USER MOD reduce.3.24.130724 H: found=0, std=0, add=829, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 827 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 52 LYS NZ :NH3+ -141:sc= -1.09 (180deg=-2.1!) USER MOD Set 1.2: A 55 GLN : amide:sc= -0.616 K(o=-1.7,f=-2.4!) USER MOD Set 2.1: A 38 CYS SG : rot 180:sc= 0.0473 USER MOD Set 2.2: A 39 LYS NZ :NH3+ -168:sc= 0.356 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -151:sc= -0.054 (180deg=-0.501) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 22:sc= 0.208! USER MOD Single : A 11 THR OG1 : rot 171:sc= -0.578 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0.013 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot 180:sc= -0.324 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -130:sc= 0 (180deg=-1.59) USER MOD Single : A 66 ASN : amide:sc= -0.872 K(o=-0.87,f=-5.3!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -1.48 X(o=-1.5,f=-1.5) USER MOD Single : A 77 SER OG : rot -27:sc= 0.503! USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 134:sc= -1.1 (180deg=-4.19!) USER MOD Single : A 85 LYS NZ :NH3+ -110:sc= -0.885 (180deg=-2.33!) USER MOD Single : A 91 LYS NZ :NH3+ -150:sc= -0.125 (180deg=-0.633) USER MOD Single : A 97 LYS NZ :NH3+ -127:sc= -0.516 (180deg=-3.27!) USER MOD Single : A 99 LYS NZ :NH3+ 158:sc= -0.0444 (180deg=-0.259) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.897 4.955 -4.218 1.00 0.00 N ATOM 2 CA MET A 1 6.458 3.969 -5.198 1.00 0.00 C ATOM 3 C MET A 1 6.755 2.553 -4.714 1.00 0.00 C ATOM 4 O MET A 1 7.652 2.341 -3.898 1.00 0.00 O ATOM 5 CB MET A 1 7.143 4.215 -6.543 1.00 0.00 C ATOM 6 CG MET A 1 7.103 5.668 -6.989 1.00 0.00 C ATOM 7 SD MET A 1 7.868 5.921 -8.601 1.00 0.00 S ATOM 8 CE MET A 1 6.488 5.578 -9.689 1.00 0.00 C ATOM 0 H1 MET A 1 6.298 5.803 -4.286 1.00 0.00 H new ATOM 0 H2 MET A 1 6.820 4.552 -3.262 1.00 0.00 H new ATOM 0 H3 MET A 1 7.886 5.214 -4.406 1.00 0.00 H new ATOM 0 HA MET A 1 5.380 4.073 -5.324 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.182 3.892 -6.477 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.665 3.597 -7.303 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.067 6.004 -7.026 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.612 6.285 -6.249 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.805 5.693 -10.726 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.142 4.557 -9.527 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.676 6.274 -9.478 1.00 0.00 H new ATOM 18 N SER A 2 5.996 1.587 -5.222 1.00 0.00 N ATOM 19 CA SER A 2 6.176 0.192 -4.839 1.00 0.00 C ATOM 20 C SER A 2 7.143 -0.512 -5.786 1.00 0.00 C ATOM 21 O SER A 2 7.228 -0.173 -6.966 1.00 0.00 O ATOM 22 CB SER A 2 4.830 -0.535 -4.834 1.00 0.00 C ATOM 23 OG SER A 2 5.004 -1.931 -4.661 1.00 0.00 O ATOM 0 H SER A 2 5.250 1.745 -5.900 1.00 0.00 H new ATOM 0 HA SER A 2 6.598 0.169 -3.834 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.204 -0.142 -4.033 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.307 -0.344 -5.771 1.00 0.00 H new ATOM 0 HG SER A 2 4.129 -2.372 -4.660 1.00 0.00 H new ATOM 29 N GLU A 3 7.870 -1.492 -5.259 1.00 0.00 N ATOM 30 CA GLU A 3 8.831 -2.243 -6.058 1.00 0.00 C ATOM 31 C GLU A 3 8.711 -3.740 -5.789 1.00 0.00 C ATOM 32 O GLU A 3 7.878 -4.174 -4.992 1.00 0.00 O ATOM 33 CB GLU A 3 10.256 -1.772 -5.756 1.00 0.00 C ATOM 34 CG GLU A 3 10.559 -1.662 -4.271 1.00 0.00 C ATOM 35 CD GLU A 3 10.178 -0.311 -3.697 1.00 0.00 C ATOM 36 OE1 GLU A 3 9.229 -0.258 -2.887 1.00 0.00 O ATOM 37 OE2 GLU A 3 10.829 0.692 -4.056 1.00 0.00 O ATOM 0 H GLU A 3 7.812 -1.784 -4.283 1.00 0.00 H new ATOM 0 HA GLU A 3 8.611 -2.062 -7.110 1.00 0.00 H new ATOM 0 HB2 GLU A 3 10.963 -2.465 -6.212 1.00 0.00 H new ATOM 0 HB3 GLU A 3 10.415 -0.800 -6.224 1.00 0.00 H new ATOM 0 HG2 GLU A 3 10.022 -2.445 -3.735 1.00 0.00 H new ATOM 0 HG3 GLU A 3 11.623 -1.836 -4.107 1.00 0.00 H new ATOM 44 N ASP A 4 9.548 -4.525 -6.459 1.00 0.00 N ATOM 45 CA ASP A 4 9.537 -5.973 -6.292 1.00 0.00 C ATOM 46 C ASP A 4 10.870 -6.467 -5.739 1.00 0.00 C ATOM 47 O ASP A 4 11.858 -5.734 -5.727 1.00 0.00 O ATOM 48 CB ASP A 4 9.239 -6.659 -7.626 1.00 0.00 C ATOM 49 CG ASP A 4 8.742 -8.081 -7.449 1.00 0.00 C ATOM 50 OD1 ASP A 4 8.788 -8.852 -8.430 1.00 0.00 O ATOM 51 OD2 ASP A 4 8.309 -8.421 -6.328 1.00 0.00 O ATOM 0 H ASP A 4 10.243 -4.182 -7.123 1.00 0.00 H new ATOM 0 HA ASP A 4 8.752 -6.225 -5.579 1.00 0.00 H new ATOM 0 HB2 ASP A 4 8.491 -6.081 -8.169 1.00 0.00 H new ATOM 0 HB3 ASP A 4 10.142 -6.666 -8.237 1.00 0.00 H new ATOM 56 N SER A 5 10.889 -7.715 -5.281 1.00 0.00 N ATOM 57 CA SER A 5 12.099 -8.305 -4.721 1.00 0.00 C ATOM 58 C SER A 5 12.341 -9.697 -5.298 1.00 0.00 C ATOM 59 O SER A 5 12.817 -10.594 -4.603 1.00 0.00 O ATOM 60 CB SER A 5 11.997 -8.383 -3.197 1.00 0.00 C ATOM 61 OG SER A 5 10.677 -8.702 -2.790 1.00 0.00 O ATOM 0 H SER A 5 10.080 -8.337 -5.287 1.00 0.00 H new ATOM 0 HA SER A 5 12.942 -7.667 -4.989 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.689 -9.137 -2.821 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.295 -7.430 -2.760 1.00 0.00 H new ATOM 0 HG SER A 5 10.638 -8.748 -1.812 1.00 0.00 H new ATOM 67 N ALA A 6 12.010 -9.868 -6.574 1.00 0.00 N ATOM 68 CA ALA A 6 12.193 -11.148 -7.245 1.00 0.00 C ATOM 69 C ALA A 6 13.091 -11.003 -8.469 1.00 0.00 C ATOM 70 O ALA A 6 12.865 -11.640 -9.498 1.00 0.00 O ATOM 71 CB ALA A 6 10.845 -11.732 -7.644 1.00 0.00 C ATOM 0 H ALA A 6 11.614 -9.136 -7.163 1.00 0.00 H new ATOM 0 HA ALA A 6 12.680 -11.829 -6.548 1.00 0.00 H new ATOM 0 HB1 ALA A 6 10.997 -12.688 -8.144 1.00 0.00 H new ATOM 0 HB2 ALA A 6 10.235 -11.881 -6.753 1.00 0.00 H new ATOM 0 HB3 ALA A 6 10.337 -11.045 -8.321 1.00 0.00 H new ATOM 77 N THR A 7 14.113 -10.160 -8.351 1.00 0.00 N ATOM 78 CA THR A 7 15.044 -9.930 -9.447 1.00 0.00 C ATOM 79 C THR A 7 16.476 -9.811 -8.937 1.00 0.00 C ATOM 80 O THR A 7 16.755 -9.048 -8.013 1.00 0.00 O ATOM 81 CB THR A 7 14.684 -8.655 -10.232 1.00 0.00 C ATOM 82 OG1 THR A 7 15.021 -7.495 -9.463 1.00 0.00 O ATOM 83 CG2 THR A 7 13.202 -8.630 -10.574 1.00 0.00 C ATOM 0 H THR A 7 14.316 -9.626 -7.506 1.00 0.00 H new ATOM 0 HA THR A 7 14.968 -10.791 -10.111 1.00 0.00 H new ATOM 0 HB THR A 7 15.255 -8.653 -11.161 1.00 0.00 H new ATOM 0 HG1 THR A 7 15.698 -7.731 -8.795 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.972 -7.720 -11.128 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.955 -9.499 -11.184 1.00 0.00 H new ATOM 0 HG23 THR A 7 12.616 -8.653 -9.655 1.00 0.00 H new ATOM 91 N VAL A 8 17.381 -10.572 -9.545 1.00 0.00 N ATOM 92 CA VAL A 8 18.785 -10.550 -9.153 1.00 0.00 C ATOM 93 C VAL A 8 19.696 -10.752 -10.359 1.00 0.00 C ATOM 94 O VAL A 8 19.483 -11.657 -11.166 1.00 0.00 O ATOM 95 CB VAL A 8 19.092 -11.636 -8.105 1.00 0.00 C ATOM 96 CG1 VAL A 8 18.843 -13.021 -8.682 1.00 0.00 C ATOM 97 CG2 VAL A 8 20.523 -11.506 -7.607 1.00 0.00 C ATOM 0 H VAL A 8 17.167 -11.211 -10.311 1.00 0.00 H new ATOM 0 HA VAL A 8 18.976 -9.570 -8.717 1.00 0.00 H new ATOM 0 HB VAL A 8 18.422 -11.497 -7.256 1.00 0.00 H new ATOM 0 HG11 VAL A 8 19.065 -13.775 -7.927 1.00 0.00 H new ATOM 0 HG12 VAL A 8 17.799 -13.107 -8.984 1.00 0.00 H new ATOM 0 HG13 VAL A 8 19.486 -13.175 -9.549 1.00 0.00 H new ATOM 0 HG21 VAL A 8 20.723 -12.281 -6.867 1.00 0.00 H new ATOM 0 HG22 VAL A 8 21.211 -11.618 -8.445 1.00 0.00 H new ATOM 0 HG23 VAL A 8 20.662 -10.525 -7.152 1.00 0.00 H new ATOM 107 N ALA A 9 20.711 -9.903 -10.475 1.00 0.00 N ATOM 108 CA ALA A 9 21.656 -9.989 -11.582 1.00 0.00 C ATOM 109 C ALA A 9 22.740 -11.024 -11.298 1.00 0.00 C ATOM 110 O ALA A 9 22.988 -11.379 -10.146 1.00 0.00 O ATOM 111 CB ALA A 9 22.281 -8.628 -11.850 1.00 0.00 C ATOM 0 H ALA A 9 20.900 -9.148 -9.816 1.00 0.00 H new ATOM 0 HA ALA A 9 21.110 -10.307 -12.470 1.00 0.00 H new ATOM 0 HB1 ALA A 9 22.984 -8.707 -12.679 1.00 0.00 H new ATOM 0 HB2 ALA A 9 21.499 -7.912 -12.105 1.00 0.00 H new ATOM 0 HB3 ALA A 9 22.808 -8.288 -10.959 1.00 0.00 H new ATOM 117 N VAL A 10 23.384 -11.505 -12.357 1.00 0.00 N ATOM 118 CA VAL A 10 24.442 -12.499 -12.222 1.00 0.00 C ATOM 119 C VAL A 10 25.707 -12.057 -12.948 1.00 0.00 C ATOM 120 O VAL A 10 25.677 -11.143 -13.773 1.00 0.00 O ATOM 121 CB VAL A 10 24.000 -13.868 -12.772 1.00 0.00 C ATOM 122 CG1 VAL A 10 22.901 -14.463 -11.904 1.00 0.00 C ATOM 123 CG2 VAL A 10 23.539 -13.738 -14.216 1.00 0.00 C ATOM 0 H VAL A 10 23.191 -11.222 -13.318 1.00 0.00 H new ATOM 0 HA VAL A 10 24.652 -12.594 -11.157 1.00 0.00 H new ATOM 0 HB VAL A 10 24.855 -14.544 -12.747 1.00 0.00 H new ATOM 0 HG11 VAL A 10 22.602 -15.430 -12.308 1.00 0.00 H new ATOM 0 HG12 VAL A 10 23.271 -14.594 -10.887 1.00 0.00 H new ATOM 0 HG13 VAL A 10 22.042 -13.792 -11.894 1.00 0.00 H new ATOM 0 HG21 VAL A 10 23.230 -14.715 -14.589 1.00 0.00 H new ATOM 0 HG22 VAL A 10 22.698 -13.047 -14.269 1.00 0.00 H new ATOM 0 HG23 VAL A 10 24.358 -13.359 -14.827 1.00 0.00 H new ATOM 133 N THR A 11 26.822 -12.712 -12.636 1.00 0.00 N ATOM 134 CA THR A 11 28.099 -12.386 -13.258 1.00 0.00 C ATOM 135 C THR A 11 28.286 -13.152 -14.563 1.00 0.00 C ATOM 136 O THR A 11 27.798 -14.272 -14.712 1.00 0.00 O ATOM 137 CB THR A 11 29.278 -12.701 -12.318 1.00 0.00 C ATOM 138 OG1 THR A 11 28.919 -13.756 -11.418 1.00 0.00 O ATOM 139 CG2 THR A 11 29.682 -11.467 -11.525 1.00 0.00 C ATOM 0 H THR A 11 26.866 -13.471 -11.956 1.00 0.00 H new ATOM 0 HA THR A 11 28.085 -11.316 -13.466 1.00 0.00 H new ATOM 0 HB THR A 11 30.125 -13.016 -12.927 1.00 0.00 H new ATOM 0 HG1 THR A 11 29.713 -14.049 -10.925 1.00 0.00 H new ATOM 0 HG21 THR A 11 30.516 -11.714 -10.868 1.00 0.00 H new ATOM 0 HG22 THR A 11 29.982 -10.676 -12.212 1.00 0.00 H new ATOM 0 HG23 THR A 11 28.837 -11.127 -10.926 1.00 0.00 H new ATOM 147 N ASP A 12 28.995 -12.540 -15.505 1.00 0.00 N ATOM 148 CA ASP A 12 29.249 -13.166 -16.798 1.00 0.00 C ATOM 149 C ASP A 12 30.015 -14.474 -16.628 1.00 0.00 C ATOM 150 O ASP A 12 29.786 -15.438 -17.358 1.00 0.00 O ATOM 151 CB ASP A 12 30.033 -12.215 -17.704 1.00 0.00 C ATOM 152 CG ASP A 12 30.433 -12.862 -19.015 1.00 0.00 C ATOM 153 OD1 ASP A 12 29.544 -13.076 -19.867 1.00 0.00 O ATOM 154 OD2 ASP A 12 31.634 -13.154 -19.190 1.00 0.00 O ATOM 0 H ASP A 12 29.404 -11.612 -15.398 1.00 0.00 H new ATOM 0 HA ASP A 12 28.288 -13.387 -17.262 1.00 0.00 H new ATOM 0 HB2 ASP A 12 29.428 -11.331 -17.908 1.00 0.00 H new ATOM 0 HB3 ASP A 12 30.928 -11.876 -17.182 1.00 0.00 H new ATOM 159 N ASP A 13 30.926 -14.498 -15.662 1.00 0.00 N ATOM 160 CA ASP A 13 31.727 -15.688 -15.396 1.00 0.00 C ATOM 161 C ASP A 13 30.875 -16.787 -14.770 1.00 0.00 C ATOM 162 O ASP A 13 30.979 -17.955 -15.144 1.00 0.00 O ATOM 163 CB ASP A 13 32.898 -15.345 -14.474 1.00 0.00 C ATOM 164 CG ASP A 13 34.116 -14.865 -15.239 1.00 0.00 C ATOM 165 OD1 ASP A 13 34.143 -13.679 -15.629 1.00 0.00 O ATOM 166 OD2 ASP A 13 35.043 -15.676 -15.446 1.00 0.00 O ATOM 0 H ASP A 13 31.129 -13.708 -15.050 1.00 0.00 H new ATOM 0 HA ASP A 13 32.118 -16.053 -16.346 1.00 0.00 H new ATOM 0 HB2 ASP A 13 32.588 -14.573 -13.769 1.00 0.00 H new ATOM 0 HB3 ASP A 13 33.164 -16.224 -13.887 1.00 0.00 H new ATOM 171 N SER A 14 30.035 -16.406 -13.814 1.00 0.00 N ATOM 172 CA SER A 14 29.169 -17.360 -13.131 1.00 0.00 C ATOM 173 C SER A 14 27.740 -17.269 -13.657 1.00 0.00 C ATOM 174 O SER A 14 26.778 -17.434 -12.907 1.00 0.00 O ATOM 175 CB SER A 14 29.186 -17.108 -11.622 1.00 0.00 C ATOM 176 OG SER A 14 30.290 -17.752 -11.010 1.00 0.00 O ATOM 0 H SER A 14 29.935 -15.443 -13.494 1.00 0.00 H new ATOM 0 HA SER A 14 29.548 -18.363 -13.329 1.00 0.00 H new ATOM 0 HB2 SER A 14 29.234 -16.036 -11.430 1.00 0.00 H new ATOM 0 HB3 SER A 14 28.258 -17.470 -11.179 1.00 0.00 H new ATOM 0 HG SER A 14 30.279 -17.574 -10.046 1.00 0.00 H new ATOM 182 N PHE A 15 27.609 -17.005 -14.953 1.00 0.00 N ATOM 183 CA PHE A 15 26.297 -16.891 -15.581 1.00 0.00 C ATOM 184 C PHE A 15 25.758 -18.265 -15.967 1.00 0.00 C ATOM 185 O PHE A 15 24.724 -18.702 -15.461 1.00 0.00 O ATOM 186 CB PHE A 15 26.378 -15.996 -16.820 1.00 0.00 C ATOM 187 CG PHE A 15 25.140 -16.034 -17.669 1.00 0.00 C ATOM 