 HA ALA A 25 -9.911 13.824 -7.568 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -10.710 15.261 -9.455 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.229 16.280 -8.077 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.144 16.107 -9.477 1.00 0.00 H new ATOM 344 N LEU A 26 -7.684 13.841 -9.990 1.00 0.00 N ATOM 345 CA LEU A 26 -7.107 12.949 -11.039 1.00 0.00 C ATOM 346 C LEU A 26 -6.491 11.708 -10.385 1.00 0.00 C ATOM 347 O LEU A 26 -6.403 10.656 -10.988 1.00 0.00 O ATOM 348 CB LEU A 26 -6.030 13.797 -11.729 1.00 0.00 C ATOM 349 CG LEU A 26 -5.649 13.191 -13.090 1.00 0.00 C ATOM 350 CD1 LEU A 26 -4.907 11.869 -12.881 1.00 0.00 C ATOM 351 CD2 LEU A 26 -6.908 12.945 -13.928 1.00 0.00 C ATOM 0 H LEU A 26 -7.253 14.763 -9.921 1.00 0.00 H new ATOM 0 HA LEU A 26 -7.855 12.594 -11.748 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.395 14.815 -11.868 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.147 13.859 -11.093 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.000 13.891 -13.617 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.640 11.445 -13.849 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.002 12.048 -12.301 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.550 11.172 -12.344 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -6.627 12.516 -14.890 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -7.567 12.255 -13.401 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -7.427 13.889 -14.090 1.00 0.00 H new ATOM 363 N ARG A 27 -6.075 11.820 -9.152 1.00 0.00 N ATOM 364 CA ARG A 27 -5.473 10.648 -8.457 1.00 0.00 C ATOM 365 C ARG A 27 -6.579 9.751 -7.903 1.00 0.00 C ATOM 366 O ARG A 27 -6.394 8.564 -7.716 1.00 0.00 O ATOM 367 CB ARG A 27 -4.639 11.242 -7.322 1.00 0.00 C ATOM 368 CG ARG A 27 -3.491 12.064 -7.909 1.00 0.00 C ATOM 369 CD ARG A 27 -2.827 12.882 -6.799 1.00 0.00 C ATOM 370 NE ARG A 27 -1.530 13.336 -7.378 1.00 0.00 N ATOM 371 CZ ARG A 27 -0.831 14.254 -6.768 1.00 0.00 C ATOM 372 NH1 ARG A 27 -0.303 14.003 -5.601 1.00 0.00 N ATOM 373 NH2 ARG A 27 -0.658 15.421 -7.325 1.00 0.00 N ATOM 0 H ARG A 27 -6.127 12.674 -8.596 1.00 0.00 H new ATOM 0 HA ARG A 27 -4.866 10.035 -9.123 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -5.264 11.871 -6.688 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -4.245 10.446 -6.691 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -2.760 11.405 -8.376 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -3.866 12.727 -8.689 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -3.448 13.730 -6.508 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -2.671 12.279 -5.904 1.00 0.00 H new ATOM 0 HE ARG A 27 -1.190 12.930 -8.249 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -0.437 13.090 -5.166 1.00 0.00 H new ATOM 0 HH12 ARG A 27 0.243 14.720 -5.124 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -1.069 15.616 -8.238 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -0.112 16.138 -6.848 1.00 0.00 H new ATOM 387 N VAL A 28 -7.732 10.310 -7.645 1.00 0.00 N ATOM 388 CA VAL A 28 -8.854 9.488 -7.109 1.00 0.00 C ATOM 389 C VAL A 28 -9.490 8.679 -8.241 1.00 0.00 C ATOM 390 O VAL A 28 -9.851 7.530 -8.071 1.00 0.00 O ATOM 391 CB VAL A 28 -9.852 10.496 -6.535 1.00 0.00 C ATOM 392 CG1 VAL A 28 -11.061 9.752 -5.963 1.00 0.00 C ATOM 393 CG2 VAL A 28 -9.179 11.304 -5.420 1.00 0.00 C ATOM 0 H VAL A 28 -7.944 11.298 -7.782 1.00 0.00 H new ATOM 0 HA VAL A 28 -8.525 8.776 -6.352 1.00 0.00 H new ATOM 0 HB VAL A 28 -10.181 11.169 -7.327 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -11.771 10.471 -5.555 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -11.542 9.177 -6.754 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -10.732 9.077 -5.172 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -9.890 12.022 -5.011 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -8.850 10.629 -4.630 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -8.318 11.836 -5.825 1.00 0.00 H new ATOM 403 N SER A 29 -9.626 9.271 -9.399 1.00 0.00 N ATOM 404 CA SER A 29 -10.234 8.539 -10.549 1.00 0.00 C ATOM 405 C SER A 29 -9.272 7.454 -11.043 1.00 0.00 C ATOM 406 O SER A 29 -9.670 6.341 -11.328 1.00 0.00 O ATOM 407 CB SER A 29 -10.448 9.598 -11.628 1.00 0.00 C ATOM 408 OG SER A 29 -11.645 10.314 -11.352 1.00 0.00 O ATOM 0 H SER A 29 -9.342 10.230 -9.598 1.00 0.00 H new ATOM 0 HA SER A 29 -11.167 8.043 -10.279 1.00 0.00 H new ATOM 0 HB2 SER A 29 -9.600 10.282 -11.656 1.00 0.00 H new ATOM 0 HB3 SER A 29 -10.510 9.127 -12.609 1.00 0.00 H new ATOM 0 HG SER A 29 -11.785 10.996 -12.042 1.00 0.00 H new ATOM 414 N MET A 30 -8.008 7.772 -11.145 1.00 0.00 N ATOM 415 CA MET A 30 -7.018 6.761 -11.617 1.00 0.00 C ATOM 416 C MET A 30 -6.967 5.583 -10.640 1.00 0.00 C ATOM 417 O MET A 30 -6.833 4.442 -11.036 1.00 0.00 O ATOM 418 CB MET A 30 -5.676 7.497 -11.643 1.00 0.00 C ATOM 419 CG MET A 30 -4.899 7.099 -12.899 1.00 0.00 C ATOM 420 SD MET A 30 -3.175 7.629 -12.735 1.00 0.00 S ATOM 421 CE MET A 30 -2.771 7.630 -14.500 1.00 0.00 C ATOM 0 H MET A 30 -7.619 8.688 -10.922 1.00 0.00 H new ATOM 0 HA MET A 30 -7.275 6.355 -12.595 1.00 0.00 H new ATOM 0 HB2 MET A 30 -5.840 8.575 -11.630 1.00 0.00 H new ATOM 0 HB3 MET A 30 -5.098 7.252 -10.752 1.00 0.00 H new ATOM 0 HG2 MET A 30 -4.947 6.020 -13.042 1.00 0.00 H new ATOM 0 HG3 MET A 30 -5.350 7.558 -13.779 1.00 0.00 H new ATOM 0 HE1 MET A 30 -1.733 7.933 -14.635 1.00 0.00 H new ATOM 0 HE2 MET A 30 -2.913 6.628 -14.906 1.00 0.00 H new ATOM 0 HE3 MET A 30 -3.424 8.329 -15.022 1.00 0.00 H new ATOM 431 N GLU A 31 -7.077 5.854 -9.367 1.00 0.00 N ATOM 432 CA GLU A 31 -7.041 4.752 -8.361 1.00 0.00 C ATOM 433 C GLU A 31 -8.236 3.818 -8.566 1.00 0.00 C ATOM 434 O GLU A 31 -8.125 2.614 -8.439 1.00 0.00 O ATOM 435 CB GLU A 31 -7.129 5.446 -6.998 1.00 0.00 C ATOM 436 CG GLU A 31 -5.993 4.955 -6.097 1.00 0.00 C ATOM 437 CD GLU A 31 -4.833 5.952 -6.148 1.00 0.00 C ATOM 438 OE1 GLU A 31 -4.921 6.969 -5.480 1.00 0.00 O ATOM 439 OE2 GLU A 31 -3.876 5.681 -6.854 1.00 0.00 O ATOM 0 H GLU A 31 -7.190 6.791 -8.980 1.00 0.00 H new ATOM 0 HA GLU A 31 -6.140 4.145 -8.446 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -7.065 6.527 -7.124 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -8.092 5.236 -6.533 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -6.348 4.847 -5.072 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -5.655 3.971 -6.423 1.00 0.00 H new ATOM 446 N GLU A 32 -9.378 4.365 -8.888 1.00 0.00 N ATOM 447 CA GLU A 32 -10.583 3.512 -9.107 1.00 0.00 C ATOM 448 C GLU A 32 -10.343 2.559 -10.280 1.00 0.00 C ATOM 449 O GLU A 32 -10.711 1.400 -10.237 1.00 0.00 O ATOM 450 CB GLU A 32 -11.713 4.492 -9.434 1.00 0.00 C ATOM 451 CG GLU A 32 -12.606 4.672 -8.206 1.00 0.00 C ATOM 452 CD GLU A 32 -13.868 5.441 -8.602 1.00 0.00 C ATOM 453 OE1 GLU A 32 -13.734 6.560 -9.070 1.00 0.00 O ATOM 454 OE2 GLU A 32 -14.947 4.898 -8.430 1.00 0.00 O ATOM 0 H GLU A 32 -9.529 5.367 -9.009 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.819 2.898 -8.238 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -11.298 5.453 -9.739 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -12.301 4.118 -10.272 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -12.874 3.700 -7.792 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -12.067 5.212 -7.427 1.00 0.00 H new ATOM 461 N GLN A 33 -9.723 3.036 -11.328 1.00 0.00 N ATOM 462 CA GLN A 33 -9.456 2.157 -12.504 1.00 0.00 C ATOM 463 C GLN A 33 -8.554 0.991 -12.092 1.00 0.00 C ATOM 464 O GLN A 33 -8.727 -0.127 -12.534 1.00 0.00 O ATOM 465 CB GLN A 33 -8.744 3.052 -13.521 1.00 0.00 C ATOM 466 CG GLN A 33 -9.726 3.461 -14.625 1.00 0.00 C ATOM 467 CD GLN A 33 -9.052 3.314 -15.991 1.00 0.00 C ATOM 468 OE1 GLN A 33 -9.560 2.640 -16.864 1.00 0.00 O ATOM 469 NE2 GLN A 33 -7.919 3.924 -16.216 1.00 0.00 N ATOM 0 H GLN A 33 -9.390 3.996 -11.420 1.00 0.00 H new ATOM 0 HA GLN A 33 -10.370 1.727 -12.914 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -8.349 3.939 -13.026 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -7.895 2.523 -13.954 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.619 2.838 -14.580 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.048 4.492 -14.476 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -7.491 4.491 -15.484 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -7.463 3.834 -17.124 1.00 0.00 H new ATOM 478 N ARG A 34 -7.594 1.244 -11.242 1.00 0.00 N ATOM 479 CA ARG A 34 -6.681 0.150 -10.796 1.00 0.00 C ATOM 480 C ARG A 34 -7.443 -0.828 -9.898 1.00 0.00 C ATOM 481 O ARG A 34 -7.208 -2.021 -9.923 1.00 0.00 O ATOM 482 CB ARG A 34 -5.566 0.847 -10.011 1.00 0.00 C ATOM 483 CG ARG A 34 -4.210 0.510 -10.637 1.00 0.00 C ATOM 484 CD ARG A 34 -4.026 1.315 -11.926 1.00 0.00 C ATOM 485 NE ARG A 34 -3.637 0.311 -12.956 1.00 0.00 N ATOM 486 CZ ARG A 34 -2.399 0.235 -13.359 1.00 0.00 C ATOM 487 NH1 ARG A 34 -1.889 1.194 -14.085 1.00 0.00 N ATOM 488 NH2 ARG A 34 -1.670 -0.797 -13.038 1.00 0.00 N ATOM 0 H ARG A 34 -7.402 2.160 -10.837 1.00 0.00 H new ATOM 0 HA ARG A 34 -6.283 -0.424 -11.633 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -5.723 1.926 -10.017 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -5.586 0.528 -8.969 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -3.407 0.738 -9.936 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -4.152 -0.557 -10.851 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -4.946 1.830 -12.204 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -3.257 2.078 -11.808 