USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 125:sc= 1.45 (180deg=-0.0074) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.116 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -166:sc=-0.00346 (180deg=-0.165) USER MOD Single : A 38 HIS : no HD1:sc= -0.321 X(o=-0.32,f=-0.47) USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.188 USER MOD Single : A 49 ASN : amide:sc= -2.42 X(o=-2.4,f=-2.4!) USER MOD Single : A 54 GLN :FLIP amide:sc= -0.919! F(o=-1.9,f=-0.92!) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -0.0372 X(o=-0.037,f=-0.1) USER MOD Single : A 72 HIS : no HD1:sc= -5.18! C(o=-5.2!,f=-5.7!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.0262 X(o=-0.026,f=0.056) USER MOD Single : A 92 HIS : no HD1:sc= -0.668 K(o=-0.67,f=-1.8!) USER MOD Single : A 99 GLN : amide:sc= -1.62! C(o=-1.6!,f=-4!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.0291 X(o=-0.029,f=-0.029) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 121 THR OG1 : rot 62:sc= -0.501! USER MOD Single : A 123 THR OG1 : rot -170:sc= -2.08 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 75.595 24.975 -20.844 1.00 1.00 N ATOM 2 CA MET A 1 76.016 23.580 -21.163 1.00 1.00 C ATOM 3 C MET A 1 74.844 22.638 -20.917 1.00 1.00 C ATOM 4 O MET A 1 73.850 23.020 -20.300 1.00 1.00 O ATOM 5 CB MET A 1 77.205 23.182 -20.280 1.00 1.00 C ATOM 6 CG MET A 1 78.406 24.098 -20.562 1.00 1.00 C ATOM 7 SD MET A 1 78.295 25.578 -19.526 1.00 1.00 S ATOM 8 CE MET A 1 80.069 25.916 -19.421 1.00 1.00 C ATOM 0 H1 MET A 1 76.250 25.385 -20.148 1.00 1.00 H new ATOM 0 H2 MET A 1 75.608 25.549 -21.711 1.00 1.00 H new ATOM 0 H3 MET A 1 74.633 24.966 -20.450 1.00 1.00 H new ATOM 0 HA MET A 1 76.319 23.517 -22.208 1.00 1.00 H new ATOM 0 HB2 MET A 1 76.925 23.250 -19.229 1.00 1.00 H new ATOM 0 HB3 MET A 1 77.477 22.144 -20.471 1.00 1.00 H new ATOM 0 HG2 MET A 1 79.336 23.568 -20.359 1.00 1.00 H new ATOM 0 HG3 MET A 1 78.423 24.379 -21.615 1.00 1.00 H new ATOM 0 HE1 MET A 1 80.234 26.807 -18.815 1.00 1.00 H new ATOM 0 HE2 MET A 1 80.575 25.066 -18.963 1.00 1.00 H new ATOM 0 HE3 MET A 1 80.468 26.079 -20.422 1.00 1.00 H new ATOM 18 N SER A 2 74.967 21.405 -21.400 1.00 1.00 N ATOM 19 CA SER A 2 73.923 20.393 -21.237 1.00 1.00 C ATOM 20 C SER A 2 74.359 19.337 -20.225 1.00 1.00 C ATOM 21 O SER A 2 73.681 18.328 -20.043 1.00 1.00 O ATOM 22 CB SER A 2 73.640 19.721 -22.583 1.00 1.00 C ATOM 23 OG SER A 2 73.291 20.714 -23.539 1.00 1.00 O ATOM 0 H SER A 2 75.786 21.079 -21.912 1.00 1.00 H new ATOM 0 HA SER A 2 73.019 20.881 -20.873 1.00 1.00 H new ATOM 0 HB2 SER A 2 74.518 19.169 -22.919 1.00 1.00 H new ATOM 0 HB3 SER A 2 72.830 18.999 -22.479 1.00 1.00 H new ATOM 0 HG SER A 2 73.111 20.288 -24.403 1.00 1.00 H new ATOM 29 N ASP A 3 75.491 19.584 -19.564 1.00 1.00 N ATOM 30 CA ASP A 3 76.013 18.652 -18.564 1.00 1.00 C ATOM 31 C ASP A 3 77.423 19.064 -18.135 1.00 1.00 C ATOM 32 O ASP A 3 78.408 18.680 -18.766 1.00 1.00 O ATOM 33 CB ASP A 3 76.043 17.225 -19.137 1.00 1.00 C ATOM 34 CG ASP A 3 76.428 17.268 -20.613 1.00 1.00 C ATOM 35 OD1 ASP A 3 77.050 18.238 -21.015 1.00 1.00 O ATOM 36 OD2 ASP A 3 76.094 16.331 -21.319 1.00 1.00 O ATOM 0 H ASP A 3 76.062 20.418 -19.702 1.00 1.00 H new ATOM 0 HA ASP A 3 75.357 18.676 -17.694 1.00 1.00 H new ATOM 0 HB2 ASP A 3 76.757 16.616 -18.583 1.00 1.00 H new ATOM 0 HB3 ASP A 3 75.066 16.756 -19.020 1.00 1.00 H new ATOM 41 N PHE A 4 77.520 19.847 -17.060 1.00 1.00 N ATOM 42 CA PHE A 4 78.820 20.298 -16.566 1.00 1.00 C ATOM 43 C PHE A 4 78.770 20.523 -15.057 1.00 1.00 C ATOM 44 O PHE A 4 77.748 20.946 -14.519 1.00 1.00 O ATOM 45 CB PHE A 4 79.214 21.601 -17.259 1.00 1.00 C ATOM 46 CG PHE A 4 80.620 21.978 -16.858 1.00 1.00 C ATOM 47 CD1 PHE A 4 81.710 21.328 -17.448 1.00 1.00 C ATOM 48 CD2 PHE A 4 80.836 22.979 -15.902 1.00 1.00 C ATOM 49 CE1 PHE A 4 83.015 21.678 -17.085 1.00 1.00 C ATOM 50 CE2 PHE A 4 82.142 23.328 -15.538 1.00 1.00 C ATOM 51 CZ PHE A 4 83.232 22.678 -16.130 1.00 1.00 C ATOM 0 H PHE A 4 76.721 20.179 -16.519 1.00 1.00 H new ATOM 0 HA PHE A 4 79.559 19.528 -16.785 1.00 1.00 H new ATOM 0 HB2 PHE A 4 79.152 21.483 -18.341 1.00 1.00 H new ATOM 0 HB3 PHE A 4 78.520 22.396 -16.984 1.00 1.00 H new ATOM 0 HD1 PHE A 4 81.544 20.556 -18.184 1.00 1.00 H new ATOM 0 HD2 PHE A 4 79.996 23.481 -15.446 1.00 1.00 H new ATOM 0 HE1 PHE A 4 83.855 21.176 -17.542 1.00 1.00 H new ATOM 0 HE2 PHE A 4 82.309 24.099 -14.800 1.00 1.00 H new ATOM 0 HZ PHE A 4 84.239 22.948 -15.850 1.00 1.00 H new ATOM 61 N ASP A 5 79.879 20.240 -14.379 1.00 1.00 N ATOM 62 CA ASP A 5 79.952 20.417 -12.932 1.00 1.00 C ATOM 63 C ASP A 5 81.402 20.617 -12.491 1.00 1.00 C ATOM 64 O ASP A 5 82.328 20.130 -13.139 1.00 1.00 O ATOM 65 CB ASP A 5 79.357 19.188 -12.232 1.00 1.00 C ATOM 66 CG ASP A 5 79.774 17.917 -12.967 1.00 1.00 C ATOM 67 OD1 ASP A 5 80.616 18.012 -13.845 1.00 1.00 O ATOM 68 OD2 ASP A 5 79.249 16.866 -12.639 1.00 1.00 O ATOM 0 H ASP A 5 80.736 19.889 -14.806 1.00 1.00 H new ATOM 0 HA ASP A 5 79.380 21.303 -12.656 1.00 1.00 H new ATOM 0 HB2 ASP A 5 79.697 19.148 -11.197 1.00 1.00 H new ATOM 0 HB3 ASP A 5 78.270 19.264 -12.207 1.00 1.00 H new ATOM 73 N THR A 6 81.591 21.338 -11.388 1.00 1.00 N ATOM 74 CA THR A 6 82.937 21.588 -10.881 1.00 1.00 C ATOM 75 C THR A 6 83.576 20.265 -10.449 1.00 1.00 C ATOM 76 O THR A 6 82.922 19.251 -10.397 1.00 1.00 O ATOM 77 CB THR A 6 82.888 22.582 -9.696 1.00 1.00 C ATOM 78 OG1 THR A 6 81.686 23.332 -9.768 1.00 1.00 O ATOM 79 CG2 THR A 6 84.081 23.544 -9.747 1.00 1.00 C ATOM 0 H THR A 6 80.841 21.754 -10.836 1.00 1.00 H new ATOM 0 HA THR A 6 83.542 22.031 -11.672 1.00 1.00 H new ATOM 0 HB THR A 6 82.929 22.019 -8.764 1.00 1.00 H new ATOM 0 HG1 THR A 6 81.648 23.962 -9.019 1.00 1.00 H new ATOM 0 HG21 THR A 6 84.028 24.235 -8.905 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.009 22.976 -9.692 1.00 1.00 H new ATOM 0 HG23 THR A 6 84.055 24.107 -10.680 1.00 1.00 H new ATOM 87 N GLU A 7 84.862 20.304 -10.179 1.00 1.00 N ATOM 88 CA GLU A 7 85.607 19.105 -9.787 1.00 1.00 C ATOM 89 C GLU A 7 85.008 18.503 -8.515 1.00 1.00 C ATOM 90 O GLU A 7 84.630 17.333 -8.477 1.00 1.00 O ATOM 91 CB GLU A 7 87.075 19.500 -9.544 1.00 1.00 C ATOM 92 CG GLU A 7 87.941 18.257 -9.243 1.00 1.00 C ATOM 93 CD GLU A 7 88.021 18.009 -7.736 1.00 1.00 C ATOM 94 OE1 GLU A 7 87.039 17.557 -7.175 1.00 1.00 O ATOM 95 OE2 GLU A 7 89.067 18.278 -7.167 1.00 1.00 O ATOM 0 H GLU A 7 85.426 21.153 -10.221 1.00 1.00 H new ATOM 0 HA GLU A 7 85.548 18.358 -10.579 1.00 1.00 H new ATOM 0 HB2 GLU A 7 87.466 20.016 -10.421 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.134 20.199 -8.710 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.518 17.383 -9.739 1.00 1.00 H new ATOM 0 HG3 GLU A 7 88.943 18.399 -9.647 1.00 1.00 H new ATOM 102 N ARG A 8 84.974 19.306 -7.473 1.00 1.00 N ATOM 103 CA ARG A 8 84.464 18.809 -6.197 1.00 1.00 C ATOM 104 C ARG A 8 83.097 18.152 -6.455 1.00 1.00 C ATOM 105 O ARG A 8 82.888 16.994 -6.165 1.00 1.00 O ATOM 106 CB ARG A 8 84.324 19.964 -5.180 1.00 1.00 C ATOM 107 CG ARG A 8 84.114 21.288 -5.925 1.00 1.00 C ATOM 108 CD ARG A 8 83.847 22.415 -4.934 1.00 1.00 C ATOM 109 NE ARG A 8 82.599 22.173 -4.217 1.00 1.00 N ATOM 110 CZ ARG A 8 81.850 23.175 -3.764 1.00 1.00 C ATOM 111 NH1 ARG A 8 82.183 24.413 -4.018 1.00 1.00 N ATOM 112 NH2 ARG A 8 80.769 22.917 -3.080 1.00 1.00 N ATOM 0 H ARG A 8 85.282 20.279 -7.473 1.00 1.00 H new ATOM 0 HA ARG A 8 85.158 18.082 -5.775 1.00 1.00 H new ATOM 0 HB2 ARG A 8 83.483 19.774 -4.513 1.00 1.00 H new ATOM 0 HB3 ARG A 8 85.217 20.024 -4.558 1.00 1.00 H new ATOM 0 HG2 ARG A 8 84.995 21.521 -6.522 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.276 21.196 -6.616 1.00 1.00 H new ATOM 0 HD2 ARG A 8 84.673 22.489 -4.226 1.00 1.00 H new ATOM 0 HD3 ARG A 8 83.793 23.367 -5.462 1.00 1.00 H new ATOM 0 HE ARG A 8 82.294 21.213 -4.059 1.00 1.00 H new ATOM 0 HH11 ARG A 8 83.020 24.614 -4.565 1.00 1.00 H new ATOM 0 HH12 ARG A 8 81.606 25.178 -3.669 1.00 1.00 H new ATOM 0 HH21 ARG A 8 80.501 21.950 -2.895 1.00 1.00 H new ATOM 0 HH22 ARG A 8 80.192 23.682 -2.731 1.00 1.00 H new ATOM 126 N VAL A 9 82.207 18.928 -7.031 1.00 1.00 N ATOM 127 CA VAL A 9 80.864 18.410 -7.340 1.00 1.00 C ATOM 128 C VAL A 9 80.953 17.274 -8.378 1.00 1.00 C ATOM 129 O VAL A 9 80.342 16.235 -8.198 1.00 1.00 O ATOM 130 CB VAL A 9 79.882 19.517 -7.790 1.00 1.00 C ATOM 131 CG1 VAL A 9 79.065 20.002 -6.584 1.00 1.00 C ATOM 132 CG2 VAL A 9 80.658 20.695 -8.363 1.00 1.00 C ATOM 0 H VAL A 9 82.368 19.900 -7.296 1.00 1.00 H new ATOM 0 HA VAL A 9 80.453 18.005 -6.415 1.00 1.00 H new ATOM 0 HB VAL A 9 79.216 19.110 -8.551 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.374 20.782 -6.903 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.502 19.167 -6.166 1.00 1.00 H new ATOM 0 HG13 VAL A 9 79.738 20.402 -5.826 1.00 1.00 H new ATOM 0 HG21 VAL A 9 79.961 21.471 -8.678 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.327 21.095 -7.601 1.00 1.00 H new ATOM 0 HG23 VAL A 9 81.243 20.363 -9.221 1.00 1.00 H new ATOM 142 N SER A 10 81.709 17.503 -9.445 1.00 1.00 N ATOM 143 CA SER A 10 81.840 16.483 -10.509 1.00 1.00 C ATOM 144 C SER A 10 82.516 15.216 -9.972 1.00 1.00 C ATOM 145 O SER A 10 81.933 14.140 -10.011 1.00 1.00 O ATOM 146 CB SER A 10 82.676 17.008 -11.681 1.00 1.00 C ATOM 147 OG SER A 10 82.776 15.992 -12.672 1.00 1.00 O ATOM 0 H SER A 10 82.235 18.362 -9.607 1.00 1.00 H new ATOM 0 HA SER A 10 80.831 16.252 -10.851 1.00 1.00 H new ATOM 0 HB2 SER A 10 82.214 17.901 -12.103 1.00 1.00 H new ATOM 0 HB3 SER A 10 83.669 17.296 -11.336 1.00 1.00 H new ATOM 0 HG SER A 10 83.308 16.322 -13.426 1.00 1.00 H new ATOM 153 N ARG A 11 83.768 15.342 -9.537 1.00 1.00 N ATOM 154 CA ARG A 11 84.521 14.173 -9.064 1.00 1.00 C ATOM 155 C ARG A 11 83.769 13.521 -7.892 1.00 1.00 C ATOM 156 O ARG A 11 83.490 12.326 -7.901 1.00 1.00 O ATOM 157 CB ARG A 11 85.939 14.630 -8.623 1.00 1.00 C ATOM 158 CG ARG A 11 87.011 13.646 -9.116 1.00 1.00 C ATOM 159 CD ARG A 11 88.390 14.096 -8.610 1.00 1.00 C ATOM 160 NE ARG A 11 89.455 13.281 -9.196 1.00 1.00 N ATOM 161 CZ ARG A 11 90.679 13.263 -8.665 1.00 1.00 C ATOM 162 NH1 ARG A 11 90.949 14.007 -7.628 1.00 1.00 N ATOM 163 NH2 ARG A 11 91.617 12.511 -9.184 1.00 1.00 N ATOM 0 H ARG A 11 84.279 16.224 -9.500 1.00 1.00 H new ATOM 0 HA ARG A 11 84.619 13.438 -9.863 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.144 15.625 -9.018 1.00 1.00 H new ATOM 0 HB3 ARG A 11 85.980 14.704 -7.536 1.00 1.00 H new ATOM 0 HG2 ARG A 11 86.790 12.641 -8.757 1.00 1.00 H new ATOM 0 HG3 ARG A 11 87.007 13.603 -10.205 1.00 1.00 H new ATOM 0 HD2 ARG A 11 88.549 15.145 -8.862 1.00 1.00 H new ATOM 0 HD3 ARG A 11 88.425 14.020 -7.523 1.00 1.00 H new ATOM 0 HE ARG A 11 89.258 12.718 -10.023 1.00 1.00 H new ATOM 0 HH11 ARG A 11 90.225 14.601 -7.224 1.00 1.00 H new ATOM 0 HH12 ARG A 11 91.884 13.994 -7.221 1.00 1.00 H new ATOM 0 HH21 ARG A 11 91.414 11.933 -10.000 1.00 1.00 H new ATOM 0 HH22 ARG A 11 92.550 12.503 -8.772 1.00 1.00 H new ATOM 177 N ALA A 12 83.487 14.337 -6.879 1.00 1.00 N ATOM 178 CA ALA A 12 82.803 13.808 -5.681 1.00 1.00 C ATOM 179 C ALA A 12 81.645 12.959 -6.205 1.00 1.00 C ATOM 180 O ALA A 12 81.464 11.809 -5.819 1.00 1.00 O ATOM 181 CB ALA A 12 82.273 14.909 -4.758 1.00 1.00 C ATOM 0 H ALA A 12 83.708 15.332 -6.852 1.00 1.00 H new ATOM 0 HA ALA A 12 83.506 13.235 -5.076 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.781 14.456 -3.897 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.102 15.529 -4.418 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.557 15.526 -5.301 1.00 1.00 H new ATOM 187 N VAL A 13 80.929 13.535 -7.151 1.00 1.00 N ATOM 188 CA VAL A 13 79.854 12.780 -7.784 1.00 1.00 C ATOM 189 C VAL A 13 80.473 11.548 -8.471 1.00 1.00 C ATOM 190 O VAL A 13 80.057 10.443 -8.224 1.00 1.00 O ATOM 191 CB VAL A 13 79.013 13.631 -8.781 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.546 12.796 -9.987 1.00 1.00 C ATOM 193 CG2 VAL A 13 77.759 14.168 -8.068 1.00 1.00 C ATOM 0 H VAL A 13 81.060 14.487 -7.492 1.00 1.00 H new ATOM 0 HA VAL A 13 79.147 12.468 -7.015 1.00 1.00 H new ATOM 0 HB VAL A 13 79.648 14.444 -9.133 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.962 13.424 -10.660 1.00 1.00 H new ATOM 0 HG12 VAL A 13 79.415 12.405 -10.517 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.930 11.967 -9.639 1.00 1.00 H new ATOM 0 HG21 VAL A 13 77.171 14.764 -8.766 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.159 13.332 -7.709 1.00 1.00 H new ATOM 0 HG23 VAL A 13 78.058 14.789 -7.224 1.00 1.00 H new ATOM 203 N ALA A 14 81.492 11.707 -9.306 1.00 1.00 N ATOM 204 CA ALA A 14 82.048 10.510 -9.939 1.00 1.00 C ATOM 205 C ALA A 14 82.502 9.511 -8.874 1.00 1.00 C ATOM 206 O ALA A 14 81.985 8.416 -8.809 1.00 1.00 O ATOM 207 CB ALA A 14 83.240 10.889 -10.821 1.00 1.00 C ATOM 0 H ALA A 14 81.931 12.594 -9.553 1.00 1.00 H new ATOM 0 HA ALA A 14 81.274 10.051 -10.554 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.647 9.992 -11.288 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.914 11.584 -11.594 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.009 11.361 -10.210 1.00 1.00 H new ATOM 213 N ALA A 15 83.488 9.891 -8.071 1.00 1.00 N ATOM 214 CA ALA A 15 84.021 8.978 -7.045 1.00 1.00 C ATOM 215 C ALA A 15 82.898 8.446 -6.150 1.00 1.00 C ATOM 216 O ALA A 15 82.726 7.242 -5.982 1.00 1.00 O ATOM 217 CB ALA A 15 85.035 9.723 -6.169 1.00 1.00 C ATOM 0 H ALA A 15 83.934 10.808 -8.101 1.00 1.00 H new ATOM 0 HA ALA A 15 84.500 8.141 -7.552 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.428 9.046 -5.411 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.854 10.087 -6.790 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.545 10.567 -5.683 1.00 1.00 H new ATOM 223 N ALA A 16 82.177 9.365 -5.556 1.00 1.00 N ATOM 224 CA ALA A 16 81.100 8.971 -4.651 1.00 1.00 C ATOM 225 C ALA A 16 80.011 8.224 -5.439 1.00 1.00 C ATOM 226 O ALA A 16 79.610 7.110 -5.097 1.00 1.00 O ATOM 227 CB ALA A 16 80.510 10.207 -3.951 1.00 1.00 C ATOM 0 H ALA A 16 82.303 10.371 -5.672 1.00 1.00 H new ATOM 0 HA ALA A 16 81.501 8.307 -3.886 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.709 9.897 -3.280 1.00 1.00 H new ATOM 0 HB2 ALA A 16 81.290 10.708 -3.378 1.00 1.00 H new ATOM 0 HB3 ALA A 16 80.112 10.893 -4.699 1.00 1.00 H new ATOM 233 N LEU A 17 79.522 8.893 -6.465 1.00 1.00 N ATOM 234 CA LEU A 17 78.433 8.290 -7.255 1.00 1.00 C ATOM 235 C LEU A 17 78.928 6.939 -7.792 