188 CD1 PHE A 15 25.007 -16.971 -18.682 1.00 0.00 C ATOM 189 CD2 PHE A 15 24.109 -15.134 -17.455 1.00 0.00 C ATOM 190 CE1 PHE A 15 23.869 -17.009 -19.465 1.00 0.00 C ATOM 191 CE2 PHE A 15 22.968 -15.168 -18.234 1.00 0.00 C ATOM 192 CZ PHE A 15 22.848 -16.106 -19.241 1.00 0.00 C ATOM 0 H PHE A 15 28.395 -16.866 -15.589 1.00 0.00 H new ATOM 0 HA PHE A 15 25.614 -16.442 -14.860 1.00 0.00 H new ATOM 0 HB2 PHE A 15 26.561 -14.969 -16.505 1.00 0.00 H new ATOM 0 HB3 PHE A 15 27.232 -16.302 -17.424 1.00 0.00 H new ATOM 0 HD1 PHE A 15 25.802 -17.680 -18.861 1.00 0.00 H new ATOM 0 HD2 PHE A 15 24.198 -14.397 -16.670 1.00 0.00 H new ATOM 0 HE1 PHE A 15 23.778 -17.744 -20.251 1.00 0.00 H new ATOM 0 HE2 PHE A 15 22.171 -14.462 -18.056 1.00 0.00 H new ATOM 0 HZ PHE A 15 21.958 -16.133 -19.852 1.00 0.00 H new ATOM 202 N SER A 16 26.465 -18.940 -16.868 1.00 0.00 N ATOM 203 CA SER A 16 26.055 -20.263 -17.326 1.00 0.00 C ATOM 204 C SER A 16 25.882 -21.216 -16.147 1.00 0.00 C ATOM 205 O SER A 16 24.909 -21.968 -16.078 1.00 0.00 O ATOM 206 CB SER A 16 27.084 -20.828 -18.306 1.00 0.00 C ATOM 207 OG SER A 16 28.405 -20.547 -17.877 1.00 0.00 O ATOM 0 H SER A 16 27.324 -18.593 -17.295 1.00 0.00 H new ATOM 0 HA SER A 16 25.096 -20.164 -17.835 1.00 0.00 H new ATOM 0 HB2 SER A 16 26.950 -21.906 -18.398 1.00 0.00 H new ATOM 0 HB3 SER A 16 26.921 -20.401 -19.296 1.00 0.00 H new ATOM 0 HG SER A 16 29.044 -20.920 -18.520 1.00 0.00 H new ATOM 213 N THR A 17 26.834 -21.180 -15.220 1.00 0.00 N ATOM 214 CA THR A 17 26.790 -22.040 -14.044 1.00 0.00 C ATOM 215 C THR A 17 25.494 -21.840 -13.265 1.00 0.00 C ATOM 216 O THR A 17 24.970 -22.778 -12.664 1.00 0.00 O ATOM 217 CB THR A 17 27.984 -21.775 -13.108 1.00 0.00 C ATOM 218 OG1 THR A 17 27.983 -22.720 -12.033 1.00 0.00 O ATOM 219 CG2 THR A 17 27.929 -20.362 -12.548 1.00 0.00 C ATOM 0 H THR A 17 27.646 -20.564 -15.261 1.00 0.00 H new ATOM 0 HA THR A 17 26.841 -23.068 -14.403 1.00 0.00 H new ATOM 0 HB THR A 17 28.902 -21.884 -13.686 1.00 0.00 H new ATOM 0 HG1 THR A 17 28.746 -22.546 -11.443 1.00 0.00 H new ATOM 0 HG21 THR A 17 28.782 -20.198 -11.890 1.00 0.00 H new ATOM 0 HG22 THR A 17 27.960 -19.644 -13.368 1.00 0.00 H new ATOM 0 HG23 THR A 17 27.005 -20.230 -11.984 1.00 0.00 H new ATOM 227 N ASP A 18 24.983 -20.614 -13.281 1.00 0.00 N ATOM 228 CA ASP A 18 23.747 -20.292 -12.578 1.00 0.00 C ATOM 229 C ASP A 18 22.531 -20.609 -13.442 1.00 0.00 C ATOM 230 O ASP A 18 21.701 -21.444 -13.082 1.00 0.00 O ATOM 231 CB ASP A 18 23.733 -18.816 -12.178 1.00 0.00 C ATOM 232 CG ASP A 18 24.340 -18.581 -10.808 1.00 0.00 C ATOM 233 OD1 ASP A 18 25.279 -19.318 -10.441 1.00 0.00 O ATOM 234 OD2 ASP A 18 23.877 -17.660 -10.104 1.00 0.00 O ATOM 0 H ASP A 18 25.406 -19.827 -13.773 1.00 0.00 H new ATOM 0 HA ASP A 18 23.700 -20.905 -11.678 1.00 0.00 H new ATOM 0 HB2 ASP A 18 24.282 -18.236 -12.920 1.00 0.00 H new ATOM 0 HB3 ASP A 18 22.706 -18.451 -12.185 1.00 0.00 H new ATOM 239 N VAL A 19 22.431 -19.936 -14.584 1.00 0.00 N ATOM 240 CA VAL A 19 21.317 -20.146 -15.500 1.00 0.00 C ATOM 241 C VAL A 19 21.192 -21.615 -15.888 1.00 0.00 C ATOM 242 O VAL A 19 20.192 -22.266 -15.584 1.00 0.00 O ATOM 243 CB VAL A 19 21.474 -19.301 -16.778 1.00 0.00 C ATOM 244 CG1 VAL A 19 20.297 -19.526 -17.716 1.00 0.00 C ATOM 245 CG2 VAL A 19 21.612 -17.827 -16.428 1.00 0.00 C ATOM 0 H VAL A 19 23.109 -19.241 -14.897 1.00 0.00 H new ATOM 0 HA VAL A 19 20.414 -19.834 -14.975 1.00 0.00 H new ATOM 0 HB VAL A 19 22.382 -19.616 -17.291 1.00 0.00 H new ATOM 0 HG11 VAL A 19 20.426 -18.921 -18.613 1.00 0.00 H new ATOM 0 HG12 VAL A 19 20.248 -20.579 -17.993 1.00 0.00 H new ATOM 0 HG13 VAL A 19 19.372 -19.240 -17.215 1.00 0.00 H new ATOM 0 HG21 VAL A 19 21.722 -17.245 -17.343 1.00 0.00 H new ATOM 0 HG22 VAL A 19 20.723 -17.496 -15.892 1.00 0.00 H new ATOM 0 HG23 VAL A 19 22.490 -17.683 -15.799 1.00 0.00 H new ATOM 255 N LEU A 20 22.215 -22.132 -16.559 1.00 0.00 N ATOM 256 CA LEU A 20 22.222 -23.526 -16.989 1.00 0.00 C ATOM 257 C LEU A 20 22.122 -24.465 -15.791 1.00 0.00 C ATOM 258 O LEU A 20 21.522 -25.536 -15.876 1.00 0.00 O ATOM 259 CB LEU A 20 23.493 -23.829 -17.784 1.00 0.00 C ATOM 260 CG LEU A 20 23.911 -22.774 -18.809 1.00 0.00 C ATOM 261 CD1 LEU A 20 25.110 -23.255 -19.612 1.00 0.00 C ATOM 262 CD2 LEU A 20 22.749 -22.438 -19.733 1.00 0.00 C ATOM 0 H LEU A 20 23.051 -21.607 -16.817 1.00 0.00 H new ATOM 0 HA LEU A 20 21.354 -23.688 -17.628 1.00 0.00 H new ATOM 0 HB2 LEU A 20 24.313 -23.968 -17.080 1.00 0.00 H new ATOM 0 HB3 LEU A 20 23.355 -24.777 -18.304 1.00 0.00 H new ATOM 0 HG LEU A 20 24.197 -21.869 -18.273 1.00 0.00 H new ATOM 0 HD11 LEU A 20 25.393 -22.491 -20.336 1.00 0.00 H new ATOM 0 HD12 LEU A 20 25.946 -23.445 -18.939 1.00 0.00 H new ATOM 0 HD13 LEU A 20 24.851 -24.175 -20.137 1.00 0.00 H new ATOM 0 HD21 LEU A 20 23.065 -21.686 -20.456 1.00 0.00 H new ATOM 0 HD22 LEU A 20 22.432 -23.338 -20.261 1.00 0.00 H new ATOM 0 HD23 LEU A 20 21.917 -22.050 -19.145 1.00 0.00 H new ATOM 274 N GLY A 21 22.714 -24.055 -14.673 1.00 0.00 N ATOM 275 CA GLY A 21 22.678 -24.871 -13.473 1.00 0.00 C ATOM 276 C GLY A 21 21.294 -24.938 -12.858 1.00 0.00 C ATOM 277 O GLY A 21 20.955 -25.908 -12.181 1.00 0.00 O ATOM 0 H GLY A 21 23.217 -23.173 -14.577 1.00 0.00 H new ATOM 0 HA2 GLY A 21 23.015 -25.880 -13.713 1.00 0.00 H new ATOM 0 HA3 GLY A 21 23.378 -24.467 -12.742 1.00 0.00 H new ATOM 281 N SER A 22 20.493 -23.904 -13.094 1.00 0.00 N ATOM 282 CA SER A 22 19.140 -23.847 -12.554 1.00 0.00 C ATOM 283 C SER A 22 18.136 -24.436 -13.541 1.00 0.00 C ATOM 284 O SER A 22 17.744 -23.783 -14.508 1.00 0.00 O ATOM 285 CB SER A 22 18.760 -22.402 -12.224 1.00 0.00 C ATOM 286 OG SER A 22 17.512 -22.343 -11.555 1.00 0.00 O ATOM 0 H SER A 22 20.758 -23.095 -13.655 1.00 0.00 H new ATOM 0 HA SER A 22 19.115 -24.440 -11.639 1.00 0.00 H new ATOM 0 HB2 SER A 22 19.532 -21.953 -11.600 1.00 0.00 H new ATOM 0 HB3 SER A 22 18.712 -21.816 -13.142 1.00 0.00 H new ATOM 0 HG SER A 22 17.292 -21.409 -11.354 1.00 0.00 H new ATOM 292 N SER A 23 17.725 -25.674 -13.289 1.00 0.00 N ATOM 293 CA SER A 23 16.770 -26.354 -14.156 1.00 0.00 C ATOM 294 C SER A 23 15.534 -25.490 -14.386 1.00 0.00 C ATOM 295 O SER A 23 14.940 -25.508 -15.464 1.00 0.00 O ATOM 296 CB SER A 23 16.362 -27.697 -13.547 1.00 0.00 C ATOM 297 OG SER A 23 17.442 -28.614 -13.565 1.00 0.00 O ATOM 0 H SER A 23 18.038 -26.227 -12.491 1.00 0.00 H new ATOM 0 HA SER A 23 17.252 -26.531 -15.118 1.00 0.00 H new ATOM 0 HB2 SER A 23 16.025 -27.547 -12.521 1.00 0.00 H new ATOM 0 HB3 SER A 23 15.520 -28.111 -14.102 1.00 0.00 H new ATOM 0 HG SER A 23 17.156 -29.464 -13.169 1.00 0.00 H new ATOM 303 N LYS A 24 15.151 -24.733 -13.363 1.00 0.00 N ATOM 304 CA LYS A 24 13.986 -23.860 -13.451 1.00 0.00 C ATOM 305 C LYS A 24 14.178 -22.804 -14.535 1.00 0.00 C ATOM 306 O LYS A 24 15.295 -22.519 -14.967 1.00 0.00 O ATOM 307 CB LYS A 24 13.729 -23.182 -12.103 1.00 0.00 C ATOM 308 CG LYS A 24 12.815 -23.976 -11.187 1.00 0.00 C ATOM 309 CD LYS A 24 13.396 -25.344 -10.869 1.00 0.00 C ATOM 310 CE LYS A 24 12.463 -26.153 -9.981 1.00 0.00 C ATOM 311 NZ LYS A 24 12.795 -27.605 -10.005 1.00 0.00 N ATOM 0 H LYS A 24 15.631 -24.706 -12.463 1.00 0.00 H new ATOM 0 HA LYS A 24 13.123 -24.472 -13.714 1.00 0.00 H new ATOM 0 HB2 LYS A 24 14.682 -23.020 -11.600 1.00 0.00 H new ATOM 0 HB3 LYS A 24 13.290 -22.200 -12.278 1.00 0.00 H new ATOM 0 HG2 LYS A 24 12.656 -23.423 -10.261 1.00 0.00 H new ATOM 0 HG3 LYS A 24 11.839 -24.095 -11.659 1.00 0.00 H new ATOM 0 HD2 LYS A 24 13.579 -25.887 -11.796 1.00 0.00 H new ATOM 0 HD3 LYS A 24 14.359 -25.225 -10.373 1.00 0.00 H new ATOM 0 HE2 LYS A 24 12.524 -25.783 -8.957 1.00 0.00 H new ATOM 0 HE3 LYS A 24 11.434 -26.010 -10.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 12.137 -28.122 -9.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 12.712 -27.964 -10.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 13.769 -27.744 -9.667 1.00 0.00 H new ATOM 325 N PRO A 25 13.064 -22.207 -14.985 1.00 0.00 N ATOM 326 CA PRO A 25 13.084 -21.172 -16.022 1.00 0.00 C ATOM 327 C PRO A 25 13.701 -19.868 -15.528 1.00 0.00 C ATOM 328 O PRO A 25 13.507 -19.475 -14.377 1.00 0.00 O ATOM 329 CB PRO A 25 11.603 -20.972 -16.353 1.00 0.00 C ATOM 330 CG PRO A 25 10.880 -21.391 -15.119 1.00 0.00 C ATOM 331 CD PRO A 25 11.699 -22.497 -14.514 1.00 0.00 C ATOM 0 HA PRO A 25 13.690 -21.466 -16.879 1.00 0.00 H new ATOM 0 HB2 PRO A 25 11.390 -19.933 -16.603 1.00 0.00 H new ATOM 0 HB3 PRO A 25 11.304 -21.574 -17.211 1.00 0.00 H new ATOM 0 HG2 PRO A 25 10.777 -20.557 -14.425 1.00 0.00 H new ATOM 0 HG3 PRO A 25 9.873 -21.735 -15.355 1.00 0.00 H new ATOM 0 HD2 PRO A 25 11.640 -22.492 -13.426 1.00 0.00 H new ATOM 0 HD3 PRO A 25 11.359 -23.478 -14.847 1.00 0.00 H new ATOM 339 N VAL A 26 14.444 -19.200 -16.405 1.00 0.00 N ATOM 340 CA VAL A 26 15.087 -17.939 -16.058 1.00 0.00 C ATOM 341 C VAL A 26 15.140 -17.000 -17.258 1.00 0.00 C ATOM 342 O VAL A 26 15.289 -17.441 -18.399 1.00 0.00 O ATOM 343 CB VAL A 26 16.517 -18.164 -15.533 1.00 0.00 C ATOM 344 CG1 VAL A 26 16.496 -19.021 -14.277 1.00 0.00 C ATOM 345 CG2 VAL A 26 17.385 -18.800 -16.608 1.00 0.00 C ATOM 0 H VAL A 26 14.615 -19.512 -17.361 1.00 0.00 H new ATOM 0 HA VAL A 26 14.486 -17.484 -15.271 1.00 0.00 H new ATOM 0 HB VAL A 26 16.948 -17.196 -15.276 1.00 0.00 H new ATOM 0 HG11 VAL A 26 17.515 -19.169 -13.921 1.00 0.00 H new ATOM 0 HG12 VAL A 26 15.911 -18.521 -13.505 1.00 0.00 H new ATOM 0 HG13 VAL A 26 16.047 -19.988 -14.504 1.00 0.00 H new ATOM 0 HG21 VAL A 26 18.392 -18.952 -16.220 1.00 0.00 H new ATOM 0 HG22 VAL A 26 16.959 -19.761 -16.898 1.00 0.00 H new ATOM 0 HG23 VAL A 26 17.426 -18.144 -17.477 1.00 0.00 H new ATOM 355 N LEU A 27 15.018 -15.704 -16.994 1.00 0.00 N ATOM 356 CA LEU A 27 15.053 -14.701 -18.053 1.00 0.00 C ATOM 357 C LEU A 27 16.224 -13.744 -17.859 1.00 0.00 C ATOM 358 O LEU A 27 16.504 -13.308 -16.742 1.00 0.00 O ATOM 359 CB LEU A 27 13.739 -13.919 -18.085 1.00 0.00 C ATOM 360 CG LEU A 27 13.732 -12.652 -18.941 1.00 0.00 C ATOM 361 CD1 LEU A 27 12.355 -12.423 -19.545 1.00 0.00 C ATOM 362 CD2 LEU A 27 14.161 -11.448 -18.116 1.00 0.00 C ATOM 0 H LEU A 27 14.894 -15.323 -16.056 1.00 0.00 H new ATOM 0 HA LEU A 27 15.185 -15.217 -19.004 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.954 -14.582 -18.447 1.00 0.00 H new ATOM 0 HB3 LEU A 27 13.478 -13.644 -17.063 1.00 0.00 H new ATOM 0 HG LEU A 27 14.446 -12.783 -19.754 1.00 0.00 H new ATOM 0 HD11 LEU A 27 12.369 -11.517 -20.151 1.00 0.00 H new ATOM 0 HD12 LEU A 27 12.086 -13.274 -20.171 1.00 0.00 H new ATOM 0 HD13 LEU A 27 11.621 -12.314 -18.747 1.00 0.00 H new ATOM 0 HD21 LEU A 27 14.150 -10.556 -18.742 1.00 0.00 H new ATOM 0 HD22 LEU A 27 13.472 -11.315 -17.282 1.00 0.00 H new ATOM 0 HD23 LEU A 27 15.168 -11.610 -17.733 1.00 0.00 H new ATOM 374 N VAL A 28 16.904 -13.418 -18.953 1.00 0.00 N ATOM 375 CA VAL A 28 18.043 -12.509 -18.904 1.00 0.00 C ATOM 376 C VAL A 28 17.921 -11.417 -19.960 1.00 0.00 C ATOM 377 O VAL A 28 17.544 -11.683 -21.102 1.00 0.00 O ATOM 378 CB VAL A 28 19.371 -13.262 -19.110 1.00 0.00 C ATOM 379 CG1 VAL A 28 20.542 -12.291 -19.099 1.00 0.00 C ATOM 380 CG2 VAL A 28 19.546 -14.334 -18.045 1.00 0.00 C ATOM 0 H VAL A 28 16.686 -13.770 -19.885 1.00 0.00 H new ATOM 0 HA VAL A 28 18.042 -12.054 -17.914 1.00 0.00 H new ATOM 0 HB VAL A 28 19.345 -13.751 -20.084 1.00 0.00 H new ATOM 0 HG11 VAL A 28 21.472 -12.841 -19.246 1.00 0.00 H new ATOM 0 HG12 VAL A 28 20.419 -11.564 -19.902 1.00 0.00 H new ATOM 0 HG13 VAL A 28 20.575 -11.772 -18.141 1.00 0.00 H new ATOM 0 HG21 VAL A 28 20.489 -14.856 -18.206 1.00 0.00 H new ATOM 0 HG22 VAL A 28 19.552 -13.870 -17.059 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.723 -15.046 -18.106 1.00 0.00 H new ATOM 390 N ASP A 29 18.242 -10.188 -19.572 1.00 0.00 N ATOM 391 CA ASP A 29 18.170 -9.054 -20.487 1.00 0.00 C ATOM 392 C ASP A 29 19.546 -8.425 -20.682 1.00 0.00 C ATOM 393 O ASP A 29 20.194 -8.013 -19.719 1.00 0.00 O ATOM 394 CB ASP A 29 17.188 -8.008 -19.959 1.00 0.00 C ATOM 395 