1.00 0.00 H new ATOM 0 HE ARG A 34 -4.339 -0.317 -13.346 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -2.459 2.002 -14.336 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -0.921 1.135 -14.400 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -2.068 -1.546 -12.471 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -0.702 -0.856 -13.354 1.00 0.00 H new ATOM 502 N GLN A 35 -8.357 -0.331 -9.107 1.00 0.00 N ATOM 503 CA GLN A 35 -9.139 -1.230 -8.208 1.00 0.00 C ATOM 504 C GLN A 35 -9.889 -2.275 -9.037 1.00 0.00 C ATOM 505 O GLN A 35 -10.015 -3.418 -8.645 1.00 0.00 O ATOM 506 CB GLN A 35 -10.124 -0.310 -7.483 1.00 0.00 C ATOM 507 CG GLN A 35 -9.598 0.002 -6.081 1.00 0.00 C ATOM 508 CD GLN A 35 -10.540 0.988 -5.389 1.00 0.00 C ATOM 509 OE1 GLN A 35 -11.708 0.706 -5.208 1.00 0.00 O ATOM 510 NE2 GLN A 35 -10.079 2.142 -4.992 1.00 0.00 N ATOM 0 H GLN A 35 -8.596 0.659 -9.045 1.00 0.00 H new ATOM 0 HA GLN A 35 -8.503 -1.773 -7.509 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.257 0.614 -8.046 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -11.102 -0.787 -7.418 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -9.522 -0.915 -5.497 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -8.595 0.424 -6.143 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -9.099 2.379 -5.144 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -10.699 2.807 -4.530 1.00 0.00 H new ATOM 519 N ARG A 36 -10.383 -1.890 -10.184 1.00 0.00 N ATOM 520 CA ARG A 36 -11.119 -2.860 -11.044 1.00 0.00 C ATOM 521 C ARG A 36 -10.136 -3.846 -11.679 1.00 0.00 C ATOM 522 O ARG A 36 -10.420 -5.020 -11.816 1.00 0.00 O ATOM 523 CB ARG A 36 -11.795 -2.007 -12.120 1.00 0.00 C ATOM 524 CG ARG A 36 -12.785 -1.038 -11.463 1.00 0.00 C ATOM 525 CD ARG A 36 -14.165 -1.202 -12.101 1.00 0.00 C ATOM 526 NE ARG A 36 -13.991 -0.758 -13.512 1.00 0.00 N ATOM 527 CZ ARG A 36 -14.943 -0.094 -14.109 1.00 0.00 C ATOM 528 NH1 ARG A 36 -15.232 1.119 -13.727 1.00 0.00 N ATOM 529 NH2 ARG A 36 -15.606 -0.644 -15.091 1.00 0.00 N ATOM 0 H ARG A 36 -10.308 -0.945 -10.562 1.00 0.00 H new ATOM 0 HA ARG A 36 -11.843 -3.448 -10.480 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -11.045 -1.451 -12.682 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -12.316 -2.647 -12.832 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -12.843 -1.233 -10.392 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -12.438 -0.012 -11.582 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -14.502 -2.237 -12.052 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -14.912 -0.598 -11.586 1.00 0.00 H new ATOM 0 HE ARG A 36 -13.128 -0.973 -14.012 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -14.714 1.550 -12.961 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -15.976 1.637 -14.194 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -15.380 -1.592 -15.391 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -16.350 -0.125 -15.558 1.00 0.00 H new ATOM 543 N GLN A 37 -8.979 -3.376 -12.064 1.00 0.00 N ATOM 544 CA GLN A 37 -7.971 -4.283 -12.688 1.00 0.00 C ATOM 545 C GLN A 37 -7.369 -5.214 -11.628 1.00 0.00 C ATOM 546 O GLN A 37 -6.815 -6.246 -11.942 1.00 0.00 O ATOM 547 CB GLN A 37 -6.898 -3.355 -13.258 1.00 0.00 C ATOM 548 CG GLN A 37 -7.296 -2.923 -14.671 1.00 0.00 C ATOM 549 CD GLN A 37 -6.040 -2.771 -15.532 1.00 0.00 C ATOM 550 OE1 GLN A 37 -4.974 -2.483 -15.025 1.00 0.00 O ATOM 551 NE2 GLN A 37 -6.121 -2.955 -16.821 1.00 0.00 N ATOM 0 H GLN A 37 -8.688 -2.403 -11.973 1.00 0.00 H new ATOM 0 HA GLN A 37 -8.409 -4.918 -13.458 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -6.781 -2.480 -12.618 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -5.935 -3.865 -13.280 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -7.966 -3.661 -15.113 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.841 -1.980 -14.634 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -7.016 -3.197 -17.246 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -5.289 -2.857 -17.403 1.00 0.00 H new ATOM 560 N GLU A 38 -7.484 -4.858 -10.376 1.00 0.00 N ATOM 561 CA GLU A 38 -6.931 -5.719 -9.292 1.00 0.00 C ATOM 562 C GLU A 38 -7.937 -6.814 -8.945 1.00 0.00 C ATOM 563 O GLU A 38 -7.633 -7.988 -9.007 1.00 0.00 O ATOM 564 CB GLU A 38 -6.723 -4.781 -8.100 1.00 0.00 C ATOM 565 CG GLU A 38 -6.098 -5.559 -6.940 1.00 0.00 C ATOM 566 CD GLU A 38 -4.579 -5.368 -6.956 1.00 0.00 C ATOM 567 OE1 GLU A 38 -4.025 -5.281 -8.040 1.00 0.00 O ATOM 568 OE2 GLU A 38 -3.997 -5.313 -5.885 1.00 0.00 O ATOM 0 H GLU A 38 -7.940 -4.003 -10.057 1.00 0.00 H new ATOM 0 HA GLU A 38 -6.002 -6.211 -9.582 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.076 -3.951 -8.385 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -7.676 -4.351 -7.792 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.509 -5.212 -5.992 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -6.343 -6.618 -7.025 1.00 0.00 H new ATOM 575 N GLU A 39 -9.141 -6.440 -8.595 1.00 0.00 N ATOM 576 CA GLU A 39 -10.172 -7.466 -8.264 1.00 0.00 C ATOM 577 C GLU A 39 -10.287 -8.453 -9.427 1.00 0.00 C ATOM 578 O GLU A 39 -10.553 -9.625 -9.243 1.00 0.00 O ATOM 579 CB GLU A 39 -11.476 -6.685 -8.086 1.00 0.00 C ATOM 580 CG GLU A 39 -11.362 -5.774 -6.863 1.00 0.00 C ATOM 581 CD GLU A 39 -12.759 -5.320 -6.432 1.00 0.00 C ATOM 582 OE1 GLU A 39 -13.610 -6.176 -6.256 1.00 0.00 O ATOM 583 OE2 GLU A 39 -12.952 -4.125 -6.286 1.00 0.00 O ATOM 0 H GLU A 39 -9.453 -5.471 -8.525 1.00 0.00 H new ATOM 0 HA GLU A 39 -9.928 -8.038 -7.369 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -11.681 -6.092 -8.977 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -12.311 -7.374 -7.963 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -10.872 -6.304 -6.046 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -10.743 -4.908 -7.098 1.00 0.00 H new ATOM 590 N GLU A 40 -10.067 -7.980 -10.625 1.00 0.00 N ATOM 591 CA GLU A 40 -10.138 -8.874 -11.811 1.00 0.00 C ATOM 592 C GLU A 40 -8.796 -9.584 -11.996 1.00 0.00 C ATOM 593 O GLU A 40 -8.741 -10.732 -12.389 1.00 0.00 O ATOM 594 CB GLU A 40 -10.427 -7.948 -12.993 1.00 0.00 C ATOM 595 CG GLU A 40 -11.365 -8.651 -13.976 1.00 0.00 C ATOM 596 CD GLU A 40 -12.806 -8.209 -13.712 1.00 0.00 C ATOM 597 OE1 GLU A 40 -13.024 -7.017 -13.571 1.00 0.00 O ATOM 598 OE2 GLU A 40 -13.669 -9.071 -13.655 1.00 0.00 O ATOM 0 H GLU A 40 -9.840 -7.007 -10.831 1.00 0.00 H new ATOM 0 HA GLU A 40 -10.902 -9.645 -11.711 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -10.881 -7.022 -12.640 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -9.497 -7.677 -13.492 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -11.082 -8.411 -15.001 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -11.279 -9.732 -13.867 1.00 0.00 H new ATOM 605 N ALA A 41 -7.710 -8.910 -11.707 1.00 0.00 N ATOM 606 CA ALA A 41 -6.373 -9.559 -11.861 1.00 0.00 C ATOM 607 C ALA A 41 -6.194 -10.645 -10.796 1.00 0.00 C ATOM 608 O ALA A 41 -5.926 -11.790 -11.101 1.00 0.00 O ATOM 609 CB ALA A 41 -5.351 -8.440 -11.658 1.00 0.00 C ATOM 0 H ALA A 41 -7.692 -7.946 -11.374 1.00 0.00 H new ATOM 0 HA ALA A 41 -6.259 -10.037 -12.834 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -4.344 -8.845 -11.757 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.506 -7.665 -12.409 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -5.473 -8.012 -10.663 1.00 0.00 H new ATOM 615 N ARG A 42 -6.344 -10.287 -9.549 1.00 0.00 N ATOM 616 CA ARG A 42 -6.187 -11.292 -8.455 1.00 0.00 C ATOM 617 C ARG A 42 -7.201 -12.425 -8.632 1.00 0.00 C ATOM 618 O ARG A 42 -6.918 -13.572 -8.347 1.00 0.00 O ATOM 619 CB ARG A 42 -6.466 -10.522 -7.161 1.00 0.00 C ATOM 620 CG ARG A 42 -5.495 -9.343 -7.044 1.00 0.00 C ATOM 621 CD ARG A 42 -5.467 -8.842 -5.598 1.00 0.00 C ATOM 622 NE ARG A 42 -6.868 -8.432 -5.299 1.00 0.00 N ATOM 623 CZ ARG A 42 -7.177 -7.978 -4.115 1.00 0.00 C ATOM 624 NH1 ARG A 42 -6.554 -6.938 -3.633 1.00 0.00 N ATOM 625 NH2 ARG A 42 -8.107 -8.564 -3.412 1.00 0.00 N ATOM 0 H ARG A 42 -6.569 -9.342 -9.239 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.196 -11.746 -8.452 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -7.494 -10.161 -7.156 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -6.356 -11.183 -6.302 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -4.496 -9.650 -7.352 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -5.802 -8.538 -7.712 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -5.132 -9.624 -4.917 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -4.779 -8.004 -5.485 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.586 -8.506 -6.020 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -5.826 -6.480 -4.181 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -6.795 -6.583 -2.708 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -8.594 -9.378 -3.788 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.347 -8.208 -2.487 1.00 0.00 H new ATOM 639 N ARG A 43 -8.379 -12.112 -9.105 1.00 0.00 N ATOM 640 CA ARG A 43 -9.411 -13.171 -9.306 1.00 0.00 C ATOM 641 C ARG A 43 -8.883 -14.248 -10.258 1.00 0.00 C ATOM 642 O ARG A 43 -8.977 -15.429 -9.989 1.00 0.00 O ATOM 643 CB ARG A 43 -10.609 -12.449 -9.927 1.00 0.00 C ATOM 644 CG ARG A 43 -11.632 -12.124 -8.837 1.00 0.00 C ATOM 645 CD ARG A 43 -12.849 -11.442 -9.466 1.00 0.00 C ATOM 646 NE ARG A 43 -13.595 -10.852 -8.320 1.00 0.00 N ATOM 647 CZ ARG A 43 -14.744 -11.354 -7.961 1.00 0.00 C ATOM 648 NH1 ARG A 43 -14.797 -12.544 -7.426 1.00 0.00 N ATOM 649 NH2 ARG A 43 -15.840 -10.668 -8.135 1.00 0.00 N ATOM 0 H ARG A 43 -8.671 -11.169 -9.361 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.676 -13.670 -8.374 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.280 -11.532 -10.417 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -11.066 -13.074 -10.694 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -11.937 -13.037 -8.326 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -11.185 -11.473 -8.086 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -12.547 -10.674 -10.178 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -13.464 -12.157 -10.011 1.00 0.00 H new ATOM 0 HE ARG A 43 -13.207 -10.055 -7.816 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -13.940 -13.080 -7.289 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -15.695 -12.937 -7.145 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -15.799 -9.738 -8.552 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -16.738 -11.062 -7.854 1.00 0.00 H new ATOM 663 N ALA A 44 -8.324 -13.845 -11.369 1.00 0.00 N ATOM 664 CA ALA A 44 -7.784 -14.842 -12.339 1.00 0.00 C ATOM 665 C ALA A 44 -6.441 -15.382 -11.841 1.00 0.00 C ATOM 666 O ALA A 44 -6.071 -16.506 -12.121 1.00 0.00 O ATOM 667 CB ALA A 44 -7.599 -14.067 -13.643 1.00 0.00 C ATOM 0 H ALA A 44 -8.218 -12.869 -11.646 1.00 0.00 H new ATOM 0 HA ALA A 44 -8.447 -15.698 -12.466 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.203 -14.733 -14.409 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.560 -13.669 -13.969 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -6.902 -13.245 -13.482 1.00 0.00 H new ATOM 673 N ALA A 45 -5.710 -14.590 -11.102 1.00 0.00 N ATOM 674 CA ALA A 45 -4.391 -15.056 -10.582 1.00 0.00 C ATOM 675 C ALA A 45 -4.596 -16.162 -9.544 1.00 0.00 C ATOM 676 O ALA A 45 -3.778 -17.048 -9.398 1.00 0.00 O ATOM 677 CB ALA A 45 -3.760 -13.823 -9.934 1.00 0.00 C ATOM 0 H ALA A 45 -5.969 -13.640 -10.836 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.759 -15.469 -11.368 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -2.784 -14.086 -9.526 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -3.642 -13.039 -10.682 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -4.404 -13.464 -9.131 1.00 0.00 H new ATOM 683 N ALA A 46 -5.686 -16.116 -8.825 1.00 0.00 N ATOM 684 CA ALA A 46 -5.949 -17.164 -7.796 1.00 0.00 C ATOM 685 C ALA A 46 -6.514 -18.423 -8.460 1.00 0.00 C ATOM 686 O ALA A 46 -6.193 -19.533 -8.083 1.00 0.00 O ATOM 687 CB ALA A 46 -6.980 -16.545 -6.853 1.00 0.00 C ATOM 0 H ALA A 46 -6.406 -15.398 -8.906 1.00 0.00 H new ATOM 0 HA ALA A 46 -5.043 -17.462 -7.268 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -7.226 -17.257 -6.065 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -6.568 -15.639 -6.408 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -7.882 -16.296 -7.413 1.00 0.00 H new ATOM 693 N ALA A 47 -7.354 -18.256 -9.448 1.00 0.00 N ATOM 694 CA ALA A 47 -7.940 -19.442 -10.139 1.00 0.00 C ATOM 695 C ALA A 47 -6.855 -20.189 -10.919 1.00 0.00 C ATOM 696 O ALA A 47 -6.927 -21.387 -11.109 1.00 0.00 O ATOM 697 CB ALA A 47 -8.989 -18.869 -11.094 1.00 0.00 C ATOM 0 H ALA A 47 -7.659 -17.351 -9.806 1.00 0.00 H new ATOM 0 HA ALA A 47 -8.375 -20.154 -9.438 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -9.466 -19.682 -11.641 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -9.742 -18.325 -10.524 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -8.508 -18.191 -11.799 1.00 0.00 H new ATOM 703 N SER A 48 -5.849 -19.487 -11.373 1.00 0.00 N ATOM 704 CA SER A 48 -4.757 -20.153 -12.141 1.00 0.00 C ATOM 705 C SER A 48 -3.684 -20.682 -11.185 1.00 0.00 C ATOM 706 O SER A 48 -3.114 -21.734 -11.398 1.00 0.00 O ATOM 707 CB SER A 48 -4.184 -19.061 -13.043 1.00 0.00 C ATOM 708 OG SER A 48 -4.017 -19.576 -14.357 1.00 0.00 O ATOM 0 H SER A 48 -5.737 -18.481 -11.245 1.00 0.00 H new ATOM 0 HA SER A 48 -5.117 -21.007 -12.715 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.852 -18.200 -13.060 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.227 -18.715 -12.652 1.00 0.00 H new ATOM 0 HG SER A 48 -3.651 -18.877 -14.938 1.00 0.00 H new ATOM 714 N ALA A 49 -3.405 -19.958 -10.134 1.00 0.00 N ATOM 715 CA ALA A 49 -2.369 -20.417 -9.163 1.00 0.00 C ATOM 716 C ALA A 49 -2.787 -21.747 -8.531 1.00 0.00 C ATOM 717 O ALA A 49 -1.960 -22.518 -8.081 1.00 0.00 O ATOM 718 CB ALA A 49 -2.300 -19.317 -8.102 1.00 0.00 C ATOM 0 H ALA A 49 -3.849 -19.069 -9.906 1.00 0.00 H new ATOM 0 HA ALA A 49 -1.403 -20.582 -9.640 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -1.557 -19.583 -7.350 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -2.019 -18.375 -8.572 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.275 -19.208 -7.627 1.00 0.00 H new ATOM 724 N ALA A 50 -4.064 -22.023 -8.494 1.00 0.00 N ATOM 725 CA ALA A 50 -4.537 -23.304 -7.892 1.00 0.00 C ATOM 726 C ALA A 50 -5.007 -24.266 -8.988 1.00 0.00 C ATOM 727 O ALA A 50 -5.709 -25.223 -8.725 1.00 0.00 O ATOM 728 CB ALA A 50 -5.706 -22.908 -6.990 1.00 0.00 C ATOM 0 H ALA A 50 -4.800 -21.416 -8.855 1.00 0.00 H new ATOM 0 HA ALA A 50 -3.749 -23.815 -7.340 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.111 -23.798 -6.508 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.358 -22.210 -6.229 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -6.483 -22.434 -7.589 1.00 0.00 H new ATOM 734 N GLU A 51 -4.625 -24.020 -10.215 1.00 0.00 N ATOM 735 CA GLU A 51 -5.048 -24.924 -11.325 1.00 0.00 C ATOM 736 C GLU A 51 -3.939 -25.931 -11.631 1.00 0.00 C ATOM 737 O GLU A 51 -4.195 -27.046 -12.043 1.00 0.00 O ATOM 738 CB GLU A 51 -5.283 -23.998 -12.523 1.00 0.00 C ATOM 739 CG GLU A 51 -6.732 -24.131 -12.998 1.00 0.00 C ATOM 740 CD GLU A 51 -6.817 -23.774 -14.483 1.00 0.00 C ATOM 741 OE1 GLU A 51 -6.540 -24.641 -15.297 1.00 0.00 O ATOM 742 OE2 GLU A 51 -7.160 -22.642 -14.782 1.00 0.00 O ATOM 0 H GLU A 51 -4.039 -23.233 -10.495 1.00 0.00 H new ATOM 0 HA GLU A 51 -5.940 -25.499 -11.076 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.075 -22.965 -12.244 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.599 -24.253 -13.333 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -7.087 -25.149 -12.837 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.378 -23.473 -12.417 1.00 0.00 H new ATOM 749 N ALA A 52 -2.706 -25.546 -11.430 1.00 0.00 N ATOM 750 CA ALA A 52 -1.576 -26.478 -11.706 1.00 0.00 C ATOM 751 C ALA A 52 -0.469 -26.295 -10.661 1.00 0.00 C ATOM 752 O ALA A 52 0.660 -26.698 -10.865 1.00 0.00 O ATOM 753 CB ALA A 52 -1.071 -26.087 -13.094 1.00 0.00 C ATOM 0 H ALA A 52 -2.434 -24.625 -11.086 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.883 -27.523 -11.662 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -0.235 -26.729 -13.371 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.875 -26.204 -13.820 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.742 -25.048 -13.082 1.00 0.00 H new ATOM 759 N GLY A 53 -0.782 -25.690 -9.543 1.00 0.00 N ATOM 760 CA GLY A 53 0.255 -25.484 -8.491 1.00 0.00 C ATOM 761 C GLY A 53 -0.065 -26.359 -7.278 1.00 0.00 C ATOM 762 O GLY A 53 0.791 -27.042 -6.752 1.00 0.00 O ATOM 0 H GLY A 53 -1.709 -25.331 -9.315 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.241 -25.735 -8.883 1.00 0.00 H new ATOM 0 HA3 GLY A 53 0.286 -24.435 -8.197 1.00 0.00 H new ATOM 766 N ILE A 54 -1.292 -26.341 -6.828 1.00 0.00 N ATOM 767 CA ILE A 54 -1.670 -27.169 -5.645 1.00 0.00 C ATOM 768 C ILE A 54 -3.140 -27.615 -5.762 1.00 0.00 C ATOM 769 O ILE A 54 -3.533 -28.185 -6.761 1.00 0.00 O ATOM 770 CB ILE A 54 -1.448 -26.251 -4.436 1.00 0.00 C ATOM 771 CG1 ILE A 54 -2.255 -24.961 -4.611 1.00 0.00 C ATOM 772 CG2 ILE A 54 0.038 -25.907 -4.325 1.00 0.00 C ATOM 773 CD1 ILE A 54 -2.513 -24.330 -3.242 1.00 0.00 C ATOM 0 H ILE A 54 -2.050 -25.788 -7.229 1.00 0.00 H new ATOM 0 HA ILE A 54 -1.082 -28.083 -5.560 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.775 -26.762 -3.531 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -1.711 -24.263 -5.248 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -3.201 -25.176 -5.108 1.00 0.00 H new ATOM 0 HG21 ILE A 54 0.197 -25.255 -3.466 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.615 -26.823 -4.197 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.362 -25.398 -5.233 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -3.087 -23.412 -3.367 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -3.074 -25.027 -2.620 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -1.562 -24.100 -2.762 1.00 0.00 H new ATOM 785 N ALA A 55 -3.953 -27.367 -4.757 1.00 0.00 N ATOM 786 CA ALA A 55 -5.392 -27.780 -4.818 1.00 0.00 C ATOM 787 C ALA A 55 -5.510 -29.309 -4.805 1.00 0.00 C ATOM 788 O ALA A 55 -5.959 -29.894 -3.839 1.00 0.00 O ATOM 789 CB ALA A 55 -5.939 -27.203 -6.128 1.00 0.00 C ATOM 0 H ALA A 55 -3.678 -26.895 -3.896 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.953 -27.412 -3.959 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.990 -27.471 -6.232 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.840 -26.118 -6.117 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.376 -27.610 -6.968 1.00 0.00 H new ATOM 795 N THR A 56 -5.113 -29.957 -5.867 1.00 0.00 N ATOM 796 CA THR A 56 -5.205 -31.447 -5.910 1.00 0.00 C ATOM 797 C THR A 56 -4.238 -32.066 -4.896 1.00 0.00 C ATOM 798 O THR A 56 -3.162 -32.513 -5.244 1.00 0.00 O ATOM 799 CB THR A 56 -4.804 -31.831 -7.336 1.00 0.00 C ATOM 800 OG1 THR A 56 -3.553 -31.234 -7.650 1.00 0.00 O ATOM 801 CG2 THR A 56 -5.867 -31.340 -8.318 1.00 0.00 C ATOM 0 H THR A 56 -4.730 -29.521 -6.706 1.00 0.00 H new ATOM 0 HA THR A 56 -6.203 -31.805 -5.658 1.00 0.00 H new ATOM 0 HB THR A 56 -4.719 -32.915 -7.411 1.00 0.00 H new ATOM 0 HG1 THR A 56 -2.908 -31.434 -6.940 1.00 0.00 H new ATOM 0 HG21 THR A 56 -5.579 -31.615 -9.333 1.00 0.00 H new ATOM 0 HG22 THR A 56 -6.826 -31.799 -8.076 1.00 0.00 H new ATOM 0 HG23 THR A 56 -5.955 -30.256 -8.247 1.00 0.00 H new ATOM 809 N THR A 57 -4.612 -32.095 -3.644 1.00 0.00 N ATOM 810 CA THR A 57 -3.716 -32.682 -2.607 1.00 0.00 C ATOM 811 C THR A 57 -4.538 -33.460 -1.576 1.00 0.00 C ATOM 812 O THR A 57 -5.747 -33.545 -1.668 1.00 0.00 O ATOM 813 CB THR A 57 -3.029 -31.483 -1.951 1.00 0.00 C ATOM 814 OG1 THR A 57 -4.000 -30.489 -1.653 1.00 0.00 O ATOM 815 CG2 THR A 57 -1.982 -30.907 -2.905 1.00 0.00 C ATOM 0 H THR A 57 -5.501 -31.737 -3.295 1.00 0.00 H new ATOM 0 HA THR A 57 -2.996 -33.382 -3.032 1.00 0.00 H new ATOM 0 HB THR A 57 -2.540 -31.802 -1.030 1.00 0.00 H new ATOM 0 HG1 THR A 57 -3.562 -29.720 -1.231 1.00 0.00 H new ATOM 0 HG21 THR A 57 -1.493 -30.053 -2.436 1.00 0.00 H new ATOM 0 HG22 THR A 57 -1.238 -31.670 -3.133 1.00 0.00 H new ATOM 0 HG23 THR A 57 -2.467 -30.587 -3.827 1.00 0.00 H new ATOM 823 N GLY A 58 -3.889 -34.031 -0.595 1.00 0.00 N ATOM 824 CA GLY A 58 -4.630 -34.804 0.444 1.00 0.00 C ATOM 825 C GLY A 58 -4.129 -34.406 1.834 1.00 0.00 C ATOM 826 O GLY A 58 -3.951 -35.238 2.701 1.00 0.00 O ATOM 0 H GLY A 58 -2.877 -33.995 -0.469 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -5.699 -34.610 0.362 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -4.487 -35.873 0.287 1.00 0.00 H new ATOM 830 N THR A 59 -3.898 -33.138 2.050 1.00 0.00 N ATOM 831 CA THR A 59 -3.408 -32.683 3.385 1.00 0.00 C ATOM 832 C THR A 59 -4.588 -32.412 4.322 1.00 0.00 C ATOM 833 O THR A 59 -4.826 -31.291 4.729 1.00 0.00 O ATOM 834 CB THR A 59 -2.631 -31.391 3.106 1.00 0.00 C ATOM 835 OG1 THR A 59 -2.113 -30.882 4.327 1.00 0.00 O ATOM 836 CG2 THR A 59 -3.558 -30.351 2.471 1.00 0.00 C ATOM 0 H THR A 59 -4.027 -32.398 1.360 1.00 0.00 H new ATOM 0 HA THR A 59 -2.786 -33.434 3.872 1.00 0.00 H new ATOM 0 HB THR A 59 -1.812 -31.605 2.419 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.852 -30.687 4.940 1.00 0.00 H new ATOM 0 HG21 THR A 59 -2.999 -29.436 2.276 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.954 -30.741 1.533 1.00 0.00 H new ATOM 0 HG23 THR A 59 -4.382 -30.135 3.151 1.00 0.00 H new ATOM 844 N GLU A 60 -5.330 -33.432 4.668 1.00 0.00 N ATOM 845 CA GLU A 60 -6.495 -33.233 5.579 1.00 0.00 C ATOM 846 C GLU A 60 -6.180 -33.794 6.969 1.00 0.00 C ATOM 847 O GLU A 60 -6.997 -34.451 7.583 1.00 0.00 O ATOM 848 CB GLU A 60 -7.642 -34.012 4.932 1.00 0.00 C ATOM 849 CG GLU A 60 -8.922 -33.177 4.987 1.00 0.00 C ATOM 850 CD GLU A 60 -10.022 -33.874 4.185 1.00 0.00 C ATOM 851 OE1 GLU A 60 -9.719 -34.385 3.119 1.00 0.00 O ATOM 852 OE2 GLU A 60 -11.151 -33.887 4.650 1.00 0.00 O ATOM 0 H GLU A 60 -5.179 -34.392 4.359 1.00 0.00 H new ATOM 0 HA GLU A 60 -6.742 -32.180 5.710 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -7.395 -34.251 3.897 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.791 -34.959 5.451 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -9.239 -33.046 6.022 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.737 -32.182 4.582 1.00 0.00 H new ATOM 859 N ASP A 61 -5.001 -33.537 7.468 1.00 0.00 N ATOM 860 CA ASP A 61 -4.631 -34.052 8.819 1.00 0.00 C ATOM 861 C ASP A 61 -4.979 -33.017 9.892 1.00 0.00 C ATOM 862 O ASP A 61 -5.334 -33.357 11.004 1.00 0.00 O ATOM 863 CB ASP A 61 -3.120 -34.275 8.759 1.00 0.00 C ATOM 864 CG ASP A 61 -2.743 -35.464 9.645 1.00 0.00 C ATOM 865 OD1 ASP A 61 -3.459 -36.451 9.615 1.00 0.00 O ATOM 866 OD2 ASP A 61 -1.746 -35.368 10.341 1.00 0.00 O ATOM 0 H ASP A 61 -4.277 -32.992 6.999 1.00 0.00 H new ATOM 0 HA ASP A 61 -5.167 -34.966 9.073 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -2.810 -34.462 7.731 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -2.596 -33.379 9.092 1.00 0.00 H new ATOM 871 N SER A 62 -4.880 -31.756 9.566 1.00 0.00 N ATOM 872 CA SER A 62 -5.205 -30.697 10.565 1.00 0.00 C ATOM 873 C SER A 62 -6.393 -29.860 10.080 1.00 0.00 C ATOM 874 O SER A 62 -6.226 -28.828 9.461 1.00 0.00 O ATOM 875 CB SER A 62 -3.945 -29.838 10.655 1.00 0.00 C ATOM 876 OG SER A 62 -2.839 -30.661 11.000 1.00 0.00 O ATOM 0 H SER A 62 -4.588 -31.413 8.651 1.00 0.00 H new ATOM 0 HA SER A 62 -5.484 -31.113 11.533 1.00 0.00 H new ATOM 0 HB2 SER A 62 -3.760 -29.342 9.702 1.00 0.00 H new ATOM 0 HB3 SER A 62 -4.077 -29.055 11.402 1.00 0.00 H new ATOM 0 HG SER A 62 -2.029 -30.113 11.057 1.00 0.00 H new ATOM 882 N ASP A 63 -7.591 -30.300 10.359 1.00 0.00 N ATOM 883 CA ASP A 63 -8.793 -29.532 9.915 1.00 0.00 C ATOM 884 C ASP A 63 -8.768 -28.120 10.506 1.00 0.00 C ATOM 885 O ASP A 63 -9.247 -27.175 9.905 1.00 0.00 O ATOM 886 CB ASP A 63 -9.989 -30.318 10.454 1.00 0.00 C ATOM 887 CG ASP A 63 -10.387 -31.399 9.446 1.00 0.00 C ATOM 888 OD1 ASP A 63 -10.514 -31.073 8.278 1.00 0.00 O ATOM 889 OD2 ASP A 63 -10.555 -32.534 9.861 1.00 0.00 O ATOM 0 H ASP A 63 -7.790 -31.157 10.875 1.00 0.00 H new ATOM 0 HA ASP A 63 -8.834 -29.421 8.831 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -9.736 -30.774 11.411 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -10.828 -29.646 10.633 1.00 0.00 H new ATOM 894 N ASP A 64 -8.205 -27.965 11.675 1.00 0.00 N ATOM 895 CA ASP A 64 -8.144 -26.612 12.293 1.00 0.00 C ATOM 896 C ASP A 64 -7.057 -25.795 11.607 1.00 0.00 C ATOM 897 O ASP A 64 -7.135 -24.586 11.531 1.00 0.00 O ATOM 898 CB ASP A 64 -7.799 -26.842 13.762 1.00 0.00 C ATOM 899 CG ASP A 64 -8.855 -27.745 14.404 1.00 0.00 C ATOM 900 OD1 ASP A 64 -10.028 -27.509 14.171 1.00 0.00 O ATOM 901 OD2 ASP A 64 -8.471 -28.656 15.118 1.00 0.00 O ATOM 0 H ASP A 64 -7.787 -28.715 12.225 1.00 0.00 H new ATOM 0 HA ASP A 64 -9.082 -26.066 12.192 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -6.814 -27.301 13.847 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -7.753 -25.889 14.288 1.00 0.00 H new ATOM 906 N ALA A 65 -6.047 -26.447 11.093 1.00 0.00 N ATOM 907 CA ALA A 65 -4.969 -25.696 10.397 1.00 0.00 C ATOM 908 C ALA A 65 -5.564 -25.001 9.178 1.00 0.00 C ATOM 909 O ALA A 65 -5.264 -23.861 8.889 1.00 0.00 O ATOM 910 CB ALA A 65 -3.939 -26.738 9.972 1.00 0.00 C ATOM 0 H ALA A 65 -5.925 -27.459 11.126 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.512 -24.936 11.031 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -3.117 -26.246 9.452 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -3.555 -27.251 10.854 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -4.408 -27.462 9.306 1.00 0.00 H new ATOM 916 N LEU A 66 -6.429 -25.678 8.472 1.00 0.00 N ATOM 917 CA LEU A 66 -7.073 -25.050 7.288 1.00 0.00 C ATOM 918 C LEU A 66 -7.971 -23.911 7.772 1.00 0.00 C ATOM 919 O LEU A 66 -8.154 -22.918 7.098 1.00 0.00 O ATOM 920 CB LEU A 66 -7.905 -26.159 6.640 1.00 0.00 C ATOM 921 CG LEU A 66 -7.196 -26.668 5.379 1.00 0.00 C ATOM 922 CD1 LEU A 66 -6.829 -28.144 5.555 1.00 0.00 C ATOM 923 CD2 LEU A 66 -8.127 -26.519 4.172 1.00 0.00 C ATOM 0 H LEU A 66 -6.716 -26.638 8.665 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.356 -24.637 6.579 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -8.048 -26.978 7.344 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -8.895 -25.782 6.385 1.00 0.00 H new ATOM 0 HG LEU A 66 -6.290 -26.084 5.216 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.325 -28.503 4.658 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.165 -28.254 6.412 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.735 -28.727 5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -7.622 -26.881 3.276 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.034 -27.101 4.338 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.389 -25.469 4.042 1.00 0.00 H new ATOM 935 N LEU A 67 -8.519 -24.051 8.952 1.00 0.00 N ATOM 936 CA LEU A 67 -9.395 -22.979 9.507 1.00 0.00 C ATOM 937 C LEU A 67 -8.539 -21.792 9.963 1.00 0.00 C ATOM 938 O LEU A 67 -8.873 -20.645 9.734 1.00 0.00 O ATOM 939 CB LEU A 67 -10.097 -23.624 10.704 1.00 0.00 C ATOM 940 CG LEU A 67 -11.171 -22.675 11.238 1.00 0.00 C ATOM 941 CD1 LEU A 67 -12.328 -23.488 11.820 1.00 0.00 C ATOM 942 CD2 LEU A 67 -10.570 -21.789 12.332 1.00 0.00 C ATOM 0 H LEU A 67 -8.396 -24.864 9.555 1.00 0.00 H new ATOM 0 HA LEU A 67 -10.107 -22.600 8.774 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -10.548 -24.571 10.408 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.372 -23.848 11.487 1.00 0.00 H new ATOM 0 HG LEU A 67 -11.540 -22.050 10.425 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -13.093 -22.811 12.200 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -12.757 -24.120 11.042 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -11.960 -24.114 12.633 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -11.335 -21.112 12.713 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -10.201 -22.414 13.145 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -9.746 -21.208 11.918 1.00 0.00 H new ATOM 954 N LYS A 68 -7.433 -22.065 10.604 1.00 0.00 N ATOM 955 CA LYS A 68 -6.546 -20.964 11.079 1.00 0.00 C ATOM 956 C LYS A 68 -5.737 -20.398 9.911 1.00 0.00 C ATOM 957 O LYS A 68 -5.730 -19.209 9.672 1.00 0.00 O ATOM 958 CB LYS A 68 -5.621 -21.613 12.110 1.00 0.00 C ATOM 959 CG LYS A 68 -5.356 -20.627 13.249 1.00 0.00 C ATOM 960 CD LYS A 68 -6.607 -20.507 14.121 1.00 0.00 C ATOM 961 CE LYS A 68 -6.658 -21.676 15.108 1.00 0.00 C ATOM 962 NZ LYS A 68 -6.080 -21.137 16.370 1.00 0.00 N ATOM 0 H LYS A 68 -7.105 -23.007 10.819 1.00 0.00 H new ATOM 0 HA LYS A 68 -7.110 -20.135 11.506 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -6.076 -22.523 12.501 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.681 -21.903 11.640 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.512 -20.967 13.850 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -5.087 -19.651 12.844 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.596 -19.561 14.662 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.500 -20.506 13.496 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -7.681 -22.022 15.258 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -6.084 -22.527 14.