1.00 1.00 C ATOM 236 O LEU A 17 78.277 5.915 -7.583 1.00 1.00 O ATOM 237 CB LEU A 17 77.908 9.193 -8.392 1.00 1.00 C ATOM 238 CG LEU A 17 76.460 8.825 -8.786 1.00 1.00 C ATOM 239 CD1 LEU A 17 76.357 7.337 -9.146 1.00 1.00 C ATOM 240 CD2 LEU A 17 75.483 9.153 -7.634 1.00 1.00 C ATOM 0 H LEU A 17 79.835 9.814 -6.772 1.00 1.00 H new ATOM 0 HA LEU A 17 77.573 8.154 -6.599 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.946 10.236 -8.077 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.558 9.099 -9.262 1.00 1.00 H new ATOM 0 HG LEU A 17 76.189 9.418 -9.660 1.00 1.00 H new ATOM 0 HD11 LEU A 17 75.329 7.099 -9.420 1.00 1.00 H new ATOM 0 HD12 LEU A 17 77.016 7.119 -9.986 1.00 1.00 H new ATOM 0 HD13 LEU A 17 76.652 6.734 -8.288 1.00 1.00 H new ATOM 0 HD21 LEU A 17 74.468 8.887 -7.930 1.00 1.00 H new ATOM 0 HD22 LEU A 17 75.763 8.585 -6.747 1.00 1.00 H new ATOM 0 HD23 LEU A 17 75.528 10.219 -7.411 1.00 1.00 H new ATOM 252 N VAL A 18 80.089 6.911 -8.451 1.00 1.00 N ATOM 253 CA VAL A 18 80.593 5.621 -8.947 1.00 1.00 C ATOM 254 C VAL A 18 80.996 4.730 -7.759 1.00 1.00 C ATOM 255 O VAL A 18 80.499 3.613 -7.621 1.00 1.00 O ATOM 256 CB VAL A 18 81.765 5.778 -9.973 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.490 6.950 -10.962 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.135 5.979 -9.271 1.00 1.00 C ATOM 0 H VAL A 18 80.676 7.722 -8.649 1.00 1.00 H new ATOM 0 HA VAL A 18 79.784 5.139 -9.496 1.00 1.00 H new ATOM 0 HB VAL A 18 81.816 4.846 -10.537 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.320 7.037 -11.663 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.569 6.754 -11.512 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.388 7.881 -10.404 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.917 6.083 -10.023 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.100 6.878 -8.656 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.351 5.117 -8.640 1.00 1.00 H new ATOM 268 N GLY A 19 81.906 5.218 -6.918 1.00 1.00 N ATOM 269 CA GLY A 19 82.376 4.454 -5.772 1.00 1.00 C ATOM 270 C GLY A 19 81.236 4.157 -4.813 1.00 1.00 C ATOM 271 O GLY A 19 80.075 4.397 -5.133 1.00 1.00 O ATOM 0 H GLY A 19 82.331 6.141 -7.012 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.823 3.520 -6.112 1.00 1.00 H new ATOM 0 HA3 GLY A 19 83.156 5.011 -5.254 1.00 1.00 H new ATOM 275 N PRO A 20 81.537 3.619 -3.658 1.00 1.00 N ATOM 276 CA PRO A 20 80.506 3.258 -2.648 1.00 1.00 C ATOM 277 C PRO A 20 79.973 4.456 -1.842 1.00 1.00 C ATOM 278 O PRO A 20 78.871 4.398 -1.327 1.00 1.00 O ATOM 279 CB PRO A 20 81.230 2.247 -1.717 1.00 1.00 C ATOM 280 CG PRO A 20 82.643 2.117 -2.235 1.00 1.00 C ATOM 281 CD PRO A 20 82.883 3.301 -3.169 1.00 1.00 C ATOM 0 HA PRO A 20 79.618 2.853 -3.133 1.00 1.00 H new ATOM 0 HB2 PRO A 20 81.227 2.599 -0.686 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.724 1.282 -1.726 1.00 1.00 H new ATOM 0 HG2 PRO A 20 83.358 2.123 -1.412 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.775 1.174 -2.765 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.330 4.145 -2.643 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.557 3.040 -3.985 1.00 1.00 H new ATOM 289 N GLY A 21 80.782 5.507 -1.707 1.00 1.00 N ATOM 290 CA GLY A 21 80.365 6.669 -0.891 1.00 1.00 C ATOM 291 C GLY A 21 79.078 7.304 -1.422 1.00 1.00 C ATOM 292 O GLY A 21 78.093 7.441 -0.699 1.00 1.00 O ATOM 0 H GLY A 21 81.705 5.588 -2.134 1.00 1.00 H new ATOM 0 HA2 GLY A 21 80.215 6.353 0.141 1.00 1.00 H new ATOM 0 HA3 GLY A 21 81.162 7.413 -0.884 1.00 1.00 H new ATOM 296 N GLY A 22 79.101 7.729 -2.666 1.00 1.00 N ATOM 297 CA GLY A 22 77.904 8.388 -3.205 1.00 1.00 C ATOM 298 C GLY A 22 76.763 7.412 -3.073 1.00 1.00 C ATOM 299 O GLY A 22 75.708 7.721 -2.516 1.00 1.00 O ATOM 0 H GLY A 22 79.889 7.643 -3.308 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.691 9.306 -2.658 1.00 1.00 H new ATOM 0 HA3 GLY A 22 78.054 8.666 -4.248 1.00 1.00 H new ATOM 303 N VAL A 23 77.001 6.226 -3.579 1.00 1.00 N ATOM 304 CA VAL A 23 76.000 5.179 -3.507 1.00 1.00 C ATOM 305 C VAL A 23 75.651 4.906 -2.044 1.00 1.00 C ATOM 306 O VAL A 23 74.516 4.562 -1.728 1.00 1.00 O ATOM 307 CB VAL A 23 76.476 3.907 -4.212 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.292 2.953 -4.391 1.00 1.00 C ATOM 309 CG2 VAL A 23 77.018 4.281 -5.594 1.00 1.00 C ATOM 0 H VAL A 23 77.870 5.959 -4.042 1.00 1.00 H new ATOM 0 HA VAL A 23 75.102 5.514 -4.026 1.00 1.00 H new ATOM 0 HB VAL A 23 77.253 3.426 -3.618 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.628 2.046 -4.893 1.00 1.00 H new ATOM 0 HG12 VAL A 23 74.881 2.696 -3.415 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.523 3.437 -4.993 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.360 3.382 -6.106 1.00 1.00 H new ATOM 0 HG22 VAL A 23 76.229 4.753 -6.179 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.851 4.975 -5.482 1.00 1.00 H new ATOM 319 N ALA A 24 76.638 5.062 -1.152 1.00 1.00 N ATOM 320 CA ALA A 24 76.349 4.810 0.261 1.00 1.00 C ATOM 321 C ALA A 24 75.216 5.732 0.726 1.00 1.00 C ATOM 322 O ALA A 24 74.175 5.248 1.163 1.00 1.00 O ATOM 323 CB ALA A 24 77.572 5.041 1.162 1.00 1.00 C ATOM 0 H ALA A 24 77.594 5.346 -1.368 1.00 1.00 H new ATOM 0 HA ALA A 24 76.061 3.762 0.346 1.00 1.00 H new ATOM 0 HB1 ALA A 24 77.303 4.840 2.199 1.00 1.00 H new ATOM 0 HB2 ALA A 24 78.378 4.372 0.860 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.904 6.075 1.067 1.00 1.00 H new ATOM 329 N LEU A 25 75.416 7.055 0.667 1.00 1.00 N ATOM 330 CA LEU A 25 74.388 7.977 1.139 1.00 1.00 C ATOM 331 C LEU A 25 73.104 7.915 0.300 1.00 1.00 C ATOM 332 O LEU A 25 72.008 7.949 0.863 1.00 1.00 O ATOM 333 CB LEU A 25 74.968 9.419 1.220 1.00 1.00 C ATOM 334 CG LEU A 25 74.640 10.257 -0.035 1.00 1.00 C ATOM 335 CD1 LEU A 25 73.200 10.837 0.049 1.00 1.00 C ATOM 336 CD2 LEU A 25 75.651 11.411 -0.145 1.00 1.00 C ATOM 0 H LEU A 25 76.261 7.498 0.305 1.00 1.00 H new ATOM 0 HA LEU A 25 74.093 7.665 2.141 1.00 1.00 H new ATOM 0 HB2 LEU A 25 74.569 9.919 2.102 1.00 1.00 H new ATOM 0 HB3 LEU A 25 76.049 9.366 1.346 1.00 1.00 H new ATOM 0 HG LEU A 25 74.703 9.615 -0.914 1.00 1.00 H new ATOM 0 HD11 LEU A 25 72.991 11.424 -0.846 1.00 1.00 H new ATOM 0 HD12 LEU A 25 72.482 10.020 0.123 1.00 1.00 H new ATOM 0 HD13 LEU A 25 73.115 11.475 0.929 1.00 1.00 H new ATOM 0 HD21 LEU A 25 75.427 12.008 -1.029 1.00 1.00 H new ATOM 0 HD22 LEU A 25 75.585 12.039 0.744 1.00 1.00 H new ATOM 0 HD23 LEU A 25 76.659 11.005 -0.228 1.00 1.00 H new ATOM 348 N VAL A 26 73.210 7.873 -1.028 1.00 1.00 N ATOM 349 CA VAL A 26 71.994 7.867 -1.828 1.00 1.00 C ATOM 350 C VAL A 26 71.163 6.630 -1.505 1.00 1.00 C ATOM 351 O VAL A 26 70.008 6.753 -1.097 1.00 1.00 O ATOM 352 CB VAL A 26 72.362 7.885 -3.316 1.00 1.00 C ATOM 353 CG1 VAL A 26 71.119 7.638 -4.178 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.959 9.249 -3.676 1.00 1.00 C ATOM 0 H VAL A 26 74.085 7.844 -1.551 1.00 1.00 H new ATOM 0 HA VAL A 26 71.403 8.753 -1.595 1.00 1.00 H new ATOM 0 HB VAL A 26 73.089 7.096 -3.507 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.398 7.654 -5.232 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.692 6.666 -3.930 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.382 8.418 -3.986 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.221 9.264 -4.734 1.00 1.00 H new ATOM 0 HG22 VAL A 26 72.228 10.031 -3.473 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.853 9.424 -3.078 1.00 1.00 H new ATOM 364 N VAL A 27 71.721 5.440 -1.715 1.00 1.00 N ATOM 365 CA VAL A 27 70.981 4.202 -1.472 1.00 1.00 C ATOM 366 C VAL A 27 70.497 4.098 -0.025 1.00 1.00 C ATOM 367 O VAL A 27 69.422 3.562 0.242 1.00 1.00 O ATOM 368 CB VAL A 27 71.885 2.997 -1.834 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.844 2.655 -0.676 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.017 1.771 -2.151 1.00 1.00 C ATOM 0 H VAL A 27 72.675 5.306 -2.050 1.00 1.00 H new ATOM 0 HA VAL A 27 70.091 4.201 -2.101 1.00 1.00 H new ATOM 0 HB VAL A 27 72.477 3.269 -2.708 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.466 1.806 -0.958 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.479 3.515 -0.463 1.00 1.00 H new ATOM 0 HG13 VAL A 27 72.266 2.402 0.213 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.658 0.927 -2.405 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.412 1.518 -1.280 1.00 1.00 H new ATOM 0 HG23 VAL A 27 70.363 1.996 -2.994 1.00 1.00 H new ATOM 380 N LYS A 28 71.301 4.594 0.900 1.00 1.00 N ATOM 381 CA LYS A 28 70.928 4.518 2.309 1.00 1.00 C ATOM 382 C LYS A 28 69.719 5.405 2.562 1.00 1.00 C ATOM 383 O LYS A 28 68.707 4.977 3.116 1.00 1.00 O ATOM 384 CB LYS A 28 72.105 4.982 3.186 1.00 1.00 C ATOM 385 CG LYS A 28 71.764 4.835 4.696 1.00 1.00 C ATOM 386 CD LYS A 28 72.208 6.083 5.474 1.00 1.00 C ATOM 387 CE LYS A 28 73.735 6.185 5.475 1.00 1.00 C ATOM 388 NZ LYS A 28 74.301 5.158 6.394 1.00 1.00 N ATOM 0 H LYS A 28 72.197 5.044 0.712 1.00 1.00 H new ATOM 0 HA LYS A 28 70.680 3.487 2.561 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.993 4.395 2.951 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.342 6.022 2.962 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.691 4.685 4.819 1.00 1.00 H new ATOM 0 HG3 LYS A 28 72.258 3.952 5.102 1.00 1.00 H new ATOM 0 HD2 LYS A 28 71.776 6.976 5.022 1.00 1.00 H new ATOM 0 HD3 LYS A 28 71.838 6.034 6.498 1.00 1.00 H new ATOM 0 HE2 LYS A 28 74.121 6.038 4.466 1.00 1.00 H new ATOM 0 HE3 LYS A 28 74.043 7.181 5.792 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 75.301 5.373 6.581 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 73.772 5.165 7.290 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 74.225 4.219 5.954 1.00 1.00 H new ATOM 402 N VAL A 29 69.879 6.661 2.187 1.00 1.00 N ATOM 403 CA VAL A 29 68.830 7.644 2.409 1.00 1.00 C ATOM 404 C VAL A 29 67.586 7.306 1.610 1.00 1.00 C ATOM 405 O VAL A 29 66.481 7.329 2.151 1.00 1.00 O ATOM 406 CB VAL A 29 69.297 9.058 2.067 1.00 1.00 C ATOM 407 CG1 VAL A 29 68.121 10.031 2.222 1.00 1.00 C ATOM 408 CG2 VAL A 29 70.413 9.468 3.028 1.00 1.00 C ATOM 0 H VAL A 29 70.716 7.024 1.731 1.00 1.00 H new ATOM 0 HA VAL A 29 68.587 7.612 3.471 1.00 1.00 H new ATOM 0 HB VAL A 29 69.665 9.083 1.041 1.00 1.00 H new ATOM 0 HG11 VAL A 29 68.450 11.041 1.979 1.00 1.00 H new ATOM 0 HG12 VAL A 29 67.316 9.739 1.547 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.760 10.005 3.250 1.00 1.00 H new ATOM 0 HG21 VAL A 29 70.749 10.477 2.787 1.00 1.00 H new ATOM 0 HG22 VAL A 29 70.039 9.445 4.051 1.00 1.00 H new ATOM 0 HG23 VAL A 29 71.249 8.775 2.932 1.00 1.00 H new ATOM 418 N CYS A 30 67.738 7.007 0.321 1.00 1.00 N ATOM 419 CA CYS A 30 66.564 6.697 -0.466 1.00 1.00 C ATOM 420 C CYS A 30 65.936 5.415 0.057 1.00 1.00 C ATOM 421 O CYS A 30 64.772 5.409 0.455 1.00 1.00 O ATOM 422 CB CYS A 30 66.984 6.541 -1.934 1.00 1.00 C ATOM 423 SG CYS A 30 65.725 5.646 -2.883 1.00 1.00 S ATOM 0 H CYS A 30 68.627 6.975 -0.178 1.00 1.00 H new ATOM 0 HA CYS A 30 65.828 7.497 -0.391 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.145 7.524 -2.376 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.933 6.007 -1.989 1.00 1.00 H new ATOM 428 N ALA A 31 66.676 4.318 0.007 1.00 1.00 N ATOM 429 CA ALA A 31 66.142 3.034 0.424 1.00 1.00 C ATOM 430 C ALA A 31 65.759 3.020 1.885 1.00 1.00 C ATOM 431 O ALA A 31 64.651 2.622 2.229 1.00 1.00 O ATOM 432 CB ALA A 31 67.184 1.937 0.167 1.00 1.00 C ATOM 0 H ALA A 31 67.643 4.292 -0.317 1.00 1.00 H new ATOM 0 HA ALA A 31 65.239 2.852 -0.159 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.783 0.973 0.480 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.422 1.903 -0.896 1.00 1.00 H new ATOM 0 HB3 ALA A 31 68.089 2.155 0.734 1.00 1.00 H new ATOM 438 N GLY A 32 66.679 3.425 2.747 1.00 1.00 N ATOM 439 CA GLY A 32 66.408 3.401 4.173 1.00 1.00 C ATOM 440 C GLY A 32 66.637 1.984 4.683 1.00 1.00 C ATOM 441 O GLY A 32 65.689 1.285 5.014 1.00 1.00 O ATOM 0 H GLY A 32 67.604 3.768 2.489 1.00 1.00 H new ATOM 0 HA2 GLY A 32 67.060 4.102 4.695 1.00 1.00 H new ATOM 0 HA3 GLY A 32 65.382 3.713 4.369 1.00 1.00 H new ATOM 445 N LEU A 33 67.913 1.588 4.738 1.00 1.00 N ATOM 446 CA LEU A 33 68.326 0.247 5.195 1.00 1.00 C ATOM 447 C LEU A 33 68.355 -0.722 4.005 1.00 1.00 C ATOM 448 O LEU A 33 67.481 -1.575 3.867 1.00 1.00 O ATOM 449 CB LEU A 33 67.388 -0.322 6.280 1.00 1.00 C ATOM 450 CG LEU A 33 67.152 0.707 7.418 1.00 1.00 C ATOM 451 CD1 LEU A 33 65.773 0.483 8.048 1.00 1.00 C ATOM 452 CD2 LEU A 33 68.220 0.540 8.494 1.00 1.00 C ATOM 0 H LEU A 33 68.694 2.186 4.467 1.00 1.00 H new ATOM 0 HA LEU A 33 69.319 0.351 5.631 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.433 -0.596 5.831 1.00 1.00 H new ATOM 0 HB3 LEU A 33 67.819 -1.233 6.695 1.00 1.00 H new ATOM 0 HG LEU A 33 67.204 1.712 6.999 1.00 1.00 H new ATOM 0 HD11 LEU A 33 65.615 1.209 8.846 1.00 1.00 H new ATOM 0 HD12 LEU A 33 65.001 0.606 7.288 1.00 1.00 H new ATOM 0 HD13 LEU A 33 65.720 -0.525 8.459 1.00 1.00 H new ATOM 0 HD21 LEU A 33 68.050 1.264 9.291 1.00 1.00 H new ATOM 0 HD22 LEU A 33 68.169 -0.469 8.904 1.00 1.00 H new ATOM 0 HD23 LEU A 33 69.205 0.705 8.058 1.00 1.00 H new ATOM 464 N PRO A 34 69.337 -0.591 3.149 1.00 1.00 N ATOM 465 CA PRO A 34 69.496 -1.449 1.920 1.00 1.00 C ATOM 466 C PRO A 34 69.420 -2.963 2.172 1.00 1.00 C ATOM 467 O PRO A 34 68.974 -3.710 1.303 1.00 1.00 O ATOM 468 CB PRO A 34 70.891 -1.062 1.407 1.00 1.00 C ATOM 469 CG PRO A 34 71.089 0.339 1.875 1.00 1.00 C ATOM 470 CD PRO A 34 70.415 0.413 3.244 1.00 1.00 C ATOM 0 HA PRO A 34 68.679 -1.271 1.220 1.00 1.00 H new ATOM 0 HB2 PRO A 34 71.658 -1.725 1.806 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.946 -1.128 0.320 1.00 1.00 H new ATOM 0 HG2 PRO A 34 72.149 0.583 1.946 1.00 1.00 H new ATOM 0 HG3 PRO A 34 70.644 1.051 1.180 1.00 1.00 H new ATOM 0 HD2 PRO A 34 71.112 0.179 4.048 1.00 1.00 H new ATOM 0 HD3 PRO A 34 70.020 1.409 3.444 1.00 1.00 H new ATOM 478 N GLY A 35 69.870 -3.411 3.335 1.00 1.00 N ATOM 479 CA GLY A 35 69.833 -4.853 3.590 1.00 1.00 C ATOM 480 C GLY A 35 68.385 -5.341 3.472 1.00 1.00 C ATOM 481 O GLY A 35 68.080 -6.195 2.638 1.00 1.00 O ATOM 0 H GLY A 35 70.248 -2.835 4.087 1.00 1.00 H new ATOM 0 HA2 GLY A 35 70.467 -5.378 2.876 1.00 1.00 H new ATOM 0 HA3 GLY A 35 70.224 -5.070 4.584 1.00 1.00 H new ATOM 485 N VAL A 36 67.483 -4.761 4.268 1.00 1.00 N ATOM 486 CA VAL A 36 66.059 -5.120 4.191 1.00 1.00 C ATOM 487 C VAL A 36 65.412 -4.151 3.224 1.00 1.00 C ATOM 488 O VAL