CG ASP A 29 16.359 -7.383 -21.065 1.00 0.00 C ATOM 396 OD1 ASP A 29 16.804 -6.366 -21.637 1.00 0.00 O ATOM 397 OD2 ASP A 29 15.266 -7.910 -21.357 1.00 0.00 O ATOM 0 H ASP A 29 18.555 -9.951 -18.630 1.00 0.00 H new ATOM 0 HA ASP A 29 17.817 -9.419 -21.452 1.00 0.00 H new ATOM 0 HB2 ASP A 29 16.524 -8.472 -19.229 1.00 0.00 H new ATOM 0 HB3 ASP A 29 17.740 -7.227 -19.436 1.00 0.00 H new ATOM 402 N PHE A 30 19.988 -8.356 -21.933 1.00 0.00 N ATOM 403 CA PHE A 30 21.288 -7.779 -22.254 1.00 0.00 C ATOM 404 C PHE A 30 21.186 -6.266 -22.422 1.00 0.00 C ATOM 405 O PHE A 30 20.407 -5.773 -23.238 1.00 0.00 O ATOM 406 CB PHE A 30 21.848 -8.409 -23.532 1.00 0.00 C ATOM 407 CG PHE A 30 22.557 -9.712 -23.297 1.00 0.00 C ATOM 408 CD1 PHE A 30 23.838 -9.916 -23.783 1.00 0.00 C ATOM 409 CD2 PHE A 30 21.942 -10.733 -22.590 1.00 0.00 C ATOM 410 CE1 PHE A 30 24.494 -11.114 -23.568 1.00 0.00 C ATOM 411 CE2 PHE A 30 22.592 -11.932 -22.372 1.00 0.00 C ATOM 412 CZ PHE A 30 23.869 -12.124 -22.863 1.00 0.00 C ATOM 0 H PHE A 30 19.465 -8.693 -22.741 1.00 0.00 H new ATOM 0 HA PHE A 30 21.965 -7.990 -21.426 1.00 0.00 H new ATOM 0 HB2 PHE A 30 21.032 -8.571 -24.236 1.00 0.00 H new ATOM 0 HB3 PHE A 30 22.539 -7.708 -24.001 1.00 0.00 H new ATOM 0 HD1 PHE A 30 24.330 -9.130 -24.336 1.00 0.00 H new ATOM 0 HD2 PHE A 30 20.943 -10.590 -22.205 1.00 0.00 H new ATOM 0 HE1 PHE A 30 25.493 -11.260 -23.951 1.00 0.00 H new ATOM 0 HE2 PHE A 30 22.102 -12.719 -21.818 1.00 0.00 H new ATOM 0 HZ PHE A 30 24.378 -13.062 -22.696 1.00 0.00 H new ATOM 422 N TRP A 31 21.976 -5.535 -21.645 1.00 0.00 N ATOM 423 CA TRP A 31 21.975 -4.078 -21.707 1.00 0.00 C ATOM 424 C TRP A 31 23.264 -3.507 -21.127 1.00 0.00 C ATOM 425 O TRP A 31 23.917 -4.141 -20.299 1.00 0.00 O ATOM 426 CB TRP A 31 20.769 -3.517 -20.952 1.00 0.00 C ATOM 427 CG TRP A 31 20.914 -3.589 -19.462 1.00 0.00 C ATOM 428 CD1 TRP A 31 21.511 -4.586 -18.744 1.00 0.00 C ATOM 429 CD2 TRP A 31 20.453 -2.626 -18.508 1.00 0.00 C ATOM 430 NE1 TRP A 31 21.448 -4.301 -17.401 1.00 0.00 N ATOM 431 CE2 TRP A 31 20.805 -3.103 -17.230 1.00 0.00 C ATOM 432 CE3 TRP A 31 19.779 -1.406 -18.609 1.00 0.00 C ATOM 433 CZ2 TRP A 31 20.504 -2.403 -16.065 1.00 0.00 C ATOM 434 CZ3 TRP A 31 19.481 -0.712 -17.451 1.00 0.00 C ATOM 435 CH2 TRP A 31 19.843 -1.212 -16.193 1.00 0.00 C ATOM 0 H TRP A 31 22.626 -5.927 -20.964 1.00 0.00 H new ATOM 0 HA TRP A 31 21.909 -3.783 -22.754 1.00 0.00 H new ATOM 0 HB2 TRP A 31 20.617 -2.478 -21.245 1.00 0.00 H new ATOM 0 HB3 TRP A 31 19.876 -4.066 -21.250 1.00 0.00 H new ATOM 0 HD1 TRP A 31 21.966 -5.469 -19.169 1.00 0.00 H new ATOM 0 HE1 TRP A 31 21.820 -4.886 -16.653 1.00 0.00 H new ATOM 0 HE3 TRP A 31 19.496 -1.012 -19.574 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 20.782 -2.786 -15.095 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 18.960 0.232 -17.517 1.00 0.00 H new ATOM 0 HH2 TRP A 31 19.595 -0.646 -15.307 1.00 0.00 H new ATOM 446 N ALA A 32 23.625 -2.306 -21.567 1.00 0.00 N ATOM 447 CA ALA A 32 24.835 -1.649 -21.089 1.00 0.00 C ATOM 448 C ALA A 32 24.516 -0.644 -19.988 1.00 0.00 C ATOM 449 O ALA A 32 23.351 -0.343 -19.726 1.00 0.00 O ATOM 450 CB ALA A 32 25.553 -0.963 -22.242 1.00 0.00 C ATOM 0 H ALA A 32 23.096 -1.768 -22.254 1.00 0.00 H new ATOM 0 HA ALA A 32 25.491 -2.411 -20.669 1.00 0.00 H new ATOM 0 HB1 ALA A 32 26.455 -0.476 -21.871 1.00 0.00 H new ATOM 0 HB2 ALA A 32 25.824 -1.704 -22.994 1.00 0.00 H new ATOM 0 HB3 ALA A 32 24.895 -0.217 -22.688 1.00 0.00 H new ATOM 456 N THR A 33 25.558 -0.127 -19.345 1.00 0.00 N ATOM 457 CA THR A 33 25.389 0.843 -18.270 1.00 0.00 C ATOM 458 C THR A 33 25.089 2.231 -18.825 1.00 0.00 C ATOM 459 O THR A 33 24.349 3.005 -18.219 1.00 0.00 O ATOM 460 CB THR A 33 26.643 0.918 -17.379 1.00 0.00 C ATOM 461 OG1 THR A 33 27.693 1.608 -18.067 1.00 0.00 O ATOM 462 CG2 THR A 33 27.115 -0.474 -16.989 1.00 0.00 C ATOM 0 H THR A 33 26.529 -0.364 -19.550 1.00 0.00 H new ATOM 0 HA THR A 33 24.545 0.505 -17.668 1.00 0.00 H new ATOM 0 HB THR A 33 26.384 1.464 -16.472 1.00 0.00 H new ATOM 0 HG1 THR A 33 28.486 1.653 -17.493 1.00 0.00 H new ATOM 0 HG21 THR A 33 28.002 -0.395 -16.360 1.00 0.00 H new ATOM 0 HG22 THR A 33 26.325 -0.985 -16.439 1.00 0.00 H new ATOM 0 HG23 THR A 33 27.357 -1.041 -17.888 1.00 0.00 H new ATOM 470 N TRP A 34 25.668 2.538 -19.980 1.00 0.00 N ATOM 471 CA TRP A 34 25.462 3.834 -20.617 1.00 0.00 C ATOM 472 C TRP A 34 24.380 3.748 -21.688 1.00 0.00 C ATOM 473 O TRP A 34 24.357 4.547 -22.625 1.00 0.00 O ATOM 474 CB TRP A 34 26.768 4.337 -21.233 1.00 0.00 C ATOM 475 CG TRP A 34 26.759 5.806 -21.529 1.00 0.00 C ATOM 476 CD1 TRP A 34 26.065 6.773 -20.858 1.00 0.00 C ATOM 477 CD2 TRP A 34 27.474 6.474 -22.573 1.00 0.00 C ATOM 478 NE1 TRP A 34 26.307 8.002 -21.423 1.00 0.00 N ATOM 479 CE2 TRP A 34 27.169 7.846 -22.476 1.00 0.00 C ATOM 480 CE3 TRP A 34 28.345 6.048 -23.580 1.00 0.00 C ATOM 481 CZ2 TRP A 34 27.702 8.791 -23.349 1.00 0.00 C ATOM 482 CZ3 TRP A 34 28.874 6.987 -24.445 1.00 0.00 C ATOM 483 CH2 TRP A 34 28.552 8.345 -24.325 1.00 0.00 C ATOM 0 H TRP A 34 26.283 1.908 -20.494 1.00 0.00 H new ATOM 0 HA TRP A 34 25.135 4.539 -19.852 1.00 0.00 H new ATOM 0 HB2 TRP A 34 27.591 4.116 -20.553 1.00 0.00 H new ATOM 0 HB3 TRP A 34 26.961 3.789 -22.155 1.00 0.00 H new ATOM 0 HD1 TRP A 34 25.421 6.597 -20.009 1.00 0.00 H new ATOM 0 HE1 TRP A 34 25.909 8.887 -21.109 1.00 0.00 H new ATOM 0 HE3 TRP A 34 28.600 5.003 -23.680 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 27.454 9.838 -23.259 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 29.547 6.668 -25.227 1.00 0.00 H new ATOM 0 HH2 TRP A 34 28.983 9.054 -25.016 1.00 0.00 H new ATOM 494 N CYS A 35 23.487 2.776 -21.544 1.00 0.00 N ATOM 495 CA CYS A 35 22.403 2.586 -22.501 1.00 0.00 C ATOM 496 C CYS A 35 21.619 3.879 -22.698 1.00 0.00 C ATOM 497 O CYS A 35 21.005 4.394 -21.764 1.00 0.00 O ATOM 498 CB CYS A 35 21.465 1.474 -22.027 1.00 0.00 C ATOM 499 SG CYS A 35 19.987 1.270 -23.047 1.00 0.00 S ATOM 0 H CYS A 35 23.492 2.107 -20.774 1.00 0.00 H new ATOM 0 HA CYS A 35 22.841 2.299 -23.457 1.00 0.00 H new ATOM 0 HB2 CYS A 35 22.014 0.533 -22.010 1.00 0.00 H new ATOM 0 HB3 CYS A 35 21.160 1.683 -21.002 1.00 0.00 H new ATOM 0 HG CYS A 35 19.259 0.306 -22.568 1.00 0.00 H new ATOM 505 N GLY A 36 21.646 4.401 -23.921 1.00 0.00 N ATOM 506 CA GLY A 36 20.935 5.631 -24.218 1.00 0.00 C ATOM 507 C GLY A 36 19.458 5.541 -23.891 1.00 0.00 C ATOM 508 O GLY A 36 18.960 6.205 -22.981 1.00 0.00 O ATOM 0 H GLY A 36 22.147 3.994 -24.711 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.380 6.450 -23.652 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.056 5.871 -25.274 1.00 0.00 H new ATOM 512 N PRO A 37 18.731 4.705 -24.646 1.00 0.00 N ATOM 513 CA PRO A 37 17.291 4.512 -24.452 1.00 0.00 C ATOM 514 C PRO A 37 16.975 3.773 -23.156 1.00 0.00 C ATOM 515 O PRO A 37 16.437 2.665 -23.177 1.00 0.00 O ATOM 516 CB PRO A 37 16.879 3.669 -25.661 1.00 0.00 C ATOM 517 CG PRO A 37 18.121 2.951 -26.063 1.00 0.00 C ATOM 518 CD PRO A 37 19.258 3.883 -25.748 1.00 0.00 C ATOM 0 HA PRO A 37 16.760 5.461 -24.376 1.00 0.00 H new ATOM 0 HB2 PRO A 37 16.083 2.970 -25.404 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.504 4.295 -26.471 1.00 0.00 H new ATOM 0 HG2 PRO A 37 18.223 2.013 -25.518 1.00 0.00 H new ATOM 0 HG3 PRO A 37 18.102 2.703 -27.124 1.00 0.00 H new ATOM 0 HD2 PRO A 37 20.153 3.338 -25.450 1.00 0.00 H new ATOM 0 HD3 PRO A 37 19.528 4.493 -26.610 1.00 0.00 H new ATOM 526 N CYS A 38 17.312 4.392 -22.030 1.00 0.00 N ATOM 527 CA CYS A 38 17.065 3.792 -20.724 1.00 0.00 C ATOM 528 C CYS A 38 15.652 4.105 -20.240 1.00 0.00 C ATOM 529 O CYS A 38 15.010 3.282 -19.588 1.00 0.00 O ATOM 530 CB CYS A 38 18.089 4.296 -19.706 1.00 0.00 C ATOM 531 SG CYS A 38 18.110 6.093 -19.507 1.00 0.00 S ATOM 0 H CYS A 38 17.757 5.309 -21.995 1.00 0.00 H new ATOM 0 HA CYS A 38 17.164 2.711 -20.824 1.00 0.00 H new ATOM 0 HB2 CYS A 38 17.881 3.837 -18.740 1.00 0.00 H new ATOM 0 HB3 CYS A 38 19.081 3.963 -20.010 1.00 0.00 H new ATOM 0 HG CYS A 38 19.006 6.421 -18.624 1.00 0.00 H new ATOM 537 N LYS A 39 15.174 5.302 -20.563 1.00 0.00 N ATOM 538 CA LYS A 39 13.838 5.727 -20.162 1.00 0.00 C ATOM 539 C LYS A 39 12.776 5.091 -21.052 1.00 0.00 C ATOM 540 O LYS A 39 11.693 4.737 -20.587 1.00 0.00 O ATOM 541 CB LYS A 39 13.725 7.252 -20.224 1.00 0.00 C ATOM 542 CG LYS A 39 14.917 7.975 -19.621 1.00 0.00 C ATOM 543 CD LYS A 39 15.215 7.483 -18.214 1.00 0.00 C ATOM 544 CE LYS A 39 16.352 8.269 -17.579 1.00 0.00 C ATOM 545 NZ LYS A 39 17.127 7.440 -16.615 1.00 0.00 N ATOM 0 H LYS A 39 15.693 5.996 -21.102 1.00 0.00 H new ATOM 0 HA LYS A 39 13.672 5.399 -19.136 1.00 0.00 H new ATOM 0 HB2 LYS A 39 13.613 7.558 -21.264 1.00 0.00 H new ATOM 0 HB3 LYS A 39 12.820 7.562 -19.702 1.00 0.00 H new ATOM 0 HG2 LYS A 39 15.792 7.825 -20.253 1.00 0.00 H new ATOM 0 HG3 LYS A 39 14.720 9.047 -19.598 1.00 0.00 H new ATOM 0 HD2 LYS A 39 14.320 7.574 -17.598 1.00 0.00 H new ATOM 0 HD3 LYS A 39 15.475 6.425 -18.245 1.00 0.00 H new ATOM 0 HE2 LYS A 39 17.018 8.638 -18.359 1.00 0.00 H new ATOM 0 HE3 LYS A 39 15.948 9.141 -17.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 17.755 8.053 -16.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 16.471 6.945 -15.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 17.696 6.743 -17.136 1.00 0.00 H new ATOM 559 N MET A 40 13.093 4.948 -22.335 1.00 0.00 N ATOM 560 CA MET A 40 12.165 4.352 -23.290 1.00 0.00 C ATOM 561 C MET A 40 11.780 2.939 -22.863 1.00 0.00 C ATOM 562 O MET A 40 10.663 2.487 -23.116 1.00 0.00 O ATOM 563 CB MET A 40 12.787 4.324 -24.687 1.00 0.00 C ATOM 564 CG MET A 40 11.761 4.313 -25.809 1.00 0.00 C ATOM 565 SD MET A 40 12.438 4.894 -27.376 1.00 0.00 S ATOM 566 CE MET A 40 11.821 6.575 -27.409 1.00 0.00 C ATOM 0 H MET A 40 13.985 5.236 -22.737 1.00 0.00 H new ATOM 0 HA MET A 40 11.263 4.964 -23.314 1.00 0.00 H new ATOM 0 HB2 MET A 40 13.434 5.194 -24.805 1.00 0.00 H new ATOM 0 HB3 MET A 40 13.420 3.441 -24.776 1.00 0.00 H new ATOM 0 HG2 MET A 40 11.379 3.300 -25.936 1.00 0.00 H new ATOM 0 HG3 MET A 40 10.915 4.940 -25.528 1.00 0.00 H new ATOM 0 HE1 MET A 40 12.157 7.068 -28.321 1.00 0.00 H new ATOM 0 HE2 MET A 40 10.731 6.563 -27.383 1.00 0.00 H new ATOM 0 HE3 MET A 40 12.199 7.118 -26.543 1.00 0.00 H new ATOM 576 N VAL A 41 12.711 2.246 -22.215 1.00 0.00 N ATOM 577 CA VAL A 41 12.468 0.885 -21.753 1.00 0.00 C ATOM 578 C VAL A 41 12.641 0.778 -20.243 1.00 0.00 C ATOM 579 O VAL A 41 12.848 -0.310 -19.707 1.00 0.00 O ATOM 580 CB VAL A 41 13.413 -0.118 -22.440 1.00 0.00 C ATOM 581 CG1 VAL A 41 12.899 -1.539 -22.271 1.00 0.00 C ATOM 582 CG2 VAL A 41 13.576 0.227 -23.913 1.00 0.00 C ATOM 0 H VAL A 41 13.641 2.605 -21.998 1.00 0.00 H new ATOM 0 HA VAL A 41 11.439 0.641 -22.015 1.00 0.00 H new ATOM 0 HB VAL A 41 14.391 -0.053 -21.964 1.00 0.00 H new ATOM 0 HG11 VAL A 41 13.580 -2.233 -22.763 1.00 0.00 H new ATOM 0 HG12 VAL A 41 12.839 -1.780 -21.210 1.00 0.00 H new ATOM 0 HG13 VAL A 41 11.909 -1.623 -22.719 1.00 0.00 H new ATOM 0 HG21 VAL A 41 14.247 -0.492 -24.383 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.604 0.191 -24.405 1.00 0.00 H new ATOM 0 HG23 VAL A 41 13.994 1.229 -24.008 1.00 0.00 H new ATOM 592 N ALA A 42 12.556 1.916 -19.561 1.00 0.00 N ATOM 593 CA ALA A 42 12.701 1.950 -18.111 1.00 0.00 C ATOM 594 C ALA A 42 11.501 1.306 -17.424 1.00 0.00 C ATOM 595 O ALA A 42 11.625 0.313 -16.707 1.00 0.00 O ATOM 596 CB ALA A 42 12.880 3.383 -17.632 1.00 0.00 C ATOM 0 H ALA A 42 12.387 2.826 -19.990 1.00 0.00 H new ATOM 0 HA ALA A 42 13.589 1.376 -17.846 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.987 3.393 -16.547 1.00 0.00 H new ATOM 0 HB2 ALA A 42 13.773 3.811 -18.089 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.009 3.973 -17.916 1.00 0.00 H new ATOM 602 N PRO A 43 10.311 1.884 -17.645 1.00 0.00 N ATOM 603 CA PRO A 43 9.066 1.383 -17.056 1.00 0.00 C ATOM 604 C PRO A 43 8.638 0.047 -17.653 1.00 0.00 C ATOM 605 O PRO A 43 7.833 -0.677 -17.067 1.00 0.00 O ATOM 606 CB PRO