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.080 -21.880 17.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -5.104 -20.821 16.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -6.651 -20.332 16.698 1.00 0.00 H new ATOM 976 N MET A 69 -5.051 -21.242 9.183 1.00 0.00 N ATOM 977 CA MET A 69 -4.239 -20.749 8.026 1.00 0.00 C ATOM 978 C MET A 69 -5.081 -19.832 7.128 1.00 0.00 C ATOM 979 O MET A 69 -4.598 -18.841 6.614 1.00 0.00 O ATOM 980 CB MET A 69 -3.828 -22.011 7.266 1.00 0.00 C ATOM 981 CG MET A 69 -2.837 -21.641 6.160 1.00 0.00 C ATOM 982 SD MET A 69 -1.853 -23.094 5.721 1.00 0.00 S ATOM 983 CE MET A 69 -1.561 -22.657 3.989 1.00 0.00 C ATOM 0 H MET A 69 -5.017 -22.250 9.338 1.00 0.00 H new ATOM 0 HA MET A 69 -3.377 -20.165 8.350 1.00 0.00 H new ATOM 0 HB2 MET A 69 -3.375 -22.729 7.950 1.00 0.00 H new ATOM 0 HB3 MET A 69 -4.707 -22.492 6.836 1.00 0.00 H new ATOM 0 HG2 MET A 69 -3.373 -21.274 5.285 1.00 0.00 H new ATOM 0 HG3 MET A 69 -2.185 -20.835 6.496 1.00 0.00 H new ATOM 0 HE1 MET A 69 -0.960 -23.433 3.514 1.00 0.00 H new ATOM 0 HE2 MET A 69 -2.515 -22.569 3.470 1.00 0.00 H new ATOM 0 HE3 MET A 69 -1.031 -21.706 3.938 1.00 0.00 H new ATOM 993 N THR A 70 -6.333 -20.155 6.939 1.00 0.00 N ATOM 994 CA THR A 70 -7.203 -19.302 6.074 1.00 0.00 C ATOM 995 C THR A 70 -7.503 -17.968 6.763 1.00 0.00 C ATOM 996 O THR A 70 -7.479 -16.923 6.143 1.00 0.00 O ATOM 997 CB THR A 70 -8.491 -20.104 5.883 1.00 0.00 C ATOM 998 OG1 THR A 70 -8.934 -20.593 7.141 1.00 0.00 O ATOM 999 CG2 THR A 70 -8.229 -21.276 4.938 1.00 0.00 C ATOM 0 H THR A 70 -6.791 -20.971 7.345 1.00 0.00 H new ATOM 0 HA THR A 70 -6.724 -19.067 5.124 1.00 0.00 H new ATOM 0 HB THR A 70 -9.260 -19.461 5.454 1.00 0.00 H new ATOM 0 HG1 THR A 70 -9.015 -21.569 7.103 1.00 0.00 H new ATOM 0 HG21 THR A 70 -9.148 -21.847 4.803 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.892 -20.897 3.973 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.460 -21.921 5.363 1.00 0.00 H new ATOM 1007 N ILE A 71 -7.786 -17.993 8.038 1.00 0.00 N ATOM 1008 CA ILE A 71 -8.086 -16.722 8.754 1.00 0.00 C ATOM 1009 C ILE A 71 -6.786 -16.028 9.179 1.00 0.00 C ATOM 1010 O ILE A 71 -6.787 -14.877 9.565 1.00 0.00 O ATOM 1011 CB ILE A 71 -8.931 -17.138 9.966 1.00 0.00 C ATOM 1012 CG1 ILE A 71 -9.855 -15.983 10.349 1.00 0.00 C ATOM 1013 CG2 ILE A 71 -8.031 -17.488 11.158 1.00 0.00 C ATOM 1014 CD1 ILE A 71 -10.930 -15.814 9.273 1.00 0.00 C ATOM 0 H ILE A 71 -7.822 -18.836 8.612 1.00 0.00 H new ATOM 0 HA ILE A 71 -8.618 -16.005 8.129 1.00 0.00 H new ATOM 0 HB ILE A 71 -9.518 -18.018 9.704 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -10.320 -16.180 11.315 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -9.281 -15.062 10.453 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -8.649 -17.780 12.007 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -7.373 -18.314 10.887 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -7.431 -16.619 11.428 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -11.590 -14.990 9.545 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -10.456 -15.598 8.316 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -11.511 -16.733 9.191 1.00 0.00 H new ATOM 1026 N SER A 72 -5.680 -16.720 9.109 1.00 0.00 N ATOM 1027 CA SER A 72 -4.385 -16.098 9.506 1.00 0.00 C ATOM 1028 C SER A 72 -3.893 -15.169 8.395 1.00 0.00 C ATOM 1029 O SER A 72 -3.506 -14.042 8.639 1.00 0.00 O ATOM 1030 CB SER A 72 -3.422 -17.269 9.695 1.00 0.00 C ATOM 1031 OG SER A 72 -3.145 -17.858 8.432 1.00 0.00 O ATOM 0 H SER A 72 -5.618 -17.688 8.794 1.00 0.00 H new ATOM 0 HA SER A 72 -4.472 -15.497 10.411 1.00 0.00 H new ATOM 0 HB2 SER A 72 -2.498 -16.924 10.159 1.00 0.00 H new ATOM 0 HB3 SER A 72 -3.858 -18.009 10.366 1.00 0.00 H new ATOM 0 HG SER A 72 -3.976 -17.936 7.918 1.00 0.00 H new ATOM 1037 N GLN A 73 -3.912 -15.634 7.174 1.00 0.00 N ATOM 1038 CA GLN A 73 -3.450 -14.778 6.041 1.00 0.00 C ATOM 1039 C GLN A 73 -4.547 -13.782 5.654 1.00 0.00 C ATOM 1040 O GLN A 73 -4.279 -12.737 5.093 1.00 0.00 O ATOM 1041 CB GLN A 73 -3.181 -15.753 4.893 1.00 0.00 C ATOM 1042 CG GLN A 73 -1.763 -16.321 5.021 1.00 0.00 C ATOM 1043 CD GLN A 73 -0.951 -15.966 3.773 1.00 0.00 C ATOM 1044 OE1 GLN A 73 -1.192 -16.496 2.706 1.00 0.00 O ATOM 1045 NE2 GLN A 73 0.007 -15.085 3.862 1.00 0.00 N ATOM 0 H GLN A 73 -4.227 -16.568 6.912 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.565 -14.195 6.295 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -3.911 -16.562 4.912 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -3.294 -15.244 3.936 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -1.278 -15.917 5.910 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -1.804 -17.403 5.144 1.00 0.00 H new ATOM 0 HE21 GLN A 73 0.209 -14.640 4.757 1.00 0.00 H new ATOM 0 HE22 GLN A 73 0.554 -14.841 3.036 1.00 0.00 H new ATOM 1054 N GLN A 74 -5.781 -14.097 5.952 1.00 0.00 N ATOM 1055 CA GLN A 74 -6.896 -13.170 5.603 1.00 0.00 C ATOM 1056 C GLN A 74 -7.052 -12.097 6.684 1.00 0.00 C ATOM 1057 O GLN A 74 -7.143 -10.920 6.393 1.00 0.00 O ATOM 1058 CB GLN A 74 -8.141 -14.056 5.545 1.00 0.00 C ATOM 1059 CG GLN A 74 -9.341 -13.222 5.093 1.00 0.00 C ATOM 1060 CD GLN A 74 -10.473 -14.154 4.654 1.00 0.00 C ATOM 1061 OE1 GLN A 74 -11.551 -14.126 5.214 1.00 0.00 O ATOM 1062 NE2 GLN A 74 -10.272 -14.985 3.668 1.00 0.00 N ATOM 0 H GLN A 74 -6.064 -14.957 6.422 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.720 -12.648 4.662 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.979 -14.884 4.854 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -8.336 -14.492 6.525 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -9.679 -12.580 5.907 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -9.054 -12.568 4.270 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -9.367 -15.009 3.198 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -11.020 -15.611 3.368 1.00 0.00 H new ATOM 1071 N GLU A 75 -7.085 -12.493 7.928 1.00 0.00 N ATOM 1072 CA GLU A 75 -7.235 -11.494 9.029 1.00 0.00 C ATOM 1073 C GLU A 75 -6.050 -10.526 9.028 1.00 0.00 C ATOM 1074 O GLU A 75 -6.213 -9.331 9.180 1.00 0.00 O ATOM 1075 CB GLU A 75 -7.254 -12.317 10.318 1.00 0.00 C ATOM 1076 CG GLU A 75 -7.566 -11.401 11.504 1.00 0.00 C ATOM 1077 CD GLU A 75 -9.081 -11.254 11.651 1.00 0.00 C ATOM 1078 OE1 GLU A 75 -9.776 -12.232 11.429 1.00 0.00 O ATOM 1079 OE2 GLU A 75 -9.521 -10.166 11.985 1.00 0.00 O ATOM 0 H GLU A 75 -7.015 -13.464 8.231 1.00 0.00 H new ATOM 0 HA GLU A 75 -8.138 -10.893 8.919 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.003 -13.106 10.247 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -6.290 -12.805 10.465 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.140 -11.814 12.418 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.108 -10.423 11.352 1.00 0.00 H new ATOM 1086 N PHE A 76 -4.859 -11.034 8.858 1.00 0.00 N ATOM 1087 CA PHE A 76 -3.660 -10.145 8.847 1.00 0.00 C ATOM 1088 C PHE A 76 -3.280 -9.789 7.407 1.00 0.00 C ATOM 1089 O PHE A 76 -2.464 -10.446 6.790 1.00 0.00 O ATOM 1090 CB PHE A 76 -2.552 -10.967 9.507 1.00 0.00 C ATOM 1091 CG PHE A 76 -1.505 -10.039 10.073 1.00 0.00 C ATOM 1092 CD1 PHE A 76 -1.764 -9.325 11.250 1.00 0.00 C ATOM 1093 CD2 PHE A 76 -0.274 -9.894 9.422 1.00 0.00 C ATOM 1094 CE1 PHE A 76 -0.792 -8.466 11.775 1.00 0.00 C ATOM 1095 CE2 PHE A 76 0.698 -9.034 9.947 1.00 0.00 C ATOM 1096 CZ PHE A 76 0.440 -8.320 11.124 1.00 0.00 C ATOM 0 H PHE A 76 -4.664 -12.026 8.726 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.837 -9.205 9.370 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -2.969 -11.589 10.299 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -2.101 -11.640 8.778 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.714 -9.437 11.752 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -0.074 -10.445 8.515 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.992 -7.915 12.682 1.00 0.00 H new ATOM 0 HE2 PHE A 76 1.647 -8.921 9.444 1.00 0.00 H new ATOM 0 HZ PHE A 76 1.190 -7.657 11.529 1.00 0.00 H new ATOM 1106 N GLY A 77 -3.866 -8.752 6.868 1.00 0.00 N ATOM 1107 CA GLY A 77 -3.541 -8.352 5.470 1.00 0.00 C ATOM 1108 C GLY A 77 -2.915 -6.956 5.468 1.00 0.00 C ATOM 1109 O GLY A 77 -1.842 -6.749 4.936 1.00 0.00 O ATOM 0 H GLY A 77 -4.556 -8.165 7.337 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -2.852 -9.071 5.026 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -4.444 -8.357 4.860 1.00 0.00 H new ATOM 1113 N ARG A 78 -3.577 -5.998 6.059 1.00 0.00 N ATOM 1114 CA ARG A 78 -3.020 -4.613 6.091 1.00 0.00 C ATOM 1115 C ARG A 78 -1.842 -4.540 7.065 1.00 0.00 C ATOM 1116 O ARG A 78 -2.015 -4.579 8.268 1.00 0.00 O ATOM 1117 CB ARG A 78 -4.172 -3.732 6.576 1.00 0.00 C ATOM 