A 36 66.056 -3.167 2.886 1.00 1.00 O ATOM 489 CB VAL A 36 65.394 -5.028 5.573 1.00 1.00 C ATOM 490 CG1 VAL A 36 65.430 -3.584 6.099 1.00 1.00 C ATOM 491 CG2 VAL A 36 63.940 -5.507 5.480 1.00 1.00 C ATOM 0 H VAL A 36 67.706 -4.050 4.965 1.00 1.00 H new ATOM 0 HA VAL A 36 65.941 -6.148 3.850 1.00 1.00 H new ATOM 0 HB VAL A 36 65.945 -5.664 6.266 1.00 1.00 H new ATOM 0 HG11 VAL A 36 64.954 -3.542 7.079 1.00 1.00 H new ATOM 0 HG12 VAL A 36 66.465 -3.253 6.184 1.00 1.00 H new ATOM 0 HG13 VAL A 36 64.896 -2.932 5.408 1.00 1.00 H new ATOM 0 HG21 VAL A 36 63.471 -5.440 6.462 1.00 1.00 H new ATOM 0 HG22 VAL A 36 63.395 -4.880 4.775 1.00 1.00 H new ATOM 0 HG23 VAL A 36 63.919 -6.542 5.137 1.00 1.00 H new ATOM 501 N ILE A 37 64.171 -4.412 2.776 1.00 1.00 N ATOM 502 CA ILE A 37 63.441 -3.548 1.824 1.00 1.00 C ATOM 503 C ILE A 37 63.299 -4.264 0.493 1.00 1.00 C ATOM 504 O ILE A 37 64.282 -4.730 -0.083 1.00 1.00 O ATOM 505 CB ILE A 37 64.064 -2.158 1.596 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.919 -1.340 2.884 1.00 1.00 C ATOM 507 CG2 ILE A 37 63.308 -1.441 0.473 1.00 1.00 C ATOM 508 CD1 ILE A 37 64.726 -0.047 2.795 1.00 1.00 C ATOM 0 H ILE A 37 63.640 -5.234 3.065 1.00 1.00 H new ATOM 0 HA ILE A 37 62.470 -3.363 2.284 1.00 1.00 H new ATOM 0 HB ILE A 37 65.115 -2.263 1.326 1.00 1.00 H new ATOM 0 HG12 ILE A 37 62.868 -1.108 3.057 1.00 1.00 H new ATOM 0 HG13 ILE A 37 64.259 -1.929 3.735 1.00 1.00 H new ATOM 0 HG21 ILE A 37 63.747 -0.457 0.310 1.00 1.00 H new ATOM 0 HG22 ILE A 37 63.378 -2.026 -0.444 1.00 1.00 H new ATOM 0 HG23 ILE A 37 62.261 -1.329 0.753 1.00 1.00 H new ATOM 0 HD11 ILE A 37 64.609 0.519 3.719 1.00 1.00 H new ATOM 0 HD12 ILE A 37 65.779 -0.285 2.646 1.00 1.00 H new ATOM 0 HD13 ILE A 37 64.366 0.549 1.957 1.00 1.00 H new ATOM 520 N HIS A 38 62.064 -4.348 0.005 1.00 1.00 N ATOM 521 CA HIS A 38 61.776 -5.003 -1.265 1.00 1.00 C ATOM 522 C HIS A 38 60.692 -4.195 -1.981 1.00 1.00 C ATOM 523 O HIS A 38 59.681 -3.833 -1.377 1.00 1.00 O ATOM 524 CB HIS A 38 61.313 -6.466 -1.022 1.00 1.00 C ATOM 525 CG HIS A 38 61.658 -6.889 0.388 1.00 1.00 C ATOM 526 ND1 HIS A 38 60.804 -6.662 1.457 1.00 1.00 N ATOM 527 CD2 HIS A 38 62.766 -7.506 0.920 1.00 1.00 C ATOM 528 CE1 HIS A 38 61.405 -7.135 2.565 1.00 1.00 C ATOM 529 NE2 HIS A 38 62.602 -7.659 2.295 1.00 1.00 N ATOM 0 H HIS A 38 61.243 -3.967 0.475 1.00 1.00 H new ATOM 0 HA HIS A 38 62.672 -5.043 -1.885 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.238 -6.548 -1.182 1.00 1.00 H new ATOM 0 HB3 HIS A 38 61.794 -7.132 -1.738 1.00 1.00 H new ATOM 0 HD2 HIS A 38 63.632 -7.824 0.357 1.00 1.00 H new ATOM 0 HE1 HIS A 38 60.971 -7.095 3.553 1.00 1.00 H new ATOM 0 HE2 HIS A 38 63.256 -8.081 2.954 1.00 1.00 H new ATOM 537 N THR A 39 60.904 -3.910 -3.263 1.00 1.00 N ATOM 538 CA THR A 39 59.929 -3.138 -4.035 1.00 1.00 C ATOM 539 C THR A 39 58.969 -4.093 -4.756 1.00 1.00 C ATOM 540 O THR A 39 59.422 -4.965 -5.500 1.00 1.00 O ATOM 541 CB THR A 39 60.654 -2.257 -5.063 1.00 1.00 C ATOM 542 OG1 THR A 39 61.688 -3.006 -5.682 1.00 1.00 O ATOM 543 CG2 THR A 39 61.255 -1.033 -4.363 1.00 1.00 C ATOM 0 H THR A 39 61.731 -4.197 -3.786 1.00 1.00 H new ATOM 0 HA THR A 39 59.362 -2.500 -3.357 1.00 1.00 H new ATOM 0 HB THR A 39 59.943 -1.925 -5.819 1.00 1.00 H new ATOM 0 HG1 THR A 39 62.150 -2.445 -6.339 1.00 1.00 H new ATOM 0 HG21 THR A 39 61.769 -0.410 -5.096 1.00 1.00 H new ATOM 0 HG22 THR A 39 60.459 -0.457 -3.891 1.00 1.00 H new ATOM 0 HG23 THR A 39 61.965 -1.360 -3.604 1.00 1.00 H new ATOM 551 N PRO A 40 57.670 -3.976 -4.570 1.00 1.00 N ATOM 552 CA PRO A 40 56.705 -4.886 -5.245 1.00 1.00 C ATOM 553 C PRO A 40 56.938 -5.001 -6.751 1.00 1.00 C ATOM 554 O PRO A 40 56.742 -6.073 -7.324 1.00 1.00 O ATOM 555 CB PRO A 40 55.326 -4.245 -4.980 1.00 1.00 C ATOM 556 CG PRO A 40 55.498 -3.409 -3.754 1.00 1.00 C ATOM 557 CD PRO A 40 56.975 -2.995 -3.706 1.00 1.00 C ATOM 0 HA PRO A 40 56.804 -5.901 -4.861 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.007 -3.637 -5.827 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.562 -5.008 -4.830 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.851 -2.532 -3.790 1.00 1.00 H new ATOM 0 HG3 PRO A 40 55.224 -3.971 -2.861 1.00 1.00 H new ATOM 0 HD2 PRO A 40 57.113 -1.978 -4.072 1.00 1.00 H new ATOM 0 HD3 PRO A 40 57.361 -3.022 -2.687 1.00 1.00 H new ATOM 565 N ALA A 41 57.309 -3.890 -7.401 1.00 1.00 N ATOM 566 CA ALA A 41 57.509 -3.881 -8.857 1.00 1.00 C ATOM 567 C ALA A 41 58.911 -3.461 -9.250 1.00 1.00 C ATOM 568 O ALA A 41 59.233 -2.275 -9.254 1.00 1.00 O ATOM 569 CB ALA A 41 56.504 -2.942 -9.519 1.00 1.00 C ATOM 0 H ALA A 41 57.476 -2.992 -6.946 1.00 1.00 H new ATOM 0 HA ALA A 41 57.358 -4.904 -9.201 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.661 -2.943 -10.598 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.491 -3.280 -9.299 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.641 -1.932 -9.133 1.00 1.00 H new ATOM 575 N ARG A 42 59.729 -4.436 -9.585 1.00 1.00 N ATOM 576 CA ARG A 42 61.107 -4.144 -9.987 1.00 1.00 C ATOM 577 C ARG A 42 61.543 -4.930 -11.213 1.00 1.00 C ATOM 578 O ARG A 42 61.030 -6.009 -11.506 1.00 1.00 O ATOM 579 CB ARG A 42 62.059 -4.402 -8.815 1.00 1.00 C ATOM 580 CG ARG A 42 62.168 -5.900 -8.534 1.00 1.00 C ATOM 581 CD ARG A 42 62.905 -6.104 -7.206 1.00 1.00 C ATOM 582 NE ARG A 42 64.253 -5.548 -7.281 1.00 1.00 N ATOM 583 CZ ARG A 42 64.975 -5.347 -6.182 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.482 -5.648 -5.012 1.00 1.00 N ATOM 585 NH2 ARG A 42 66.177 -4.845 -6.272 1.00 1.00 N ATOM 0 H ARG A 42 59.479 -5.425 -9.591 1.00 1.00 H new ATOM 0 HA ARG A 42 61.146 -3.091 -10.264 1.00 1.00 H new ATOM 0 HB2 ARG A 42 63.045 -3.996 -9.043 1.00 1.00 H new ATOM 0 HB3 ARG A 42 61.699 -3.884 -7.926 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.175 -6.348 -8.487 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.704 -6.397 -9.343 1.00 1.00 H new ATOM 0 HD2 ARG A 42 62.352 -5.625 -6.398 1.00 1.00 H new ATOM 0 HD3 ARG A 42 62.956 -7.167 -6.971 1.00 1.00 H new ATOM 0 HE ARG A 42 64.648 -5.310 -8.191 1.00 1.00 H new ATOM 0 HH11 ARG A 42 63.542 -6.038 -4.940 1.00 1.00 H new ATOM 0 HH12 ARG A 42 65.036 -5.494 -4.170 1.00 1.00 H new ATOM 0 HH21 ARG A 42 66.563 -4.607 -7.186 1.00 1.00 H new ATOM 0 HH22 ARG A 42 66.730 -4.691 -5.429 1.00 1.00 H new ATOM 599 N ARG A 43 62.488 -4.324 -11.923 1.00 1.00 N ATOM 600 CA ARG A 43 63.044 -4.915 -13.146 1.00 1.00 C ATOM 601 C ARG A 43 63.709 -6.260 -12.802 1.00 1.00 C ATOM 602 O ARG A 43 64.647 -6.697 -13.460 1.00 1.00 O ATOM 603 CB ARG A 43 64.071 -3.967 -13.783 1.00 1.00 C ATOM 604 CG ARG A 43 64.310 -4.367 -15.247 1.00 1.00 C ATOM 605 CD ARG A 43 65.286 -3.393 -15.909 1.00 1.00 C ATOM 606 NE ARG A 43 65.542 -3.820 -17.280 1.00 1.00 N ATOM 607 CZ ARG A 43 66.578 -3.363 -17.974 1.00 1.00 C ATOM 608 NH1 ARG A 43 67.386 -2.480 -17.449 1.00 1.00 N ATOM 609 NH2 ARG A 43 66.784 -3.797 -19.187 1.00 1.00 N ATOM 0 H ARG A 43 62.890 -3.420 -11.676 1.00 1.00 H new ATOM 0 HA ARG A 43 62.239 -5.078 -13.862 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.712 -2.939 -13.731 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.008 -4.006 -13.228 1.00 1.00 H new ATOM 0 HG2 ARG A 43 64.708 -5.380 -15.294 1.00 1.00 H new ATOM 0 HG3 ARG A 43 63.365 -4.371 -15.789 1.00 1.00 H new ATOM 0 HD2 ARG A 43 64.872 -2.385 -15.902 1.00 1.00 H new ATOM 0 HD3 ARG A 43 66.219 -3.358 -15.347 1.00 1.00 H new ATOM 0 HE ARG A 43 64.908 -4.488 -17.718 1.00 1.00 H new ATOM 0 HH11 ARG A 43 67.222 -2.139 -16.502 1.00 1.00 H new ATOM 0 HH12 ARG A 43 68.180 -2.132 -17.986 1.00 1.00 H new ATOM 0 HH21 ARG A 43 66.151 -4.484 -19.597 1.00 1.00 H new ATOM 0 HH22 ARG A 43 67.578 -3.450 -19.725 1.00 1.00 H new ATOM 623 N GLY A 44 63.195 -6.914 -11.762 1.00 1.00 N ATOM 624 CA GLY A 44 63.713 -8.192 -11.320 1.00 1.00 C ATOM 625 C GLY A 44 65.023 -8.003 -10.574 1.00 1.00 C ATOM 626 O GLY A 44 65.408 -8.833 -9.753 1.00 1.00 O ATOM 0 H GLY A 44 62.411 -6.568 -11.209 1.00 1.00 H new ATOM 0 HA2 GLY A 44 62.986 -8.682 -10.673 1.00 1.00 H new ATOM 0 HA3 GLY A 44 63.867 -8.846 -12.178 1.00 1.00 H new ATOM 630 N PHE A 45 65.726 -6.926 -10.898 1.00 1.00 N ATOM 631 CA PHE A 45 67.022 -6.665 -10.281 1.00 1.00 C ATOM 632 C PHE A 45 67.534 -5.277 -10.694 1.00 1.00 C ATOM 633 O PHE A 45 66.937 -4.652 -11.560 1.00 1.00 O ATOM 634 CB PHE A 45 68.024 -7.780 -10.687 1.00 1.00 C ATOM 635 CG PHE A 45 67.483 -8.541 -11.887 1.00 1.00 C ATOM 636 CD1 PHE A 45 66.940 -7.842 -12.976 1.00 1.00 C ATOM 637 CD2 PHE A 45 67.490 -9.941 -11.891 1.00 1.00 C ATOM 638 CE1 PHE A 45 66.412 -8.541 -14.066 1.00 1.00 C ATOM 639 CE2 PHE A 45 66.958 -10.641 -12.979 1.00 1.00 C ATOM 640 CZ PHE A 45 66.419 -9.942 -14.065 1.00 1.00 C ATOM 0 H PHE A 45 65.426 -6.226 -11.576 1.00 1.00 H new ATOM 0 HA PHE A 45 66.919 -6.673 -9.196 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.993 -7.342 -10.928 1.00 1.00 H new ATOM 0 HB3 PHE A 45 68.182 -8.463 -9.852 1.00 1.00 H new ATOM 0 HD1 PHE A 45 66.930 -6.762 -12.972 1.00 1.00 H new ATOM 0 HD2 PHE A 45 67.906 -10.481 -11.053 1.00 1.00 H new ATOM 0 HE1 PHE A 45 66.000 -8.002 -14.906 1.00 1.00 H new ATOM 0 HE2 PHE A 45 66.963 -11.721 -12.981 1.00 1.00 H new ATOM 0 HZ PHE A 45 66.008 -10.484 -14.904 1.00 1.00 H new ATOM 650 N PHE A 46 68.657 -4.866 -10.054 1.00 1.00 N ATOM 651 CA PHE A 46 69.375 -3.561 -10.269 1.00 1.00 C ATOM 652 C PHE A 46 69.545 -2.838 -8.930 1.00 1.00 C ATOM 653 O PHE A 46 68.581 -2.236 -8.477 1.00 1.00 O ATOM 654 CB PHE A 46 68.640 -2.552 -11.234 1.00 1.00 C ATOM 655 CG PHE A 46 69.388 -2.374 -12.543 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.517 -3.441 -13.438 1.00 1.00 C ATOM 657 CD2 PHE A 46 69.937 -1.120 -12.864 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.195 -3.253 -14.651 1.00 1.00 C ATOM 659 CE2 PHE A 46 70.612 -0.937 -14.070 1.00 1.00 C ATOM 660 CZ PHE A 46 70.741 -2.001 -14.965 1.00 1.00 C ATOM 0 H PHE A 46 69.112 -5.445 -9.348 1.00 1.00 H new ATOM 0 HA PHE A 46 70.322 -3.839 -10.731 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.632 -2.914 -11.438 1.00 1.00 H new ATOM 0 HB3 PHE A 46 68.538 -1.586 -10.740 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.096 -4.406 -13.196 1.00 1.00 H new ATOM 0 HD2 PHE A 46 69.835 -0.296 -12.174 1.00 1.00 H new ATOM 0 HE1 PHE A 46 70.297 -4.075 -15.345 1.00 1.00 H new ATOM 0 HE2 PHE A 46 71.035 0.027 -14.312 1.00 1.00 H new ATOM 0 HZ PHE A 46 71.262 -1.859 -15.900 1.00 1.00 H new ATOM 670 N ARG A 47 70.762 -2.887 -8.337 1.00 1.00 N ATOM 671 CA ARG A 47 71.087 -2.217 -7.050 1.00 1.00 C ATOM 672 C ARG A 47 71.245 -3.238 -5.940 1.00 1.00 C ATOM 673 O ARG A 47 70.812 -4.380 -6.079 1.00 1.00 O ATOM 674 CB ARG A 47 70.041 -1.161 -6.642 1.00 1.00 C ATOM 675 CG ARG A 47 68.832 -1.817 -5.920 1.00 1.00 C ATOM 676 CD ARG A 47 67.562 -0.947 -6.042 1.00 1.00 C ATOM 677 NE ARG A 47 67.346 -0.499 -7.421 1.00 1.00 N ATOM 678 CZ ARG A 47 67.777 0.688 -7.846 1.00 1.00 C ATOM 679 NH1 ARG A 47 68.437 1.462 -7.032 1.00 1.00 N ATOM 680 NH2 ARG A 47 67.585 1.053 -9.085 1.00 1.00 N ATOM 0 H ARG A 47 71.551 -3.394 -8.738 1.00 1.00 H new ATOM 0 HA ARG A 47 72.031 -1.695 -7.206 1.00 1.00 H new ATOM 0 HB2 ARG A 47 70.503 -0.423 -5.986 1.00 1.00 H new ATOM 0 HB3 ARG A 47 69.694 -0.628 -7.527 1.00 1.00 H new ATOM 0 HG2 ARG A 47 68.642 -2.802 -6.347 1.00 1.00 H new ATOM 0 HG3 ARG A 47 69.072 -1.967 -4.867 1.00 1.00 H new ATOM 0 HD2 ARG A 47 66.696 -1.516 -5.704 1.00 1.00 H new ATOM 0 HD3 ARG A 47 67.649 -0.080 -5.387 1.00 1.00 H new ATOM 0 HE ARG A 47 66.853 -1.111 -8.071 1.00 1.00 H new ATOM 0 HH11 ARG A 47 68.621 1.158 -6.076 1.00 1.00 H new ATOM 0 HH12 ARG A 47 68.770 2.372 -7.351 1.00 1.00 H new ATOM 0 HH21 ARG A 47 67.103 0.428 -9.732 1.00 1.00 H new ATOM 0 HH22 ARG A 47 67.917 1.963 -9.406 1.00 1.00 H new ATOM 694 N CYS A 48 71.878 -2.837 -4.841 1.00 1.00 N ATOM 695 CA CYS A 48 72.088 -3.751 -3.731 1.00 1.00 C ATOM 696 C CYS A 48 73.100 -4.812 -4.166 1.00 1.00 C ATOM 697 O CYS A 48 72.758 -5.974 -4.345 1.00 1.00 O ATOM 698 CB CYS A 48 70.730 -4.381 -3.315 1.00 1.00 C ATOM 699 SG CYS A 48 70.494 -4.262 -1.520 1.00 1.00 S ATOM 0 H CYS A 48 72.249 -1.897 -4.699 1.00 1.00 H new ATOM 0 HA CYS A 48 72.485 -3.227 -2.862 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.914 -3.872 -3.829 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.698 -5.426 -3.623 1.00 1.00 H new ATOM 704 N ASN A 49 74.366 -4.419 -4.324 1.00 1.00 N ATOM 705 CA ASN A 49 75.409 -5.351 -4.732 1.00 1.00 C ATOM 706 C ASN A 49 76.730 -4.920 -4.064 1.00 1.00 C ATOM 707 O ASN A 49 77.005 -3.724 -4.014 1.00 1.00 O ATOM 708 CB ASN A 49 75.567 -5.294 -6.257 1.00 1.00 C ATOM 709 CG ASN A 49 75.374 -3.856 -6.737 1.00 1.00 C ATOM 710 OD1 ASN A 49 75.805 -2.916 -6.068 1.00 1.00 O ATOM 711 ND2 ASN A 49 74.746 -3.629 -7.857 1.00 1.00 N ATOM 0 H ASN A 49 74.689 -3.463 -4.175 1.00 1.00 H new ATOM 0 HA ASN A 49 75.150 -6.367 -4.434 1.00 1.00 H new ATOM 0 HB2 ASN A 49 76.554 -5.655 -6.545 1.00 1.00 H new ATOM 0 HB3 ASN A 49 74.837 -5.949 -6.733 1.00 1.00 H new ATOM 0 HD21 ASN A 49 74.611 -2.671 -8.181 1.00 1.00 H new ATOM 0 HD22 ASN A 49 74.390 -4.409 -8.409 1.00 1.00 H new ATOM 718 N PRO A 50 77.554 -5.820 -3.558 1.00 1.00 N ATOM 719 CA PRO A 50 78.851 -5.422 -2.914 1.00 1.00 C ATOM 720 C PRO A 50 79.723 -4.562 -3.842 1.00 1.00 C ATOM 721 O PRO A 50 80.754 -5.012 -4.333 1.00 1.00 O ATOM 722 CB PRO A 50 79.543 -6.767 -2.600 1.00 1.00 C ATOM 723 CG PRO A 50 78.444 -7.780 -2.565 1.00 1.00 C ATOM 724 CD PRO A 50 77.360 -7.285 -3.529 1.00 1.00 C ATOM 0 HA PRO A 50 78.689 -4.807 -2.029 1.00 1.00 H new ATOM 0 HB2 PRO A 50 80.282 -7.016 -3.361 1.00 1.00 H new ATOM 0 HB3 PRO A 50 80.069 -6.725 -1.646 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.812 -8.761 -2.866 1.00 1.00 H new ATOM 0 HG3 PRO A 50 78.046 -7.885 -1.556 1.00 1.00 H new ATOM 0 HD2 PRO A 50 77.476 -7.723 -4.520 1.00 1.00 H new ATOM 0 HD3 PRO A 50 76.362 -7.549 -3.178 1.00 1.00 H new ATOM 732 N GLU A 51 79.331 -3.317 -4.065 1.00 1.00 N ATOM 733 CA GLU A 51 80.105 -2.430 -4.918 1.00 1.00 C ATOM 734 C GLU A 51 80.283 -3.026 -6.313 1.00 1.00 C ATOM 735 O GLU A 51 80.964 -2.448 -7.157 1.00 1.00 O ATOM 736 CB GLU A 51 81.476 -2.147 -4.281 1.00 1.00 C ATOM 737 CG GLU A 51 81.345 -2.105 -2.737 1.00 1.00 C ATOM 738 CD GLU A 51 81.742 -3.451 -2.129 1.00 1.00 C ATOM 739 OE1 GLU A 51 82.826 -3.920 -2.437 1.00 1.00 O ATOM 740 OE2 GLU A 51 80.959 -3.989 -1.364 1.00 1.00 O ATOM 0 H GLU A 51 78.488 -2.901 -3.670 