A 43 8.047 2.473 -17.399 1.00 0.00 C ATOM 607 CG PRO A 43 8.593 3.130 -18.620 1.00 0.00 C ATOM 608 CD PRO A 43 10.090 3.071 -18.489 1.00 0.00 C ATOM 0 HA PRO A 43 9.168 1.197 -15.987 1.00 0.00 H new ATOM 0 HB2 PRO A 43 7.060 2.048 -17.585 1.00 0.00 H new ATOM 0 HB3 PRO A 43 7.938 3.185 -16.581 1.00 0.00 H new ATOM 0 HG2 PRO A 43 8.260 2.616 -19.522 1.00 0.00 H new ATOM 0 HG3 PRO A 43 8.248 4.161 -18.695 1.00 0.00 H new ATOM 0 HD2 PRO A 43 10.575 2.970 -19.460 1.00 0.00 H new ATOM 0 HD3 PRO A 43 10.489 3.974 -18.026 1.00 0.00 H new ATOM 616 N VAL A 44 9.183 -0.275 -18.822 1.00 0.00 N ATOM 617 CA VAL A 44 8.859 -1.526 -19.498 1.00 0.00 C ATOM 618 C VAL A 44 9.626 -2.694 -18.889 1.00 0.00 C ATOM 619 O VAL A 44 9.116 -3.812 -18.810 1.00 0.00 O ATOM 620 CB VAL A 44 9.173 -1.448 -21.003 1.00 0.00 C ATOM 621 CG1 VAL A 44 8.924 -2.791 -21.671 1.00 0.00 C ATOM 622 CG2 VAL A 44 8.347 -0.354 -21.664 1.00 0.00 C ATOM 0 H VAL A 44 9.851 0.313 -19.321 1.00 0.00 H new ATOM 0 HA VAL A 44 7.789 -1.690 -19.366 1.00 0.00 H new ATOM 0 HB VAL A 44 10.227 -1.199 -21.123 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.151 -2.716 -22.734 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.563 -3.548 -21.216 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.879 -3.073 -21.542 1.00 0.00 H new ATOM 0 HG21 VAL A 44 8.582 -0.313 -22.728 1.00 0.00 H new ATOM 0 HG22 VAL A 44 7.287 -0.570 -21.535 1.00 0.00 H new ATOM 0 HG23 VAL A 44 8.580 0.606 -21.204 1.00 0.00 H new ATOM 632 N LEU A 45 10.855 -2.428 -18.461 1.00 0.00 N ATOM 633 CA LEU A 45 11.695 -3.457 -17.858 1.00 0.00 C ATOM 634 C LEU A 45 11.311 -3.689 -16.401 1.00 0.00 C ATOM 635 O LEU A 45 11.469 -4.791 -15.875 1.00 0.00 O ATOM 636 CB LEU A 45 13.169 -3.060 -17.952 1.00 0.00 C ATOM 637 CG LEU A 45 13.697 -2.169 -16.827 1.00 0.00 C ATOM 638 CD1 LEU A 45 14.250 -3.015 -15.691 1.00 0.00 C ATOM 639 CD2 LEU A 45 14.762 -1.219 -17.354 1.00 0.00 C ATOM 0 H LEU A 45 11.292 -1.508 -18.520 1.00 0.00 H new ATOM 0 HA LEU A 45 11.540 -4.386 -18.407 1.00 0.00 H new ATOM 0 HB2 LEU A 45 13.769 -3.970 -17.980 1.00 0.00 H new ATOM 0 HB3 LEU A 45 13.326 -2.546 -18.900 1.00 0.00 H new ATOM 0 HG LEU A 45 12.868 -1.575 -16.441 1.00 0.00 H new ATOM 0 HD11 LEU A 45 14.621 -2.364 -14.900 1.00 0.00 H new ATOM 0 HD12 LEU A 45 13.460 -3.653 -15.295 1.00 0.00 H new ATOM 0 HD13 LEU A 45 15.066 -3.635 -16.063 1.00 0.00 H new ATOM 0 HD21 LEU A 45 15.126 -0.593 -16.540 1.00 0.00 H new ATOM 0 HD22 LEU A 45 15.590 -1.794 -17.768 1.00 0.00 H new ATOM 0 HD23 LEU A 45 14.334 -0.588 -18.133 1.00 0.00 H new ATOM 651 N GLU A 46 10.803 -2.644 -15.754 1.00 0.00 N ATOM 652 CA GLU A 46 10.394 -2.736 -14.357 1.00 0.00 C ATOM 653 C GLU A 46 8.995 -3.333 -14.238 1.00 0.00 C ATOM 654 O GLU A 46 8.691 -4.039 -13.276 1.00 0.00 O ATOM 655 CB GLU A 46 10.429 -1.354 -13.701 1.00 0.00 C ATOM 656 CG GLU A 46 9.251 -0.472 -14.078 1.00 0.00 C ATOM 657 CD GLU A 46 8.074 -0.636 -13.135 1.00 0.00 C ATOM 658 OE1 GLU A 46 8.293 -0.617 -11.906 1.00 0.00 O ATOM 659 OE2 GLU A 46 6.936 -0.782 -13.626 1.00 0.00 O ATOM 0 H GLU A 46 10.665 -1.725 -16.175 1.00 0.00 H new ATOM 0 HA GLU A 46 11.095 -3.393 -13.842 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.449 -1.476 -12.618 1.00 0.00 H new ATOM 0 HB3 GLU A 46 11.354 -0.851 -13.983 1.00 0.00 H new ATOM 0 HG2 GLU A 46 9.568 0.571 -14.079 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.934 -0.710 -15.093 1.00 0.00 H new ATOM 666 N GLU A 47 8.149 -3.044 -15.221 1.00 0.00 N ATOM 667 CA GLU A 47 6.781 -3.551 -15.225 1.00 0.00 C ATOM 668 C GLU A 47 6.740 -5.000 -15.702 1.00 0.00 C ATOM 669 O GLU A 47 5.931 -5.797 -15.228 1.00 0.00 O ATOM 670 CB GLU A 47 5.894 -2.682 -16.118 1.00 0.00 C ATOM 671 CG GLU A 47 6.101 -2.927 -17.604 1.00 0.00 C ATOM 672 CD GLU A 47 5.260 -2.009 -18.469 1.00 0.00 C ATOM 673 OE1 GLU A 47 5.736 -0.901 -18.796 1.00 0.00 O ATOM 674 OE2 GLU A 47 4.126 -2.397 -18.819 1.00 0.00 O ATOM 0 H GLU A 47 8.386 -2.462 -16.025 1.00 0.00 H new ATOM 0 HA GLU A 47 6.403 -3.512 -14.203 1.00 0.00 H new ATOM 0 HB2 GLU A 47 4.849 -2.868 -15.870 1.00 0.00 H new ATOM 0 HB3 GLU A 47 6.091 -1.632 -15.900 1.00 0.00 H new ATOM 0 HG2 GLU A 47 7.154 -2.787 -17.848 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.856 -3.964 -17.835 1.00 0.00 H new ATOM 681 N ILE A 48 7.617 -5.331 -16.644 1.00 0.00 N ATOM 682 CA ILE A 48 7.681 -6.683 -17.185 1.00 0.00 C ATOM 683 C ILE A 48 8.415 -7.622 -16.234 1.00 0.00 C ATOM 684 O ILE A 48 8.071 -8.797 -16.116 1.00 0.00 O ATOM 685 CB ILE A 48 8.382 -6.708 -18.556 1.00 0.00 C ATOM 686 CG1 ILE A 48 7.502 -6.040 -19.615 1.00 0.00 C ATOM 687 CG2 ILE A 48 8.710 -8.138 -18.957 1.00 0.00 C ATOM 688 CD1 ILE A 48 6.217 -6.788 -19.892 1.00 0.00 C ATOM 0 H ILE A 48 8.292 -4.682 -17.048 1.00 0.00 H new ATOM 0 HA ILE A 48 6.653 -7.023 -17.306 1.00 0.00 H new ATOM 0 HB ILE A 48 9.315 -6.150 -18.481 1.00 0.00 H new ATOM 0 HG12 ILE A 48 7.261 -5.028 -19.290 1.00 0.00 H new ATOM 0 HG13 ILE A 48 8.068 -5.950 -20.542 1.00 0.00 H new ATOM 0 HG21 ILE A 48 9.205 -8.139 -19.928 1.00 0.00 H new ATOM 0 HG22 ILE A 48 9.371 -8.582 -18.212 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.790 -8.719 -19.018 1.00 0.00 H new ATOM 0 HD11 ILE A 48 5.644 -6.257 -20.652 1.00 0.00 H new ATOM 0 HD12 ILE A 48 6.450 -7.792 -20.248 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.630 -6.855 -18.976 1.00 0.00 H new ATOM 700 N ALA A 49 9.429 -7.094 -15.556 1.00 0.00 N ATOM 701 CA ALA A 49 10.210 -7.883 -14.612 1.00 0.00 C ATOM 702 C ALA A 49 9.346 -8.364 -13.451 1.00 0.00 C ATOM 703 O ALA A 49 9.523 -9.474 -12.951 1.00 0.00 O ATOM 704 CB ALA A 49 11.389 -7.073 -14.094 1.00 0.00 C ATOM 0 H ALA A 49 9.729 -6.123 -15.643 1.00 0.00 H new ATOM 0 HA ALA A 49 10.589 -8.760 -15.137 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.963 -7.675 -13.390 1.00 0.00 H new ATOM 0 HB2 ALA A 49 12.027 -6.784 -14.929 1.00 0.00 H new ATOM 0 HB3 ALA A 49 11.023 -6.178 -13.591 1.00 0.00 H new ATOM 710 N ALA A 50 8.412 -7.519 -13.026 1.00 0.00 N ATOM 711 CA ALA A 50 7.519 -7.859 -11.924 1.00 0.00 C ATOM 712 C ALA A 50 6.329 -8.676 -12.414 1.00 0.00 C ATOM 713 O ALA A 50 5.759 -9.469 -11.665 1.00 0.00 O ATOM 714 CB ALA A 50 7.042 -6.595 -11.224 1.00 0.00 C ATOM 0 H ALA A 50 8.254 -6.595 -13.428 1.00 0.00 H new ATOM 0 HA ALA A 50 8.075 -8.468 -11.212 1.00 0.00 H new ATOM 0 HB1 ALA A 50 6.376 -6.863 -10.404 1.00 0.00 H new ATOM 0 HB2 ALA A 50 7.901 -6.050 -10.832 1.00 0.00 H new ATOM 0 HB3 ALA A 50 6.507 -5.965 -11.935 1.00 0.00 H new ATOM 720 N GLU A 51 5.959 -8.478 -13.675 1.00 0.00 N ATOM 721 CA GLU A 51 4.835 -9.197 -14.263 1.00 0.00 C ATOM 722 C GLU A 51 4.954 -10.696 -14.007 1.00 0.00 C ATOM 723 O GLU A 51 4.129 -11.287 -13.310 1.00 0.00 O ATOM 724 CB GLU A 51 4.761 -8.929 -15.768 1.00 0.00 C ATOM 725 CG GLU A 51 3.853 -7.767 -16.136 1.00 0.00 C ATOM 726 CD GLU A 51 2.391 -8.163 -16.187 1.00 0.00 C ATOM 727 OE1 GLU A 51 1.631 -7.527 -16.948 1.00 0.00 O ATOM 728 OE2 GLU A 51 2.005 -9.108 -15.467 1.00 0.00 O ATOM 0 H GLU A 51 6.421 -7.826 -14.309 1.00 0.00 H new ATOM 0 HA GLU A 51 3.920 -8.838 -13.792 1.00 0.00 H new ATOM 0 HB2 GLU A 51 5.765 -8.727 -16.142 1.00 0.00 H new ATOM 0 HB3 GLU A 51 4.408 -9.829 -16.272 1.00 0.00 H new ATOM 0 HG2 GLU A 51 3.983 -6.965 -15.410 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.152 -7.370 -17.106 1.00 0.00 H new ATOM 735 N LYS A 52 5.987 -11.307 -14.578 1.00 0.00 N ATOM 736 CA LYS A 52 6.218 -12.738 -14.412 1.00 0.00 C ATOM 737 C LYS A 52 7.417 -12.994 -13.506 1.00 0.00 C ATOM 738 O LYS A 52 8.010 -14.072 -13.535 1.00 0.00 O ATOM 739 CB LYS A 52 6.442 -13.400 -15.773 1.00 0.00 C ATOM 740 CG LYS A 52 5.453 -12.955 -16.837 1.00 0.00 C ATOM 741 CD LYS A 52 4.027 -13.317 -16.459 1.00 0.00 C ATOM 742 CE LYS A 52 3.498 -14.461 -17.310 1.00 0.00 C ATOM 743 NZ LYS A 52 2.013 -14.559 -17.247 1.00 0.00 N ATOM 0 H LYS A 52 6.678 -10.833 -15.160 1.00 0.00 H new ATOM 0 HA LYS A 52 5.334 -13.172 -13.945 1.00 0.00 H new ATOM 0 HB2 LYS A 52 7.453 -13.178 -16.113 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.375 -14.482 -15.657 1.00 0.00 H new ATOM 0 HG2 LYS A 52 5.530 -11.877 -16.979 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.707 -13.421 -17.789 1.00 0.00 H new ATOM 0 HD2 LYS A 52 3.989 -13.597 -15.406 1.00 0.00 H new ATOM 0 HD3 LYS A 52 3.385 -12.445 -16.580 1.00 0.00 H new ATOM 0 HE2 LYS A 52 3.809 -14.318 -18.345 1.00 0.00 H new ATOM 0 HE3 LYS A 52 3.938 -15.399 -16.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.732 -15.560 -17.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 1.670 -14.081 -16.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.599 -14.105 -18.086 1.00 0.00 H new ATOM 757 N GLY A 53 7.769 -11.997 -12.700 1.00 0.00 N ATOM 758 CA GLY A 53 8.896 -12.136 -11.796 1.00 0.00 C ATOM 759 C GLY A 53 8.722 -13.288 -10.826 1.00 0.00 C ATOM 760 O GLY A 53 9.698 -13.917 -10.419 1.00 0.00 O ATOM 0 H GLY A 53 7.294 -11.095 -12.657 1.00 0.00 H new ATOM 0 HA2 GLY A 53 9.806 -12.288 -12.376 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.025 -11.210 -11.236 1.00 0.00 H new ATOM 764 N ASP A 54 7.477 -13.563 -10.455 1.00 0.00 N ATOM 765 CA ASP A 54 7.178 -14.647 -9.526 1.00 0.00 C ATOM 766 C ASP A 54 7.282 -16.002 -10.220 1.00 0.00 C ATOM 767 O ASP A 54 7.687 -16.992 -9.611 1.00 0.00 O ATOM 768 CB ASP A 54 5.779 -14.469 -8.934 1.00 0.00 C ATOM 769 CG ASP A 54 4.692 -14.990 -9.853 1.00 0.00 C ATOM 770 OD1 ASP A 54 4.377 -14.305 -10.849 1.00 0.00 O ATOM 771 OD2 ASP A 54 4.155 -16.084 -9.576 1.00 0.00 O ATOM 0 H ASP A 54 6.658 -13.051 -10.783 1.00 0.00 H new ATOM 0 HA ASP A 54 7.911 -14.615 -8.720 1.00 0.00 H new ATOM 0 HB2 ASP A 54 5.723 -14.990 -7.978 1.00 0.00 H new ATOM 0 HB3 ASP A 54 5.605 -13.412 -8.732 1.00 0.00 H new ATOM 776 N GLN A 55 6.913 -16.037 -11.496 1.00 0.00 N ATOM 777 CA GLN A 55 6.963 -17.271 -12.271 1.00 0.00 C ATOM 778 C GLN A 55 8.403 -17.642 -12.612 1.00 0.00 C ATOM 779 O GLN A 55 8.777 -18.815 -12.582 1.00 0.00 O ATOM 780 CB GLN A 55 6.144 -17.125 -13.555 1.00 0.00 C ATOM 781 CG GLN A 55 4.786 -16.477 -13.340 1.00 0.00 C ATOM 782 CD GLN A 55 3.836 -16.717 -14.496 1.00 0.00 C ATOM 783 OE1 GLN A 55 4.019 -17.646 -15.283 1.00 0.00 O ATOM 784 NE2 GLN A 55 2.812 -15.878 -14.605 1.00 0.00 N ATOM 0 H GLN A 55 6.576 -15.226 -12.015 1.00 0.00 H new ATOM 0 HA GLN A 55 6.535 -18.069 -11.664 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.711 -16.532 -14.272 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.001 -18.110 -13.999 1.00 0.00 H new ATOM 0 HG2 GLN A 55 4.343 -16.866 -12.424 1.00 0.00 H new ATOM 0 HG3 GLN A 55 4.918 -15.404 -13.200 1.00 0.00 H new ATOM 0 HE21 GLN A 55 2.698 -15.122 -13.930 1.00 0.00 H new ATOM 0 HE22 GLN A 55 2.139 -15.990 -15.363 1.00 0.00 H new ATOM 793 N LEU A 56 9.207 -16.635 -12.936 1.00 0.00 N ATOM 794 CA LEU A 56 10.607 -16.855 -13.283 1.00 0.00 C ATOM 795 C LEU A 56 11.474 -15.691 -12.813 1.00 0.00 C ATOM 796 O LEU A 56 10.978 -14.589 -12.576 1.00 0.00 O ATOM 797 CB LEU A 56 10.755 -17.038 -14.795 1.00 0.00 C ATOM 798 CG LEU A 56 10.554 -15.784 -15.646 1.00 0.00 C ATOM 799 CD1 LEU A 56 11.279 -15.919 -16.976 1.00 0.00 C ATOM 800 CD2 LEU A 56 9.071 -15.524 -15.870 1.00 0.00 C ATOM 0 H LEU A 56 8.914 -15.659 -12.966 1.00 0.00 H new ATOM 0 HA LEU A 56 10.943 -17.761 -12.779 1.00 0.00 H new ATOM 0 HB2 LEU A 56 11.750 -17.434 -14.997 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.039 -17.793 -15.121 1.00 0.00 H new ATOM 0 HG LEU A 56 10.976 -14.934 -15.110 1.00 0.00 H new ATOM 0 HD11 LEU A 56 11.124 -15.017 -17.568 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.345 -16.057 -16.797 1.00 0.00 H new ATOM 0 HD13 LEU A 56 10.888 -16.780 -17.518 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.946 -14.628 -16.478 1.00 0.00 H new ATOM 0 HD22 LEU A 56 8.626 -16.376 -16.384 1.00 0.00 H new ATOM 0 HD23 LEU A 56 8.577 -15.382 -14.909 1.00 0.00 H new ATOM 812 N THR A 57 12.772 -15.943 -12.682 1.00 0.00 N ATOM 813 CA THR A 57 13.709 -14.916 -12.242 1.00 0.00 C ATOM 814 C THR