1118 CG ARG A 78 -3.980 -2.308 6.050 1.00 0.00 C ATOM 1119 CD ARG A 78 -4.347 -2.256 4.565 1.00 0.00 C ATOM 1120 NE ARG A 78 -5.082 -0.972 4.396 1.00 0.00 N ATOM 1121 CZ ARG A 78 -6.355 -0.907 4.675 1.00 0.00 C ATOM 1122 NH1 ARG A 78 -7.223 -1.515 3.914 1.00 0.00 N ATOM 1123 NH2 ARG A 78 -6.760 -0.234 5.718 1.00 0.00 N ATOM 0 H ARG A 78 -4.479 -6.114 6.521 1.00 0.00 H new ATOM 0 HA ARG A 78 -2.647 -4.296 5.117 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -5.123 -4.135 6.228 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -4.207 -3.727 7.665 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.604 -1.614 6.614 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -2.946 -1.994 6.191 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -3.457 -2.287 3.937 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -4.967 -3.106 4.281 1.00 0.00 H new ATOM 0 HE ARG A 78 -4.590 -0.143 4.062 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -6.907 -2.042 3.100 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -8.218 -1.463 4.133 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -6.081 0.240 6.314 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -7.755 -0.183 5.937 1.00 0.00 H new ATOM 1137 N THR A 79 -0.645 -4.433 6.553 1.00 0.00 N ATOM 1138 CA THR A 79 0.547 -4.358 7.447 1.00 0.00 C ATOM 1139 C THR A 79 1.685 -3.599 6.756 1.00 0.00 C ATOM 1140 O THR A 79 2.379 -2.813 7.371 1.00 0.00 O ATOM 1141 CB THR A 79 0.950 -5.811 7.702 1.00 0.00 C ATOM 1142 OG1 THR A 79 -0.215 -6.620 7.790 1.00 0.00 O ATOM 1143 CG2 THR A 79 1.732 -5.898 9.012 1.00 0.00 C ATOM 0 H THR A 79 -0.441 -4.394 5.554 1.00 0.00 H new ATOM 0 HA THR A 79 0.330 -3.828 8.374 1.00 0.00 H new ATOM 0 HB THR A 79 1.574 -6.164 6.881 1.00 0.00 H new ATOM 0 HG1 THR A 79 -0.050 -7.366 8.404 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.020 -6.933 9.196 1.00 0.00 H new ATOM 0 HG22 THR A 79 2.627 -5.279 8.944 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.108 -5.544 9.833 1.00 0.00 H new ATOM 1151 N GLY A 80 1.881 -3.827 5.483 1.00 0.00 N ATOM 1152 CA GLY A 80 2.974 -3.120 4.750 1.00 0.00 C ATOM 1153 C GLY A 80 2.850 -1.610 4.970 1.00 0.00 C ATOM 1154 O GLY A 80 3.826 -0.886 4.932 1.00 0.00 O ATOM 0 H GLY A 80 1.330 -4.474 4.918 1.00 0.00 H new ATOM 0 HA2 GLY A 80 3.945 -3.470 5.100 1.00 0.00 H new ATOM 0 HA3 GLY A 80 2.918 -3.348 3.686 1.00 0.00 H new ATOM 1158 N LEU A 81 1.658 -1.131 5.203 1.00 0.00 N ATOM 1159 CA LEU A 81 1.467 0.331 5.432 1.00 0.00 C ATOM 1160 C LEU A 81 0.446 0.561 6.555 1.00 0.00 C ATOM 1161 O LEU A 81 -0.743 0.605 6.312 1.00 0.00 O ATOM 1162 CB LEU A 81 0.946 0.883 4.102 1.00 0.00 C ATOM 1163 CG LEU A 81 -0.320 0.126 3.682 1.00 0.00 C ATOM 1164 CD1 LEU A 81 -1.481 1.110 3.526 1.00 0.00 C ATOM 1165 CD2 LEU A 81 -0.074 -0.583 2.348 1.00 0.00 C ATOM 0 H LEU A 81 0.806 -1.690 5.245 1.00 0.00 H new ATOM 0 HA LEU A 81 2.390 0.825 5.737 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.728 1.947 4.200 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.712 0.784 3.332 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.568 -0.610 4.447 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.379 0.569 3.228 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.660 1.615 4.475 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -1.232 1.848 2.764 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -0.974 -1.121 2.050 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.177 0.154 1.585 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.750 -1.288 2.457 1.00 0.00 H new ATOM 1177 N PRO A 82 0.949 0.699 7.755 1.00 0.00 N ATOM 1178 CA PRO A 82 0.068 0.922 8.927 1.00 0.00 C ATOM 1179 C PRO A 82 -0.516 2.338 8.893 1.00 0.00 C ATOM 1180 O PRO A 82 0.205 3.316 8.873 1.00 0.00 O ATOM 1181 CB PRO A 82 1.004 0.749 10.119 1.00 0.00 C ATOM 1182 CG PRO A 82 2.368 1.051 9.587 1.00 0.00 C ATOM 1183 CD PRO A 82 2.368 0.660 8.132 1.00 0.00 C ATOM 0 HA PRO A 82 -0.783 0.242 8.959 1.00 0.00 H new ATOM 0 HB2 PRO A 82 0.738 1.426 10.931 1.00 0.00 H new ATOM 0 HB3 PRO A 82 0.951 -0.264 10.518 1.00 0.00 H new ATOM 0 HG2 PRO A 82 2.602 2.109 9.702 1.00 0.00 H new ATOM 0 HG3 PRO A 82 3.128 0.495 10.136 1.00 0.00 H new ATOM 0 HD2 PRO A 82 2.960 1.352 7.533 1.00 0.00 H new ATOM 0 HD3 PRO A 82 2.793 -0.333 7.985 1.00 0.00 H new ATOM 1191 N ASP A 83 -1.818 2.454 8.888 1.00 0.00 N ATOM 1192 CA ASP A 83 -2.448 3.806 8.857 1.00 0.00 C ATOM 1193 C ASP A 83 -2.357 4.462 10.236 1.00 0.00 C ATOM 1194 O ASP A 83 -2.858 3.944 11.215 1.00 0.00 O ATOM 1195 CB ASP A 83 -3.908 3.556 8.478 1.00 0.00 C ATOM 1196 CG ASP A 83 -4.487 4.812 7.822 1.00 0.00 C ATOM 1197 OD1 ASP A 83 -3.789 5.417 7.028 1.00 0.00 O ATOM 1198 OD2 ASP A 83 -5.621 5.146 8.128 1.00 0.00 O ATOM 0 H ASP A 83 -2.472 1.671 8.904 1.00 0.00 H new ATOM 0 HA ASP A 83 -1.954 4.475 8.153 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -3.978 2.710 7.794 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -4.486 3.297 9.365 1.00 0.00 H new ATOM 1203 N LEU A 84 -1.721 5.601 10.320 1.00 0.00 N ATOM 1204 CA LEU A 84 -1.595 6.292 11.637 1.00 0.00 C ATOM 1205 C LEU A 84 -2.903 7.008 11.984 1.00 0.00 C ATOM 1206 O LEU A 84 -3.248 7.163 13.140 1.00 0.00 O ATOM 1207 CB LEU A 84 -0.464 7.304 11.447 1.00 0.00 C ATOM 1208 CG LEU A 84 0.855 6.560 11.235 1.00 0.00 C ATOM 1209 CD1 LEU A 84 1.958 7.563 10.890 1.00 0.00 C ATOM 1210 CD2 LEU A 84 1.231 5.812 12.517 1.00 0.00 C ATOM 0 H LEU A 84 -1.284 6.082 9.534 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.387 5.597 12.450 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.675 7.944 10.590 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.392 7.953 12.320 1.00 0.00 H new ATOM 0 HG LEU A 84 0.742 5.848 10.417 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.898 7.032 10.739 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.692 8.097 9.978 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.071 8.275 11.707 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.171 5.281 12.366 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.343 6.524 13.334 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.447 5.097 12.764 1.00 0.00 H new ATOM 1222 N SER A 85 -3.632 7.445 10.993 1.00 0.00 N ATOM 1223 CA SER A 85 -4.919 8.152 11.265 1.00 0.00 C ATOM 1224 C SER A 85 -5.933 7.186 11.885 1.00 0.00 C ATOM 1225 O SER A 85 -6.819 7.587 12.613 1.00 0.00 O ATOM 1226 CB SER A 85 -5.404 8.635 9.899 1.00 0.00 C ATOM 1227 OG SER A 85 -5.071 10.007 9.739 1.00 0.00 O ATOM 0 H SER A 85 -3.393 7.344 10.007 1.00 0.00 H new ATOM 0 HA SER A 85 -4.796 8.976 11.967 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.945 8.043 9.107 1.00 0.00 H new ATOM 0 HB3 SER A 85 -6.482 8.499 9.814 1.00 0.00 H new ATOM 0 HG SER A 85 -5.380 10.318 8.863 1.00 0.00 H new ATOM 1233 N SER A 86 -5.808 5.917 11.601 1.00 0.00 N ATOM 1234 CA SER A 86 -6.763 4.925 12.174 1.00 0.00 C ATOM 1235 C SER A 86 -6.158 4.261 13.413 1.00 0.00 C ATOM 1236 O SER A 86 -6.379 3.095 13.674 1.00 0.00 O ATOM 1237 CB SER A 86 -6.977 3.897 11.065 1.00 0.00 C ATOM 1238 OG SER A 86 -7.885 2.900 11.518 1.00 0.00 O ATOM 0 H SER A 86 -5.086 5.525 10.997 1.00 0.00 H new ATOM 0 HA SER A 86 -7.699 5.387 12.488 1.00 0.00 H new ATOM 0 HB2 SER A 86 -7.369 4.384 10.172 1.00 0.00 H new ATOM 0 HB3 SER A 86 -6.027 3.441 10.788 1.00 0.00 H new ATOM 0 HG SER A 86 -7.605 2.580 12.401 1.00 0.00 H new ATOM 1244 N MET A 87 -5.396 4.997 14.179 1.00 0.00 N ATOM 1245 CA MET A 87 -4.776 4.410 15.403 1.00 0.00 C ATOM 1246 C MET A 87 -5.160 5.234 16.636 1.00 0.00 C ATOM 1247 O MET A 87 -5.143 6.449 16.613 1.00 0.00 O ATOM 1248 CB MET A 87 -3.269 4.483 15.157 1.00 0.00 C ATOM 1249 CG MET A 87 -2.806 3.209 14.447 1.00 0.00 C ATOM 1250 SD MET A 87 -1.080 3.396 13.934 1.00 0.00 S ATOM 1251 CE MET A 87 -0.412 2.001 14.874 1.00 0.00 C ATOM 0 H MET A 87 -5.176 5.979 14.010 1.00 0.00 H new ATOM 0 HA MET A 87 -5.110 3.389 15.587 1.00 0.00 H new ATOM 0 HB2 MET A 87 -3.031 5.357 14.551 1.00 0.00 H new ATOM 0 HB3 MET A 87 -2.740 4.597 16.103 1.00 0.00 H new ATOM 0 HG2 MET A 87 -2.908 2.352 15.113 1.00 0.00 H new ATOM 0 HG3 MET A 87 -3.435 3.015 13.579 1.00 0.00 H new ATOM 0 HE1 MET A 87 0.662 1.927 14.702 1.00 0.00 H new ATOM 0 HE2 MET A 87 -0.600 2.155 15.937 1.00 0.00 H new ATOM 0 HE3 MET A 87 -0.895 1.079 14.550 1.00 0.00 H new ATOM 1261 N THR A 88 -5.506 4.579 17.712 1.00 0.00 N ATOM 1262 CA THR A 88 -5.892 5.321 18.949 1.00 0.00 C ATOM 1263 C THR A 88 -4.660 5.977 19.579 1.00 0.00 C ATOM 1264 O THR A 88 -3.543 5.762 19.152 1.00 0.00 O ATOM 1265 CB THR A 88 -6.467 4.258 19.890 1.00 0.00 C ATOM 1266 OG1 THR A 88 -5.463 3.300 20.187 1.00 0.00 O ATOM 1267 CG2 THR A 88 -7.655 3.565 19.220 1.00 0.00 C ATOM 0 H THR A 88 -5.538 3.562 17.789 1.00 0.00 H new ATOM 0 HA THR A 88 -6.609 6.116 18.743 1.00 0.00 H new ATOM 0 HB THR A 88 -6.802 4.733 20.812 1.00 0.00 H new ATOM 0 HG1 THR A 88 -5.822 2.398 20.052 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.062 2.809 19.892 1.00 0.00 H new ATOM 0 HG22 THR A 88 -8.426 4.302 18.994 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.325 3.089 18.296 1.00 0.00 H new ATOM 1275 N GLU A 89 -4.859 6.775 20.596 1.00 0.00 N ATOM 1276 CA GLU A 89 -3.699 7.445 21.258 1.00 0.00 C ATOM 1277 C GLU A 89 -2.706 6.399 21.773 1.00 0.00 C ATOM 1278 O GLU A 89 -1.508 6.611 21.764 1.00 0.00 O ATOM 1279 CB GLU A 89 -4.304 8.235 22.424 1.00 0.00 C ATOM 1280 CG GLU A 89 -5.002 7.277 23.394 1.00 0.00 C ATOM 1281 CD GLU A 89 -5.842 8.079 24.389 1.00 0.00 C ATOM 1282 OE1 GLU