1.00 1.00 H new ATOM 0 HA GLU A 51 79.559 -1.492 -5.019 1.00 1.00 H new ATOM 0 HB2 GLU A 51 82.188 -2.919 -4.573 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.867 -1.198 -4.647 1.00 1.00 H new ATOM 0 HG2 GLU A 51 81.979 -1.316 -2.334 1.00 1.00 H new ATOM 0 HG3 GLU A 51 80.319 -1.862 -2.460 1.00 1.00 H new ATOM 747 N ARG A 52 79.649 -4.172 -6.556 1.00 1.00 N ATOM 748 CA ARG A 52 79.734 -4.809 -7.868 1.00 1.00 C ATOM 749 C ARG A 52 78.691 -4.208 -8.785 1.00 1.00 C ATOM 750 O ARG A 52 77.587 -3.884 -8.350 1.00 1.00 O ATOM 751 CB ARG A 52 79.521 -6.316 -7.752 1.00 1.00 C ATOM 752 CG ARG A 52 80.723 -6.930 -7.044 1.00 1.00 C ATOM 753 CD ARG A 52 80.536 -8.437 -6.932 1.00 1.00 C ATOM 754 NE ARG A 52 81.650 -9.026 -6.202 1.00 1.00 N ATOM 755 CZ ARG A 52 81.899 -10.326 -6.275 1.00 1.00 C ATOM 756 NH1 ARG A 52 81.176 -11.079 -7.056 1.00 1.00 N ATOM 757 NH2 ARG A 52 82.870 -10.848 -5.578 1.00 1.00 N ATOM 0 H ARG A 52 79.079 -4.672 -5.873 1.00 1.00 H new ATOM 0 HA ARG A 52 80.728 -4.636 -8.281 1.00 1.00 H new ATOM 0 HB2 ARG A 52 78.608 -6.526 -7.196 1.00 1.00 H new ATOM 0 HB3 ARG A 52 79.400 -6.757 -8.741 1.00 1.00 H new ATOM 0 HG2 ARG A 52 81.636 -6.707 -7.596 1.00 1.00 H new ATOM 0 HG3 ARG A 52 80.836 -6.493 -6.052 1.00 1.00 H new ATOM 0 HD2 ARG A 52 79.599 -8.658 -6.421 1.00 1.00 H new ATOM 0 HD3 ARG A 52 80.469 -8.878 -7.927 1.00 1.00 H new ATOM 0 HE ARG A 52 82.246 -8.431 -5.627 1.00 1.00 H new ATOM 0 HH11 ARG A 52 80.423 -10.667 -7.607 1.00 1.00 H new ATOM 0 HH12 ARG A 52 81.363 -12.080 -7.116 1.00 1.00 H new ATOM 0 HH21 ARG A 52 83.440 -10.256 -4.975 1.00 1.00 H new ATOM 0 HH22 ARG A 52 83.059 -11.849 -5.636 1.00 1.00 H new ATOM 771 N ILE A 53 79.045 -4.010 -10.045 1.00 1.00 N ATOM 772 CA ILE A 53 78.130 -3.392 -10.977 1.00 1.00 C ATOM 773 C ILE A 53 76.889 -4.254 -11.277 1.00 1.00 C ATOM 774 O ILE A 53 76.908 -5.488 -11.275 1.00 1.00 O ATOM 775 CB ILE A 53 78.872 -3.034 -12.266 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.008 -2.087 -13.114 1.00 1.00 C ATOM 777 CG2 ILE A 53 79.177 -4.302 -13.047 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.782 -1.653 -14.367 1.00 1.00 C ATOM 0 H ILE A 53 79.951 -4.267 -10.438 1.00 1.00 H new ATOM 0 HA ILE A 53 77.753 -2.485 -10.504 1.00 1.00 H new ATOM 0 HB ILE A 53 79.809 -2.534 -12.019 1.00 1.00 H new ATOM 0 HG12 ILE A 53 77.083 -2.586 -13.402 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.729 -1.212 -12.527 1.00 1.00 H new ATOM 0 HG21 ILE A 53 79.706 -4.046 -13.965 1.00 1.00 H new ATOM 0 HG22 ILE A 53 79.799 -4.961 -12.442 1.00 1.00 H new ATOM 0 HG23 ILE A 53 78.245 -4.810 -13.295 1.00 1.00 H new ATOM 0 HD11 ILE A 53 78.163 -0.982 -14.963 1.00 1.00 H new ATOM 0 HD12 ILE A 53 79.695 -1.137 -14.070 1.00 1.00 H new ATOM 0 HD13 ILE A 53 79.038 -2.532 -14.959 1.00 1.00 H new ATOM 790 N GLN A 54 75.833 -3.509 -11.495 1.00 1.00 N ATOM 791 CA GLN A 54 74.524 -4.099 -11.780 1.00 1.00 C ATOM 792 C GLN A 54 74.466 -4.652 -13.221 1.00 1.00 C ATOM 793 O GLN A 54 73.896 -4.020 -14.108 1.00 1.00 O ATOM 794 CB GLN A 54 73.418 -3.057 -11.558 1.00 1.00 C ATOM 795 CG GLN A 54 73.618 -1.840 -12.493 1.00 1.00 C ATOM 796 CD GLN A 54 73.271 -0.538 -11.769 1.00 1.00 C ATOM 797 OE1 GLN A 54 73.902 -0.228 -10.671 1.00 1.00 O flip ATOM 798 NE2 GLN A 54 72.405 0.212 -12.217 1.00 1.00 N flip ATOM 0 H GLN A 54 75.843 -2.489 -11.483 1.00 1.00 H new ATOM 0 HA GLN A 54 74.367 -4.933 -11.096 1.00 1.00 H new ATOM 0 HB2 GLN A 54 72.443 -3.508 -11.744 1.00 1.00 H new ATOM 0 HB3 GLN A 54 73.424 -2.728 -10.519 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.652 -1.806 -12.837 1.00 1.00 H new ATOM 0 HG3 GLN A 54 72.991 -1.948 -13.378 1.00 1.00 H new ATOM 0 HE21 GLN A 54 71.913 -0.033 -13.076 1.00 1.00 H new ATOM 0 HE22 GLN A 54 72.179 1.079 -11.729 1.00 1.00 H new ATOM 807 N ILE A 55 75.012 -5.872 -13.432 1.00 1.00 N ATOM 808 CA ILE A 55 74.962 -6.548 -14.744 1.00 1.00 C ATOM 809 C ILE A 55 74.907 -8.069 -14.543 1.00 1.00 C ATOM 810 O ILE A 55 75.332 -8.566 -13.504 1.00 1.00 O ATOM 811 CB ILE A 55 76.177 -6.205 -15.626 1.00 1.00 C ATOM 812 CG1 ILE A 55 77.500 -6.724 -14.988 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.242 -4.686 -15.803 1.00 1.00 C ATOM 814 CD1 ILE A 55 77.914 -8.082 -15.581 1.00 1.00 C ATOM 0 H ILE A 55 75.492 -6.407 -12.708 1.00 1.00 H new ATOM 0 HA ILE A 55 74.065 -6.194 -15.253 1.00 1.00 H new ATOM 0 HB ILE A 55 76.062 -6.693 -16.594 1.00 1.00 H new ATOM 0 HG12 ILE A 55 78.295 -5.996 -15.152 1.00 1.00 H new ATOM 0 HG13 ILE A 55 77.373 -6.820 -13.910 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.099 -4.429 -16.426 1.00 1.00 H new ATOM 0 HG22 ILE A 55 75.327 -4.336 -16.281 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.347 -4.210 -14.828 1.00 1.00 H new ATOM 0 HD11 ILE A 55 78.841 -8.416 -15.114 1.00 1.00 H new ATOM 0 HD12 ILE A 55 77.129 -8.815 -15.394 1.00 1.00 H new ATOM 0 HD13 ILE A 55 78.066 -7.979 -16.655 1.00 1.00 H new ATOM 826 N GLY A 56 74.395 -8.806 -15.534 1.00 1.00 N ATOM 827 CA GLY A 56 74.308 -10.274 -15.439 1.00 1.00 C ATOM 828 C GLY A 56 72.869 -10.702 -15.214 1.00 1.00 C ATOM 829 O GLY A 56 72.541 -11.887 -15.191 1.00 1.00 O ATOM 0 H GLY A 56 74.036 -8.418 -16.406 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.691 -10.728 -16.353 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.933 -10.630 -14.620 1.00 1.00 H new ATOM 833 N ASP A 57 72.023 -9.703 -15.071 1.00 1.00 N ATOM 834 CA ASP A 57 70.603 -9.933 -14.870 1.00 1.00 C ATOM 835 C ASP A 57 69.923 -10.210 -16.208 1.00 1.00 C ATOM 836 O ASP A 57 69.726 -9.311 -17.023 1.00 1.00 O ATOM 837 CB ASP A 57 69.987 -8.721 -14.203 1.00 1.00 C ATOM 838 CG ASP A 57 70.636 -8.487 -12.839 1.00 1.00 C ATOM 839 OD1 ASP A 57 70.237 -9.150 -11.894 1.00 1.00 O ATOM 840 OD2 ASP A 57 71.526 -7.658 -12.760 1.00 1.00 O ATOM 0 H ASP A 57 72.293 -8.720 -15.090 1.00 1.00 H new ATOM 0 HA ASP A 57 70.463 -10.802 -14.227 1.00 1.00 H new ATOM 0 HB2 ASP A 57 70.120 -7.842 -14.834 1.00 1.00 H new ATOM 0 HB3 ASP A 57 68.914 -8.868 -14.084 1.00 1.00 H new ATOM 845 N TRP A 58 69.614 -11.484 -16.447 1.00 1.00 N ATOM 846 CA TRP A 58 69.013 -11.916 -17.707 1.00 1.00 C ATOM 847 C TRP A 58 67.471 -11.896 -17.714 1.00 1.00 C ATOM 848 O TRP A 58 66.791 -11.644 -16.728 1.00 1.00 O ATOM 849 CB TRP A 58 69.566 -13.307 -18.106 1.00 1.00 C ATOM 850 CG TRP A 58 70.806 -13.171 -18.944 1.00 1.00 C ATOM 851 CD1 TRP A 58 71.697 -12.160 -18.843 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.319 -14.063 -19.983 1.00 1.00 C ATOM 853 NE1 TRP A 58 72.710 -12.359 -19.756 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.528 -13.519 -20.480 1.00 1.00 C ATOM 855 CE3 TRP A 58 70.862 -15.274 -20.542 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.256 -14.146 -21.489 1.00 1.00 C ATOM 857 CZ3 TRP A 58 71.596 -15.911 -21.560 1.00 1.00 C ATOM 858 CH2 TRP A 58 72.790 -15.346 -22.031 1.00 1.00 C ATOM 0 H TRP A 58 69.772 -12.239 -15.779 1.00 1.00 H new ATOM 0 HA TRP A 58 69.302 -11.180 -18.457 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.790 -13.885 -17.209 1.00 1.00 H new ATOM 0 HB3 TRP A 58 68.807 -13.859 -18.660 1.00 1.00 H new ATOM 0 HD1 TRP A 58 71.627 -11.329 -18.157 1.00 1.00 H new ATOM 0 HE1 TRP A 58 73.499 -11.725 -19.881 1.00 1.00 H new ATOM 0 HE3 TRP A 58 69.943 -15.716 -20.187 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 74.175 -13.707 -21.850 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 71.238 -16.839 -21.980 1.00 1.00 H new ATOM 0 HH2 TRP A 58 73.349 -15.839 -22.813 1.00 1.00 H new ATOM 869 N ARG A 59 67.014 -12.136 -18.923 1.00 1.00 N ATOM 870 CA ARG A 59 65.574 -12.127 -19.232 1.00 1.00 C ATOM 871 C ARG A 59 64.832 -13.417 -18.800 1.00 1.00 C ATOM 872 O ARG A 59 63.902 -13.366 -17.994 1.00 1.00 O ATOM 873 CB ARG A 59 65.361 -11.847 -20.731 1.00 1.00 C ATOM 874 CG ARG A 59 65.819 -13.031 -21.589 1.00 1.00 C ATOM 875 CD ARG A 59 65.962 -12.579 -23.047 1.00 1.00 C ATOM 876 NE ARG A 59 66.318 -13.709 -23.895 1.00 1.00 N ATOM 877 CZ ARG A 59 67.511 -14.287 -23.807 1.00 1.00 C ATOM 878 NH1 ARG A 59 68.387 -13.860 -22.938 1.00 1.00 N ATOM 879 NH2 ARG A 59 67.802 -15.292 -24.584 1.00 1.00 N ATOM 0 H ARG A 59 67.612 -12.343 -19.723 1.00 1.00 H new ATOM 0 HA ARG A 59 65.134 -11.325 -18.640 1.00 1.00 H new ATOM 0 HB2 ARG A 59 64.307 -11.645 -20.919 1.00 1.00 H new ATOM 0 HB3 ARG A 59 65.913 -10.952 -21.018 1.00 1.00 H new ATOM 0 HG2 ARG A 59 66.771 -13.414 -21.221 1.00 1.00 H new ATOM 0 HG3 ARG A 59 65.098 -13.846 -21.518 1.00 1.00 H new ATOM 0 HD2 ARG A 59 65.027 -12.138 -23.391 1.00 1.00 H new ATOM 0 HD3 ARG A 59 66.726 -11.805 -23.122 1.00 1.00 H new ATOM 0 HE ARG A 59 65.639 -14.063 -24.569 1.00 1.00 H new ATOM 0 HH11 ARG A 59 68.157 -13.080 -22.323 1.00 1.00 H new ATOM 0 HH12 ARG A 59 69.302 -14.307 -22.874 1.00 1.00 H new ATOM 0 HH21 ARG A 59 67.115 -15.632 -25.257 1.00 1.00 H new ATOM 0 HH22 ARG A 59 68.717 -15.738 -24.519 1.00 1.00 H new ATOM 893 N TYR A 60 65.246 -14.547 -19.343 1.00 1.00 N ATOM 894 CA TYR A 60 64.653 -15.875 -19.054 1.00 1.00 C ATOM 895 C TYR A 60 65.357 -16.613 -17.912 1.00 1.00 C ATOM 896 O TYR A 60 64.901 -17.665 -17.423 1.00 1.00 O ATOM 897 CB TYR A 60 64.616 -16.738 -20.338 1.00 1.00 C ATOM 898 CG TYR A 60 63.231 -17.346 -20.519 1.00 1.00 C ATOM 899 CD1 TYR A 60 62.874 -18.496 -19.803 1.00 1.00 C ATOM 900 CD2 TYR A 60 62.303 -16.747 -21.382 1.00 1.00 C ATOM 901 CE1 TYR A 60 61.594 -19.046 -19.949 1.00 1.00 C ATOM 902 CE2 TYR A 60 61.024 -17.300 -21.531 1.00 1.00 C ATOM 903 CZ TYR A 60 60.669 -18.450 -20.813 1.00 1.00 C ATOM 904 OH TYR A 60 59.405 -18.991 -20.954 1.00 1.00 O ATOM 0 H TYR A 60 66.016 -14.587 -20.011 1.00 1.00 H new ATOM 0 HA TYR A 60 63.633 -15.699 -18.714 1.00 1.00 H new ATOM 0 HB2 TYR A 60 64.870 -16.127 -21.204 1.00 1.00 H new ATOM 0 HB3 TYR A 60 65.364 -17.529 -20.276 1.00 1.00 H new ATOM 0 HD1 TYR A 60 63.587 -18.959 -19.137 1.00 1.00 H new ATOM 0 HD2 TYR A 60 62.574 -15.858 -21.933 1.00 1.00 H new ATOM 0 HE1 TYR A 60 61.321 -19.931 -19.394 1.00 1.00 H new ATOM 0 HE2 TYR A 60 60.312 -16.840 -22.199 1.00 1.00 H new ATOM 0 HH TYR A 60 58.889 -18.454 -21.591 1.00 1.00 H new ATOM 914 N GLU A 61 66.480 -16.083 -17.495 1.00 1.00 N ATOM 915 CA GLU A 61 67.261 -16.696 -16.452 1.00 1.00 C ATOM 916 C GLU A 61 66.664 -16.440 -15.080 1.00 1.00 C ATOM 917 O GLU A 61 67.092 -17.029 -14.100 1.00 1.00 O ATOM 918 CB GLU A 61 68.674 -16.122 -16.501 1.00 1.00 C ATOM 919 CG GLU A 61 69.663 -17.086 -15.855 1.00 1.00 C ATOM 920 CD GLU A 61 71.049 -16.446 -15.809 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.504 -15.992 -16.846 1.00 1.00 O ATOM 922 OE2 GLU A 61 71.632 -16.419 -14.739 1.00 1.00 O ATOM 0 H GLU A 61 66.876 -15.220 -17.867 1.00 1.00 H new ATOM 0 HA GLU A 61 67.272 -17.774 -16.616 1.00 1.00 H new ATOM 0 HB2 GLU A 61 68.962 -15.935 -17.536 1.00 1.00 H new ATOM 0 HB3 GLU A 61 68.702 -15.163 -15.984 1.00 1.00 H new ATOM 0 HG2 GLU A 61 69.334 -17.338 -14.847 1.00 1.00 H new ATOM 0 HG3 GLU A 61 69.700 -18.017 -16.420 1.00 1.00 H new ATOM 929 N VAL A 62 65.748 -15.494 -14.979 1.00 1.00 N ATOM 930 CA VAL A 62 65.217 -15.133 -13.665 1.00 1.00 C ATOM 931 C VAL A 62 64.828 -16.376 -12.898 1.00 1.00 C ATOM 932 O VAL A 62 65.262 -16.557 -11.786 1.00 1.00 O ATOM 933 CB VAL A 62 63.996 -14.194 -13.800 1.00 1.00 C ATOM 934 CG1 VAL A 62 64.465 -12.736 -13.929 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.166 -14.569 -15.039 1.00 1.00 C ATOM 0 H VAL A 62 65.361 -14.971 -15.764 1.00 1.00 H new ATOM 0 HA VAL A 62 65.999 -14.605 -13.118 1.00 1.00 H new ATOM 0 HB VAL A 62 63.379 -14.302 -12.908 1.00 1.00 H new ATOM 0 HG11 VAL A 62 63.598 -12.082 -14.024 1.00 1.00 H new ATOM 0 HG12 VAL A 62 65.035 -12.457 -13.043 1.00 1.00 H new ATOM 0 HG13 VAL A 62 65.095 -12.633 -14.812 1.00 1.00 H new ATOM 0 HG21 VAL A 62 62.310 -13.899 -15.120 1.00 1.00 H new ATOM 0 HG22 VAL A 62 63.784 -14.478 -15.932 1.00 1.00 H new ATOM 0 HG23 VAL A 62 62.815 -15.596 -14.944 1.00 1.00 H new ATOM 945 N ALA A 63 63.980 -17.203 -13.450 1.00 1.00 N ATOM 946 CA ALA A 63 63.571 -18.383 -12.740 1.00 1.00 C ATOM 947 C ALA A 63 64.754 -19.314 -12.570 1.00 1.00 C ATOM 948 O ALA A 63 65.069 -19.711 -11.452 1.00 1.00 O ATOM 949 CB ALA A 63 62.466 -19.106 -13.514 1.00 1.00 C ATOM 0 H ALA A 63 63.565 -17.084 -14.374 1.00 1.00 H new ATOM 0 HA ALA A 63 63.192 -18.090 -11.761 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.163 -19.999 -12.967 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.609 -18.443 -13.629 1.00 1.00 H new ATOM 0 HB3 ALA A 63 62.838 -19.392 -14.498 1.00 1.00 H new ATOM 955 N HIS A 64 65.419 -19.622 -13.691 1.00 1.00 N ATOM 956 CA HIS A 64 66.579 -20.525 -13.625 1.00 1.00 C ATOM 957 C HIS A 64 67.531 -20.074 -12.510 1.00 1.00 C ATOM 958 O HIS A 64 67.825 -20.819 -11.576 1.00 1.00 O ATOM 959 CB HIS A 64 67.318 -20.563 -14.964 1.00 1.00 C ATOM 960 CG HIS A 64 66.395 -21.073 -16.037 1.00 1.00 C ATOM 961 ND1 HIS A 64 65.762 -22.302 -15.942 1.00 1.00 N ATOM 962 CD2 HIS A 64 65.992 -20.538 -17.239 1.00 1.00 C ATOM 963 CE1 HIS A 64 65.021 -22.467 -17.054 1.00 1.00 C ATOM 964 NE2 HIS A 64 65.126 -21.420 -17.877 1.00 1.00 N ATOM 0 H HIS A 64 65.187 -19.276 -14.622 1.00 1.00 H new ATOM 0 HA HIS A 64 66.220 -21.530 -13.405 1.00 1.00 H new ATOM 0 HB2 HIS A 64 67.675 -19.566 -15.222 1.00 1.00 H new ATOM 0 HB3 HIS A 64 68.195 -21.206 -14.889 1.00 1.00 H new ATOM 0 HD2 HIS A 64 66.301 -19.579 -17.628 1.00 1.00 H new ATOM 0 HE1 HIS A 64 64.416 -23.339 -17.256 1.00 1.00 H new ATOM 0 HE2 HIS A 64 64.669 -21.294 -18.780 1.00 1.00 H new ATOM 972 N ASP A 65 67.984 -18.845 -12.601 1.00 1.00 N ATOM 973 CA ASP A 65 68.876 -18.297 -11.584 1.00 1.00 C ATOM 974 C ASP A 65 68.102 -18.020 -10.288 1.00 1.00 C ATOM 975 O ASP A 65 68.494 -18.452 -9.191 1.00 1.00 O ATOM 976 CB ASP A 65 69.552 -17.022 -12.112 1.00 1.00 C ATOM 977 CG ASP A 65 70.190 -16.238 -10.971 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.659 -16.865 -10.039 1.00 1.00 O ATOM 979 OD2 ASP A 65 70.194 -15.020 -11.048 1.00 1.00 O ATOM 0 H ASP A 65 67.756 -18.203 -13.360 1.00 1.00 H new ATOM 0 HA ASP A 65 69.653 -19.027 -11.359 1.00 1.00 H new ATOM 0 HB2 ASP A 65 70.312 -17.285 -12.848 1.00 1.00 H new ATOM 0 HB3 ASP A 65 68.817 -16.399 -12.621 1.00 1.00 H new ATOM 984 N GLY A 66 66.958 -17.369 -10.390 1.00 1.00 N ATOM 985 CA GLY A 66 66.136 -17.100 -9.223 1.00 1.00 C ATOM 986 C GLY A 66 65.504 -18.379 -8.708 1.00 1.00 C ATOM 987 O GLY A 66 64.487 -18.352 -8.012 1.00 1.00 O ATOM 0 H GLY A 66 66.576 -17.017 -11.268 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.744 -16.648 -8.440 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.358 -16.381 -9.478 1.00 1.00 H new ATOM 991 N ARG A 67 66.173 -19.484 -8.985 1.00 1.00 N ATOM 992 CA ARG A 67 65.776 -20.784 -8.494 1.00 1.00 C ATOM 993 C ARG A 67 66.112 -20.807 -7.010 1.00 1.00 C ATOM 994 O ARG A 67 66.011 -21.854 -6.377 1.00 1.00 O ATOM 995 CB ARG A 67 66.494 -21.951 -9.201 1.00 1.00 C ATOM 996 CG ARG A 67 65.741 -22.424 -10.449 1.00 1.00 C ATOM 997 CD ARG A 67 66.466 -23.635 -11.076 1.00 1.00 C ATOM 998 NE ARG A 67 65.755 -24.863 -10.742 1.00 1.00 N ATOM 999 CZ ARG A 67 64.673 -25.227 -11.422 1.00 1.00 C ATOM 1000 NH1 ARG A 67 64.247 -24.483 -12.407 1.00 1.00 N ATOM 1001 NH2 ARG A 67 64.040 -26.324 -11.111 1.00 1.00 N ATOM 0 H ARG A 67 67.014 -19.500 -9.562 1.00 1.00 H new ATOM 0 HA ARG A 67 64.713 -20.925 -8.690 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.500 -21.639 -9.482 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.601 -22.784 -8.506 1.00 1.00 H new ATOM 0 HG2 ARG A 67 64.719 -22.698 -10.185 1.00 1.00 H new ATOM 0 HG3 ARG A 67 65.677 -21.613 -11.174 1.00 1.00 H new ATOM 0 HD2 ARG A 67 66.520 -23.518 -12.158 1.00 1.00 H new ATOM 0 HD3 ARG A 67 67.491 -23.686 -10.710 1.00 1.00 H new ATOM 0 HE ARG A 67 66.092 -25.449 -9.978 1.00 1.00 H new ATOM 0 HH11 ARG A 67 64.744 -23.627 -12.651 1.00 1.00 H new ATOM 0 HH12 ARG A 67 63.417 -24.758 -12.932 1.00 1.00 H new ATOM 0 HH21 ARG A 67 64.375 -26.906 -10.343 1.00 1.00 H new ATOM 0 HH22 ARG A 67 63.210 -26.600 -11.635 1.00 1.00 H new ATOM 1015 N LEU A 68 66.599 -19.650 -6.481 1.00 1.00 N ATOM 1016 CA LEU A 68 67.030 -19.566 -5.061 1.00 1.00 C ATOM 1017 C LEU A 68 66.144 -20.490 -4.231 1.00 1.00 C ATOM 1018 O LEU A 68 66.565 -21.050 -3.225 1.00 1.00 O ATOM 1019 CB LEU A 68 66.958 -18.112 -4.438 1.00 1.00 C ATOM 1020 CG LEU A 68 66.212 -17.078 -5.342 1.00 1.00 C ATOM 1021 CD1 LEU A 68 65.166 -16.294 -4.518 1.00 1.00 C ATOM 1022 CD2 LEU A 68 67.216 -16.068 -5.916 1.00 1.00 C ATOM 0 H LEU A 68 66.701 -18.781 -7.006 1.00 1.00 H new ATOM 0 HA LEU A 68 68.080 -19.859 -5.040 1.00 1.00 H new ATOM 0 HB2 LEU A 68 66.457 -18.165 -3.472 1.00 1.00 H new ATOM 0 HB3 LEU A 68 67.971 -17.755 -4.253 1.00 1.00 H new ATOM 0 HG LEU A 68 65.718 -17.626 -6.144 1.00 1.00 H new ATOM 0 HD11 LEU A 68 64.656 -15.579 -5.163 1.00 1.00 H new ATOM 0 HD12 LEU A 68 64.438 -16.989 -4.100 1.00 1.00 H new ATOM 0 HD13 LEU A 68 65.665 -15.761 -3.709 1.00 1.00 H new ATOM 0 HD21 LEU A 68 66.690 -15.350 -6.545 1.00 1.00 H new ATOM 0 HD22 LEU A 68 67.710 -15.542 -5.099 1.00 1.00 H new ATOM 0 HD23 LEU A 68 67.962 -16.595 -6.512 1.00 1.00 H new ATOM 1034 N LEU A 69 64.923 -20.661 -4.687 1.00 1.00 N ATOM 1035 CA LEU A 69 64.029 -21.562 -3.966 1.00 1.00 C ATOM 1036 C LEU A 69 64.648 -22.964 -4.001 1.00 1.00 C ATOM 1037 O LEU A 69 65.056 -23.497 -2.967 1.00 1.00 O ATOM 1038 CB LEU A 69 62.654 -21.559 -4.634 1.00 1.00 C ATOM 1039 CG LEU A 69 61.932 -20.239 -4.303 1.00 1.00 C ATOM 1040 CD1 LEU A 69 60.859 -19.961 -5.358 1.00 1.00 C ATOM 1041 CD2 LEU A 69 61.263 -20.334 -2.923 1.00 1.00 C ATOM 0 H LEU A 69 64.531 -20.214 -5.516 1.00 1.00 H new ATOM 0 HA LEU A 69 63.902 -21.242 -2.932 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.761 -21.668 -5.713 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.065 -22.407 -4.285 1.00 1.00 H new ATOM 0 HG LEU A 69 62.664 -19.431 -4.296 1.00 1.00 H new ATOM 0 HD11 LEU A 69 60.350 -19.027 -5.122 1.00 1.00 H new ATOM 0 HD12 LEU A 69 61.326 -19.881 -6.340 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.136 -20.777 -5.365 1.00 1.00 H new ATOM 0 HD21 LEU A 69 60.756 -19.396 -2.699 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.537 -21.147 -2.926 1.00 1.00 H new ATOM 0 HD23 LEU A 69 62.021 -20.527 -2.164 1.00 1.00 H new ATOM 1053 N ALA A 70 64.779 -23.526 -5.205 1.00 1.00 N ATOM 1054 CA ALA A 70 65.429 -24.833 -5.330 1.00 1.00 C ATOM 1055 C ALA A 70 66.926 -24.573 -5.259 1.00 1.00 C ATOM 1056 O ALA A 70 67.559 -24.831 -4.238 1.00 1.00 O ATOM 1057 CB ALA A 70 65.057 -25.492 -6.663 1.00 1.00 C ATOM 0 H ALA A 70 64.456 -23.114 -6.080 1.00 1.00 H new ATOM 0 HA ALA A 70 65.110 -25.512 -4.539 1.00 1.00 H new ATOM 0 HB1 ALA A 70 65.549 -26.462 -6.739 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.977 -25.628 -6.713 1.00 1.00 H new ATOM 0 HB3 ALA A 70 65.381 -24.856 -7.486 1.00 1.00 H new ATOM 1063 N ALA A 71 67.469 -24.049 -6.357 1.00 1.00 N ATOM 1064 CA ALA A 71 68.876 -23.699 -6.504 1.00 1.00 C ATOM 1065 C ALA A 71 69.457 -22.974 -5.302 1.00 1.00 C ATOM 1066 O ALA A 71 70.611 -22.545 -5.362 1.00 1.00 O ATOM 1067 CB ALA A 71 69.085 -22.837 -7.740 1.00 1.00 C ATOM 0 H ALA A 71 66.921 -23.851 -7.195 1.00 1.00 H new ATOM 0 HA ALA A 71 69.403 -24.649 -6.598 1.00 1.00 H new ATOM 0 HB1 ALA A 71 70.141 -22.585 -7.834 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.763 -23.386 -8.625 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.501 -21.921 -7.648 1.00 1.00 H new ATOM 1073 N HIS A 72 68.681 -22.799 -4.232 1.00 1.00 N ATOM 1074 CA HIS A 72 69.133 -22.090 -3.035 1.00 1.00 C ATOM 1075 C HIS A 72 70.645 -22.205 -2.851 1.00 1.00 C ATOM 1076 O HIS A 72 71.355 -21.213 -3.003 1.00 1.00 O ATOM 1077 CB HIS A 72 68.393 -22.726 -1.825 1.00 1.00 C ATOM 1078 CG HIS A 72 67.854 -21.689 -0.876 1.00 1.00 C ATOM 1079 ND1 HIS A 72 68.218 -20.354 -0.931 1.00 1.00 N ATOM 1080 CD2 HIS A 72 66.968 -21.792 0.170 1.00 1.00 C ATOM 1081 CE1 HIS A 72 67.560 -19.714 0.054 1.00 1.00 C ATOM 1082 NE2 HIS A 72 66.787 -20.545 0.755 1.00 1.00 N ATOM 0 H HIS A 72 67.723 -23.144 -4.171 1.00 1.00 H new ATOM 0 HA HIS A 72 68.908 -21.027 -3.123 1.00 1.00 H new ATOM 0 HB2 HIS A 72 67.572 -23.345 -2.188 1.00 1.00 H new ATOM 0 HB3 HIS A 72 69.076 -23.385 -1.290 1.00 1.00 H new ATOM 0 HD2 HIS A 72 66.486 -22.704 0.489 1.00 1.00 H new ATOM 0 HE1 HIS A 72 67.647 -18.656 0.253 1.00 1.00 H new ATOM 0 HE2 HIS A 72 66.191 -20.314 1.550 1.00 1.00 H new ATOM 1090 N MET A 73 71.151 -23.394 -2.557 1.00 1.00 N ATOM 1091 CA MET A 73 72.591 -23.530 -2.410 1.00 1.00 C ATOM 1092 C MET A 73 73.246 -23.366 -3.776 1.00 1.00 C ATOM 1093 O MET A 73 74.248 -22.661 -3.909 1.00 1.00 O ATOM 1094 CB MET A 73 72.960 -24.872 -1.773 1.00 1.00 C ATOM 1095 CG MET A 73 72.487 -26.034 -2.647 1.00 1.00 C ATOM 1096 SD MET A 73 72.591 -27.573 -1.696 1.00 1.00 S ATOM 1097 CE MET A 73 70.957 -27.493 -0.918 1.00 1.00 C ATOM 0 H MET A 73 70.610 -24.248 -2.420 1.00 1.00 H new ATOM 0 HA MET A 73 72.959 -22.752 -1.741 1.00 1.00 H new ATOM 0 HB2 MET A 73 74.040 -24.930 -1.635 1.00 1.00 H new ATOM 0 HB3 MET A 73 72.508 -24.947 -0.784 1.00 1.00 H new ATOM 0 HG2 MET A 73 71.462 -25.864 -2.976 1.00 1.00 H new ATOM 0 HG3 MET A 73 73.102 -26.104 -3.544 1.00 1.00 H new ATOM 0 HE1 MET A 73 70.816 -28.364 -0.278 1.00 1.00 H new ATOM 0 HE2 MET A 73 70.884 -26.586 -0.318 1.00 1.00 H new ATOM 0 HE3 MET A 73 70.187 -27.481 -1.689 1.00 1.00 H new ATOM 1107 N VAL A 74 72.721 -24.077 -4.776 1.00 1.00 N ATOM 1108 CA VAL A 74 73.321 -24.055 -6.108 1.00 1.00 C ATOM 1109 C VAL A 74 73.706 -22.633 -6.528 1.00 1.00 C ATOM 1110 O VAL A 74 74.768 -22.490 -7.130 1.00 1.00 O ATOM 1111 CB VAL A 74 72.382 -24.677 -7.127 1.00 1.00 C ATOM 1112 CG1 VAL A 74 73.009 -24.640 -8.522 1.00 1.00 C ATOM 1113 CG2 VAL A 74 72.083 -26.124 -6.733 1.00 1.00 C ATOM 0 H VAL A 74 71.893 -24.667 -4.690 1.00 1.00 H new ATOM 0 HA VAL A 74 74.235 -24.647 -6.069 1.00 1.00 H new ATOM 0 HB VAL A 74 71.454 -24.106 -7.146 1.00 1.00 H new ATOM 0 HG11 VAL A 74 72.324 -25.089 -9.241 1.00 1.00 H new ATOM 0 HG12 VAL A 74 73.205 -23.606 -8.805 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.945 -25.198 -8.515 1.00 1.00 H new ATOM 0 HG21 VAL A 74 71.409 -26.569 -7.465 1.00 1.00 H new ATOM 0 HG22 VAL A 74 73.013 -26.692 -6.703 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.614 -26.144 -5.749 1.00 1.00 H new ATOM 1123 N ASN A 75 72.892 -21.568 -6.256 1.00 1.00 N ATOM 1124 CA ASN A 75 73.246 -20.161 -6.639 1.00 1.00 C ATOM 1125 C ASN A 75 74.758 -19.890 -6.531 1.00 1.00 C ATOM 1126 O ASN A 75 75.285 -18.925 -7.081 1.00 1.00 O ATOM 1127 CB ASN A 75 72.493 -19.177 -5.711 1.00 1.00 C ATOM 1128 CG ASN A 75 71.126 -18.817 -6.288 1.00 1.00 C ATOM 1129 OD1 ASN A 75 70.311 -19.700 -6.557 1.00 1.00 O ATOM 1130 ND2 ASN A 75 70.829 -17.564 -6.494 1.00 1.00 N ATOM 0 H ASN A 75 71.995 -21.654 -5.778 1.00 1.00 H new ATOM 0 HA ASN A 75 72.954 -20.019 -7.680 1.00 1.00 H new ATOM 0 HB2 ASN A 75 72.369 -19.624 -4.725 1.00 1.00 H new ATOM 0 HB3 ASN A 75 73.085 -18.272 -5.578 1.00 1.00 H new ATOM 0 HD21 ASN A 75 69.919 -17.312 -6.879 1.00 1.00 H new ATOM 0 HD22 ASN A 75 71.507 -16.836 -6.270 1.00 1.00 H new ATOM 1137 N GLY A 76 75.420 -20.818 -5.891 1.00 1.00 N ATOM 1138 CA GLY A 76 76.865 -20.792 -5.776 1.00 1.00 C ATOM 1139 C GLY A 76 77.444 -20.469 -7.168 1.00 1.00 C ATOM 1140 O GLY A 76 78.553 -19.986 -7.293 1.00 1.00 O ATOM 0 H GLY A 76 74.978 -21.615 -5.433 1.00 1.00 H new ATOM 0 HA2 GLY A 76 77.177 -20.042 -5.049 1.00 1.00 H new ATOM 0 HA3 GLY A 76 77.237 -21.753 -5.421 1.00 1.00 H new ATOM 1144 N ILE A 77 76.649 -20.718 -8.216 1.00 1.00 N ATOM 1145 CA ILE A 77 77.091 -20.405 -9.575 1.00 1.00 C ATOM 1146 C ILE A 77 77.072 -18.876 -9.732 1.00 1.00 C ATOM 1147 O ILE A 77 78.047 -18.260 -10.117 1.00 1.00 O ATOM 1148 CB ILE A 77 76.176 -21.094 -10.618 1.00 1.00 C ATOM 1149 CG1 ILE A 77 74.732 -21.191 -10.086 1.00 1.00 C ATOM 1150 CG2 ILE A 77 76.688 -22.516 -10.909 1.00 1.00 C ATOM 1151 CD1 ILE A 77 73.761 -21.372 -11.257 1.00 1.00 C ATOM 0 H ILE A 77 75.717 -21.126 -8.150 1.00 1.00 H new ATOM 0 HA ILE A 77 78.100 -20.780 -9.746 1.00 1.00 H new ATOM 0 HB ILE A 77 76.190 -20.498 -11.530 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.644 -22.030 -9.395 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.479 -20.290 -9.527 1.00 1.00 H new ATOM 0 HG21 ILE A 77 76.039 -22.993 -11.643 1.00 1.00 H new ATOM 0 HG22 ILE A 77 77.703 -22.464 -11.302 1.00 1.00 H new ATOM 0 HG23 ILE A 77 76.685 -23.099 -9.988 1.00 1.00 H new ATOM 0 HD11 ILE A 77 72.742 -21.440 -10.877 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.841 -20.519 -11.931 1.00 1.00 H new ATOM 0 HD13 ILE A 77 74.009 -22.286 -11.797 1.00 1.00 H new ATOM 1163 N VAL A 78 75.893 -18.339 -9.463 1.00 1.00 N ATOM 1164 CA VAL A 78 75.662 -16.902 -9.607 1.00 1.00 C ATOM 1165 C VAL A 78 76.986 -16.196 -9.236 1.00 1.00 C ATOM 1166 O VAL A 78 77.370 -15.204 -9.857 1.00 1.00 O ATOM 1167 CB VAL A 78 74.543 -16.390 -8.709 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.453 -14.868 -8.863 1.00 1.00 C ATOM 1169 CG2 VAL A 78 73.215 -17.015 -9.135 1.00 1.00 C ATOM 0 H VAL A 78 75.082 -18.869 -9.145 1.00 1.00 H new ATOM 0 HA VAL A 78 75.353 -16.693 -10.631 1.00 1.00 H new ATOM 0 HB VAL A 78 74.750 -16.656 -7.672 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.656 -14.484 -8.226 1.00 1.00 H new ATOM 0 HG12 VAL A 78 75.401 -14.416 -8.570 1.00 1.00 H new ATOM 0 HG13 VAL A 78 74.238 -14.620 -9.902 1.00 1.00 H new ATOM 0 HG21 VAL A 78 72.416 -16.647 -8.491 1.00 1.00 H new ATOM 0 HG22 VAL A 78 73.001 -16.745 -10.169 1.00 1.00 H new ATOM 0 HG23 VAL A 78 73.279 -18.100 -9.049 1.00 1.00 H new ATOM 1179 N ILE A 79 77.706 -16.783 -8.252 1.00 1.00 N ATOM 1180 CA ILE A 79 79.024 -16.286 -7.826 1.00 1.00 C ATOM 1181 C ILE A 79 80.189 -17.075 -8.471 1.00 1.00 C ATOM 1182 O ILE A 79 81.228 -16.523 -8.770 1.00 1.00 O ATOM 1183 CB ILE A 79 79.142 -16.318 -6.283 1.00 1.00 C ATOM 1184 CG1 ILE A 79 80.605 -15.980 -5.838 1.00 1.00 C ATOM 1185 CG2 ILE A 79 78.682 -17.678 -5.725 1.00 1.00 C ATOM 1186 CD1 ILE A 79 81.445 -17.244 -5.560 1.00 1.00 C ATOM 0 H ILE A 79 77.389 -17.606 -7.739 1.00 1.00 H new ATOM 0 HA ILE A 79 79.103 -15.255 -8.171 1.00 1.00 H new ATOM 0 HB ILE A 79 78.482 -15.555 -5.870 1.00 1.00 H new ATOM 0 HG12 ILE A 79 81.090 -15.389 -6.615 1.00 1.00 H new ATOM 0 HG13 ILE A 79 80.575 -15.363 -4.940 1.00 1.00 H new ATOM 0 HG21 ILE A 79 78.774 -17.676 -4.639 1.00 1.00 H new ATOM 0 HG22 ILE A 79 77.642 -17.851 -6.000 1.00 1.00 H new ATOM 0 HG23 ILE A 79 79.304 -18.471 -6.140 1.00 1.00 H new ATOM 0 HD11 ILE A 79 82.450 -16.953 -5.255 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.978 -17.823 -4.764 1.00 1.00 H new ATOM 0 HD13 ILE A 79 81.501 -17.850 -6.464 1.00 1.00 H new ATOM 1198 N ALA A 80 80.002 -18.368 -8.710 1.00 1.00 N ATOM 1199 CA ALA A 80 81.056 -19.199 -9.330 1.00 1.00 C ATOM 1200 C ALA A 80 81.067 -19.117 -10.855 1.00 1.00 C ATOM 1201 O ALA A 80 81.983 -19.633 -11.494 1.00 1.00 O ATOM 1202 CB ALA A 80 80.961 -20.667 -8.890 1.00 1.00 C ATOM 0 H ALA A 80 79.142 -18.871 -8.490 1.00 1.00 H new ATOM 0 HA ALA A 80 81.997 -18.782 -8.971 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.754 -21.242 -9.369 1.00 1.00 H new ATOM 0 HB2 ALA A 80 81.070 -20.730 -7.807 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.992 -21.072 -9.181 1.00 1.00 H new ATOM 1208 N GLU A 81 80.038 -18.518 -11.449 1.00 1.00 N ATOM 1209 CA GLU A 81 79.950 -18.445 -12.895 1.00 1.00 C ATOM 1210 C GLU A 81 80.636 -17.194 -13.452 1.00 1.00 C ATOM 1211 O GLU A 81 81.709 -17.301 -14.044 1.00 1.00 O ATOM 1212 CB GLU A 81 78.446 -18.445 -13.283 1.00 1.00 C ATOM 1213 CG GLU A 81 78.168 -19.447 -14.410 1.00 1.00 C ATOM 1214 CD GLU A 81 78.172 -20.862 -13.845 1.00 1.00 C ATOM 1215 OE1 GLU A 81 78.724 -21.048 -12.772 1.00 1.00 O ATOM 1216 OE2 GLU A 81 77.627 -21.740 -14.493 1.00 1.00 O ATOM 0 H GLU A 81 79.262 -18.081 -10.952 1.00 1.00 H new ATOM 0 HA GLU A 81 80.465 -19.304 -13.325 1.00 1.00 H new ATOM 0 HB2 GLU A 81 77.842 -18.696 -12.411 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.149 -17.445 -13.599 1.00 1.00 H new ATOM 0 HG2 GLU A 81 77.205 -19.232 -14.873 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.924 -19.353 -15.189 1.00 1.00 H new ATOM 1223 N ASP A 82 80.031 -16.002 -13.294 1.00 1.00 N ATOM 1224 CA ASP A 82 80.623 -14.773 -13.819 1.00 1.00 C ATOM 1225 C ASP A 82 81.530 -14.028 -12.828 1.00 1.00 C ATOM 1226 O ASP A 82 82.279 -13.150 -13.236 1.00 1.00 O ATOM 1227 CB ASP A 82 79.507 -13.843 -14.283 1.00 1.00 C ATOM 1228 CG ASP A 82 78.607 -14.580 -15.272 1.00 1.00 C ATOM 1229 OD1 ASP A 82 79.046 -14.808 -16.388 1.00 1.00 O ATOM 1230 OD2 ASP A 82 77.493 -14.906 -14.898 1.00 1.00 O ATOM 0 H ASP A 82 79.142 -15.872 -12.811 1.00 1.00 H new ATOM 0 HA ASP A 82 81.268 -15.073 -14.645 1.00 1.00 H new ATOM 0 HB2 ASP A 82 78.923 -13.503 -13.427 1.00 1.00 H new ATOM 0 HB3 ASP