A 57 14.204 -14.083 -13.418 1.00 0.00 C ATOM 815 O THR A 57 14.753 -14.616 -14.383 1.00 0.00 O ATOM 816 CB THR A 57 14.921 -15.534 -11.520 1.00 0.00 C ATOM 817 OG1 THR A 57 15.843 -14.506 -11.143 1.00 0.00 O ATOM 818 CG2 THR A 57 15.622 -16.550 -12.410 1.00 0.00 C ATOM 0 H THR A 57 13.199 -16.849 -12.874 1.00 0.00 H new ATOM 0 HA THR A 57 13.169 -14.273 -11.546 1.00 0.00 H new ATOM 0 HB THR A 57 14.562 -16.045 -10.627 1.00 0.00 H new ATOM 0 HG1 THR A 57 16.610 -14.907 -10.683 1.00 0.00 H new ATOM 0 HG21 THR A 57 16.474 -16.973 -11.878 1.00 0.00 H new ATOM 0 HG22 THR A 57 14.926 -17.347 -12.671 1.00 0.00 H new ATOM 0 HG23 THR A 57 15.969 -16.059 -13.319 1.00 0.00 H new ATOM 826 N VAL A 58 14.007 -12.771 -13.332 1.00 0.00 N ATOM 827 CA VAL A 58 14.435 -11.862 -14.390 1.00 0.00 C ATOM 828 C VAL A 58 15.727 -11.148 -14.010 1.00 0.00 C ATOM 829 O VAL A 58 15.779 -10.424 -13.016 1.00 0.00 O ATOM 830 CB VAL A 58 13.353 -10.812 -14.700 1.00 0.00 C ATOM 831 CG1 VAL A 58 12.156 -11.463 -15.377 1.00 0.00 C ATOM 832 CG2 VAL A 58 12.930 -10.092 -13.428 1.00 0.00 C ATOM 0 H VAL A 58 13.554 -12.314 -12.541 1.00 0.00 H new ATOM 0 HA VAL A 58 14.606 -12.469 -15.279 1.00 0.00 H new ATOM 0 HB VAL A 58 13.772 -10.075 -15.385 1.00 0.00 H new ATOM 0 HG11 VAL A 58 11.401 -10.706 -15.589 1.00 0.00 H new ATOM 0 HG12 VAL A 58 12.474 -11.929 -16.310 1.00 0.00 H new ATOM 0 HG13 VAL A 58 11.734 -12.222 -14.718 1.00 0.00 H new ATOM 0 HG21 VAL A 58 12.165 -9.353 -13.665 1.00 0.00 H new ATOM 0 HG22 VAL A 58 12.529 -10.814 -12.717 1.00 0.00 H new ATOM 0 HG23 VAL A 58 13.793 -9.592 -12.989 1.00 0.00 H new ATOM 842 N ALA A 59 16.769 -11.355 -14.809 1.00 0.00 N ATOM 843 CA ALA A 59 18.061 -10.729 -14.558 1.00 0.00 C ATOM 844 C ALA A 59 18.573 -10.011 -15.802 1.00 0.00 C ATOM 845 O ALA A 59 17.930 -10.029 -16.852 1.00 0.00 O ATOM 846 CB ALA A 59 19.070 -11.768 -14.093 1.00 0.00 C ATOM 0 H ALA A 59 16.743 -11.952 -15.636 1.00 0.00 H new ATOM 0 HA ALA A 59 17.931 -9.988 -13.770 1.00 0.00 H new ATOM 0 HB1 ALA A 59 20.030 -11.286 -13.909 1.00 0.00 H new ATOM 0 HB2 ALA A 59 18.716 -12.233 -13.173 1.00 0.00 H new ATOM 0 HB3 ALA A 59 19.188 -12.531 -14.863 1.00 0.00 H new ATOM 852 N LYS A 60 19.735 -9.378 -15.678 1.00 0.00 N ATOM 853 CA LYS A 60 20.335 -8.653 -16.792 1.00 0.00 C ATOM 854 C LYS A 60 21.856 -8.752 -16.748 1.00 0.00 C ATOM 855 O LYS A 60 22.444 -8.959 -15.686 1.00 0.00 O ATOM 856 CB LYS A 60 19.907 -7.184 -16.761 1.00 0.00 C ATOM 857 CG LYS A 60 19.828 -6.603 -15.359 1.00 0.00 C ATOM 858 CD LYS A 60 21.195 -6.553 -14.698 1.00 0.00 C ATOM 859 CE LYS A 60 21.268 -5.451 -13.653 1.00 0.00 C ATOM 860 NZ LYS A 60 22.546 -5.494 -12.890 1.00 0.00 N ATOM 0 H LYS A 60 20.280 -9.353 -14.816 1.00 0.00 H new ATOM 0 HA LYS A 60 19.986 -9.107 -17.719 1.00 0.00 H new ATOM 0 HB2 LYS A 60 20.612 -6.596 -17.350 1.00 0.00 H new ATOM 0 HB3 LYS A 60 18.933 -7.088 -17.241 1.00 0.00 H new ATOM 0 HG2 LYS A 60 19.408 -5.598 -15.404 1.00 0.00 H new ATOM 0 HG3 LYS A 60 19.151 -7.205 -14.752 1.00 0.00 H new ATOM 0 HD2 LYS A 60 21.410 -7.514 -14.231 1.00 0.00 H new ATOM 0 HD3 LYS A 60 21.961 -6.389 -15.456 1.00 0.00 H new ATOM 0 HE2 LYS A 60 21.169 -4.481 -14.140 1.00 0.00 H new ATOM 0 HE3 LYS A 60 20.430 -5.549 -12.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 22.343 -5.462 -11.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 23.055 -6.373 -13.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 23.134 -4.677 -13.152 1.00 0.00 H new ATOM 874 N ILE A 61 22.488 -8.600 -17.908 1.00 0.00 N ATOM 875 CA ILE A 61 23.941 -8.670 -18.000 1.00 0.00 C ATOM 876 C ILE A 61 24.560 -7.276 -17.980 1.00 0.00 C ATOM 877 O ILE A 61 23.873 -6.277 -18.192 1.00 0.00 O ATOM 878 CB ILE A 61 24.389 -9.400 -19.280 1.00 0.00 C ATOM 879 CG1 ILE A 61 25.791 -9.983 -19.096 1.00 0.00 C ATOM 880 CG2 ILE A 61 24.356 -8.452 -20.470 1.00 0.00 C ATOM 881 CD1 ILE A 61 26.130 -11.068 -20.094 1.00 0.00 C ATOM 0 H ILE A 61 22.017 -8.428 -18.796 1.00 0.00 H new ATOM 0 HA ILE A 61 24.286 -9.231 -17.132 1.00 0.00 H new ATOM 0 HB ILE A 61 23.697 -10.220 -19.474 1.00 0.00 H new ATOM 0 HG12 ILE A 61 26.524 -9.180 -19.181 1.00 0.00 H new ATOM 0 HG13 ILE A 61 25.878 -10.388 -18.088 1.00 0.00 H new ATOM 0 HG21 ILE A 61 24.675 -8.983 -21.367 1.00 0.00 H new ATOM 0 HG22 ILE A 61 23.341 -8.080 -20.611 1.00 0.00 H new ATOM 0 HG23 ILE A 61 25.028 -7.614 -20.286 1.00 0.00 H new ATOM 0 HD11 ILE A 61 27.139 -11.435 -19.904 1.00 0.00 H new ATOM 0 HD12 ILE A 61 25.420 -11.889 -19.994 1.00 0.00 H new ATOM 0 HD13 ILE A 61 26.076 -10.663 -21.104 1.00 0.00 H new ATOM 893 N ASP A 62 25.862 -7.218 -17.725 1.00 0.00 N ATOM 894 CA ASP A 62 26.576 -5.947 -17.679 1.00 0.00 C ATOM 895 C ASP A 62 27.551 -5.829 -18.847 1.00 0.00 C ATOM 896 O ASP A 62 28.657 -6.369 -18.803 1.00 0.00 O ATOM 897 CB ASP A 62 27.328 -5.807 -16.355 1.00 0.00 C ATOM 898 CG ASP A 62 26.984 -4.522 -15.627 1.00 0.00 C ATOM 899 OD1 ASP A 62 26.659 -3.525 -16.305 1.00 0.00 O ATOM 900 OD2 ASP A 62 27.040 -4.514 -14.380 1.00 0.00 O ATOM 0 H ASP A 62 26.445 -8.036 -17.547 1.00 0.00 H new ATOM 0 HA ASP A 62 25.843 -5.144 -17.758 1.00 0.00 H new ATOM 0 HB2 ASP A 62 27.093 -6.658 -15.715 1.00 0.00 H new ATOM 0 HB3 ASP A 62 28.401 -5.838 -16.545 1.00 0.00 H new ATOM 905 N VAL A 63 27.134 -5.121 -19.891 1.00 0.00 N ATOM 906 CA VAL A 63 27.969 -4.932 -21.070 1.00 0.00 C ATOM 907 C VAL A 63 29.366 -4.459 -20.684 1.00 0.00 C ATOM 908 O VAL A 63 30.346 -4.762 -21.365 1.00 0.00 O ATOM 909 CB VAL A 63 27.345 -3.915 -22.044 1.00 0.00 C ATOM 910 CG1 VAL A 63 28.275 -3.662 -23.221 1.00 0.00 C ATOM 911 CG2 VAL A 63 25.986 -4.401 -22.522 1.00 0.00 C ATOM 0 H VAL A 63 26.222 -4.668 -19.944 1.00 0.00 H new ATOM 0 HA VAL A 63 28.040 -5.900 -21.565 1.00 0.00 H new ATOM 0 HB VAL A 63 27.203 -2.972 -21.516 1.00 0.00 H new ATOM 0 HG11 VAL A 63 27.817 -2.941 -23.898 1.00 0.00 H new ATOM 0 HG12 VAL A 63 29.223 -3.266 -22.857 1.00 0.00 H new ATOM 0 HG13 VAL A 63 28.452 -4.597 -23.752 1.00 0.00 H new ATOM 0 HG21 VAL A 63 25.559 -3.670 -23.209 1.00 0.00 H new ATOM 0 HG22 VAL A 63 26.101 -5.357 -23.034 1.00 0.00 H new ATOM 0 HG23 VAL A 63 25.322 -4.525 -21.666 1.00 0.00 H new ATOM 921 N ASP A 64 29.450 -3.713 -19.588 1.00 0.00 N ATOM 922 CA ASP A 64 30.728 -3.198 -19.109 1.00 0.00 C ATOM 923 C ASP A 64 31.746 -4.324 -18.961 1.00 0.00 C ATOM 924 O ASP A 64 32.939 -4.129 -19.191 1.00 0.00 O ATOM 925 CB ASP A 64 30.543 -2.482 -17.771 1.00 0.00 C ATOM 926 CG ASP A 64 31.608 -1.430 -17.526 1.00 0.00 C ATOM 927 OD1 ASP A 64 31.983 -0.729 -18.489 1.00 0.00 O ATOM 928 OD2 ASP A 64 32.065 -1.308 -16.370 1.00 0.00 O ATOM 0 H ASP A 64 28.648 -3.451 -19.014 1.00 0.00 H new ATOM 0 HA ASP A 64 31.104 -2.487 -19.844 1.00 0.00 H new ATOM 0 HB2 ASP A 64 29.560 -2.012 -17.746 1.00 0.00 H new ATOM 0 HB3 ASP A 64 30.567 -3.214 -16.964 1.00 0.00 H new ATOM 933 N ALA A 65 31.267 -5.502 -18.575 1.00 0.00 N ATOM 934 CA ALA A 65 32.136 -6.659 -18.398 1.00 0.00 C ATOM 935 C ALA A 65 32.445 -7.324 -19.735 1.00 0.00 C ATOM 936 O ALA A 65 33.537 -7.852 -19.938 1.00 0.00 O ATOM 937 CB ALA A 65 31.496 -7.658 -17.445 1.00 0.00 C ATOM 0 H ALA A 65 30.282 -5.680 -18.379 1.00 0.00 H new ATOM 0 HA ALA A 65 33.076 -6.314 -17.968 1.00 0.00 H new ATOM 0 HB1 ALA A 65 32.155 -8.517 -17.322 1.00 0.00 H new ATOM 0 HB2 ALA A 65 31.333 -7.184 -16.477 1.00 0.00 H new ATOM 0 HB3 ALA A 65 30.541 -7.989 -17.853 1.00 0.00 H new ATOM 943 N ASN A 66 31.475 -7.294 -20.643 1.00 0.00 N ATOM 944 CA ASN A 66 31.644 -7.895 -21.961 1.00 0.00 C ATOM 945 C ASN A 66 31.642 -6.827 -23.051 1.00 0.00 C ATOM 946 O ASN A 66 30.675 -6.666 -23.795 1.00 0.00 O ATOM 947 CB ASN A 66 30.532 -8.913 -22.227 1.00 0.00 C ATOM 948 CG ASN A 66 30.138 -9.677 -20.978 1.00 0.00 C ATOM 949 OD1 ASN A 66 30.908 -10.490 -20.465 1.00 0.00 O ATOM 950 ND2 ASN A 66 28.932 -9.420 -20.483 1.00 0.00 N ATOM 0 H ASN A 66 30.564 -6.860 -20.490 1.00 0.00 H new ATOM 0 HA ASN A 66 32.607 -8.405 -21.979 1.00 0.00 H new ATOM 0 HB2 ASN A 66 29.658 -8.397 -22.625 1.00 0.00 H new ATOM 0 HB3 ASN A 66 30.862 -9.617 -22.991 1.00 0.00 H new ATOM 0 HD21 ASN A 66 28.611 -9.904 -19.645 1.00 0.00 H new ATOM 0 HD22 ASN A 66 28.327 -8.738 -20.941 1.00 0.00 H new ATOM 957 N PRO A 67 32.752 -6.080 -23.148 1.00 0.00 N ATOM 958 CA PRO A 67 32.904 -5.015 -24.144 1.00 0.00 C ATOM 959 C PRO A 67 33.029 -5.561 -25.562 1.00 0.00 C ATOM 960 O PRO A 67 32.688 -4.884 -26.531 1.00 0.00 O ATOM 961 CB PRO A 67 34.200 -4.318 -23.723 1.00 0.00 C ATOM 962 CG PRO A 67 34.968 -5.360 -22.985 1.00 0.00 C ATOM 963 CD PRO A 67 33.943 -6.217 -22.294 1.00 0.00 C ATOM 0 HA PRO A 67 32.038 -4.354 -24.170 1.00 0.00 H new ATOM 0 HB2 PRO A 67 34.754 -3.957 -24.589 1.00 0.00 H new ATOM 0 HB3 PRO A 67 33.997 -3.454 -23.091 1.00 0.00 H new ATOM 0 HG2 PRO A 67 35.577 -5.953 -23.668 1.00 0.00 H new ATOM 0 HG3 PRO A 67 35.648 -4.906 -22.264 1.00 0.00 H new ATOM 0 HD2 PRO A 67 34.269 -7.255 -22.223 1.00 0.00 H new ATOM 0 HD3 PRO A 67 33.751 -5.873 -21.278 1.00 0.00 H new ATOM 971 N ALA A 68 33.521 -6.791 -25.677 1.00 0.00 N ATOM 972 CA ALA A 68 33.689 -7.429 -26.976 1.00 0.00 C ATOM 973 C ALA A 68 32.406 -7.348 -27.797 1.00 0.00 C ATOM 974 O ALA A 68 32.445 -7.301 -29.027 1.00 0.00 O ATOM 975 CB ALA A 68 34.115 -8.879 -26.802 1.00 0.00 C ATOM 0 H ALA A 68 33.810 -7.365 -24.885 1.00 0.00 H new ATOM 0 HA ALA A 68 34.471 -6.895 -27.516 1.00 0.00 H new ATOM 0 HB1 ALA A 68 34.237 -9.343 -27.781 1.00 0.00 H new ATOM 0 HB2 ALA A 68 35.061 -8.918 -26.262 1.00 0.00 H new ATOM 0 HB3 ALA A 68 33.353 -9.417 -26.238 1.00 0.00 H new ATOM 981 N THR A 69 31.268 -7.333 -27.110 1.00 0.00 N ATOM 982 CA THR A 69 29.974 -7.260 -27.775 1.00 0.00 C ATOM 983 C THR A 69 29.734 -5.873 -28.360 1.00 0.00 C ATOM 984 O THR A 69 29.622 -5.712 -29.575 1.00 0.00 O ATOM 985 CB THR A 69 28.825 -7.602 -26.808 1.00 0.00 C ATOM 986 OG1 THR A 69 29.077 -8.861 -26.174 1.00 0.00 O ATOM 987 CG2 THR A 69 27.495 -7.657 -27.545 1.00 0.00 C ATOM 0 H THR A 69 31.217 -7.371 -26.092 1.00 0.00 H new ATOM 0 HA THR A 69 29.991 -7.994 -28.581 1.00 0.00 H new ATOM 0 HB THR A 69 28.771 -6.819 -26.052 1.00 0.00 H new ATOM 0 HG1 THR A 69 28.343 -9.071 -25.560 1.00 0.00 H new ATOM 0 HG21 THR A 69 26.699 -7.900 -26.841 1.00 0.00 H new ATOM 0 HG22 THR A 69 27.292 -6.689 -28.002 1.00 0.00 H new ATOM 0 HG23 THR A 69 27.540 -8.422 -28.320 1.00 0.00 H new ATOM 995 N ALA A 70 29.658 -4.873 -27.488 1.00 0.00 N ATOM 996 CA ALA A 70 29.434 -3.498 -27.919 1.00 0.00 C ATOM 997 C ALA A 70 30.548 -3.026 -28.847 1.00 0.00 C ATOM 998 O ALA A 70 30.288 -2.537 -29.946 1.00 0.00 O ATOM 999 CB ALA A 70 29.324 -2.578 -26.712 1.00 0.00 C ATOM 0 H ALA A 70 29.748 -4.989 -26.479 1.00 0.00 H new ATOM 0 HA ALA A 70 28.496 -3.465 -28.474 1.00 0.00 H new ATOM 0 HB1 ALA A 70 29.157 -1.555 -27.048 1.00 0.00 H new ATOM 0 HB2 ALA A 70 28.489 -2.896 -26.087 1.00 0.00 H new ATOM 0 HB3 ALA A 70 30.247 -2.624 -26.134 1.00 0.00 H new ATOM 1005 N ARG A 71 31.790 -3.175 -28.396 1.00 0.00 N ATOM 1006 CA ARG A 71 32.944 -2.761 -29.186 1.00 0.00 C ATOM 1007 C ARG A 71 32.874 -3.341 -30.596 1.00 0.00 C ATOM 1008 O ARG A 71 33.360 -2.735 -31.551 1.00 0.00 O ATOM 1009 CB ARG A 71 34.240 -3.203 -28.504 1.00 0.00 C ATOM 1010 CG ARG A 71 35.494 -2.824 -29.276 1.00 0.00 C ATOM 1011 CD ARG A 71 36.753 -3.248 -28.535 1.00 0.00 C ATOM 1012 NE ARG A 71 37.859 -3.521 -29.449 1.00 0.00 N ATOM 1013 CZ ARG A 71 38.571 -2.572 -30.045 1.00 0.00 C ATOM 1014 NH1 ARG A 71 38.295 -1.294 -29.826 1.00 0.00 N ATOM 1015 NH2 ARG A 71 39.563 -2.901 -30.863 1.00 0.00 N ATOM 0 H ARG A 71 32.023 -3.579 -27.489 1.00 0.00 H new ATOM 0 HA ARG A 71 32.932 -1.673 -29.259 1.00 0.00 H new ATOM 0 HB2 ARG A 71 34.287 -2.759 -27.510 1.00 0.00 H new ATOM 0 HB3 ARG A 71 34.219 -4.284 -28.369 1.00 0.00 H new ATOM 0 HG2 ARG A 71 35.473 -3.294 -30.259 1.00 0.00 H new ATOM 0 HG3 ARG A 71 35.511 -1.746 -29.438 1.00 0.00 H new ATOM 0 HD2 ARG A 71 37.045 -2.463 -27.837 1.00 0.00 H new ATOM 0 HD3 ARG A 71 36.543 -4.139 -27.943 1.00 0.00 H new ATOM 0 HE ARG A 71 38.098 -4.494 -29.640 1.00 0.00 H new ATOM 0 HH11 ARG A 71 37.534 -1.037 -29.198 1.00 0.00 H new ATOM 0 HH12 ARG A 71 38.844 -0.568 -30.286 1.00 0.00 H new ATOM 0 HH21 ARG A 71 39.779 -3.883 -31.034 1.00 0.00 H new ATOM 0 HH22 ARG A 71 40.110 -2.172 -31.321 1.00 0.00 H new ATOM 1029 N ASP A 72 32.268 -4.517 -30.717 1.00 0.00 N ATOM 1030 CA ASP A 72 32.134 -5.179 -32.009 1.00 0.00 C ATOM 1031 C ASP A 72 31.608 -4.210 -33.064 1.00 0.00 C ATOM 1032 O ASP A 72 32.206 -4.050 -34.128 1.00 0.00 O ATOM 1033 CB ASP A 72 31.200 -6.384 -31.894 1.00 0.00 C ATOM 1034 CG ASP A 72 31.611 -7.524 -32.806 1.00 0.00 C ATOM 1035 OD1 ASP A 72 32.753 -8.011 -32.670 1.00 0.00 O ATOM 1036 OD2 ASP A 72 30.790 -7.929 -33.655 1.00 0.00 O ATOM 0 H ASP A 72 31.862 -5.031 -29.936 1.00 0.00 H new ATOM 0 HA ASP A 72 33.121 -5.523 -32.318 1.00 0.00 H new ATOM 0 HB2 ASP A 72 31.189 -6.734 -30.862 1.00 0.00 H new ATOM 0 HB3 ASP A 72 30.183 -6.076 -32.137 1.00 0.00 H new ATOM 1041 N PHE A 73 30.485 -3.567 -32.761 1.00 0.00 N ATOM 1042 CA PHE A 73 29.877 -2.615 -33.684 1.00 0.00 C ATOM 1043 C PHE A 73 29.955 -1.195 -33.130 1.00 0.00 C ATOM 1044 O PHE A 73 29.174 -0.325 -33.515 1.00 0.00 O ATOM 1045 CB PHE A 73 28.418 -2.992 -33.950 1.00 0.00 C ATOM 1046 CG PHE A 73 28.246 -3.954 -35.091 1.00 0.00 C ATOM 1047 CD1 PHE A 73 28.476 -5.308 -34.913 1.00 0.00 C ATOM 1048 CD2 PHE A 73 27.855 -3.503 -36.341 1.00 0.00 C ATOM 1049 CE1 PHE A 73 28.318 -6.196 -35.961 1.00 0.00 C ATOM 1050 CE2 PHE A 73 27.695 -4.386 -37.392 1.00 0.00 C ATOM 1051 CZ PHE A 73 27.928 -5.734 -37.202 1.00 0.00 C ATOM 0 H PHE A 73 29.978 -3.688 -31.884 1.00 0.00 H new ATOM 0 HA PHE A 73 30.431 -2.651 -34.622 1.00 0.00 H new ATOM 0 HB2 PHE A 73 27.994 -3.432 -33.047 1.00 0.00 H new ATOM 0 HB3 PHE A 73 27.849 -2.086 -34.160 1.00 0.00 H new ATOM 0 HD1 PHE A 73 28.782 -5.675 -33.944 1.00 0.00 H new ATOM 0 HD2 PHE A 73 27.673 -2.450 -36.496 1.00 0.00 H new ATOM 0 HE1 PHE A 73 28.499 -7.250 -35.809 1.00 0.00 H new ATOM 0 HE2 PHE A 73 27.388 -4.022 -38.361 1.00 0.00 H new ATOM 0 HZ PHE A 73 27.805 -6.425 -38.023 1.00 0.00 H new ATOM 1061 N GLN A 74 30.902 -0.971 -32.225 1.00 0.00 N ATOM 1062 CA GLN A 74 31.081 0.343 -31.618 1.00 0.00 C ATOM 1063 C GLN A 74 29.745 0.914 -31.154 1.00 0.00 C ATOM 1064 O GLN A 74 29.351 2.008 -31.559 1.00 0.00 O ATOM 1065 CB GLN A 74 31.742 1.301 -32.610 1.00 0.00 C ATOM 1066 CG GLN A 74 33.261 1.242 -32.593 1.00 0.00 C ATOM 1067 CD GLN A 74 33.794 -0.140 -32.915 1.00 0.00 C ATOM 1068 OE1 GLN A 74 34.704 -0.637 -32.251 1.00 0.00 O ATOM 1069 NE2 GLN A 74 33.229 -0.769 -33.939 1.00 0.00 N ATOM 0 H GLN A 74 31.556 -1.681 -31.896 1.00 0.00 H new ATOM 0 HA GLN A 74 31.728 0.229 -30.749 1.00 0.00 H new ATOM 0 HB2 GLN A 74 31.389 1.070 -33.615 1.00 0.00 H new ATOM 0 HB3 GLN A 74 31.424 2.319 -32.386 1.00 0.00 H new ATOM 0 HG2 GLN A 74 33.657 1.957 -33.314 1.00 0.00 H new ATOM 0 HG3 GLN A 74 33.622 1.547 -31.611 1.00 0.00 H new ATOM 0 HE21 GLN A 74 32.477 -0.319 -34.462 1.00 0.00 H new ATOM 0 HE22 GLN A 74 33.547 -1.702 -34.203 1.00 0.00 H new ATOM 1078 N VAL A 75 29.051 0.167 -30.301 1.00 0.00 N ATOM 1079 CA VAL A 75 27.760 0.599 -29.781 1.00 0.00 C ATOM 1080 C VAL A 75 27.800 0.750 -28.264 1.00 0.00 C ATOM 1081 O VAL A 75 28.568 0.071 -27.583 1.00 0.00 O ATOM 1082 CB VAL A 75 26.642 -0.392 -30.157 1.00 0.00 C ATOM 1083 CG1 VAL A 75 26.855 -1.727 -29.459 1.00 0.00 C ATOM 1084 CG2 VAL A 75 25.278 0.187 -29.814 1.00 0.00 C ATOM 0 H VAL A 75 29.362 -0.741 -29.956 1.00 0.00 H new ATOM 0 HA VAL A 75 27.545 1.567 -30.234 1.00 0.00 H new ATOM 0 HB VAL A 75 26.678 -0.562 -31.233 1.00 0.00 H new ATOM 0 HG11 VAL A 75 26.056 -2.414 -29.736 1.00 0.00 H new ATOM 0 HG12 VAL A 75 27.815 -2.146 -29.760 1.00 0.00 H new ATOM 0 HG13 VAL A 75 26.847 -1.578 -28.379 1.00 0.00 H new ATOM 0 HG21 VAL A 75 24.501 -0.527 -30.087 1.00 0.00 H new ATOM 0 HG22 VAL A 75 25.227 0.388 -28.744 1.00 0.00 H new ATOM 0 HG23 VAL A 75 25.128 1.115 -30.365 1.00 0.00 H new ATOM 1094 N VAL A 76 26.968 1.645 -27.741 1.00 0.00 N ATOM 1095 CA VAL A 76 26.908 1.884 -26.305 1.00 0.00 C ATOM 1096 C VAL A 76 25.633 1.302 -25.704 1.00 0.00 C ATOM 1097 O VAL A 76 25.634 0.814 -24.574 1.00 0.00 O ATOM 1098 CB VAL A 76 26.973 3.389 -25.983 1.00 0.00 C ATOM 1099 CG1 VAL A 76 28.317 3.967 -26.401 1.00 0.00 C ATOM 1100 CG2 VAL A 76 25.831 4.129 -26.663 1.00 0.00 C ATOM 0 H VAL A 76 26.326 2.216 -28.291 1.00 0.00 H new ATOM 0 HA VAL A 76 27.773 1.388 -25.865 1.00 0.00 H new ATOM 0 HB VAL A 76 26.868 3.517 -24.906 1.00 0.00 H new ATOM 0 HG11 VAL A 76 28.344 5.031 -26.166 1.00 0.00 H new ATOM 0 HG12 VAL A 76 29.116 3.456 -25.864 1.00 0.00 H new ATOM 0 HG13 VAL A 76 28.455 3.829 -27.473 1.00 0.00 H new ATOM 0 HG21 VAL A 76 25.892 5.191 -26.425 1.00 0.00 H new ATOM 0 HG22 VAL A 76 25.902 3.995 -27.742 1.00 0.00 H new ATOM 0 HG23 VAL A 76 24.879 3.732 -26.310 1.00 0.00 H new ATOM 1110 N SER A 77 24.547 1.357 -26.468 1.00 0.00 N ATOM 1111 CA SER A 77 23.263 0.838 -26.010 1.00 0.00 C ATOM 1112 C SER A 77 22.873 -0.413 -26.791 1.00 0.00 C ATOM 1113 O SER A 77 22.804 -0.395 -28.020 1.00 0.00 O ATOM 1114 CB SER A 77 22.176 1.904 -26.158 1.00 0.00 C ATOM 1115 OG SER A 77 21.363 1.650 -27.290 1.00 0.00 O ATOM 0 H SER A 77 24.530 1.756 -27.407 1.00 0.00 H new ATOM 0 HA SER A 77 23.361 0.573 -24.957 1.00 0.00 H new ATOM 0 HB2 SER A 77 21.558 1.925 -25.260 1.00 0.00 H new ATOM 0 HB3 SER A 77 22.637 2.887 -26.251 1.00 0.00 H new ATOM 0 HG SER A 77 21.878 1.150 -27.957 1.00 0.00 H new ATOM 1121 N ILE A 78 22.621 -1.499 -26.068 1.00 0.00 N ATOM 1122 CA ILE A 78 22.237 -2.760 -26.692 1.00 0.00 C ATOM 1123 C ILE A 78 21.104 -3.431 -25.923 1.00 0.00 C ATOM 1124 O ILE A 78 21.277 -4.483 -25.307 1.00 0.00 O ATOM 1125 CB ILE A 78 23.430 -3.730 -26.779 1.00 0.00 C ATOM 1126 CG1 ILE A 78 24.217 -3.725 -25.467 1.00 0.00 C ATOM 1127 CG2 ILE A 78 24.331 -3.358 -27.946 1.00 0.00 C ATOM 1128 CD1 ILE A 78 25.312 -2.681 -25.424 1.00 0.00 C ATOM 0 H ILE A 78 22.676 -1.531 -25.050 1.00 0.00 H new ATOM 0 HA ILE A 78 21.897 -2.524 -27.700 1.00 0.00 H new ATOM 0 HB ILE A 78 23.049 -4.737 -26.947 1.00 0.00 H new ATOM 0 HG12 ILE A 78 23.528 -3.552 -24.640 1.00 0.00 H new ATOM 0 HG13 ILE A 78 24.658 -4.710 -25.314 1.00 0.00 H new ATOM 0 HG21 ILE A 78 25.170 -4.053 -27.994 1.00 0.00 H new ATOM 0 HG22 ILE A 78 23.763 -3.410 -28.875 1.00 0.00 H new ATOM 0 HG23 ILE A 78 24.707 -2.345 -27.807 1.00 0.00 H new ATOM 0 HD11 ILE A 78 25.828 -2.735 -24.466 1.00 0.00 H new ATOM 0 HD12 ILE A 78 26.023 -2.866 -26.230 1.00 0.00 H new ATOM 0 HD13 ILE A 78 24.875 -1.690 -25.546 1.00 0.00 H new ATOM 1140 N PRO A 79 19.916 -2.811 -25.959 1.00 0.00 N ATOM 1141 CA PRO A 79 18.730 -3.332 -25.273 1.00 0.00 C ATOM 1142 C PRO A 79 18.196 -4.604 -25.923 1.00 0.00 C ATOM 1143 O PRO A 79 17.597 -4.560 -26.998 1.00 0.00 O ATOM 1144 CB PRO A 79 17.714 -2.195 -25.408 1.00 0.00 C ATOM 1145 CG PRO A 79 18.138 -1.450 -26.626 1.00 0.00 C ATOM 1146 CD PRO A 79 19.638 -1.553 -26.673 1.00 0.00 C ATOM 0 HA PRO A 79 18.945 -3.609 -24.241 1.00 0.00 H new ATOM 0 HB2 PRO A 79 16.700 -2.581 -25.513 1.00 0.00 H new ATOM 0 HB3 PRO A 79 17.721 -1.552 -24.528 1.00 0.00 H new ATOM 0 HG2 PRO A 79 17.689 -1.879 -27.522 1.00 0.00 H new ATOM 0 HG3 PRO A 79 17.820 -0.409 -26.577 1.00 0.00 H new ATOM 0 HD2 PRO A 79 20.007 -1.583 -27.698 1.00 0.00 H new ATOM 0 HD3 PRO A 79 20.115 -0.701 -26.187 1.00 0.00 H new ATOM 1154 N THR A 80 18.416 -5.737 -25.264 1.00 0.00 N ATOM 1155 CA THR A 80 17.957 -7.021 -25.778 1.00 0.00 C ATOM 1156 C THR A 80 17.359 -7.877 -24.667 1.00 0.00 C ATOM 1157 O THR A 80 17.823 -7.844 -23.528 1.00 0.00 O ATOM 1158 CB THR A 80 19.105 -7.800 -26.448 1.00 0.00 C ATOM 1159 OG1 THR A 80 19.615 -7.059 -27.562 1.00 0.00 O ATOM 1160 CG2 THR A 80 18.630 -9.167 -26.917 1.00 0.00 C ATOM 0 H THR A 80 18.909 -5.791 -24.373 1.00 0.00 H new ATOM 0 HA THR A 80 17.189 -6.807 -26.521 1.00 0.00 H new ATOM 0 HB THR A 80 19.897 -7.941 -25.712 1.00 0.00 H new ATOM 0 HG1 THR A 80 20.345 -7.560 -27.981 1.00 0.00 H new ATOM 0 HG21 THR A 80 19.458 -9.698 -27.387 1.00 0.00 H new ATOM 0 HG22 THR A 80 18.269 -9.740 -26.063 1.00 0.00 H new ATOM 0 HG23 THR A 80 17.822 -9.044 -27.638 1.00 0.00 H new ATOM 1168 N MET A 81 16.326 -8.641 -25.006 1.00 0.00 N ATOM 1169 CA MET A 81 15.665 -9.507 -24.036 1.00 0.00 C ATOM 1170 C MET A 81 15.718 -10.964 -24.483 1.00 0.00 C ATOM 1171 O MET A 81 15.081 -11.345 -25.466 1.00 0.00 O ATOM 1172 CB MET A 81 14.211 -9.074 -23.841 1.00 0.00 C ATOM 1173 CG MET A 81 13.410 -10.014 -22.956 1.00 0.00 C ATOM 1174 SD MET A 81 12.258 -9.142 -21.878 1.00 0.00 S ATOM 1175 CE MET A 81 10.890 -10.298 -21.839 1.00 0.00 C ATOM 0 H MET A 81 15.928 -8.678 -25.945 1.00 0.00 H new ATOM 0 HA MET A 81 16.194 -9.417 -23.087 1.00 0.00 H new ATOM 0 HB2 MET A 81 14.193 -8.075 -23.405 1.00 0.00 H new ATOM 0 HB3 MET A 81 13.727 -9.005 -24.815 1.00 0.00 H new ATOM 0 HG2 MET A 81 12.856 -10.713 -23.583 1.00 0.00 H new ATOM 0 HG3 MET A 81 14.094 -10.605 -22.347 1.00 0.00 H new ATOM 0 HE1 MET A 81 10.551 -10.426 -20.811 1.00 0.00 H new ATOM 0 HE2 MET A 81 10.071 -9.913 -22.446 1.00 0.00 H new ATOM 0 HE3 MET A 81 11.215 -11.260 -22.236 1.00 0.00 H new ATOM 1185 N ILE A 82 16.481 -11.774 -23.757 1.00 0.00 N ATOM 1186 CA ILE A 82 16.616 -13.189 -24.079 1.00 0.00 C ATOM 1187 C ILE A 82 16.013 -14.062 -22.984 1.00 0.00 C ATOM 1188 O ILE A 82 16.200 -13.802 -21.794 1.00 0.00 O ATOM 1189 CB ILE A 82 18.091 -13.583 -24.281 1.00 0.00 C ATOM 1190 CG1 ILE A 82 18.781 -12.596 -25.225 1.00 0.00 C ATOM 1191 CG2 ILE A 82 18.191 -15.001 -24.822 1.00 0.00 C ATOM 1192 CD1 ILE A 82 20.251 -12.884 -25.432 1.00 0.00 C ATOM 0 H ILE A 82 17.015 -11.474 -22.941 1.00 0.00 H new ATOM 0 HA ILE A 82 16.074 -13.353 -25.011 1.00 0.00 H new ATOM 0 HB ILE A 82 18.597 -13.547 -23.316 1.00 0.00 H new ATOM 0 HG12 ILE A 82 18.276 -12.616 -26.191 1.00 0.00 H new ATOM 0 HG13 ILE A 82 18.669 -11.587 -24.828 1.00 0.00 H new ATOM 0 HG21 ILE A 82 19.240 -15.265 -24.959 1.00 0.00 H new ATOM 0 HG22 ILE A 82 17.732 -15.693 -24.116 1.00 0.00 H new ATOM 0 HG23 ILE A 82 17.673 -15.063 -25.779 1.00 0.00 H new ATOM 0 HD11 ILE A 82 20.674 -12.145 -26.112 1.00 0.00 H new ATOM 0 HD12 ILE A 82 20.770 -12.835 -24.475 1.00 0.00 H new ATOM 0 HD13 ILE A 82 20.370 -13.880 -25.859 1.00 0.00 H new ATOM 1204 N LEU A 83 15.291 -15.100 -23.392 1.00 0.00 N ATOM 1205 CA LEU A 83 14.662 -16.014 -22.446 1.00 0.00 C ATOM 1206 C LEU A 83 15.403 -17.346 -22.401 1.00 0.00 C ATOM 1207 O LEU A 83 15.826 -17.869 -23.432 1.00 0.00 O ATOM 1208 CB LEU A 83 13.198 -16.244 -22.825 1.00 0.00 C ATOM 1209 CG LEU A 83 12.160 -15.526 -21.962 1.00 0.00 C ATOM 1210 CD1 LEU A 83 12.115 -14.045 -22.304 1.00 0.00 C ATOM 1211 CD2 LEU A 83 10.787 -16.158 -22.142 1.00 0.00 C ATOM 0 H LEU A 83 15.127 -15.329 -24.372 1.00 0.00 H new ATOM 0 HA LEU A 83 14.707 -15.561 -21.456 1.00 0.00 H new ATOM 0 HB2 LEU A 83 13.058 -15.933 -23.860 1.00 0.00 H new ATOM 0 HB3 LEU A 83 12.997 -17.315 -22.784 1.00 0.00 H new ATOM 0 HG LEU A 83 12.451 -15.629 -20.917 1.00 0.00 H new ATOM 0 HD11 LEU A 83 11.371 -13.550 -21.680 1.00 0.00 H new ATOM 0 HD12 LEU A 83 13.094 -13.600 -22.124 1.00 0.00 H new ATOM 0 HD13 LEU A 83 11.848 -13.922 -23.354 1.00 0.00 H new ATOM 0 HD21 LEU A 83 10.061 -15.634 -21.520 1.00 0.00 H new ATOM 0 HD22 LEU A 83 10.488 -16.087 -23.188 1.00 0.00 H new ATOM 0 HD23 LEU A 83 10.828 -17.207 -21.847 1.00 0.00 H new ATOM 1223 N PHE A 84 15.555 -17.893 -21.199 1.00 0.00 N ATOM 1224 CA PHE A 84 16.244 -19.165 -21.019 1.00 0.00 C ATOM 1225 C PHE A 84 15.358 -20.163 -20.279 1.00 0.00 C ATOM 1226 O PHE A 84 14.915 -19.908 -19.159 1.00 0.00 O ATOM 1227 CB PHE A 84 17.550 -18.958 -20.250 1.00 0.00 C ATOM 1228 CG PHE A 84 18.540 -18.090 -20.972 1.00 0.00 C ATOM 1229 CD1 PHE A 84 19.649 -18.646 -21.590 1.00 0.00 C ATOM 1230 CD2 PHE A 84 18.363 -16.717 -21.034 1.00 0.00 C ATOM 1231 CE1 PHE A 84 20.561 -17.850 -22.256 1.00 0.00 C ATOM 1232 CE2 PHE A 84 19.272 -15.916 -21.699 1.00 0.00 C ATOM 1233 CZ PHE A 84 20.373 -16.483 -22.310 1.00 0.00 C ATOM 0 H PHE A 84 15.210 -17.475 -20.335 1.00 0.00 H new ATOM 0 HA PHE A 84 16.472 -19.569 -22.005 1.00 0.00 H new ATOM 0 HB2 PHE A 84 17.325 -18.511 -19.282 1.00 0.00 H new ATOM 0 HB3 PHE A 84 18.005 -19.929 -20.055 1.00 0.00 H new ATOM 0 HD1 PHE A 84 19.802 -19.714 -21.550 1.00 0.00 H new ATOM 0 HD2 PHE A 84 17.505 -16.268 -20.557 1.00 0.00 H new ATOM 0 HE1 PHE A 84 21.420 -18.297 -22.734 1.00 0.00 H new ATOM 0 HE2 PHE A 84 19.121 -14.847 -21.741 1.00 0.00 H new ATOM 0 HZ PHE A 84 21.085 -15.859 -22.829 1.00 0.00 H new ATOM 1243 N LYS A 85 15.103 -21.302 -20.914 1.00 0.00 N ATOM 1244 CA LYS A 85 14.271 -22.341 -20.319 1.00 0.00 C ATOM 1245 C LYS A 85 15.005 -23.678 -20.294 1.00 0.00 C ATOM 1246 O LYS A 85 15.483 -24.154 -21.324 1.00 0.00 O ATOM 1247 CB LYS A 85 12.960 -22.481 -21.096 1.00 0.00 C ATOM 1248 CG LYS A 85 11.800 -22.975 -20.248 1.00 0.00 C ATOM 1249 CD LYS A 85 10.847 -21.846 -19.894 1.00 0.00 C ATOM 1250 CE LYS A 85 9.547 -22.377 -19.309 1.00 0.00 C ATOM 1251 NZ LYS A 85 9.791 -23.329 -18.190 1.00 0.00 N ATOM 0 H LYS A 85 15.461 -21.529 -21.842 1.00 0.00 H new ATOM 0 HA LYS A 85 14.048 -22.050 -19.293 1.00 0.00 H new ATOM 0 HB2 LYS A 85 12.698 -21.515 -21.527 1.00 0.00 H new ATOM 0 HB3 LYS A 85 13.111 -23.170 -21.927 1.00 0.00 H new ATOM 0 HG2 LYS A 85 11.259 -23.753 -20.787 1.00 0.00 H new ATOM 0 HG3 LYS A 85 12.184 -23.428 -19.334 1.00 0.00 H new ATOM 0 HD2 LYS A 85 11.324 -21.177 -19.177 1.00 0.00 H new ATOM 0 HD3 LYS A 85 10.632 -21.257 -20.785 1.00 0.00 H new ATOM 0 HE2 LYS A 85 8.942 -21.544 -18.952 1.00 0.00 H new ATOM 0 HE3 LYS A 85 8.973 -22.875 -20.