A 89 -5.301 8.996 24.986 1.00 0.00 O ATOM 1283 OE2 GLU A 89 -7.011 7.763 24.539 1.00 0.00 O ATOM 0 H GLU A 89 -5.772 6.992 20.996 1.00 0.00 H new ATOM 0 HA GLU A 89 -3.151 8.091 20.572 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -3.522 8.788 22.945 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -5.017 8.969 22.047 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -5.637 6.583 22.843 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -4.262 6.679 23.926 1.00 0.00 H new ATOM 1290 N GLU A 90 -3.194 5.271 22.216 1.00 0.00 N ATOM 1291 CA GLU A 90 -2.278 4.210 22.728 1.00 0.00 C ATOM 1292 C GLU A 90 -1.684 3.419 21.559 1.00 0.00 C ATOM 1293 O GLU A 90 -0.557 2.966 21.615 1.00 0.00 O ATOM 1294 CB GLU A 90 -3.152 3.306 23.598 1.00 0.00 C ATOM 1295 CG GLU A 90 -3.795 4.130 24.716 1.00 0.00 C ATOM 1296 CD GLU A 90 -4.427 3.191 25.745 1.00 0.00 C ATOM 1297 OE1 GLU A 90 -3.762 2.248 26.145 1.00 0.00 O ATOM 1298 OE2 GLU A 90 -5.564 3.431 26.118 1.00 0.00 O ATOM 0 H GLU A 90 -4.187 5.038 22.246 1.00 0.00 H new ATOM 0 HA GLU A 90 -1.442 4.626 23.291 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -3.924 2.836 22.989 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -2.550 2.504 24.025 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -3.045 4.760 25.195 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -4.553 4.795 24.302 1.00 0.00 H new ATOM 1305 N GLU A 91 -2.431 3.251 20.498 1.00 0.00 N ATOM 1306 CA GLU A 91 -1.905 2.488 19.324 1.00 0.00 C ATOM 1307 C GLU A 91 -0.601 3.123 18.831 1.00 0.00 C ATOM 1308 O GLU A 91 0.447 2.507 18.858 1.00 0.00 O ATOM 1309 CB GLU A 91 -2.994 2.595 18.251 1.00 0.00 C ATOM 1310 CG GLU A 91 -3.518 1.197 17.912 1.00 0.00 C ATOM 1311 CD GLU A 91 -4.300 0.641 19.102 1.00 0.00 C ATOM 1312 OE1 GLU A 91 -5.465 0.980 19.232 1.00 0.00 O ATOM 1313 OE2 GLU A 91 -3.721 -0.115 19.866 1.00 0.00 O ATOM 0 H GLU A 91 -3.381 3.608 20.393 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.685 1.450 19.572 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.810 3.224 18.608 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.592 3.071 17.356 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.159 1.241 17.031 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.687 0.535 17.669 1.00 0.00 H new ATOM 1320 N GLN A 92 -0.654 4.354 18.394 1.00 0.00 N ATOM 1321 CA GLN A 92 0.588 5.028 17.914 1.00 0.00 C ATOM 1322 C GLN A 92 1.609 5.086 19.054 1.00 0.00 C ATOM 1323 O GLN A 92 2.803 5.070 18.835 1.00 0.00 O ATOM 1324 CB GLN A 92 0.153 6.437 17.507 1.00 0.00 C ATOM 1325 CG GLN A 92 -0.881 6.349 16.383 1.00 0.00 C ATOM 1326 CD GLN A 92 -0.880 7.653 15.584 1.00 0.00 C ATOM 1327 OE1 GLN A 92 0.014 7.897 14.798 1.00 0.00 O ATOM 1328 NE2 GLN A 92 -1.852 8.508 15.752 1.00 0.00 N ATOM 0 H GLN A 92 -1.501 4.920 18.349 1.00 0.00 H new ATOM 0 HA GLN A 92 1.056 4.501 17.083 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -0.270 6.960 18.365 1.00 0.00 H new ATOM 0 HB3 GLN A 92 1.017 7.014 17.176 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -0.651 5.509 15.728 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -1.872 6.166 16.800 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -2.603 8.304 16.412 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -1.861 9.380 15.224 1.00 0.00 H new ATOM 1337 N ILE A 93 1.137 5.142 20.272 1.00 0.00 N ATOM 1338 CA ILE A 93 2.068 5.188 21.436 1.00 0.00 C ATOM 1339 C ILE A 93 2.850 3.872 21.516 1.00 0.00 C ATOM 1340 O ILE A 93 4.054 3.865 21.672 1.00 0.00 O ATOM 1341 CB ILE A 93 1.158 5.386 22.661 1.00 0.00 C ATOM 1342 CG1 ILE A 93 1.244 6.847 23.116 1.00 0.00 C ATOM 1343 CG2 ILE A 93 1.590 4.465 23.810 1.00 0.00 C ATOM 1344 CD1 ILE A 93 0.363 7.059 24.349 1.00 0.00 C ATOM 0 H ILE A 93 0.145 5.158 20.510 1.00 0.00 H new ATOM 0 HA ILE A 93 2.808 5.985 21.365 1.00 0.00 H new ATOM 0 HB ILE A 93 0.133 5.138 22.386 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.277 7.105 23.347 1.00 0.00 H new ATOM 0 HG13 ILE A 93 0.923 7.508 22.311 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.934 4.620 24.667 1.00 0.00 H new ATOM 0 HG22 ILE A 93 1.526 3.426 23.487 1.00 0.00 H new ATOM 0 HG23 ILE A 93 2.617 4.694 24.093 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.428 8.099 24.668 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.671 6.819 24.103 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.704 6.410 25.156 1.00 0.00 H new ATOM 1356 N ALA A 94 2.171 2.761 21.400 1.00 0.00 N ATOM 1357 CA ALA A 94 2.874 1.445 21.460 1.00 0.00 C ATOM 1358 C ALA A 94 3.962 1.394 20.385 1.00 0.00 C ATOM 1359 O ALA A 94 5.035 0.863 20.594 1.00 0.00 O ATOM 1360 CB ALA A 94 1.794 0.400 21.181 1.00 0.00 C ATOM 0 H ALA A 94 1.161 2.708 21.266 1.00 0.00 H new ATOM 0 HA ALA A 94 3.359 1.274 22.421 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.236 -0.596 21.208 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.014 0.472 21.939 1.00 0.00 H new ATOM 0 HB3 ALA A 94 1.361 0.578 20.197 1.00 0.00 H new ATOM 1366 N TYR A 95 3.690 1.953 19.237 1.00 0.00 N ATOM 1367 CA TYR A 95 4.701 1.954 18.142 1.00 0.00 C ATOM 1368 C TYR A 95 5.694 3.101 18.352 1.00 0.00 C ATOM 1369 O TYR A 95 6.834 3.032 17.936 1.00 0.00 O ATOM 1370 CB TYR A 95 3.893 2.170 16.863 1.00 0.00 C ATOM 1371 CG TYR A 95 4.653 1.614 15.684 1.00 0.00 C ATOM 1372 CD1 TYR A 95 5.082 0.281 15.695 1.00 0.00 C ATOM 1373 CD2 TYR A 95 4.930 2.431 14.583 1.00 0.00 C ATOM 1374 CE1 TYR A 95 5.788 -0.235 14.601 1.00 0.00 C ATOM 1375 CE2 TYR A 95 5.636 1.915 13.489 1.00 0.00 C ATOM 1376 CZ TYR A 95 6.064 0.582 13.498 1.00 0.00 C ATOM 1377 OH TYR A 95 6.760 0.074 12.420 1.00 0.00 O ATOM 0 H TYR A 95 2.807 2.411 19.010 1.00 0.00 H new ATOM 0 HA TYR A 95 5.280 1.031 18.106 1.00 0.00 H new ATOM 0 HB2 TYR A 95 2.923 1.680 16.947 1.00 0.00 H new ATOM 0 HB3 TYR A 95 3.702 3.233 16.717 1.00 0.00 H new ATOM 0 HD1 TYR A 95 4.869 -0.349 16.546 1.00 0.00 H new ATOM 0 HD2 TYR A 95 4.600 3.459 14.576 1.00 0.00 H new ATOM 0 HE1 TYR A 95 6.119 -1.263 14.608 1.00 0.00 H new ATOM 0 HE2 TYR A 95 5.850 2.545 12.639 1.00 0.00 H new ATOM 0 HH TYR A 95 6.865 0.772 11.740 1.00 0.00 H new ATOM 1387 N ALA A 96 5.266 4.154 18.996 1.00 0.00 N ATOM 1388 CA ALA A 96 6.181 5.309 19.239 1.00 0.00 C ATOM 1389 C ALA A 96 7.189 4.961 20.337 1.00 0.00 C ATOM 1390 O ALA A 96 8.347 5.322 20.267 1.00 0.00 O ATOM 1391 CB ALA A 96 5.268 6.450 19.690 1.00 0.00 C ATOM 0 H ALA A 96 4.322 4.265 19.365 1.00 0.00 H new ATOM 0 HA ALA A 96 6.756 5.575 18.352 1.00 0.00 H new ATOM 0 HB1 ALA A 96 5.867 7.338 19.889 1.00 0.00 H new ATOM 0 HB2 ALA A 96 4.544 6.669 18.905 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.741 6.157 20.598 1.00 0.00 H new ATOM 1397 N MET A 97 6.757 4.255 21.349 1.00 0.00 N ATOM 1398 CA MET A 97 7.689 3.877 22.448 1.00 0.00 C ATOM 1399 C MET A 97 8.524 2.667 22.026 1.00 0.00 C ATOM 1400 O MET A 97 9.594 2.426 22.549 1.00 0.00 O ATOM 1401 CB MET A 97 6.786 3.521 23.629 1.00 0.00 C ATOM 1402 CG MET A 97 6.430 4.792 24.401 1.00 0.00 C ATOM 1403 SD MET A 97 6.140 4.383 26.141 1.00 0.00 S ATOM 1404 CE MET A 97 6.597 5.991 26.832 1.00 0.00 C ATOM 0 H MET A 97 5.798 3.925 21.460 1.00 0.00 H new ATOM 0 HA MET A 97 8.385 4.677 22.698 1.00 0.00 H new ATOM 0 HB2 MET A 97 5.879 3.033 23.273 1.00 0.00 H new ATOM 0 HB3 MET A 97 7.291 2.813 24.286 1.00 0.00 H new ATOM 0 HG2 MET A 97 7.238 5.519 24.317 1.00 0.00 H new ATOM 0 HG3 MET A 97 5.540 5.253 23.972 1.00 0.00 H new ATOM 0 HE1 MET A 97 6.490 5.965 27.916 1.00 0.00 H new ATOM 0 HE2 MET A 97 7.632 6.217 26.575 1.00 0.00 H new ATOM 0 HE3 MET A 97 5.945 6.762 26.422 1.00 0.00 H new ATOM 1414 N GLN A 98 8.042 1.907 21.078 1.00 0.00 N ATOM 1415 CA GLN A 98 8.808 0.715 20.618 1.00 0.00 C ATOM 1416 C GLN A 98 9.972 1.152 19.726 1.00 0.00 C ATOM 1417 O GLN A 98 11.084 0.678 19.863 1.00 0.00 O ATOM 1418 CB GLN A 98 7.805 -0.122 19.820 1.00 0.00 C ATOM 1419 CG GLN A 98 7.304 -1.284 20.681 1.00 0.00 C ATOM 1420 CD GLN A 98 7.222 -2.554 19.832 1.00 0.00 C ATOM 1421 OE1 GLN A 98 6.204 -2.833 19.230 1.00 0.00 O ATOM 1422 NE2 GLN A 98 8.260 -3.341 19.756 1.00 0.00 N ATOM 0 H GLN A 98 7.152 2.061 20.604 1.00 0.00 H new ATOM 0 HA GLN A 98 9.235 0.152 21.448 1.00 0.00 H new ATOM 0 HB2 GLN A 98 6.966 0.499 19.506 1.00 0.00 H new ATOM 0 HB3 GLN A 98 8.275 -0.504 18.914 1.00 0.00 H new ATOM 0 HG2 GLN A 98 7.976 -1.441 21.524 1.00 0.00 H new ATOM 0 HG3 GLN A 98 6.324 -1.047 21.095 1.00 0.00 H new ATOM 0 HE21 GLN A 98 9.115 -3.108 20.261 1.00 0.00 H new ATOM 0 HE22 GLN A 98 8.216 -4.190 19.192 1.00 0.00 H new ATOM 1431 N MET A 99 9.726 2.057 18.816 1.00 0.00 N ATOM 1432 CA MET A 99 10.818 2.530 17.915 1.00 0.00 C ATOM 1433 C MET A 99 11.825 3.368 18.708 1.00 0.00 C ATOM 1434 O MET A 99 13.004 3.379 18.412 1.00 0.00 O ATOM 1435 CB MET A 99 10.120 3.389 16.860 1.00 0.00 C ATOM 1436 CG MET A 99 9.139 2.525 16.064 1.00 0.00 C ATOM 1437 SD MET A 99 9.986 1.821 14.627 1.00 0.00 S ATOM 1438 CE MET A 99 9.538 3.116 13.444 1.00 0.00 C ATOM 0 H MET A 99 8.816 2.489 18.658 1.00 0.00 H new ATOM 0 HA MET A 99 11.371 1.705 17.466 1.00 0.00 H new ATOM 0 HB2 MET A 99 9.590 4.212 17.339 1.00 0.00 H new ATOM 0 HB3 MET A 99 10.857 3.831 16.190 1.00 0.00 H new ATOM 0 HG2 MET A 99 8.745 1.728 16.694 1.00 0.00 H new ATOM 0 HG3 MET A 99 8.288 3.125 15.741 1.00 0.00 H new ATOM 0 HE1 MET A 99 9.964 2.881 12.469 1.00 0.00 H new ATOM 0 HE2 MET A 99 8.453 3.174 13.361 1.00 0.00 H new ATOM 0 HE3 MET A 99 9.927 4.074 13.789 1.00 0.00 H new ATOM 1448 N SER A 100 11.368 4.067 19.712 1.00 0.00 N ATOM 