A 82 79.931 -12.955 -14.753 1.00 1.00 H new ATOM 1235 N ALA A 83 81.439 -14.335 -11.530 1.00 1.00 N ATOM 1236 CA ALA A 83 82.264 -13.582 -10.577 1.00 1.00 C ATOM 1237 C ALA A 83 83.715 -13.537 -11.036 1.00 1.00 C ATOM 1238 O ALA A 83 84.341 -12.504 -10.954 1.00 1.00 O ATOM 1239 CB ALA A 83 82.194 -14.129 -9.157 1.00 1.00 C ATOM 0 H ALA A 83 80.839 -15.057 -11.130 1.00 1.00 H new ATOM 0 HA ALA A 83 81.851 -12.574 -10.555 1.00 1.00 H new ATOM 0 HB1 ALA A 83 82.826 -13.527 -8.504 1.00 1.00 H new ATOM 0 HB2 ALA A 83 81.164 -14.090 -8.802 1.00 1.00 H new ATOM 0 HB3 ALA A 83 82.542 -15.162 -9.147 1.00 1.00 H new ATOM 1245 N LEU A 84 84.245 -14.647 -11.529 1.00 1.00 N ATOM 1246 CA LEU A 84 85.641 -14.678 -11.987 1.00 1.00 C ATOM 1247 C LEU A 84 86.007 -13.384 -12.744 1.00 1.00 C ATOM 1248 O LEU A 84 87.124 -12.880 -12.628 1.00 1.00 O ATOM 1249 CB LEU A 84 85.847 -15.908 -12.899 1.00 1.00 C ATOM 1250 CG LEU A 84 87.285 -16.461 -12.774 1.00 1.00 C ATOM 1251 CD1 LEU A 84 88.302 -15.336 -13.016 1.00 1.00 C ATOM 1252 CD2 LEU A 84 87.506 -17.070 -11.371 1.00 1.00 C ATOM 0 H LEU A 84 83.744 -15.530 -11.625 1.00 1.00 H new ATOM 0 HA LEU A 84 86.295 -14.750 -11.118 1.00 1.00 H new ATOM 0 HB2 LEU A 84 85.131 -16.686 -12.633 1.00 1.00 H new ATOM 0 HB3 LEU A 84 85.649 -15.633 -13.935 1.00 1.00 H new ATOM 0 HG LEU A 84 87.425 -17.240 -13.523 1.00 1.00 H new ATOM 0 HD11 LEU A 84 89.313 -15.734 -12.926 1.00 1.00 H new ATOM 0 HD12 LEU A 84 88.161 -14.927 -14.016 1.00 1.00 H new ATOM 0 HD13 LEU A 84 88.155 -14.548 -12.278 1.00 1.00 H new ATOM 0 HD21 LEU A 84 88.523 -17.455 -11.298 1.00 1.00 H new ATOM 0 HD22 LEU A 84 87.354 -16.302 -10.613 1.00 1.00 H new ATOM 0 HD23 LEU A 84 86.798 -17.883 -11.212 1.00 1.00 H new ATOM 1264 N ILE A 85 85.054 -12.831 -13.484 1.00 1.00 N ATOM 1265 CA ILE A 85 85.317 -11.586 -14.203 1.00 1.00 C ATOM 1266 C ILE A 85 85.341 -10.404 -13.222 1.00 1.00 C ATOM 1267 O ILE A 85 86.104 -9.456 -13.414 1.00 1.00 O ATOM 1268 CB ILE A 85 84.301 -11.361 -15.337 1.00 1.00 C ATOM 1269 CG1 ILE A 85 82.950 -10.824 -14.785 1.00 1.00 C ATOM 1270 CG2 ILE A 85 84.088 -12.694 -16.067 1.00 1.00 C ATOM 1271 CD1 ILE A 85 82.857 -9.308 -14.996 1.00 1.00 C ATOM 0 H ILE A 85 84.115 -13.211 -13.602 1.00 1.00 H new ATOM 0 HA ILE A 85 86.298 -11.662 -14.672 1.00 1.00 H new ATOM 0 HB ILE A 85 84.690 -10.612 -16.027 1.00 1.00 H new ATOM 0 HG12 ILE A 85 82.120 -11.320 -15.288 1.00 1.00 H new ATOM 0 HG13 ILE A 85 82.864 -11.057 -13.724 1.00 1.00 H new ATOM 0 HG21 ILE A 85 83.370 -12.555 -16.875 1.00 1.00 H new ATOM 0 HG22 ILE A 85 85.036 -13.039 -16.479 1.00 1.00 H new ATOM 0 HG23 ILE A 85 83.706 -13.436 -15.366 1.00 1.00 H new ATOM 0 HD11 ILE A 85 81.907 -8.944 -14.605 1.00 1.00 H new ATOM 0 HD12 ILE A 85 83.677 -8.817 -14.472 1.00 1.00 H new ATOM 0 HD13 ILE A 85 82.921 -9.084 -16.061 1.00 1.00 H new ATOM 1283 N ALA A 86 84.516 -10.465 -12.165 1.00 1.00 N ATOM 1284 CA ALA A 86 84.465 -9.406 -11.155 1.00 1.00 C ATOM 1285 C ALA A 86 85.345 -9.739 -9.936 1.00 1.00 C ATOM 1286 O ALA A 86 85.787 -8.851 -9.222 1.00 1.00 O ATOM 1287 CB ALA A 86 83.015 -9.212 -10.702 1.00 1.00 C ATOM 0 H ALA A 86 83.876 -11.240 -11.991 1.00 1.00 H new ATOM 0 HA ALA A 86 84.849 -8.490 -11.603 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.971 -8.424 -9.950 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.401 -8.931 -11.558 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.639 -10.142 -10.276 1.00 1.00 H new ATOM 1293 N GLU A 87 85.569 -11.022 -9.673 1.00 1.00 N ATOM 1294 CA GLU A 87 86.370 -11.433 -8.524 1.00 1.00 C ATOM 1295 C GLU A 87 87.759 -10.818 -8.608 1.00 1.00 C ATOM 1296 O GLU A 87 88.453 -10.674 -7.601 1.00 1.00 O ATOM 1297 CB GLU A 87 86.479 -12.961 -8.476 1.00 1.00 C ATOM 1298 CG GLU A 87 87.255 -13.380 -7.221 1.00 1.00 C ATOM 1299 CD GLU A 87 87.381 -14.894 -7.159 1.00 1.00 C ATOM 1300 OE1 GLU A 87 88.221 -15.426 -7.864 1.00 1.00 O ATOM 1301 OE2 GLU A 87 86.643 -15.500 -6.400 1.00 1.00 O ATOM 0 H GLU A 87 85.209 -11.793 -10.236 1.00 1.00 H new ATOM 0 HA GLU A 87 85.882 -11.084 -7.614 1.00 1.00 H new ATOM 0 HB2 GLU A 87 85.484 -13.407 -8.467 1.00 1.00 H new ATOM 0 HB3 GLU A 87 86.985 -13.328 -9.369 1.00 1.00 H new ATOM 0 HG2 GLU A 87 88.246 -12.926 -7.229 1.00 1.00 H new ATOM 0 HG3 GLU A 87 86.744 -13.014 -6.330 1.00 1.00 H new ATOM 1308 N ALA A 88 88.137 -10.413 -9.815 1.00 1.00 N ATOM 1309 CA ALA A 88 89.441 -9.765 -10.014 1.00 1.00 C ATOM 1310 C ALA A 88 89.358 -8.376 -9.406 1.00 1.00 C ATOM 1311 O ALA A 88 90.327 -7.622 -9.341 1.00 1.00 O ATOM 1312 CB ALA A 88 89.796 -9.683 -11.499 1.00 1.00 C ATOM 0 H ALA A 88 87.576 -10.516 -10.660 1.00 1.00 H new ATOM 0 HA ALA A 88 90.226 -10.348 -9.533 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.766 -9.199 -11.615 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.839 -10.688 -11.919 1.00 1.00 H new ATOM 0 HB3 ALA A 88 89.036 -9.103 -12.023 1.00 1.00 H new ATOM 1318 N VAL A 89 88.157 -8.125 -8.909 1.00 1.00 N ATOM 1319 CA VAL A 89 87.833 -6.896 -8.218 1.00 1.00 C ATOM 1320 C VAL A 89 87.917 -7.166 -6.723 1.00 1.00 C ATOM 1321 O VAL A 89 87.172 -6.581 -5.943 1.00 1.00 O ATOM 1322 CB VAL A 89 86.477 -6.293 -8.652 1.00 1.00 C ATOM 1323 CG1 VAL A 89 86.392 -4.822 -8.208 1.00 1.00 C ATOM 1324 CG2 VAL A 89 86.370 -6.319 -10.190 1.00 1.00 C ATOM 0 H VAL A 89 87.376 -8.777 -8.977 1.00 1.00 H new ATOM 0 HA VAL A 89 88.556 -6.126 -8.489 1.00 1.00 H new ATOM 0 HB VAL A 89 85.677 -6.877 -8.197 1.00 1.00 H new ATOM 0 HG11 VAL A 89 85.434 -4.403 -8.517 1.00 1.00 H new ATOM 0 HG12 VAL A 89 86.480 -4.764 -7.123 1.00 1.00 H new ATOM 0 HG13 VAL A 89 87.201 -4.255 -8.669 1.00 1.00 H new ATOM 0 HG21 VAL A 89 85.414 -5.894 -10.495 1.00 1.00 H new ATOM 0 HG22 VAL A 89 87.182 -5.733 -10.621 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.438 -7.348 -10.542 1.00 1.00 H new ATOM 1334 N GLY A 90 88.890 -8.025 -6.295 1.00 1.00 N ATOM 1335 CA GLY A 90 89.097 -8.291 -4.891 1.00 1.00 C ATOM 1336 C GLY A 90 89.346 -7.009 -4.111 1.00 1.00 C ATOM 1337 O GLY A 90 88.986 -6.978 -2.936 1.00 1.00 O ATOM 0 H GLY A 90 89.523 -8.527 -6.918 1.00 1.00 H new ATOM 0 HA2 GLY A 90 88.224 -8.802 -4.484 1.00 1.00 H new ATOM 0 HA3 GLY A 90 89.946 -8.963 -4.768 1.00 1.00 H new ATOM 1341 N PRO A 91 89.883 -5.926 -4.716 1.00 1.00 N ATOM 1342 CA PRO A 91 90.029 -4.598 -4.037 1.00 1.00 C ATOM 1343 C PRO A 91 88.864 -4.256 -3.091 1.00 1.00 C ATOM 1344 O PRO A 91 88.834 -3.168 -2.514 1.00 1.00 O ATOM 1345 CB PRO A 91 90.083 -3.580 -5.211 1.00 1.00 C ATOM 1346 CG PRO A 91 90.236 -4.389 -6.478 1.00 1.00 C ATOM 1347 CD PRO A 91 90.544 -5.820 -6.047 1.00 1.00 C ATOM 0 HA PRO A 91 90.912 -4.588 -3.398 1.00 1.00 H new ATOM 0 HB2 PRO A 91 89.175 -2.978 -5.243 1.00 1.00 H new ATOM 0 HB3 PRO A 91 90.919 -2.891 -5.088 1.00 1.00 H new ATOM 0 HG2 PRO A 91 89.324 -4.352 -7.074 1.00 1.00 H new ATOM 0 HG3 PRO A 91 91.039 -3.990 -7.098 1.00 1.00 H new ATOM 0 HD2 PRO A 91 90.145 -6.548 -6.754 1.00 1.00 H new ATOM 0 HD3 PRO A 91 91.617 -5.997 -5.979 1.00 1.00 H new ATOM 1355 N HIS A 92 87.912 -5.175 -2.931 1.00 1.00 N ATOM 1356 CA HIS A 92 86.788 -4.938 -2.069 1.00 1.00 C ATOM 1357 C HIS A 92 87.341 -4.393 -0.758 1.00 1.00 C ATOM 1358 O HIS A 92 86.672 -3.614 -0.104 1.00 1.00 O ATOM 1359 CB HIS A 92 86.013 -6.271 -1.836 1.00 1.00 C ATOM 1360 CG HIS A 92 86.192 -6.758 -0.412 1.00 1.00 C ATOM 1361 ND1 HIS A 92 85.547 -6.162 0.661 1.00 1.00 N ATOM 1362 CD2 HIS A 92 86.983 -7.743 0.129 1.00 1.00 C ATOM 1363 CE1 HIS A 92 85.958 -6.784 1.783 1.00 1.00 C ATOM 1364 NE2 HIS A 92 86.834 -7.755 1.515 1.00 1.00 N ATOM 0 H HIS A 92 87.910 -6.085 -3.393 1.00 1.00 H new ATOM 0 HA HIS A 92 86.090 -4.226 -2.510 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.953 -6.121 -2.043 1.00 1.00 H new ATOM 0 HB3 HIS A 92 86.370 -7.030 -2.532 1.00 1.00 H new ATOM 0 HD2 HIS A 92 87.623 -8.407 -0.434 1.00 1.00 H new ATOM 0 HE1 HIS A 92 85.620 -6.529 2.777 1.00 1.00 H new ATOM 0 HE2 HIS A 92 87.296 -8.374 2.182 1.00 1.00 H new ATOM 1372 N LEU A 93 88.590 -4.752 -0.399 1.00 1.00 N ATOM 1373 CA LEU A 93 89.179 -4.193 0.800 1.00 1.00 C ATOM 1374 C LEU A 93 89.186 -2.664 0.625 1.00 1.00 C ATOM 1375 O LEU A 93 88.702 -1.927 1.474 1.00 1.00 O ATOM 1376 CB LEU A 93 90.595 -4.795 1.031 1.00 1.00 C ATOM 1377 CG LEU A 93 91.660 -4.130 0.135 1.00 1.00 C ATOM 1378 CD1 LEU A 93 92.173 -2.809 0.771 1.00 1.00 C ATOM 1379 CD2 LEU A 93 92.840 -5.100 -0.060 1.00 1.00 C ATOM 0 H LEU A 93 89.181 -5.405 -0.913 1.00 1.00 H new ATOM 0 HA LEU A 93 88.607 -4.442 1.694 1.00 1.00 H new ATOM 0 HB2 LEU A 93 90.874 -4.673 2.077 1.00 1.00 H new ATOM 0 HB3 LEU A 93 90.570 -5.866 0.831 1.00 1.00 H new ATOM 0 HG LEU A 93 91.207 -3.895 -0.828 1.00 1.00 H new ATOM 0 HD11 LEU A 93 92.923 -2.359 0.120 1.00 1.00 H new ATOM 0 HD12 LEU A 93 91.340 -2.118 0.896 1.00 1.00 H new ATOM 0 HD13 LEU A 93 92.617 -3.022 1.743 1.00 1.00 H new ATOM 0 HD21 LEU A 93 93.594 -4.633 -0.693 1.00 1.00 H new ATOM 0 HD22 LEU A 93 93.278 -5.340 0.909 1.00 1.00 H new ATOM 0 HD23 LEU A 93 92.484 -6.015 -0.534 1.00 1.00 H new ATOM 1391 N ALA A 94 89.734 -2.188 -0.489 1.00 1.00 N ATOM 1392 CA ALA A 94 89.780 -0.754 -0.722 1.00 1.00 C ATOM 1393 C ALA A 94 88.377 -0.206 -0.481 1.00 1.00 C ATOM 1394 O ALA A 94 88.197 0.727 0.285 1.00 1.00 O ATOM 1395 CB ALA A 94 90.227 -0.462 -2.152 1.00 1.00 C ATOM 0 H ALA A 94 90.143 -2.761 -1.227 1.00 1.00 H new ATOM 0 HA ALA A 94 90.496 -0.280 -0.050 1.00 1.00 H new ATOM 0 HB1 ALA A 94 90.256 0.616 -2.311 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.220 -0.880 -2.315 1.00 1.00 H new ATOM 0 HB3 ALA A 94 89.524 -0.913 -2.852 1.00 1.00 H new ATOM 1401 N ARG A 95 87.390 -0.801 -1.126 1.00 1.00 N ATOM 1402 CA ARG A 95 86.010 -0.381 -0.935 1.00 1.00 C ATOM 1403 C ARG A 95 85.593 -0.650 0.512 1.00 1.00 C ATOM 1404 O ARG A 95 84.728 0.034 1.061 1.00 1.00 O ATOM 1405 CB ARG A 95 85.086 -1.162 -1.886 1.00 1.00 C ATOM 1406 CG ARG A 95 85.095 -0.548 -3.292 1.00 1.00 C ATOM 1407 CD ARG A 95 86.413 -0.858 -4.003 1.00 1.00 C ATOM 1408 NE ARG A 95 86.411 -0.256 -5.329 1.00 1.00 N ATOM 1409 CZ ARG A 95 86.511 1.059 -5.474 1.00 1.00 C ATOM 1410 NH1 ARG A 95 86.602 1.824 -4.417 1.00 1.00 N ATOM 1411 NH2 ARG A 95 86.516 1.590 -6.666 1.00 1.00 N ATOM 0 H ARG A 95 87.515 -1.571 -1.783 1.00 1.00 H new ATOM 0 HA ARG A 95 85.927 0.684 -1.151 1.00 1.00 H new ATOM 0 HB2 ARG A 95 85.408 -2.202 -1.938 1.00 1.00 H new ATOM 0 HB3 ARG A 95 84.070 -1.162 -1.492 1.00 1.00 H new ATOM 0 HG2 ARG A 95 84.260 -0.941 -3.872 1.00 1.00 H new ATOM 0 HG3 ARG A 95 84.956 0.531 -3.225 1.00 1.00 H new ATOM 0 HD2 ARG A 95 87.250 -0.474 -3.420 1.00 1.00 H new ATOM 0 HD3 ARG A 95 86.549 -1.937 -4.083 1.00 1.00 H new ATOM 0 HE ARG A 95 86.332 -0.851 -6.154 1.00 1.00 H new ATOM 0 HH11 ARG A 95 86.596 1.409 -3.485 1.00 1.00 H new ATOM 0 HH12 ARG A 95 86.679 2.835 -4.525 1.00 1.00 H new ATOM 0 HH21 ARG A 95 86.443 0.994 -7.490 1.00 1.00 H new ATOM 0 HH22 ARG A 95 86.593 2.601 -6.773 1.00 1.00 H new ATOM 1425 N ALA A 96 86.169 -1.702 1.101 1.00 1.00 N ATOM 1426 CA ALA A 96 85.769 -2.088 2.475 1.00 1.00 C ATOM 1427 C ALA A 96 85.854 -0.851 3.300 1.00 1.00 C ATOM 1428 O ALA A 96 85.012 -0.569 4.103 1.00 1.00 O ATOM 1429 CB ALA A 96 86.619 -3.217 3.063 1.00 1.00 C ATOM 0 H ALA A 96 86.888 -2.288 0.676 1.00 1.00 H new ATOM 0 HA ALA A 96 84.757 -2.493 2.462 1.00 1.00 H new ATOM 0 HB1 ALA A 96 86.271 -3.448 4.070 1.00 1.00 H new ATOM 0 HB2 ALA A 96 86.530 -4.104 2.436 1.00 1.00 H new ATOM 0 HB3 ALA A 96 87.662 -2.904 3.103 1.00 1.00 H new ATOM 1435 N LEU A 97 86.933 -0.171 3.068 1.00 1.00 N ATOM 1436 CA LEU A 97 87.217 1.067 3.794 1.00 1.00 C ATOM 1437 C LEU A 97 85.833 1.802 4.051 1.00 1.00 C ATOM 1438 O LEU A 97 85.592 2.411 5.098 1.00 1.00 O ATOM 1439 CB LEU A 97 88.168 1.931 2.938 1.00 1.00 C ATOM 1440 CG LEU A 97 89.075 2.794 3.818 1.00 1.00 C ATOM 1441 CD1 LEU A 97 90.111 3.500 2.943 1.00 1.00 C ATOM 1442 CD2 LEU A 97 88.237 3.835 4.559 1.00 1.00 C ATOM 0 H LEU A 97 87.643 -0.437 2.385 1.00 1.00 H new ATOM 0 HA LEU A 97 87.702 0.877 4.752 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.778 1.287 2.305 1.00 1.00 H new ATOM 0 HB3 LEU A 97 87.585 2.570 2.275 1.00 1.00 H new ATOM 0 HG LEU A 97 89.583 2.159 4.544 1.00 1.00 H new ATOM 0 HD11 LEU A 97 90.758 4.115 3.569 1.00 1.00 H new ATOM 0 HD12 LEU A 97 90.713 2.757 2.420 1.00 1.00 H new ATOM 0 HD13 LEU A 97 89.602 4.132 2.215 1.00 1.00 H new ATOM 0 HD21 LEU A 97 88.887 4.447 5.184 1.00 1.00 H new ATOM 0 HD22 LEU A 97 87.725 4.471 3.837 1.00 1.00 H new ATOM 0 HD23 LEU A 97 87.501 3.331 5.185 1.00 1.00 H new ATOM 1454 N GLY A 98 84.841 1.505 3.185 1.00 1.00 N ATOM 1455 CA GLY A 98 83.442 1.956 3.417 1.00 1.00 C ATOM 1456 C GLY A 98 82.631 0.915 4.254 1.00 1.00 C ATOM 1457 O GLY A 98 82.036 1.201 5.311 1.00 1.00 O ATOM 0 H GLY A 98 84.974 0.964 2.331 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.450 2.914 3.937 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.948 2.117 2.459 1.00 1.00 H new ATOM 1461 N GLN A 99 82.675 -0.327 3.780 1.00 1.00 N ATOM 1462 CA GLN A 99 82.040 -1.444 4.423 1.00 1.00 C ATOM 1463 C GLN A 99 82.914 -1.820 5.599 1.00 1.00 C ATOM 1464 O GLN A 99 82.689 -2.826 6.266 1.00 1.00 O ATOM 1465 CB GLN A 99 81.831 -2.609 3.426 1.00 1.00 C ATOM 1466 CG GLN A 99 80.448 -2.486 2.747 1.00 1.00 C ATOM 1467 CD GLN A 99 80.474 -3.099 1.346 1.00 1.00 C ATOM 1468 OE1 GLN A 99 80.716 -2.390 0.368 1.00 1.00 O ATOM 1469 NE2 GLN A 99 80.246 -4.374 1.190 1.00 1.00 N ATOM 0 H GLN A 99 83.166 -0.577 2.921 1.00 1.00 H new ATOM 0 HA GLN A 99 81.041 -1.191 4.778 1.00 1.00 H new ATOM 0 HB2 GLN A 99 82.617 -2.598 2.671 1.00 1.00 H new ATOM 0 HB3 GLN A 99 81.905 -3.563 3.949 1.00 1.00 H new ATOM 0 HG2 GLN A 99 79.694 -2.987 3.354 1.00 1.00 H new ATOM 0 HG3 GLN A 99 80.161 -1.436 2.684 1.00 1.00 H new ATOM 0 HE21 GLN A 99 80.046 -4.959 2.001 1.00 1.00 H new ATOM 0 HE22 GLN A 99 80.268 -4.786 0.257 1.00 1.00 H new ATOM 1478 N ILE A 100 83.912 -0.954 5.854 1.00 1.00 N ATOM 1479 CA ILE A 100 84.815 -1.144 6.962 1.00 1.00 C ATOM 1480 C ILE A 100 83.981 -1.157 8.177 1.00 1.00 C ATOM 1481 O ILE A 100 84.056 -2.073 8.967 1.00 1.00 O ATOM 1482 CB ILE A 100 85.861 -0.022 7.092 1.00 1.00 C ATOM 1483 CG1 ILE A 100 86.847 -0.381 8.207 1.00 1.00 C ATOM 1484 CG2 ILE A 100 85.208 1.327 7.435 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.059 0.546 8.135 1.00 1.00 C ATOM 0 H ILE A 100 84.099 -0.120 5.297 1.00 1.00 H new ATOM 0 HA ILE A 100 85.372 -2.069 6.810 1.00 1.00 H new ATOM 0 HB