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 9.534 -24.291 -18.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 10.797 -23.306 -17.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 9.213 -23.056 -17.370 1.00 0.00 H new ATOM 1265 N ASP A 86 15.088 -24.280 -19.113 1.00 0.00 N ATOM 1266 CA ASP A 86 15.761 -25.564 -18.954 1.00 0.00 C ATOM 1267 C ASP A 86 17.247 -25.443 -19.280 1.00 0.00 C ATOM 1268 O ASP A 86 17.856 -26.374 -19.803 1.00 0.00 O ATOM 1269 CB ASP A 86 15.114 -26.618 -19.855 1.00 0.00 C ATOM 1270 CG ASP A 86 15.310 -28.027 -19.330 1.00 0.00 C ATOM 1271 OD1 ASP A 86 14.800 -28.327 -18.230 1.00 0.00 O ATOM 1272 OD2 ASP A 86 15.973 -28.829 -20.020 1.00 0.00 O ATOM 0 H ASP A 86 14.697 -23.899 -18.251 1.00 0.00 H new ATOM 0 HA ASP A 86 15.659 -25.873 -17.914 1.00 0.00 H new ATOM 0 HB2 ASP A 86 14.047 -26.411 -19.943 1.00 0.00 H new ATOM 0 HB3 ASP A 86 15.537 -26.544 -20.857 1.00 0.00 H new ATOM 1277 N GLY A 87 17.823 -24.286 -18.967 1.00 0.00 N ATOM 1278 CA GLY A 87 19.232 -24.063 -19.234 1.00 0.00 C ATOM 1279 C GLY A 87 19.533 -23.966 -20.716 1.00 0.00 C ATOM 1280 O GLY A 87 20.666 -24.186 -21.142 1.00 0.00 O ATOM 0 H GLY A 87 17.339 -23.500 -18.534 1.00 0.00 H new ATOM 0 HA2 GLY A 87 19.551 -23.145 -18.741 1.00 0.00 H new ATOM 0 HA3 GLY A 87 19.814 -24.876 -18.801 1.00 0.00 H new ATOM 1284 N ALA A 88 18.515 -23.638 -21.505 1.00 0.00 N ATOM 1285 CA ALA A 88 18.676 -23.512 -22.948 1.00 0.00 C ATOM 1286 C ALA A 88 17.881 -22.328 -23.488 1.00 0.00 C ATOM 1287 O ALA A 88 16.907 -21.876 -22.885 1.00 0.00 O ATOM 1288 CB ALA A 88 18.247 -24.798 -23.641 1.00 0.00 C ATOM 0 H ALA A 88 17.570 -23.455 -21.169 1.00 0.00 H new ATOM 0 HA ALA A 88 19.731 -23.333 -23.157 1.00 0.00 H new ATOM 0 HB1 ALA A 88 18.372 -24.690 -24.718 1.00 0.00 H new ATOM 0 HB2 ALA A 88 18.861 -25.625 -23.285 1.00 0.00 H new ATOM 0 HB3 ALA A 88 17.200 -25.001 -23.416 1.00 0.00 H new ATOM 1294 N PRO A 89 18.305 -21.811 -24.650 1.00 0.00 N ATOM 1295 CA PRO A 89 17.647 -20.671 -25.297 1.00 0.00 C ATOM 1296 C PRO A 89 16.272 -21.032 -25.846 1.00 0.00 C ATOM 1297 O PRO A 89 16.117 -22.023 -26.560 1.00 0.00 O ATOM 1298 CB PRO A 89 18.602 -20.311 -26.438 1.00 0.00 C ATOM 1299 CG PRO A 89 19.330 -21.576 -26.736 1.00 0.00 C ATOM 1300 CD PRO A 89 19.459 -22.299 -25.424 1.00 0.00 C ATOM 0 HA PRO A 89 17.468 -19.853 -24.599 1.00 0.00 H new ATOM 0 HB2 PRO A 89 18.058 -19.952 -27.312 1.00 0.00 H new ATOM 0 HB3 PRO A 89 19.290 -19.518 -26.143 1.00 0.00 H new ATOM 0 HG2 PRO A 89 18.784 -22.179 -27.462 1.00 0.00 H new ATOM 0 HG3 PRO A 89 20.310 -21.370 -27.166 1.00 0.00 H new ATOM 0 HD2 PRO A 89 19.426 -23.380 -25.556 1.00 0.00 H new ATOM 0 HD3 PRO A 89 20.402 -22.067 -24.929 1.00 0.00 H new ATOM 1308 N VAL A 90 15.274 -20.220 -25.509 1.00 0.00 N ATOM 1309 CA VAL A 90 13.910 -20.453 -25.971 1.00 0.00 C ATOM 1310 C VAL A 90 13.389 -19.262 -26.767 1.00 0.00 C ATOM 1311 O VAL A 90 12.611 -19.423 -27.708 1.00 0.00 O ATOM 1312 CB VAL A 90 12.957 -20.725 -24.792 1.00 0.00 C ATOM 1313 CG1 VAL A 90 13.124 -22.151 -24.288 1.00 0.00 C ATOM 1314 CG2 VAL A 90 13.197 -19.724 -23.672 1.00 0.00 C ATOM 0 H VAL A 90 15.384 -19.396 -24.918 1.00 0.00 H new ATOM 0 HA VAL A 90 13.939 -21.332 -26.615 1.00 0.00 H new ATOM 0 HB VAL A 90 11.931 -20.606 -25.141 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.443 -22.325 -23.455 1.00 0.00 H new ATOM 0 HG12 VAL A 90 12.898 -22.850 -25.093 1.00 0.00 H new ATOM 0 HG13 VAL A 90 14.151 -22.301 -23.954 1.00 0.00 H new ATOM 0 HG21 VAL A 90 12.515 -19.931 -22.847 1.00 0.00 H new ATOM 0 HG22 VAL A 90 14.226 -19.809 -23.322 1.00 0.00 H new ATOM 0 HG23 VAL A 90 13.022 -18.714 -24.043 1.00 0.00 H new ATOM 1324 N LYS A 91 13.823 -18.066 -26.385 1.00 0.00 N ATOM 1325 CA LYS A 91 13.402 -16.846 -27.064 1.00 0.00 C ATOM 1326 C LYS A 91 14.528 -15.817 -27.080 1.00 0.00 C ATOM 1327 O LYS A 91 15.452 -15.881 -26.269 1.00 0.00 O ATOM 1328 CB LYS A 91 12.168 -16.256 -26.378 1.00 0.00 C ATOM 1329 CG LYS A 91 11.158 -15.666 -27.347 1.00 0.00 C ATOM 1330 CD LYS A 91 10.332 -16.749 -28.020 1.00 0.00 C ATOM 1331 CE LYS A 91 10.727 -16.927 -29.478 1.00 0.00 C ATOM 1332 NZ LYS A 91 10.512 -15.682 -30.267 1.00 0.00 N ATOM 0 H LYS A 91 14.467 -17.915 -25.608 1.00 0.00 H new ATOM 0 HA LYS A 91 13.151 -17.101 -28.094 1.00 0.00 H new ATOM 0 HB2 LYS A 91 11.683 -17.035 -25.789 1.00 0.00 H new ATOM 0 HB3 LYS A 91 12.486 -15.481 -25.681 1.00 0.00 H new ATOM 0 HG2 LYS A 91 10.498 -14.982 -26.814 1.00 0.00 H new ATOM 0 HG3 LYS A 91 11.679 -15.081 -28.105 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.464 -17.692 -27.489 1.00 0.00 H new ATOM 0 HD3 LYS A 91 9.274 -16.493 -27.957 1.00 0.00 H new ATOM 0 HE2 LYS A 91 11.776 -17.218 -29.537 1.00 0.00 H new ATOM 0 HE3 LYS A 91 10.146 -17.739 -29.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 10.293 -15.929 -31.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 9.719 -15.146 -29.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 11.374 -15.100 -30.240 1.00 0.00 H new ATOM 1346 N ARG A 92 14.443 -14.869 -28.007 1.00 0.00 N ATOM 1347 CA ARG A 92 15.455 -13.826 -28.128 1.00 0.00 C ATOM 1348 C ARG A 92 14.939 -12.662 -28.969 1.00 0.00 C ATOM 1349 O ARG A 92 14.795 -12.779 -30.187 1.00 0.00 O ATOM 1350 CB ARG A 92 16.731 -14.393 -28.752 1.00 0.00 C ATOM 1351 CG ARG A 92 16.478 -15.257 -29.977 1.00 0.00 C ATOM 1352 CD ARG A 92 17.769 -15.853 -30.515 1.00 0.00 C ATOM 1353 NE ARG A 92 18.430 -16.706 -29.532 1.00 0.00 N ATOM 1354 CZ ARG A 92 19.597 -17.305 -29.744 1.00 0.00 C ATOM 1355 NH1 ARG A 92 20.227 -17.145 -30.899 1.00 0.00 N ATOM 1356 NH2 ARG A 92 20.135 -18.067 -28.800 1.00 0.00 N ATOM 0 H ARG A 92 13.684 -14.801 -28.685 1.00 0.00 H new ATOM 0 HA ARG A 92 15.681 -13.457 -27.128 1.00 0.00 H new ATOM 0 HB2 ARG A 92 17.387 -13.568 -29.029 1.00 0.00 H new ATOM 0 HB3 ARG A 92 17.260 -14.984 -28.004 1.00 0.00 H new ATOM 0 HG2 ARG A 92 15.785 -16.058 -29.721 1.00 0.00 H new ATOM 0 HG3 ARG A 92 16.001 -14.659 -30.753 1.00 0.00 H new ATOM 0 HD2 ARG A 92 17.554 -16.434 -31.412 1.00 0.00 H new ATOM 0 HD3 ARG A 92 18.444 -15.049 -30.810 1.00 0.00 H new ATOM 0 HE ARG A 92 17.971 -16.850 -28.633 1.00 0.00 H new ATOM 0 HH11 ARG A 92 19.816 -16.561 -31.627 1.00 0.00 H new ATOM 0 HH12 ARG A 92 21.123 -17.606 -31.059 1.00 0.00 H new ATOM 0 HH21 ARG A 92 19.653 -18.194 -27.910 1.00 0.00 H new ATOM 0 HH22 ARG A 92 21.031 -18.526 -28.964 1.00 0.00 H new ATOM 1370 N ILE A 93 14.661 -11.541 -28.312 1.00 0.00 N ATOM 1371 CA ILE A 93 14.162 -10.357 -29.000 1.00 0.00 C ATOM 1372 C ILE A 93 15.030 -9.140 -28.700 1.00 0.00 C ATOM 1373 O ILE A 93 15.227 -8.775 -27.541 1.00 0.00 O ATOM 1374 CB ILE A 93 12.707 -10.046 -28.601 1.00 0.00 C ATOM 1375 CG1 ILE A 93 11.797 -11.228 -28.945 1.00 0.00 C ATOM 1376 CG2 ILE A 93 12.226 -8.781 -29.296 1.00 0.00 C ATOM 1377 CD1 ILE A 93 11.708 -11.511 -30.428 1.00 0.00 C ATOM 0 H ILE A 93 14.773 -11.428 -27.304 1.00 0.00 H new ATOM 0 HA ILE A 93 14.200 -10.573 -30.068 1.00 0.00 H new ATOM 0 HB ILE A 93 12.668 -9.883 -27.524 1.00 0.00 H new ATOM 0 HG12 ILE A 93 12.164 -12.119 -28.435 1.00 0.00 H new ATOM 0 HG13 ILE A 93 10.797 -11.030 -28.561 1.00 0.00 H new ATOM 0 HG21 ILE A 93 11.196 -8.575 -29.004 1.00 0.00 H new ATOM 0 HG22 ILE A 93 12.860 -7.943 -29.006 1.00 0.00 H new ATOM 0 HG23 ILE A 93 12.276 -8.918 -30.376 1.00 0.00 H new ATOM 0 HD11 ILE A 93 11.047 -12.361 -30.597 1.00 0.00 H new ATOM 0 HD12 ILE A 93 11.312 -10.635 -30.942 1.00 0.00 H new ATOM 0 HD13 ILE A 93 12.701 -11.741 -30.815 1.00 0.00 H new ATOM 1389 N VAL A 94 15.545 -8.513 -29.753 1.00 0.00 N ATOM 1390 CA VAL A 94 16.390 -7.335 -29.603 1.00 0.00 C ATOM 1391 C VAL A 94 15.657 -6.073 -30.045 1.00 0.00 C ATOM 1392 O VAL A 94 14.844 -6.106 -30.967 1.00 0.00 O ATOM 1393 CB VAL A 94 17.692 -7.470 -30.416 1.00 0.00 C ATOM 1394 CG1 VAL A 94 18.358 -8.809 -30.138 1.00 0.00 C ATOM 1395 CG2 VAL A 94 17.411 -7.303 -31.901 1.00 0.00 C ATOM 0 H VAL A 94 15.392 -8.802 -30.719 1.00 0.00 H new ATOM 0 HA VAL A 94 16.638 -7.256 -28.544 1.00 0.00 H new ATOM 0 HB VAL A 94 18.377 -6.680 -30.108 1.00 0.00 H new ATOM 0 HG11 VAL A 94 19.276 -8.887 -30.721 1.00 0.00 H new ATOM 0 HG12 VAL A 94 18.594 -8.884 -29.077 1.00 0.00 H new ATOM 0 HG13 VAL A 94 17.682 -9.617 -30.417 1.00 0.00 H new ATOM 0 HG21 VAL A 94 18.341 -7.401 -32.461 1.00 0.00 H new ATOM 0 HG22 VAL A 94 16.709 -8.070 -32.227 1.00 0.00 H new ATOM 0 HG23 VAL A 94 16.981 -6.318 -32.081 1.00 0.00 H new ATOM 1405 N GLY A 95 15.951 -4.960 -29.378 1.00 0.00 N ATOM 1406 CA GLY A 95 15.311 -3.702 -29.717 1.00 0.00 C ATOM 1407 C GLY A 95 14.546 -3.109 -28.551 1.00 0.00 C ATOM 1408 O GLY A 95 13.803 -3.811 -27.866 1.00 0.00 O ATOM 0 H GLY A 95 16.620 -4.907 -28.610 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.067 -2.991 -30.051 1.00 0.00 H new ATOM 0 HA3 GLY A 95 14.629 -3.858 -30.553 1.00 0.00 H new ATOM 1412 N ALA A 96 14.729 -1.812 -28.323 1.00 0.00 N ATOM 1413 CA ALA A 96 14.050 -1.125 -27.232 1.00 0.00 C ATOM 1414 C ALA A 96 12.605 -0.806 -27.599 1.00 0.00 C ATOM 1415 O ALA A 96 12.324 0.215 -28.228 1.00 0.00 O ATOM 1416 CB ALA A 96 14.797 0.149 -26.865 1.00 0.00 C ATOM 0 H ALA A 96 15.342 -1.216 -28.880 1.00 0.00 H new ATOM 0 HA ALA A 96 14.040 -1.789 -26.368 1.00 0.00 H new ATOM 0 HB1 ALA A 96 14.279 0.652 -26.049 1.00 0.00 H new ATOM 0 HB2 ALA A 96 15.811 -0.101 -26.552 1.00 0.00 H new ATOM 0 HB3 ALA A 96 14.837 0.810 -27.731 1.00 0.00 H new ATOM 1422 N LYS A 97 11.690 -1.685 -27.203 1.00 0.00 N ATOM 1423 CA LYS A 97 10.273 -1.497 -27.490 1.00 0.00 C ATOM 1424 C LYS A 97 9.473 -1.347 -26.201 1.00 0.00 C ATOM 1425 O LYS A 97 10.032 -1.365 -25.105 1.00 0.00 O ATOM 1426 CB LYS A 97 9.735 -2.678 -28.302 1.00 0.00 C ATOM 1427 CG LYS A 97 10.055 -2.592 -29.785 1.00 0.00 C ATOM 1428 CD LYS A 97 11.491 -2.997 -30.070 1.00 0.00 C ATOM 1429 CE LYS A 97 12.217 -1.938 -30.885 1.00 0.00 C ATOM 1430 NZ LYS A 97 13.048 -2.541 -31.964 1.00 0.00 N ATOM 0 H LYS A 97 11.905 -2.535 -26.682 1.00 0.00 H new ATOM 0 HA LYS A 97 10.164 -0.583 -28.074 1.00 0.00 H new ATOM 0 HB2 LYS A 97 10.151 -3.603 -27.902 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.654 -2.733 -28.175 1.00 0.00 H new ATOM 0 HG2 LYS A 97 9.376 -3.238 -30.343 1.00 0.00 H new ATOM 0 HG3 LYS A 97 9.887 -1.574 -30.136 1.00 0.00 H new ATOM 0 HD2 LYS A 97 12.018 -3.159 -29.130 1.00 0.00 H new ATOM 0 HD3 LYS A 97 11.503 -3.944 -30.609 1.00 0.00 H new ATOM 0 HE2 LYS A 97 11.489 -1.256 -31.325 1.00 0.00 H new ATOM 0 HE3 LYS A 97 12.852 -1.345 -30.