1449 CA SER A 100 12.298 4.904 20.526 1.00 0.00 C ATOM 1450 C SER A 100 13.279 4.012 21.293 1.00 0.00 C ATOM 1451 O SER A 100 14.475 4.224 21.266 1.00 0.00 O ATOM 1452 CB SER A 100 11.398 5.668 21.497 1.00 0.00 C ATOM 1453 OG SER A 100 10.718 6.699 20.793 1.00 0.00 O ATOM 0 H SER A 100 10.391 4.095 20.004 1.00 0.00 H new ATOM 0 HA SER A 100 12.895 5.576 19.909 1.00 0.00 H new ATOM 0 HB2 SER A 100 10.679 4.989 21.955 1.00 0.00 H new ATOM 0 HB3 SER A 100 11.993 6.094 22.304 1.00 0.00 H new ATOM 0 HG SER A 100 9.833 6.379 20.519 1.00 0.00 H new ATOM 1459 N LEU A 101 12.779 3.018 21.978 1.00 0.00 N ATOM 1460 CA LEU A 101 13.680 2.111 22.748 1.00 0.00 C ATOM 1461 C LEU A 101 14.468 1.204 21.797 1.00 0.00 C ATOM 1462 O LEU A 101 15.486 0.648 22.159 1.00 0.00 O ATOM 1463 CB LEU A 101 12.747 1.279 23.630 1.00 0.00 C ATOM 1464 CG LEU A 101 12.346 2.095 24.860 1.00 0.00 C ATOM 1465 CD1 LEU A 101 11.152 1.430 25.548 1.00 0.00 C ATOM 1466 CD2 LEU A 101 13.525 2.158 25.833 1.00 0.00 C ATOM 0 H LEU A 101 11.786 2.795 22.038 1.00 0.00 H new ATOM 0 HA LEU A 101 14.413 2.664 23.335 1.00 0.00 H new ATOM 0 HB2 LEU A 101 11.860 0.989 23.067 1.00 0.00 H new ATOM 0 HB3 LEU A 101 13.244 0.359 23.937 1.00 0.00 H new ATOM 0 HG LEU A 101 12.071 3.104 24.554 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.867 2.012 26.424 1.00 0.00 H new ATOM 0 HD12 LEU A 101 10.312 1.383 24.855 1.00 0.00 H new ATOM 0 HD13 LEU A 101 11.425 0.421 25.856 1.00 0.00 H new ATOM 0 HD21 LEU A 101 13.242 2.739 26.711 1.00 0.00 H new ATOM 0 HD22 LEU A 101 13.798 1.148 26.139 1.00 0.00 H new ATOM 0 HD23 LEU A 101 14.376 2.632 25.343 1.00 0.00 H new ATOM 1478 N GLN A 102 14.005 1.049 20.583 1.00 0.00 N ATOM 1479 CA GLN A 102 14.729 0.176 19.611 1.00 0.00 C ATOM 1480 C GLN A 102 16.170 0.664 19.428 1.00 0.00 C ATOM 1481 O GLN A 102 17.115 -0.036 19.736 1.00 0.00 O ATOM 1482 CB GLN A 102 13.950 0.307 18.301 1.00 0.00 C ATOM 1483 CG GLN A 102 14.534 -0.651 17.261 1.00 0.00 C ATOM 1484 CD GLN A 102 13.488 -0.932 16.181 1.00 0.00 C ATOM 1485 OE1 GLN A 102 12.305 -0.950 16.454 1.00 0.00 O ATOM 1486 NE2 GLN A 102 13.877 -1.153 14.954 1.00 0.00 N ATOM 0 H GLN A 102 13.158 1.489 20.223 1.00 0.00 H new ATOM 0 HA GLN A 102 14.785 -0.858 19.951 1.00 0.00 H new ATOM 0 HB2 GLN A 102 12.897 0.081 18.468 1.00 0.00 H new ATOM 0 HB3 GLN A 102 14.002 1.333 17.936 1.00 0.00 H new ATOM 0 HG2 GLN A 102 15.428 -0.217 16.812 1.00 0.00 H new ATOM 0 HG3 GLN A 102 14.838 -1.582 17.739 1.00 0.00 H new ATOM 0 HE21 GLN A 102 14.870 -1.138 14.723 1.00 0.00 H new ATOM 0 HE22 GLN A 102 13.187 -1.340 14.226 1.00 0.00 H new ATOM 1495 N GLY A 103 16.343 1.859 18.930 1.00 0.00 N ATOM 1496 CA GLY A 103 17.720 2.393 18.728 1.00 0.00 C ATOM 1497 C GLY A 103 17.779 3.177 17.417 1.00 0.00 C ATOM 1498 O GLY A 103 17.241 2.761 16.409 1.00 0.00 O ATOM 0 H GLY A 103 15.589 2.489 18.654 1.00 0.00 H new ATOM 0 HA2 GLY A 103 17.997 3.038 19.562 1.00 0.00 H new ATOM 0 HA3 GLY A 103 18.439 1.574 18.706 1.00 0.00 H new ATOM 1502 N ALA A 104 18.429 4.311 17.422 1.00 0.00 N ATOM 1503 CA ALA A 104 18.524 5.126 16.176 1.00 0.00 C ATOM 1504 C ALA A 104 19.617 6.189 16.322 1.00 0.00 C ATOM 1505 O ALA A 104 19.404 7.236 16.902 1.00 0.00 O ATOM 1506 CB ALA A 104 17.151 5.784 16.027 1.00 0.00 C ATOM 0 H ALA A 104 18.898 4.708 18.236 1.00 0.00 H new ATOM 0 HA ALA A 104 18.783 4.522 15.306 1.00 0.00 H new ATOM 0 HB1 ALA A 104 17.140 6.403 15.130 1.00 0.00 H new ATOM 0 HB2 ALA A 104 16.385 5.013 15.945 1.00 0.00 H new ATOM 0 HB3 ALA A 104 16.949 6.406 16.899 1.00 0.00 H new ATOM 1512 N GLU A 105 20.786 5.925 15.801 1.00 0.00 N ATOM 1513 CA GLU A 105 21.895 6.918 15.909 1.00 0.00 C ATOM 1514 C GLU A 105 22.348 7.358 14.515 1.00 0.00 C ATOM 1515 O GLU A 105 23.419 7.003 14.058 1.00 0.00 O ATOM 1516 CB GLU A 105 23.020 6.177 16.633 1.00 0.00 C ATOM 1517 CG GLU A 105 22.588 5.868 18.067 1.00 0.00 C ATOM 1518 CD GLU A 105 22.611 7.153 18.898 1.00 0.00 C ATOM 1519 OE1 GLU A 105 23.505 7.956 18.685 1.00 0.00 O ATOM 1520 OE2 GLU A 105 21.736 7.312 19.732 1.00 0.00 O ATOM 0 H GLU A 105 21.021 5.065 15.305 1.00 0.00 H new ATOM 0 HA GLU A 105 21.593 7.820 16.442 1.00 0.00 H new ATOM 0 HB2 GLU A 105 23.258 5.253 16.107 1.00 0.00 H new ATOM 0 HB3 GLU A 105 23.925 6.784 16.638 1.00 0.00 H new ATOM 0 HG2 GLU A 105 21.586 5.438 18.071 1.00 0.00 H new ATOM 0 HG3 GLU A 105 23.255 5.126 18.507 1.00 0.00 H new ATOM 1527 N PHE A 106 21.542 8.130 13.835 1.00 0.00 N ATOM 1528 CA PHE A 106 21.926 8.595 12.470 1.00 0.00 C ATOM 1529 C PHE A 106 21.515 10.056 12.274 1.00 0.00 C ATOM 1530 O PHE A 106 20.353 10.366 12.096 1.00 0.00 O ATOM 1531 CB PHE A 106 21.153 7.688 11.511 1.00 0.00 C ATOM 1532 CG PHE A 106 21.552 8.003 10.089 1.00 0.00 C ATOM 1533 CD1 PHE A 106 20.952 9.075 9.416 1.00 0.00 C ATOM 1534 CD2 PHE A 106 22.520 7.225 9.444 1.00 0.00 C ATOM 1535 CE1 PHE A 106 21.322 9.368 8.098 1.00 0.00 C ATOM 1536 CE2 PHE A 106 22.889 7.518 8.126 1.00 0.00 C ATOM 1537 CZ PHE A 106 22.291 8.589 7.452 1.00 0.00 C ATOM 0 H PHE A 106 20.635 8.459 14.166 1.00 0.00 H new ATOM 0 HA PHE A 106 23.002 8.543 12.303 1.00 0.00 H new ATOM 0 HB2 PHE A 106 21.361 6.642 11.735 1.00 0.00 H new ATOM 0 HB3 PHE A 106 20.081 7.834 11.640 1.00 0.00 H new ATOM 0 HD1 PHE A 106 20.204 9.675 9.914 1.00 0.00 H new ATOM 0 HD2 PHE A 106 22.982 6.399 9.963 1.00 0.00 H new ATOM 0 HE1 PHE A 106 20.860 10.195 7.579 1.00 0.00 H new ATOM 0 HE2 PHE A 106 23.636 6.917 7.629 1.00 0.00 H new ATOM 0 HZ PHE A 106 22.576 8.815 6.435 1.00 0.00 H new ATOM 1547 N GLY A 107 22.462 10.956 12.305 1.00 0.00 N ATOM 1548 CA GLY A 107 22.131 12.398 12.122 1.00 0.00 C ATOM 1549 C GLY A 107 23.420 13.219 12.092 1.00 0.00 C ATOM 1550 O GLY A 107 23.492 14.300 12.643 1.00 0.00 O ATOM 0 H GLY A 107 23.451 10.754 12.449 1.00 0.00 H new ATOM 0 HA2 GLY A 107 21.576 12.539 11.195 1.00 0.00 H new ATOM 0 HA3 GLY A 107 21.489 12.740 12.933 1.00 0.00 H new ATOM 1554 N GLN A 108 24.441 12.713 11.451 1.00 0.00 N ATOM 1555 CA GLN A 108 25.729 13.463 11.384 1.00 0.00 C ATOM 1556 C GLN A 108 26.423 13.202 10.044 1.00 0.00 C ATOM 1557 O GLN A 108 27.011 12.158 9.833 1.00 0.00 O ATOM 1558 CB GLN A 108 26.569 12.915 12.541 1.00 0.00 C ATOM 1559 CG GLN A 108 26.733 13.994 13.614 1.00 0.00 C ATOM 1560 CD GLN A 108 27.918 14.893 13.257 1.00 0.00 C ATOM 1561 OE1 GLN A 108 27.892 15.585 12.259 1.00 0.00 O ATOM 1562 NE2 GLN A 108 28.965 14.911 14.036 1.00 0.00 N ATOM 0 H GLN A 108 24.438 11.813 10.971 1.00 0.00 H new ATOM 0 HA GLN A 108 25.584 14.541 11.462 1.00 0.00 H new ATOM 0 HB2 GLN A 108 26.088 12.034 12.967 1.00 0.00 H new ATOM 0 HB3 GLN A 108 27.546 12.599 12.176 1.00 0.00 H new ATOM 0 HG2 GLN A 108 25.822 14.588 13.690 1.00 0.00 H new ATOM 0 HG3 GLN A 108 26.894 13.532 14.588 1.00 0.00 H new ATOM 0 HE21 GLN A 108 28.987 14.330 14.874 1.00 0.00 H new ATOM 0 HE22 GLN A 108 29.761 15.506 13.807 1.00 0.00 H new ATOM 1571 N ALA A 109 26.360 14.143 9.140 1.00 0.00 N ATOM 1572 CA ALA A 109 27.015 13.950 7.813 1.00 0.00 C ATOM 1573 C ALA A 109 28.039 15.061 7.563 1.00 0.00 C ATOM 1574 O ALA A 109 28.280 15.453 6.438 1.00 0.00 O ATOM 1575 CB ALA A 109 25.878 14.030 6.795 1.00 0.00 C ATOM 0 H ALA A 109 25.884 15.037 9.263 1.00 0.00 H new ATOM 0 HA ALA A 109 27.552 13.003 7.751 1.00 0.00 H new ATOM 0 HB1 ALA A 109 26.279 13.897 5.790 1.00 0.00 H new ATOM 0 HB2 ALA A 109 25.149 13.246 7.001 1.00 0.00 H new ATOM 0 HB3 ALA A 109 25.394 15.004 6.866 1.00 0.00 H new ATOM 1581 N GLU A 110 28.644 15.568 8.604 1.00 0.00 N ATOM 1582 CA GLU A 110 29.653 16.653 8.428 1.00 0.00 C ATOM 1583 C GLU A 110 30.964 16.071 7.894 1.00 0.00 C ATOM 1584 O GLU A 110 31.691 16.719 7.167 1.00 0.00 O ATOM 1585 CB GLU A 110 29.857 17.238 9.827 1.00 0.00 C ATOM 1586 CG GLU A 110 29.080 18.551 9.952 1.00 0.00 C ATOM 1587 CD GLU A 110 27.704 18.276 10.563 1.00 0.00 C ATOM 1588 OE1 GLU A 110 27.648 18.015 11.753 1.00 0.00 O ATOM 1589 OE2 GLU A 110 26.731 18.330 9.829 1.00 0.00 O ATOM 0 H GLU A 110 28.483 15.278 9.569 1.00 0.00 H new ATOM 0 HA GLU A 110 29.326 17.410 7.715 1.00 0.00 H new ATOM 0 HB2 GLU A 110 29.517 16.529 10.582 1.00 0.00 H new ATOM 0 HB3 GLU A 110 30.918 17.412 10.008 1.00 0.00 H new ATOM 0 HG2 GLU A 110 29.632 19.254 10.575 1.00 0.00 H new ATOM 0 HG3 GLU A 110 28.968 19.014 8.972 1.00 0.00 H new ATOM 1596 N SER A 111 31.270 14.853 8.250 1.00 0.00 N ATOM 1597 CA SER A 111 32.533 14.224 7.765 1.00 0.00 C ATOM 1598 C SER A 111 32.373 12.703 7.694 1.00 0.00 C ATOM 1599 O SER A 111 31.311 12.169 7.946 1.00 0.00 O ATOM 1600 CB SER A 111 33.589 14.606 8.801 1.00 0.00 C ATOM 1601 OG SER A 111 33.084 14.345 10.103 1.00 0.00 O ATOM 0 H SER A 111 30.699 14.265 8.857 1.00 0.00 H new ATOM 0 HA SER A 111 32.805 14.561 6.765 1.00 0.00 H new ATOM 0 HB2 SER A 111 34.503 14.037 8.632 1.00 0.00 H new ATOM 0 HB3 SER A 111 33.847 15.661 8.703 1.00 0.00 H new ATOM 0 HG SER A 111 33.759 14.587 10.770 1.00 0.00 H new ATOM 1607 N ALA A 112 33.422 12.003 7.351 1.00 0.00 N ATOM 1608 CA ALA A 112 33.332 10.516 7.263 1.00 0.00 C ATOM 1609 C ALA A 112 34.707 9.889 7.505 1.00 0.00 C ATOM 1610 O ALA A 112 34.792 8.671 7.492 1.00 0.00 O ATOM 1611 CB ALA A 112 32.855 10.232 5.838 1.00 0.00 C ATOM 1612 OXT ALA A 112 35.652 10.636 7.699 1.00 0.00 O ATOM 0 H ALA A 112 34.336 12.396 7.128 1.00 0.00 H new ATOM 0 HA ALA A 112 32.657 10.097 8.009 1.00 0.00 H new ATOM 0 HB1 ALA A 112 32.763 9.156 5.693 1.00 0.00 H new ATOM 0 HB2 ALA A 112 31.885 10.704 5.678 1.00 0.00 H new ATOM 0 HB3 ALA A 112 33.576 10.634 5.126 1.00 0.00 H new TER 1618 ALA A 112