ILE A 100 86.370 0.073 6.133 1.00 1.00 H new ATOM 0 HG12 ILE A 100 86.362 -0.288 9.179 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.164 -1.419 8.106 1.00 1.00 H new ATOM 0 HG21 ILE A 100 85.979 2.093 7.518 1.00 1.00 H new ATOM 0 HG22 ILE A 100 84.506 1.602 6.648 1.00 1.00 H new ATOM 0 HG23 ILE A 100 84.676 1.243 8.382 1.00 1.00 H new ATOM 0 HD11 ILE A 100 88.761 0.290 8.929 1.00 1.00 H new ATOM 0 HD12 ILE A 100 88.548 0.431 7.168 1.00 1.00 H new ATOM 0 HD13 ILE A 100 87.734 1.579 8.257 1.00 1.00 H new ATOM 1497 N VAL A 101 83.165 -0.132 8.345 1.00 1.00 N ATOM 1498 CA VAL A 101 82.318 -0.114 9.522 1.00 1.00 C ATOM 1499 C VAL A 101 81.478 -1.384 9.526 1.00 1.00 C ATOM 1500 O VAL A 101 81.533 -2.169 10.464 1.00 1.00 O ATOM 1501 CB VAL A 101 81.434 1.172 9.553 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.040 1.601 8.134 1.00 1.00 C ATOM 1503 CG2 VAL A 101 80.153 0.934 10.370 1.00 1.00 C ATOM 0 H VAL A 101 83.071 0.664 7.714 1.00 1.00 H new ATOM 0 HA VAL A 101 82.929 -0.088 10.424 1.00 1.00 H new ATOM 0 HB VAL A 101 82.024 1.960 10.020 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.424 2.499 8.183 1.00 1.00 H new ATOM 0 HG12 VAL A 101 81.939 1.809 7.554 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.476 0.800 7.655 1.00 1.00 H new ATOM 0 HG21 VAL A 101 79.552 1.844 10.378 1.00 1.00 H new ATOM 0 HG22 VAL A 101 79.579 0.124 9.919 1.00 1.00 H new ATOM 0 HG23 VAL A 101 80.418 0.665 11.393 1.00 1.00 H new ATOM 1513 N CYS A 102 80.665 -1.557 8.505 1.00 1.00 N ATOM 1514 CA CYS A 102 79.782 -2.704 8.452 1.00 1.00 C ATOM 1515 C CYS A 102 80.547 -4.001 8.703 1.00 1.00 C ATOM 1516 O CYS A 102 79.975 -4.956 9.199 1.00 1.00 O ATOM 1517 CB CYS A 102 79.088 -2.716 7.079 1.00 1.00 C ATOM 1518 SG CYS A 102 78.661 -4.400 6.575 1.00 1.00 S ATOM 0 H CYS A 102 80.597 -0.925 7.707 1.00 1.00 H new ATOM 0 HA CYS A 102 79.031 -2.629 9.239 1.00 1.00 H new ATOM 0 HB2 CYS A 102 78.185 -2.106 7.120 1.00 1.00 H new ATOM 0 HB3 CYS A 102 79.744 -2.266 6.334 1.00 1.00 H new ATOM 1523 N ARG A 103 81.843 -3.963 8.410 1.00 1.00 N ATOM 1524 CA ARG A 103 82.756 -5.115 8.600 1.00 1.00 C ATOM 1525 C ARG A 103 83.323 -5.189 10.026 1.00 1.00 C ATOM 1526 O ARG A 103 83.300 -6.223 10.692 1.00 1.00 O ATOM 1527 CB ARG A 103 83.912 -4.980 7.591 1.00 1.00 C ATOM 1528 CG ARG A 103 84.972 -6.066 7.809 1.00 1.00 C ATOM 1529 CD ARG A 103 86.029 -5.978 6.703 1.00 1.00 C ATOM 1530 NE ARG A 103 86.806 -4.750 6.836 1.00 1.00 N ATOM 1531 CZ ARG A 103 87.862 -4.691 7.644 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.187 -5.731 8.365 1.00 1.00 N ATOM 1533 NH2 ARG A 103 88.564 -3.594 7.725 1.00 1.00 N ATOM 0 H ARG A 103 82.304 -3.135 8.032 1.00 1.00 H new ATOM 0 HA ARG A 103 82.190 -6.032 8.437 1.00 1.00 H new ATOM 0 HB2 ARG A 103 83.521 -5.049 6.576 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.371 -3.996 7.690 1.00 1.00 H new ATOM 0 HG2 ARG A 103 85.441 -5.941 8.785 1.00 1.00 H new ATOM 0 HG3 ARG A 103 84.505 -7.051 7.803 1.00 1.00 H new ATOM 0 HD2 ARG A 103 86.691 -6.842 6.755 1.00 1.00 H new ATOM 0 HD3 ARG A 103 85.545 -6.006 5.727 1.00 1.00 H new ATOM 0 HE ARG A 103 86.536 -3.924 6.302 1.00 1.00 H new ATOM 0 HH11 ARG A 103 87.632 -6.585 8.308 1.00 1.00 H new ATOM 0 HH12 ARG A 103 88.996 -5.689 8.985 1.00 1.00 H new ATOM 0 HH21 ARG A 103 88.304 -2.780 7.169 1.00 1.00 H new ATOM 0 HH22 ARG A 103 89.373 -3.551 8.345 1.00 1.00 H new ATOM 1547 N TYR A 104 83.808 -4.054 10.442 1.00 1.00 N ATOM 1548 CA TYR A 104 84.407 -3.781 11.746 1.00 1.00 C ATOM 1549 C TYR A 104 83.337 -3.171 12.664 1.00 1.00 C ATOM 1550 O TYR A 104 83.660 -2.519 13.655 1.00 1.00 O ATOM 1551 CB TYR A 104 85.680 -2.883 11.597 1.00 1.00 C ATOM 1552 CG TYR A 104 85.740 -1.820 12.683 1.00 1.00 C ATOM 1553 CD1 TYR A 104 86.212 -2.130 13.969 1.00 1.00 C ATOM 1554 CD2 TYR A 104 85.266 -0.537 12.409 1.00 1.00 C ATOM 1555 CE1 TYR A 104 86.205 -1.148 14.971 1.00 1.00 C ATOM 1556 CE2 TYR A 104 85.265 0.444 13.403 1.00 1.00 C ATOM 1557 CZ TYR A 104 85.729 0.139 14.687 1.00 1.00 C ATOM 1558 OH TYR A 104 85.711 1.108 15.673 1.00 1.00 O ATOM 0 H TYR A 104 83.801 -3.226 9.846 1.00 1.00 H new ATOM 0 HA TYR A 104 84.753 -4.706 12.207 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.574 -3.505 11.645 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.677 -2.405 10.618 1.00 1.00 H new ATOM 0 HD1 TYR A 104 86.580 -3.122 14.186 1.00 1.00 H new ATOM 0 HD2 TYR A 104 84.897 -0.301 11.422 1.00 1.00 H new ATOM 0 HE1 TYR A 104 86.566 -1.384 15.961 1.00 1.00 H new ATOM 0 HE2 TYR A 104 84.906 1.438 13.180 1.00 1.00 H new ATOM 0 HH TYR A 104 85.352 1.942 15.305 1.00 1.00 H new ATOM 1568 N GLY A 105 82.057 -3.410 12.403 1.00 1.00 N ATOM 1569 CA GLY A 105 81.013 -2.886 13.262 1.00 1.00 C ATOM 1570 C GLY A 105 79.756 -3.682 12.953 1.00 1.00 C ATOM 1571 O GLY A 105 79.534 -4.758 13.511 1.00 1.00 O ATOM 0 H GLY A 105 81.724 -3.958 11.610 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.288 -2.988 14.312 1.00 1.00 H new ATOM 0 HA3 GLY A 105 80.855 -1.824 13.075 1.00 1.00 H new ATOM 1575 N ALA A 106 78.950 -3.152 12.042 1.00 1.00 N ATOM 1576 CA ALA A 106 77.717 -3.788 11.618 1.00 1.00 C ATOM 1577 C ALA A 106 76.635 -3.798 12.711 1.00 1.00 C ATOM 1578 O ALA A 106 76.286 -4.854 13.209 1.00 1.00 O ATOM 1579 CB ALA A 106 78.008 -5.230 11.108 1.00 1.00 C ATOM 0 H ALA A 106 79.137 -2.264 11.576 1.00 1.00 H new ATOM 0 HA ALA A 106 77.314 -3.190 10.801 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.076 -5.699 10.792 1.00 1.00 H new ATOM 0 HB2 ALA A 106 78.696 -5.185 10.264 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.455 -5.816 11.911 1.00 1.00 H new ATOM 1585 N THR A 107 76.137 -2.628 13.143 1.00 1.00 N ATOM 1586 CA THR A 107 75.092 -2.628 14.183 1.00 1.00 C ATOM 1587 C THR A 107 73.730 -2.981 13.541 1.00 1.00 C ATOM 1588 O THR A 107 73.051 -3.917 13.960 1.00 1.00 O ATOM 1589 CB THR A 107 74.999 -1.262 14.878 1.00 1.00 C ATOM 1590 OG1 THR A 107 76.243 -0.955 15.499 1.00 1.00 O ATOM 1591 CG2 THR A 107 73.895 -1.313 15.945 1.00 1.00 C ATOM 0 H THR A 107 76.423 -1.708 12.808 1.00 1.00 H new ATOM 0 HA THR A 107 75.354 -3.373 14.935 1.00 1.00 H new ATOM 0 HB THR A 107 74.765 -0.494 14.141 1.00 1.00 H new ATOM 0 HG1 THR A 107 76.182 -0.082 15.940 1.00 1.00 H new ATOM 0 HG21 THR A 107 73.824 -0.345 16.442 1.00 1.00 H new ATOM 0 HG22 THR A 107 72.942 -1.548 15.471 1.00 1.00 H new ATOM 0 HG23 THR A 107 74.134 -2.082 16.680 1.00 1.00 H new ATOM 1599 N VAL A 108 73.313 -2.176 12.570 1.00 1.00 N ATOM 1600 CA VAL A 108 72.019 -2.367 11.922 1.00 1.00 C ATOM 1601 C VAL A 108 71.957 -3.763 11.297 1.00 1.00 C ATOM 1602 O VAL A 108 70.970 -4.482 11.415 1.00 1.00 O ATOM 1603 CB VAL A 108 71.830 -1.270 10.866 1.00 1.00 C ATOM 1604 CG1 VAL A 108 73.038 -1.232 9.921 1.00 1.00 C ATOM 1605 CG2 VAL A 108 70.570 -1.539 10.054 1.00 1.00 C ATOM 0 H VAL A 108 73.851 -1.386 12.214 1.00 1.00 H new ATOM 0 HA VAL A 108 71.212 -2.293 12.651 1.00 1.00 H new ATOM 0 HB VAL A 108 71.738 -0.311 11.376 1.00 1.00 H new ATOM 0 HG11 VAL A 108 72.893 -0.450 9.176 1.00 1.00 H new ATOM 0 HG12 VAL A 108 73.942 -1.024 10.494 1.00 1.00 H new ATOM 0 HG13 VAL A 108 73.139 -2.195 9.421 1.00 1.00 H new ATOM 0 HG21 VAL A 108 70.444 -0.755 9.307 1.00 1.00 H new ATOM 0 HG22 VAL A 108 70.658 -2.504 9.556 1.00 1.00 H new ATOM 0 HG23 VAL A 108 69.705 -1.550 10.717 1.00 1.00 H new ATOM 1615 N ILE A 109 73.040 -4.106 10.643 1.00 1.00 N ATOM 1616 CA ILE A 109 73.135 -5.422 9.990 1.00 1.00 C ATOM 1617 C ILE A 109 72.520 -6.513 10.935 1.00 1.00 C ATOM 1618 O ILE A 109 71.500 -7.107 10.606 1.00 1.00 O ATOM 1619 CB ILE A 109 74.584 -5.719 9.542 1.00 1.00 C ATOM 1620 CG1 ILE A 109 74.902 -4.898 8.266 1.00 1.00 C ATOM 1621 CG2 ILE A 109 74.765 -7.224 9.263 1.00 1.00 C ATOM 1622 CD1 ILE A 109 74.437 -5.625 6.994 1.00 1.00 C ATOM 0 H ILE A 109 73.865 -3.514 10.540 1.00 1.00 H new ATOM 0 HA ILE A 109 72.550 -5.430 9.070 1.00 1.00 H new ATOM 0 HB ILE A 109 75.271 -5.435 10.339 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.415 -3.925 8.328 1.00 1.00 H new ATOM 0 HG13 ILE A 109 75.975 -4.714 8.209 1.00 1.00 H new ATOM 0 HG21 ILE A 109 75.791 -7.415 8.949 1.00 1.00 H new ATOM 0 HG22 ILE A 109 74.552 -7.790 10.170 1.00 1.00 H new ATOM 0 HG23 ILE A 109 74.080 -7.533 8.473 1.00 1.00 H new ATOM 0 HD11 ILE A 109 74.677 -5.019 6.120 1.00 1.00 H new ATOM 0 HD12 ILE A 109 74.944 -6.587 6.919 1.00 1.00 H new ATOM 0 HD13 ILE A 109 73.360 -5.785 7.040 1.00 1.00 H new ATOM 1634 N PRO A 110 73.052 -6.723 12.116 1.00 1.00 N ATOM 1635 CA PRO A 110 72.469 -7.662 13.133 1.00 1.00 C ATOM 1636 C PRO A 110 70.944 -7.473 13.343 1.00 1.00 C ATOM 1637 O PRO A 110 70.228 -8.434 13.609 1.00 1.00 O ATOM 1638 CB PRO A 110 73.196 -7.297 14.448 1.00 1.00 C ATOM 1639 CG PRO A 110 74.400 -6.477 14.071 1.00 1.00 C ATOM 1640 CD PRO A 110 74.292 -6.142 12.577 1.00 1.00 C ATOM 0 HA PRO A 110 72.600 -8.694 12.809 1.00 1.00 H new ATOM 0 HB2 PRO A 110 72.537 -6.734 15.109 1.00 1.00 H new ATOM 0 HB3 PRO A 110 73.495 -8.197 14.986 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.441 -5.564 14.665 1.00 1.00 H new ATOM 0 HG3 PRO A 110 75.317 -7.030 14.273 1.00 1.00 H new ATOM 0 HD2 PRO A 110 74.297 -5.063 12.420 1.00 1.00 H new ATOM 0 HD3 PRO A 110 75.140 -6.549 12.026 1.00 1.00 H new ATOM 1648 N ASN A 111 70.448 -6.236 13.300 1.00 1.00 N ATOM 1649 CA ASN A 111 69.022 -6.032 13.539 1.00 1.00 C ATOM 1650 C ASN A 111 68.209 -6.637 12.393 1.00 1.00 C ATOM 1651 O ASN A 111 67.492 -7.626 12.583 1.00 1.00 O ATOM 1652 CB ASN A 111 68.728 -4.532 13.691 1.00 1.00 C ATOM 1653 CG ASN A 111 67.239 -4.247 13.515 1.00 1.00 C ATOM 1654 OD1 ASN A 111 66.424 -4.635 14.352 1.00 1.00 O ATOM 1655 ND2 ASN A 111 66.837 -3.593 12.459 1.00 1.00 N ATOM 0 H ASN A 111 70.988 -5.392 13.110 1.00 1.00 H new ATOM 0 HA ASN A 111 68.734 -6.533 14.463 1.00 1.00 H new ATOM 0 HB2 ASN A 111 69.054 -4.192 14.674 1.00 1.00 H new ATOM 0 HB3 ASN A 111 69.300 -3.969 12.953 1.00 1.00 H new ATOM 0 HD21 ASN A 111 65.844 -3.402 12.325 1.00 1.00 H new ATOM 0 HD22 ASN A 111 67.516 -3.273 11.768 1.00 1.00 H new ATOM 1662 N ILE A 112 68.308 -6.058 11.201 1.00 1.00 N ATOM 1663 CA ILE A 112 67.555 -6.571 10.060 1.00 1.00 C ATOM 1664 C ILE A 112 67.755 -8.077 9.966 1.00 1.00 C ATOM 1665 O ILE A 112 66.965 -8.812 9.379 1.00 1.00 O ATOM 1666 CB ILE A 112 68.077 -5.887 8.771 1.00 1.00 C ATOM 1667 CG1 ILE A 112 69.308 -6.626 8.200 1.00 1.00 C ATOM 1668 CG2 ILE A 112 68.496 -4.437 9.082 1.00 1.00 C ATOM 1669 CD1 ILE A 112 69.816 -5.884 6.977 1.00 1.00 C ATOM 0 H ILE A 112 68.892 -5.246 11.000 1.00 1.00 H new ATOM 0 HA ILE A 112 66.493 -6.359 10.181 1.00 1.00 H new ATOM 0 HB ILE A 112 67.270 -5.911 8.039 1.00 1.00 H new ATOM 0 HG12 ILE A 112 70.092 -6.687 8.954 1.00 1.00 H new ATOM 0 HG13 ILE A 112 69.041 -7.649 7.934 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.862 -3.961 8.172 1.00 1.00 H new ATOM 0 HG22 ILE A 112 67.637 -3.883 9.461 1.00 1.00 H new ATOM 0 HG23 ILE A 112 69.286 -4.440 9.833 1.00 1.00 H new ATOM 0 HD11 ILE A 112 70.685 -6.403 6.572 1.00 1.00 H new ATOM 0 HD12 ILE A 112 69.031 -5.846 6.222 1.00 1.00 H new ATOM 0 HD13 ILE A 112 70.098 -4.869 7.258 1.00 1.00 H new ATOM 1681 N ASN A 113 68.867 -8.473 10.527 1.00 1.00 N ATOM 1682 CA ASN A 113 69.240 -9.878 10.484 1.00 1.00 C ATOM 1683 C ASN A 113 68.150 -10.664 11.163 1.00 1.00 C ATOM 1684 O ASN A 113 67.617 -11.609 10.580 1.00 1.00 O ATOM 1685 CB ASN A 113 70.602 -10.192 11.102 1.00 1.00 C ATOM 1686 CG ASN A 113 70.872 -11.700 11.010 1.00 1.00 C ATOM 1687 OD1 ASN A 113 70.687 -12.301 9.952 1.00 1.00 O ATOM 1688 ND2 ASN A 113 71.295 -12.348 12.064 1.00 1.00 N ATOM 0 H ASN A 113 69.525 -7.863 11.012 1.00 1.00 H new ATOM 0 HA ASN A 113 69.346 -10.160 9.437 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.385 -9.640 10.582 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.623 -9.871 12.143 1.00 1.00 H new ATOM 0 HD21 ASN A 113 71.472 -13.351 12.009 1.00 1.00 H new ATOM 0 HD22 ASN A 113 71.448 -11.850 12.941 1.00 1.00 H new ATOM 1695 N ALA A 114 67.800 -10.304 12.397 1.00 1.00 N ATOM 1696 CA ALA A 114 66.766 -11.022 13.107 1.00 1.00 C ATOM 1697 C ALA A 114 65.448 -11.044 12.341 1.00 1.00 C ATOM 1698 O ALA A 114 64.729 -12.031 12.424 1.00 1.00 O ATOM 1699 CB ALA A 114 66.537 -10.365 14.470 1.00 1.00 C ATOM 0 H ALA A 114 68.216 -9.529 12.913 1.00 1.00 H new ATOM 0 HA ALA A 114 67.103 -12.052 13.223 1.00 1.00 H new ATOM 0 HB1 ALA A 114 65.757 -10.905 15.008 1.00 1.00 H new ATOM 0 HB2 ALA A 114 67.461 -10.392 15.047 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.229 -9.329 14.327 1.00 1.00 H new ATOM 1705 N ALA A 115 65.127 -9.993 11.569 1.00 1.00 N ATOM 1706 CA ALA A 115 63.882 -9.995 10.792 1.00 1.00 C ATOM 1707 C ALA A 115 64.053 -10.840 9.525 1.00 1.00 C ATOM 1708 O ALA A 115 63.231 -11.659 9.177 1.00 1.00 O ATOM 1709 CB ALA A 115 63.511 -8.563 10.396 1.00 1.00 C ATOM 0 H ALA A 115 65.697 -9.153 11.468 1.00 1.00 H new ATOM 0 HA ALA A 115 63.089 -10.421 11.406 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.586 -8.573 9.820 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.372 -7.961 11.294 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.310 -8.134 9.792 1.00 1.00 H new ATOM 1715 N ILE A 116 65.155 -10.577 8.866 1.00 1.00 N ATOM 1716 CA ILE A 116 65.453 -11.296 7.613 1.00 1.00 C ATOM 1717 C ILE A 116 65.371 -12.799 7.914 1.00 1.00 C ATOM 1718 O ILE A 116 64.678 -13.573 7.252 1.00 1.00 O ATOM 1719 CB ILE A 116 66.841 -10.949 7.042 1.00 1.00 C ATOM 1720 CG1 ILE A 116 66.782 -9.571 6.363 1.00 1.00 C ATOM 1721 CG2 ILE A 116 67.248 -12.017 6.007 1.00 1.00 C ATOM 1722 CD1 ILE A 116 68.178 -9.153 5.881 1.00 1.00 C ATOM 0 H ILE A 116 65.855 -9.892 9.151 1.00 1.00 H new ATOM 0 HA ILE A 116 64.728 -10.997 6.856 1.00 1.00 H new ATOM 0 HB ILE A 116 67.574 -10.926 7.848 1.00 1.00 H new ATOM 0 HG12 ILE A 116 66.093 -9.603 5.519 1.00 1.00 H new ATOM 0 HG13 ILE A 116 66.395 -8.830 7.062 1.00 1.00 H new ATOM 0 HG21 ILE A 116 68.230 -11.774 5.601 1.00 1.00 H new ATOM 0 HG22 ILE A 116 67.286 -12.994 6.488 1.00 1.00 H new ATOM 0 HG23 ILE A 116 66.516 -12.038 5.199 1.00 1.00 H new ATOM 0 HD11 ILE A 116 68.120 -8.175 5.402 1.00 1.00 H new ATOM 0 HD12 ILE A 116 68.856 -9.101 6.733 1.00 1.00 H new ATOM 0 HD13 ILE A 116 68.550 -9.886 5.165 1.00 1.00 H new ATOM 1734 N GLU A 117 66.120 -13.159 8.936 1.00 1.00 N ATOM 1735 CA GLU A 117 66.186 -14.560 9.366 1.00 1.00 C ATOM 1736 C GLU A 117 64.771 -15.126 9.379 1.00 1.00 C ATOM 1737 O GLU A 117 