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 14.022 -2.182 -31.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 13.052 -3.576 -31.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 12.651 -2.286 -32.891 1.00 0.00 H new ATOM 1444 N GLY A 98 8.158 -1.200 -26.339 1.00 0.00 N ATOM 1445 CA GLY A 98 7.302 -1.050 -25.177 1.00 0.00 C ATOM 1446 C GLY A 98 6.930 -2.382 -24.555 1.00 0.00 C ATOM 1447 O GLY A 98 7.213 -3.439 -25.118 1.00 0.00 O ATOM 0 H GLY A 98 7.671 -1.182 -27.235 1.00 0.00 H new ATOM 0 HA2 GLY A 98 7.808 -0.434 -24.434 1.00 0.00 H new ATOM 0 HA3 GLY A 98 6.394 -0.520 -25.465 1.00 0.00 H new ATOM 1451 N LYS A 99 6.295 -2.332 -23.389 1.00 0.00 N ATOM 1452 CA LYS A 99 5.884 -3.543 -22.689 1.00 0.00 C ATOM 1453 C LYS A 99 5.066 -4.449 -23.603 1.00 0.00 C ATOM 1454 O LYS A 99 5.085 -5.671 -23.460 1.00 0.00 O ATOM 1455 CB LYS A 99 5.067 -3.185 -21.445 1.00 0.00 C ATOM 1456 CG LYS A 99 3.650 -2.736 -21.756 1.00 0.00 C ATOM 1457 CD LYS A 99 3.628 -1.358 -22.396 1.00 0.00 C ATOM 1458 CE LYS A 99 2.386 -0.577 -21.996 1.00 0.00 C ATOM 1459 NZ LYS A 99 2.418 -0.182 -20.560 1.00 0.00 N ATOM 0 H LYS A 99 6.054 -1.465 -22.909 1.00 0.00 H new ATOM 0 HA LYS A 99 6.783 -4.079 -22.385 1.00 0.00 H new ATOM 0 HB2 LYS A 99 5.028 -4.051 -20.785 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.579 -2.392 -20.900 1.00 0.00 H new ATOM 0 HG2 LYS A 99 3.178 -3.456 -22.425 1.00 0.00 H new ATOM 0 HG3 LYS A 99 3.063 -2.721 -20.838 1.00 0.00 H new ATOM 0 HD2 LYS A 99 4.519 -0.804 -22.100 1.00 0.00 H new ATOM 0 HD3 LYS A 99 3.662 -1.459 -23.481 1.00 0.00 H new ATOM 0 HE2 LYS A 99 2.303 0.315 -22.616 1.00 0.00 H new ATOM 0 HE3 LYS A 99 1.499 -1.182 -22.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 1.786 0.630 -20.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 2.102 -0.980 -19.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 3.388 0.080 -20.294 1.00 0.00 H new ATOM 1473 N ALA A 100 4.350 -3.841 -24.544 1.00 0.00 N ATOM 1474 CA ALA A 100 3.528 -4.594 -25.484 1.00 0.00 C ATOM 1475 C ALA A 100 4.336 -5.698 -26.158 1.00 0.00 C ATOM 1476 O ALA A 100 3.812 -6.770 -26.455 1.00 0.00 O ATOM 1477 CB ALA A 100 2.932 -3.661 -26.528 1.00 0.00 C ATOM 0 H ALA A 100 4.323 -2.830 -24.675 1.00 0.00 H new ATOM 0 HA ALA A 100 2.717 -5.062 -24.926 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.321 -4.236 -27.223 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.313 -2.911 -26.035 1.00 0.00 H new ATOM 0 HB3 ALA A 100 3.735 -3.166 -27.074 1.00 0.00 H new ATOM 1483 N ALA A 101 5.616 -5.427 -26.396 1.00 0.00 N ATOM 1484 CA ALA A 101 6.496 -6.398 -27.033 1.00 0.00 C ATOM 1485 C ALA A 101 6.969 -7.449 -26.034 1.00 0.00 C ATOM 1486 O ALA A 101 6.728 -8.644 -26.214 1.00 0.00 O ATOM 1487 CB ALA A 101 7.688 -5.695 -27.665 1.00 0.00 C ATOM 0 H ALA A 101 6.066 -4.543 -26.157 1.00 0.00 H new ATOM 0 HA ALA A 101 5.931 -6.905 -27.815 1.00 0.00 H new ATOM 0 HB1 ALA A 101 8.337 -6.433 -28.137 1.00 0.00 H new ATOM 0 HB2 ALA A 101 7.337 -4.987 -28.416 1.00 0.00 H new ATOM 0 HB3 ALA A 101 8.245 -5.161 -26.895 1.00 0.00 H new ATOM 1493 N LEU A 102 7.643 -6.998 -24.982 1.00 0.00 N ATOM 1494 CA LEU A 102 8.150 -7.901 -23.955 1.00 0.00 C ATOM 1495 C LEU A 102 7.049 -8.829 -23.453 1.00 0.00 C ATOM 1496 O LEU A 102 7.292 -10.003 -23.172 1.00 0.00 O ATOM 1497 CB LEU A 102 8.730 -7.100 -22.787 1.00 0.00 C ATOM 1498 CG LEU A 102 10.141 -6.546 -22.988 1.00 0.00 C ATOM 1499 CD1 LEU A 102 10.123 -5.387 -23.972 1.00 0.00 C ATOM 1500 CD2 LEU A 102 10.737 -6.109 -21.658 1.00 0.00 C ATOM 0 H LEU A 102 7.851 -6.013 -24.818 1.00 0.00 H new ATOM 0 HA LEU A 102 8.938 -8.510 -24.398 1.00 0.00 H new ATOM 0 HB2 LEU A 102 8.060 -6.266 -22.577 1.00 0.00 H new ATOM 0 HB3 LEU A 102 8.734 -7.737 -21.902 1.00 0.00 H new ATOM 0 HG LEU A 102 10.766 -7.338 -23.401 1.00 0.00 H new ATOM 0 HD11 LEU A 102 11.135 -5.005 -24.103 1.00 0.00 H new ATOM 0 HD12 LEU A 102 9.738 -5.731 -24.932 1.00 0.00 H new ATOM 0 HD13 LEU A 102 9.483 -4.593 -23.587 1.00 0.00 H new ATOM 0 HD21 LEU A 102 11.741 -5.718 -21.820 1.00 0.00 H new ATOM 0 HD22 LEU A 102 10.112 -5.333 -21.217 1.00 0.00 H new ATOM 0 HD23 LEU A 102 10.785 -6.963 -20.983 1.00 0.00 H new ATOM 1512 N LEU A 103 5.837 -8.295 -23.344 1.00 0.00 N ATOM 1513 CA LEU A 103 4.696 -9.076 -22.878 1.00 0.00 C ATOM 1514 C LEU A 103 4.565 -10.373 -23.670 1.00 0.00 C ATOM 1515 O LEU A 103 4.253 -11.425 -23.110 1.00 0.00 O ATOM 1516 CB LEU A 103 3.409 -8.258 -23.000 1.00 0.00 C ATOM 1517 CG LEU A 103 3.112 -7.299 -21.846 1.00 0.00 C ATOM 1518 CD1 LEU A 103 1.905 -6.433 -22.170 1.00 0.00 C ATOM 1519 CD2 LEU A 103 2.886 -8.072 -20.555 1.00 0.00 C ATOM 0 H LEU A 103 5.619 -7.325 -23.572 1.00 0.00 H new ATOM 0 HA LEU A 103 4.862 -9.327 -21.830 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.455 -7.681 -23.923 1.00 0.00 H new ATOM 0 HB3 LEU A 103 2.571 -8.948 -23.097 1.00 0.00 H new ATOM 0 HG LEU A 103 3.975 -6.647 -21.709 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.708 -5.757 -21.338 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.105 -5.852 -23.070 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.035 -7.069 -22.335 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.676 -7.374 -19.745 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.040 -8.748 -20.679 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.779 -8.648 -20.315 1.00 0.00 H new ATOM 1531 N ARG A 104 4.806 -10.291 -24.974 1.00 0.00 N ATOM 1532 CA ARG A 104 4.715 -11.459 -25.843 1.00 0.00 C ATOM 1533 C ARG A 104 5.697 -12.541 -25.403 1.00 0.00 C ATOM 1534 O ARG A 104 5.347 -13.718 -25.335 1.00 0.00 O ATOM 1535 CB ARG A 104 4.991 -11.063 -27.295 1.00 0.00 C ATOM 1536 CG ARG A 104 5.136 -12.251 -28.232 1.00 0.00 C ATOM 1537 CD ARG A 104 4.806 -11.871 -29.667 1.00 0.00 C ATOM 1538 NE ARG A 104 3.365 -11.812 -29.900 1.00 0.00 N ATOM 1539 CZ ARG A 104 2.814 -11.212 -30.949 1.00 0.00 C ATOM 1540 NH1 ARG A 104 3.580 -10.622 -31.857 1.00 0.00 N ATOM 1541 NH2 ARG A 104 1.495 -11.200 -31.091 1.00 0.00 N ATOM 0 H ARG A 104 5.066 -9.428 -25.452 1.00 0.00 H new ATOM 0 HA ARG A 104 3.704 -11.859 -25.769 1.00 0.00 H new ATOM 0 HB2 ARG A 104 4.180 -10.428 -27.650 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.903 -10.467 -27.333 1.00 0.00 H new ATOM 0 HG2 ARG A 104 6.155 -12.634 -28.181 1.00 0.00 H new ATOM 0 HG3 ARG A 104 4.476 -13.055 -27.906 1.00 0.00 H new ATOM 0 HD2 ARG A 104 5.250 -10.903 -29.897 1.00 0.00 H new ATOM 0 HD3 ARG A 104 5.254 -12.596 -30.346 1.00 0.00 H new ATOM 0 HE ARG A 104 2.748 -12.256 -29.220 1.00 0.00 H new ATOM 0 HH11 ARG A 104 4.594 -10.628 -31.750 1.00 0.00 H new ATOM 0 HH12 ARG A 104 3.155 -10.162 -32.662 1.00 0.00 H new ATOM 0 HH21 ARG A 104 0.903 -11.652 -30.394 1.00 0.00 H new ATOM 0 HH22 ARG A 104 1.073 -10.739 -31.897 1.00 0.00 H new ATOM 1555 N GLU A 105 6.927 -12.132 -25.107 1.00 0.00 N ATOM 1556 CA GLU A 105 7.959 -13.067 -24.676 1.00 0.00 C ATOM 1557 C GLU A 105 7.464 -13.927 -23.517 1.00 0.00 C ATOM 1558 O GLU A 105 7.801 -15.108 -23.417 1.00 0.00 O ATOM 1559 CB GLU A 105 9.223 -12.311 -24.261 1.00 0.00 C ATOM 1560 CG GLU A 105 9.890 -11.566 -25.405 1.00 0.00 C ATOM 1561 CD GLU A 105 10.480 -12.500 -26.444 1.00 0.00 C ATOM 1562 OE1 GLU A 105 9.764 -12.843 -27.408 1.00 0.00 O ATOM 1563 OE2 GLU A 105 11.657 -12.887 -26.293 1.00 0.00 O ATOM 0 H GLU A 105 7.232 -11.160 -25.158 1.00 0.00 H new ATOM 0 HA GLU A 105 8.195 -13.720 -25.516 1.00 0.00 H new ATOM 0 HB2 GLU A 105 8.969 -11.600 -23.475 1.00 0.00 H new ATOM 0 HB3 GLU A 105 9.935 -13.017 -23.834 1.00 0.00 H new ATOM 0 HG2 GLU A 105 9.160 -10.912 -25.882 1.00 0.00 H new ATOM 0 HG3 GLU A 105 10.678 -10.927 -25.007 1.00 0.00 H new ATOM 1570 N LEU A 106 6.662 -13.328 -22.644 1.00 0.00 N ATOM 1571 CA LEU A 106 6.120 -14.038 -21.490 1.00 0.00 C ATOM 1572 C LEU A 106 5.302 -15.247 -21.930 1.00 0.00 C ATOM 1573 O LEU A 106 5.482 -16.351 -21.418 1.00 0.00 O ATOM 1574 CB LEU A 106 5.253 -13.099 -20.650 1.00 0.00 C ATOM 1575 CG LEU A 106 5.831 -11.708 -20.385 1.00 0.00 C ATOM 1576 CD1 LEU A 106 4.891 -10.898 -19.505 1.00 0.00 C ATOM 1577 CD2 LEU A 106 7.206 -11.817 -19.741 1.00 0.00 C ATOM 0 H LEU A 106 6.372 -12.352 -22.713 1.00 0.00 H new ATOM 0 HA LEU A 106 6.956 -14.389 -20.885 1.00 0.00 H new ATOM 0 HB2 LEU A 106 4.291 -12.982 -21.149 1.00 0.00 H new ATOM 0 HB3 LEU A 106 5.058 -13.578 -19.691 1.00 0.00 H new ATOM 0 HG LEU A 106 5.938 -11.191 -21.339 1.00 0.00 H new ATOM 0 HD11 LEU A 106 5.319 -9.911 -19.327 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.928 -10.791 -20.003 1.00 0.00 H new ATOM 0 HD13 LEU A 106 4.752 -11.410 -18.553 1.00 0.00 H new ATOM 0 HD21 LEU A 106 7.603 -10.818 -19.559 1.00 0.00 H new ATOM 0 HD22 LEU A 106 7.123 -12.352 -18.795 1.00 0.00 H new ATOM 0 HD23 LEU A 106 7.878 -12.359 -20.407 1.00 0.00 H new ATOM 1589 N SER A 107 4.402 -15.031 -22.885 1.00 0.00 N ATOM 1590 CA SER A 107 3.554 -16.102 -23.394 1.00 0.00 C ATOM 1591 C SER A 107 4.393 -17.308 -23.808 1.00 0.00 C ATOM 1592 O SER A 107 3.979 -18.455 -23.636 1.00 0.00 O ATOM 1593 CB SER A 107 2.729 -15.608 -24.583 1.00 0.00 C ATOM 1594 OG SER A 107 1.967 -16.660 -25.148 1.00 0.00 O ATOM 0 H SER A 107 4.242 -14.123 -23.322 1.00 0.00 H new ATOM 0 HA SER A 107 2.878 -16.408 -22.595 1.00 0.00 H new ATOM 0 HB2 SER A 107 2.065 -14.806 -24.260 1.00 0.00 H new ATOM 0 HB3 SER A 107 3.392 -15.188 -25.340 1.00 0.00 H new ATOM 0 HG SER A 107 1.448 -16.318 -25.905 1.00 0.00 H new ATOM 1600 N ASP A 108 5.573 -17.040 -24.354 1.00 0.00 N ATOM 1601 CA ASP A 108 6.472 -18.101 -24.793 1.00 0.00 C ATOM 1602 C ASP A 108 7.035 -18.865 -23.598 1.00 0.00 C ATOM 1603 O ASP A 108 7.116 -20.092 -23.615 1.00 0.00 O ATOM 1604 CB ASP A 108 7.615 -17.520 -25.626 1.00 0.00 C ATOM 1605 CG ASP A 108 7.709 -18.153 -27.001 1.00 0.00 C ATOM 1606 OD1 ASP A 108 7.181 -17.559 -27.965 1.00 0.00 O ATOM 1607 OD2 ASP A 108 8.311 -19.241 -27.113 1.00 0.00 O ATOM 0 H ASP A 108 5.930 -16.096 -24.504 1.00 0.00 H new ATOM 0 HA ASP A 108 5.900 -18.795 -25.410 1.00 0.00 H new ATOM 0 HB2 ASP A 108 7.473 -16.445 -25.733 1.00 0.00 H new ATOM 0 HB3 ASP A 108 8.557 -17.666 -25.097 1.00 0.00 H new ATOM 1612 N ALA A 109 7.424 -18.129 -22.562 1.00 0.00 N ATOM 1613 CA ALA A 109 7.979 -18.736 -21.359 1.00 0.00 C ATOM 1614 C ALA A 109 6.930 -19.568 -20.630 1.00 0.00 C ATOM 1615 O ALA A 109 7.217 -20.664 -20.146 1.00 0.00 O ATOM 1616 CB ALA A 109 8.539 -17.663 -20.436 1.00 0.00 C ATOM 0 H ALA A 109 7.365 -17.111 -22.532 1.00 0.00 H new ATOM 0 HA ALA A 109 8.789 -19.401 -21.658 1.00 0.00 H new ATOM 0 HB1 ALA A 109 8.950 -18.131 -19.542 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.326 -17.113 -20.952 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.742 -16.975 -20.152 1.00 0.00 H new ATOM 1622 N LEU A 110 5.713 -19.041 -20.553 1.00 0.00 N ATOM 1623 CA LEU A 110 4.619 -19.735 -19.882 1.00 0.00 C ATOM 1624 C LEU A 110 3.887 -20.661 -20.848 1.00 0.00 C ATOM 1625 O LEU A 110 4.140 -20.643 -22.052 1.00 0.00 O ATOM 1626 CB LEU A 110 3.639 -18.725 -19.283 1.00 0.00 C ATOM 1627 CG LEU A 110 2.924 -17.812 -20.280 1.00 0.00 C ATOM 1628 CD1 LEU A 110 1.462 -18.211 -20.416 1.00 0.00 C ATOM 1629 CD2 LEU A 110 3.044 -16.357 -19.852 1.00 0.00 C ATOM 0 H LEU A 110 5.459 -18.135 -20.947 1.00 0.00 H new ATOM 0 HA LEU A 110 5.043 -20.340 -19.080 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.885 -19.272 -18.717 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.181 -18.100 -18.573 1.00 0.00 H new ATOM 0 HG LEU A 110 3.402 -17.924 -21.253 1.00 0.00 H new ATOM 0 HD11 LEU A 110 0.969 -17.550 -21.129 1.00 0.00 H new ATOM 0 HD12 LEU A 110 1.397 -19.240 -20.770 1.00 0.00 H new ATOM 0 HD13 LEU A 110 0.971 -18.129 -19.446 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.529 -15.722 -20.573 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.592 -16.229 -18.868 1.00 0.00 H new ATOM 0 HD23 LEU A 110 4.096 -16.076 -19.807 1.00 0.00 H new TER 1641 LEU A 110