64.439 -16.016 8.611 1.00 1.00 O ATOM 1738 CB GLU A 117 66.803 -14.752 10.755 1.00 1.00 C ATOM 1739 CG GLU A 117 67.080 -16.263 10.979 1.00 1.00 C ATOM 1740 CD GLU A 117 67.030 -16.627 12.462 1.00 1.00 C ATOM 1741 OE1 GLU A 117 67.769 -16.037 13.230 1.00 1.00 O ATOM 1742 OE2 GLU A 117 66.247 -17.499 12.806 1.00 1.00 O ATOM 0 H GLU A 117 66.690 -12.516 9.486 1.00 1.00 H new ATOM 0 HA GLU A 117 66.834 -15.080 8.660 1.00 1.00 H new ATOM 0 HB2 GLU A 117 67.729 -14.183 10.838 1.00 1.00 H new ATOM 0 HB3 GLU A 117 66.127 -14.375 11.523 1.00 1.00 H new ATOM 0 HG2 GLU A 117 66.344 -16.854 10.433 1.00 1.00 H new ATOM 0 HG3 GLU A 117 68.059 -16.519 10.573 1.00 1.00 H new ATOM 1749 N VAL A 118 63.948 -14.577 10.254 1.00 1.00 N ATOM 1750 CA VAL A 118 62.563 -15.050 10.343 1.00 1.00 C ATOM 1751 C VAL A 118 61.859 -14.857 8.985 1.00 1.00 C ATOM 1752 O VAL A 118 61.220 -15.781 8.481 1.00 1.00 O ATOM 1753 CB VAL A 118 61.797 -14.355 11.482 1.00 1.00 C ATOM 1754 CG1 VAL A 118 62.428 -14.750 12.822 1.00 1.00 C ATOM 1755 CG2 VAL A 118 61.897 -12.845 11.332 1.00 1.00 C ATOM 0 H VAL A 118 64.195 -13.826 10.898 1.00 1.00 H new ATOM 0 HA VAL A 118 62.575 -16.114 10.581 1.00 1.00 H new ATOM 0 HB VAL A 118 60.751 -14.659 11.444 1.00 1.00 H new ATOM 0 HG11 VAL A 118 61.891 -14.262 13.635 1.00 1.00 H new ATOM 0 HG12 VAL A 118 62.370 -15.831 12.947 1.00 1.00 H new ATOM 0 HG13 VAL A 118 63.472 -14.438 12.838 1.00 1.00 H new ATOM 0 HG21 VAL A 118 61.352 -12.362 12.143 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.944 -12.544 11.369 1.00 1.00 H new ATOM 0 HG23 VAL A 118 61.467 -12.545 10.376 1.00 1.00 H new ATOM 1765 N LEU A 119 61.939 -13.651 8.416 1.00 1.00 N ATOM 1766 CA LEU A 119 61.248 -13.413 7.145 1.00 1.00 C ATOM 1767 C LEU A 119 61.696 -14.524 6.179 1.00 1.00 C ATOM 1768 O LEU A 119 60.906 -15.414 5.853 1.00 1.00 O ATOM 1769 CB LEU A 119 61.629 -12.011 6.598 1.00 1.00 C ATOM 1770 CG LEU A 119 60.449 -11.333 5.887 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.955 -10.071 5.172 1.00 1.00 C ATOM 1772 CD2 LEU A 119 59.823 -12.285 4.860 1.00 1.00 C ATOM 0 H LEU A 119 62.452 -12.855 8.795 1.00 1.00 H new ATOM 0 HA LEU A 119 60.165 -13.433 7.267 1.00 1.00 H new ATOM 0 HB2 LEU A 119 61.968 -11.381 7.420 1.00 1.00 H new ATOM 0 HB3 LEU A 119 62.464 -12.107 5.904 1.00 1.00 H new ATOM 0 HG LEU A 119 59.692 -11.069 6.625 1.00 1.00 H new ATOM 0 HD11 LEU A 119 60.123 -9.583 4.664 1.00 1.00 H new ATOM 0 HD12 LEU A 119 61.386 -9.387 5.903 1.00 1.00 H new ATOM 0 HD13 LEU A 119 61.715 -10.347 4.441 1.00 1.00 H new ATOM 0 HD21 LEU A 119 58.988 -11.789 4.365 1.00 1.00 H new ATOM 0 HD22 LEU A 119 60.571 -12.563 4.118 1.00 1.00 H new ATOM 0 HD23 LEU A 119 59.464 -13.181 5.366 1.00 1.00 H new ATOM 1784 N GLY A 120 62.954 -14.472 5.720 1.00 1.00 N ATOM 1785 CA GLY A 120 63.421 -15.512 4.798 1.00 1.00 C ATOM 1786 C GLY A 120 63.552 -16.867 5.515 1.00 1.00 C ATOM 1787 O GLY A 120 62.693 -17.732 5.410 1.00 1.00 O ATOM 0 H GLY A 120 63.639 -13.755 5.959 1.00 1.00 H new ATOM 0 HA2 GLY A 120 62.724 -15.603 3.965 1.00 1.00 H new ATOM 0 HA3 GLY A 120 64.385 -15.224 4.378 1.00 1.00 H new ATOM 1791 N THR A 121 64.664 -16.955 6.230 1.00 1.00 N ATOM 1792 CA THR A 121 65.058 -18.144 7.032 1.00 1.00 C ATOM 1793 C THR A 121 66.564 -18.190 7.276 1.00 1.00 C ATOM 1794 O THR A 121 67.019 -18.717 8.290 1.00 1.00 O ATOM 1795 CB THR A 121 64.651 -19.460 6.314 1.00 1.00 C ATOM 1796 OG1 THR A 121 63.239 -19.574 6.234 1.00 1.00 O ATOM 1797 CG2 THR A 121 65.159 -20.680 7.091 1.00 1.00 C ATOM 0 H THR A 121 65.343 -16.196 6.282 1.00 1.00 H new ATOM 0 HA THR A 121 64.537 -18.056 7.985 1.00 1.00 H new ATOM 0 HB THR A 121 65.090 -19.428 5.317 1.00 1.00 H new ATOM 0 HG1 THR A 121 62.881 -18.834 5.700 1.00 1.00 H new ATOM 0 HG21 THR A 121 64.863 -21.591 6.571 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.246 -20.639 7.162 1.00 1.00 H new ATOM 0 HG23 THR A 121 64.729 -20.678 8.093 1.00 1.00 H new ATOM 1805 N GLY A 122 67.335 -17.683 6.317 1.00 1.00 N ATOM 1806 CA GLY A 122 68.797 -17.721 6.406 1.00 1.00 C ATOM 1807 C GLY A 122 69.288 -18.910 5.591 1.00 1.00 C ATOM 1808 O GLY A 122 70.422 -18.950 5.135 1.00 1.00 O ATOM 0 H GLY A 122 66.975 -17.242 5.471 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.226 -16.794 6.025 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.113 -17.815 7.445 1.00 1.00 H new ATOM 1812 N THR A 123 68.361 -19.846 5.404 1.00 1.00 N ATOM 1813 CA THR A 123 68.654 -21.045 4.595 1.00 1.00 C ATOM 1814 C THR A 123 69.348 -20.537 3.326 1.00 1.00 C ATOM 1815 O THR A 123 68.700 -20.213 2.337 1.00 1.00 O ATOM 1816 CB THR A 123 67.399 -21.834 4.223 1.00 1.00 C ATOM 1817 OG1 THR A 123 66.686 -22.181 5.398 1.00 1.00 O ATOM 1818 CG2 THR A 123 67.823 -23.108 3.497 1.00 1.00 C ATOM 0 H THR A 123 67.417 -19.808 5.789 1.00 1.00 H new ATOM 0 HA THR A 123 69.275 -21.733 5.168 1.00 1.00 H new ATOM 0 HB THR A 123 66.758 -21.229 3.582 1.00 1.00 H new ATOM 0 HG1 THR A 123 65.974 -22.816 5.173 1.00 1.00 H new ATOM 0 HG21 THR A 123 66.938 -23.683 3.224 1.00 1.00 H new ATOM 0 HG22 THR A 123 68.377 -22.846 2.596 1.00 1.00 H new ATOM 0 HG23 THR A 123 68.457 -23.706 4.152 1.00 1.00 H new ATOM 1826 N ASP A 124 70.676 -20.463 3.387 1.00 1.00 N ATOM 1827 CA ASP A 124 71.461 -19.983 2.256 1.00 1.00 C ATOM 1828 C ASP A 124 72.929 -20.364 2.373 1.00 1.00 C ATOM 1829 O ASP A 124 73.392 -20.805 3.425 1.00 1.00 O ATOM 1830 CB ASP A 124 71.337 -18.463 2.164 1.00 1.00 C ATOM 1831 CG ASP A 124 72.019 -17.813 3.362 1.00 1.00 C ATOM 1832 OD1 ASP A 124 72.492 -18.542 4.219 1.00 1.00 O ATOM 1833 OD2 ASP A 124 72.058 -16.594 3.409 1.00 1.00 O ATOM 0 H ASP A 124 71.227 -20.728 4.204 1.00 1.00 H new ATOM 0 HA ASP A 124 71.068 -20.455 1.355 1.00 1.00 H new ATOM 0 HB2 ASP A 124 71.791 -18.108 1.239 1.00 1.00 H new ATOM 0 HB3 ASP A 124 70.286 -18.176 2.133 1.00 1.00 H new ATOM 1838 N TYR A 125 73.669 -20.123 1.296 1.00 1.00 N ATOM 1839 CA TYR A 125 75.108 -20.365 1.277 1.00 1.00 C ATOM 1840 C TYR A 125 75.781 -19.261 0.464 1.00 1.00 C ATOM 1841 O TYR A 125 75.246 -18.828 -0.558 1.00 1.00 O ATOM 1842 CB TYR A 125 75.423 -21.731 0.671 1.00 1.00 C ATOM 1843 CG TYR A 125 76.912 -21.959 0.742 1.00 1.00 C ATOM 1844 CD1 TYR A 125 77.505 -22.327 1.958 1.00 1.00 C ATOM 1845 CD2 TYR A 125 77.702 -21.797 -0.402 1.00 1.00 C ATOM 1846 CE1 TYR A 125 78.887 -22.533 2.026 1.00 1.00 C ATOM 1847 CE2 TYR A 125 79.084 -22.004 -0.332 1.00 1.00 C ATOM 1848 CZ TYR A 125 79.676 -22.373 0.881 1.00 1.00 C ATOM 1849 OH TYR A 125 81.039 -22.577 0.949 1.00 1.00 O ATOM 0 H TYR A 125 73.294 -19.758 0.420 1.00 1.00 H new ATOM 0 HA TYR A 125 75.486 -20.359 2.299 1.00 1.00 H new ATOM 0 HB2 TYR A 125 74.894 -22.516 1.212 1.00 1.00 H new ATOM 0 HB3 TYR A 125 75.083 -21.773 -0.364 1.00 1.00 H new ATOM 0 HD1 TYR A 125 76.896 -22.451 2.841 1.00 1.00 H new ATOM 0 HD2 TYR A 125 77.245 -21.512 -1.338 1.00 1.00 H new ATOM 0 HE1 TYR A 125 79.345 -22.816 2.962 1.00 1.00 H new ATOM 0 HE2 TYR A 125 79.694 -21.879 -1.214 1.00 1.00 H new ATOM 0 HH TYR A 125 81.437 -22.426 0.066 1.00 1.00 H new ATOM 1859 N ARG A 126 76.956 -18.813 0.903 1.00 1.00 N ATOM 1860 CA ARG A 126 77.705 -17.771 0.202 1.00 1.00 C ATOM 1861 C ARG A 126 79.210 -18.001 0.381 1.00 1.00 C ATOM 1862 O ARG A 126 79.647 -18.501 1.418 1.00 1.00 O ATOM 1863 CB ARG A 126 77.330 -16.386 0.748 1.00 1.00 C ATOM 1864 CG ARG A 126 75.900 -15.994 0.323 1.00 1.00 C ATOM 1865 CD ARG A 126 75.818 -15.805 -1.201 1.00 1.00 C ATOM 1866 NE ARG A 126 77.052 -15.207 -1.705 1.00 1.00 N ATOM 1867 CZ ARG A 126 77.490 -15.444 -2.938 1.00 1.00 C ATOM 1868 NH1 ARG A 126 76.812 -16.221 -3.737 1.00 1.00 N ATOM 1869 NH2 ARG A 126 78.602 -14.897 -3.344 1.00 1.00 N ATOM 0 H ARG A 126 77.413 -19.158 1.747 1.00 1.00 H new ATOM 0 HA ARG A 126 77.454 -17.815 -0.858 1.00 1.00 H new ATOM 0 HB2 ARG A 126 77.403 -16.388 1.836 1.00 1.00 H new ATOM 0 HB3 ARG A 126 78.039 -15.643 0.383 1.00 1.00 H new ATOM 0 HG2 ARG A 126 75.198 -16.766 0.637 1.00 1.00 H new ATOM 0 HG3 ARG A 126 75.606 -15.072 0.825 1.00 1.00 H new ATOM 0 HD2 ARG A 126 75.648 -16.767 -1.685 1.00 1.00 H new ATOM 0 HD3 ARG A 126 74.969 -15.168 -1.450 1.00 1.00 H new ATOM 0 HE ARG A 126 77.591 -14.592 -1.096 1.00 1.00 H new ATOM 0 HH11 ARG A 126 75.943 -16.649 -3.417 1.00 1.00 H new ATOM 0 HH12 ARG A 126 77.151 -16.401 -4.682 1.00 1.00 H new ATOM 0 HH21 ARG A 126 79.131 -14.291 -2.717 1.00 1.00 H new ATOM 0 HH22 ARG A 126 78.943 -15.075 -4.289 1.00 1.00 H new ATOM 1883 N PHE A 127 79.994 -17.627 -0.633 1.00 1.00 N ATOM 1884 CA PHE A 127 81.455 -17.791 -0.580 1.00 1.00 C ATOM 1885 C PHE A 127 81.982 -17.512 0.826 1.00 1.00 C ATOM 1886 O PHE A 127 82.668 -18.368 1.361 1.00 1.00 O ATOM 1887 CB PHE A 127 82.126 -16.828 -1.563 1.00 1.00 C ATOM 1888 CG PHE A 127 83.575 -17.222 -1.769 1.00 1.00 C ATOM 1889 CD1 PHE A 127 84.538 -16.874 -0.813 1.00 1.00 C ATOM 1890 CD2 PHE A 127 83.957 -17.933 -2.917 1.00 1.00 C ATOM 1891 CE1 PHE A 127 85.879 -17.234 -1.003 1.00 1.00 C ATOM 1892 CE2 PHE A 127 85.298 -18.291 -3.106 1.00 1.00 C ATOM 1893 CZ PHE A 127 86.258 -17.943 -2.148 1.00 1.00 C ATOM 1894 OXT PHE A 127 81.690 -16.448 1.346 1.00 1.00 O ATOM 0 H PHE A 127 79.648 -17.211 -1.497 1.00 1.00 H new ATOM 0 HA PHE A 127 81.689 -18.821 -0.851 1.00 1.00 H new ATOM 0 HB2 PHE A 127 81.598 -16.842 -2.516 1.00 1.00 H new ATOM 0 HB3 PHE A 127 82.069 -15.808 -1.182 1.00 1.00 H new ATOM 0 HD1 PHE A 127 84.247 -16.327 0.072 1.00 1.00 H new ATOM 0 HD2 PHE A 127 83.217 -18.204 -3.655 1.00 1.00 H new ATOM 0 HE1 PHE A 127 86.620 -16.964 -0.265 1.00 1.00 H new ATOM 0 HE2 PHE A 127 85.592 -18.836 -3.991 1.00 1.00 H new ATOM 0 HZ PHE A 127 87.291 -18.222 -2.293 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 67.168 4.215 -10.160 1.00 1.00 O HETATM 1906 N1 MTN A 128 66.330 4.314 -9.214 1.00 1.00 N HETATM 1907 C1 MTN A 128 64.968 3.714 -9.259 1.00 1.00 C HETATM 1908 C2 MTN A 128 64.448 4.128 -7.930 1.00 1.00 C HETATM 1909 C3 MTN A 128 65.300 4.832 -7.212 1.00 1.00 C HETATM 1910 C4 MTN A 128 65.004 5.362 -5.832 1.00 1.00 C HETATM 1911 S1 MTN A 128 66.448 5.665 -4.779 1.00 1.00 S HETATM 1912 C5 MTN A 128 66.626 5.055 -7.938 1.00 1.00 C HETATM 1913 C6 MTN A 128 66.949 6.534 -8.128 1.00 1.00 C HETATM 1914 C7 MTN A 128 67.777 4.329 -7.218 1.00 1.00 C HETATM 1915 C8 MTN A 128 64.107 4.278 -10.387 1.00 1.00 C HETATM 1916 C9 MTN A 128 65.043 2.193 -9.344 1.00 1.00 C HETATM 0 H93 MTN A 128 65.581 1.905 -10.247 1.00 1.00 H new HETATM 0 H92 MTN A 128 65.567 1.805 -8.470 1.00 1.00 H new HETATM 0 H91 MTN A 128 64.035 1.780 -9.376 1.00 1.00 H new HETATM 0 H83 MTN A 128 63.991 5.354 -10.253 1.00 1.00 H new HETATM 0 H82 MTN A 128 64.588 4.081 -11.345 1.00 1.00 H new HETATM 0 H81 MTN A 128 63.126 3.803 -10.369 1.00 1.00 H new HETATM 0 H73 MTN A 128 67.479 3.304 -6.996 1.00 1.00 H new HETATM 0 H72 MTN A 128 68.659 4.319 -7.859 1.00 1.00 H new HETATM 0 H71 MTN A 128 68.010 4.849 -6.289 1.00 1.00 H new HETATM 0 H63 MTN A 128 67.827 6.636 -8.765 1.00 1.00 H new HETATM 0 H62 MTN A 128 66.101 7.034 -8.596 1.00 1.00 H new HETATM 0 H61 MTN A 128 67.149 6.990 -7.158 1.00 1.00 H new HETATM 0 H42 MTN A 128 64.449 6.295 -5.933 1.00 1.00 H new HETATM 0 H41 MTN A 128 64.349 4.654 -5.324 1.00 1.00 H new HETATM 0 H2 MTN A 128 63.448 3.872 -7.579 1.00 1.00 H new HETATM 1932 O1 MTN A 129 71.592 -10.296 -4.484 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.813 -9.332 -4.221 1.00 1.00 N HETATM 1934 C1 MTN A 129 70.099 -8.575 -5.268 1.00 1.00 C HETATM 1935 C2 MTN A 129 69.381 -7.593 -4.419 1.00 1.00 C HETATM 1936 C3 MTN A 129 69.610 -7.740 -3.119 1.00 1.00 C HETATM 1937 C4 MTN A 129 69.023 -6.885 -2.032 1.00 1.00 C HETATM 1938 S1 MTN A 129 70.245 -6.171 -0.900 1.00 1.00 S HETATM 1939 C5 MTN A 129 70.555 -8.884 -2.827 1.00 1.00 C HETATM 1940 C6 MTN A 129 71.804 -8.490 -2.033 1.00 1.00 C HETATM 1941 C7 MTN A 129 69.783 -10.001 -2.120 1.00 1.00 C HETATM 1942 C8 MTN A 129 71.029 -7.906 -6.277 1.00 1.00 C HETATM 1943 C9 MTN A 129 69.109 -9.492 -5.968 1.00 1.00 C HETATM 0 H93 MTN A 129 69.644 -10.326 -6.423 1.00 1.00 H new HETATM 0 H92 MTN A 129 68.391 -9.874 -5.242 1.00 1.00 H new HETATM 0 H91 MTN A 129 68.581 -8.934 -6.742 1.00 1.00 H new HETATM 0 H83 MTN A 129 71.685 -7.206 -5.759 1.00 1.00 H new HETATM 0 H82 MTN A 129 71.630 -8.665 -6.777 1.00 1.00 H new HETATM 0 H81 MTN A 129 70.436 -7.368 -7.017 1.00 1.00 H new HETATM 0 H73 MTN A 129 68.843 -10.181 -2.642 1.00 1.00 H new HETATM 0 H72 MTN A 129 70.379 -10.913 -2.122 1.00 1.00 H new HETATM 0 H71 MTN A 129 69.576 -9.706 -1.091 1.00 1.00 H new HETATM 0 H63 MTN A 129 72.478 -9.344 -1.967 1.00 1.00 H new HETATM 0 H62 MTN A 129 72.311 -7.667 -2.537 1.00 1.00 H new HETATM 0 H61 MTN A 129 71.514 -8.178 -1.030 1.00 1.00 H new HETATM 0 H42 MTN A 129 68.454 -6.076 -2.490 1.00 1.00 H new HETATM 0 H41 MTN A 129 68.318 -7.484 -1.456 1.00 1.00 H new HETATM 0 H2 MTN A 129 68.726 -6.822 -4.825 1.00 1.00 H new HETATM 1959 O1 MTN A 130 81.728 -10.925 5.939 1.00 1.00 O HETATM 1960 N1 MTN A 130 81.198 -9.778 6.034 1.00 1.00 N HETATM 1961 C1 MTN A 130 80.830 -9.168 7.331 1.00 1.00 C HETATM 1962 C2 MTN A 130 80.279 -7.878 6.852 1.00 1.00 C HETATM 1963 C3 MTN A 130 80.304 -7.743 5.538 1.00 1.00 C HETATM 1964 C4 MTN A 130 79.793 -6.556 4.795 1.00 1.00 C HETATM 1965 S1 MTN A 130 80.278 -4.980 5.520 1.00 1.00 S HETATM 1966 C5 MTN A 130 80.898 -8.943 4.841 1.00 1.00 C HETATM 1967 C6 MTN A 130 79.951 -9.578 3.833 1.00 1.00 C HETATM 1968 C7 MTN A 130 82.223 -8.567 4.179 1.00 1.00 C HETATM 1969 C8 MTN A 130 79.782 -9.969 8.103 1.00 1.00 C HETATM 1970 C9 MTN A 130 82.077 -8.953 8.166 1.00 1.00 C HETATM 0 H93 MTN A 130 82.566 -9.911 8.343 1.00 1.00 H new HETATM 0 H92 MTN A 130 82.760 -8.290 7.636 1.00 1.00 H new HETATM 0 H91 MTN A 130 81.803 -8.504 9.120 1.00 1.00 H new HETATM 0 H83 MTN A 130 78.872 -10.046 7.508 1.00 1.00 H new HETATM 0 H82 MTN A 130 80.167 -10.968 8.309 1.00 1.00 H new HETATM 0 H81 MTN A 130 79.559 -9.465 9.043 1.00 1.00 H new HETATM 0 H73 MTN A 130 82.836 -8.007 4.885 1.00 1.00 H new HETATM 0 H72 MTN A 130 82.750 -9.473 3.880 1.00 1.00 H new HETATM 0 H71 MTN A 130 82.029 -7.953 3.300 1.00 1.00 H new HETATM 0 H63 MTN A 130 80.384 -10.507 3.462 1.00 1.00 H new HETATM 0 H62 MTN A 130 78.996 -9.789 4.314 1.00 1.00 H new HETATM 0 H61 MTN A 130 79.794 -8.893 3.000 1.00 1.00 H new HETATM 0 H42 MTN A 130 80.154 -6.599 3.768 1.00 1.00 H new HETATM 0 H41 MTN A 130 78.705 -6.606 4.753 1.00 1.00 H new HETATM 0 H2 MTN A 130 79.889 -7.112 7.522 1.00 1.00 H new