USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 753 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 MET CE :methyl -107:sc= -2.58 (180deg=-4.68!) USER MOD Set 1.2: A 70 SER OG : rot -83:sc= 0.833 USER MOD Single : A 1 MET CE :methyl -170:sc= 0 (180deg=-0.115) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0197 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot 70:sc= 0.0695 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 180:sc= 0 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -158:sc= 0.23 (180deg=-1.45!) USER MOD Single : A 23 HIS : no HD1:sc= -4.24! C(o=-4.2!,f=-5.7!) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -4.81! K(o=-4.8!,f=-1.6) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot -71:sc= 1.15 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 HIS : no HD1:sc= -7.11! C(o=-7.1!,f=-15!) USER MOD Single : A 66 ASN : amide:sc= -0.956 K(o=-0.96,f=-0.15) USER MOD Single : A 68 ASN : amide:sc= -1.97! C(o=-2!,f=-4.1!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.181 X(o=-0.18,f=-0.23) USER MOD Single : A 83 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0034) USER MOD Single : A 85 MET CE :methyl -121:sc= -0.053 (180deg=-1.42!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 52:sc= 0.999 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 -33.955 -19.912 17.534 1.00 0.00 N ATOM 2 CA GLY A -6 -33.366 -19.919 16.208 1.00 0.00 C ATOM 3 C GLY A -6 -32.553 -18.671 15.928 1.00 0.00 C ATOM 4 O GLY A -6 -33.109 -17.609 15.648 1.00 0.00 O ATOM 0 H1 GLY A -6 -34.500 -20.786 17.676 1.00 0.00 H new ATOM 0 H2 GLY A -6 -33.201 -19.854 18.248 1.00 0.00 H new ATOM 0 H3 GLY A -6 -34.586 -19.091 17.629 1.00 0.00 H new ATOM 0 HA2 GLY A -6 -32.728 -20.796 16.102 1.00 0.00 H new ATOM 0 HA3 GLY A -6 -34.157 -20.008 15.463 1.00 0.00 H new ATOM 8 N SER A -5 -31.232 -18.798 16.004 1.00 0.00 N ATOM 9 CA SER A -5 -30.340 -17.670 15.762 1.00 0.00 C ATOM 10 C SER A -5 -30.296 -17.321 14.278 1.00 0.00 C ATOM 11 O SER A -5 -30.411 -18.196 13.420 1.00 0.00 O ATOM 12 CB SER A -5 -28.931 -17.990 16.265 1.00 0.00 C ATOM 13 OG SER A -5 -28.939 -18.291 17.650 1.00 0.00 O ATOM 0 H SER A -5 -30.756 -19.671 16.231 1.00 0.00 H new ATOM 0 HA SER A -5 -30.726 -16.809 16.308 1.00 0.00 H new ATOM 0 HB2 SER A -5 -28.526 -18.835 15.708 1.00 0.00 H new ATOM 0 HB3 SER A -5 -28.273 -17.141 16.078 1.00 0.00 H new ATOM 0 HG SER A -5 -28.027 -18.493 17.946 1.00 0.00 H new ATOM 19 N SER A -4 -30.128 -16.036 13.983 1.00 0.00 N ATOM 20 CA SER A -4 -30.072 -15.569 12.603 1.00 0.00 C ATOM 21 C SER A -4 -28.811 -14.745 12.359 1.00 0.00 C ATOM 22 O SER A -4 -28.131 -14.917 11.348 1.00 0.00 O ATOM 23 CB SER A -4 -31.312 -14.735 12.274 1.00 0.00 C ATOM 24 OG SER A -4 -31.349 -14.397 10.898 1.00 0.00 O ATOM 0 H SER A -4 -30.028 -15.300 14.682 1.00 0.00 H new ATOM 0 HA SER A -4 -30.046 -16.442 11.951 1.00 0.00 H new ATOM 0 HB2 SER A -4 -32.210 -15.293 12.539 1.00 0.00 H new ATOM 0 HB3 SER A -4 -31.313 -13.826 12.875 1.00 0.00 H new ATOM 0 HG SER A -4 -32.151 -13.866 10.713 1.00 0.00 H new ATOM 30 N GLY A -3 -28.507 -13.850 13.293 1.00 0.00 N ATOM 31 CA GLY A -3 -27.329 -13.012 13.161 1.00 0.00 C ATOM 32 C GLY A -3 -27.670 -11.536 13.116 1.00 0.00 C ATOM 33 O GLY A -3 -28.461 -11.100 12.279 1.00 0.00 O ATOM 0 H GLY A -3 -29.055 -13.690 14.138 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -26.657 -13.201 13.998 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -26.792 -13.286 12.253 1.00 0.00 H new ATOM 37 N SER A -2 -27.073 -10.764 14.019 1.00 0.00 N ATOM 38 CA SER A -2 -27.322 -9.329 14.082 1.00 0.00 C ATOM 39 C SER A -2 -26.832 -8.636 12.814 1.00 0.00 C ATOM 40 O SER A -2 -25.689 -8.186 12.741 1.00 0.00 O ATOM 41 CB SER A -2 -26.632 -8.723 15.306 1.00 0.00 C ATOM 42 OG SER A -2 -27.286 -7.539 15.727 1.00 0.00 O ATOM 0 H SER A -2 -26.414 -11.109 14.717 1.00 0.00 H new ATOM 0 HA SER A -2 -28.398 -9.176 14.167 1.00 0.00 H new ATOM 0 HB2 SER A -2 -26.626 -9.448 16.120 1.00 0.00 H new ATOM 0 HB3 SER A -2 -25.591 -8.502 15.068 1.00 0.00 H new ATOM 0 HG SER A -2 -26.827 -7.173 16.511 1.00 0.00 H new ATOM 48 N SER A -1 -27.706 -8.555 11.816 1.00 0.00 N ATOM 49 CA SER A -1 -27.363 -7.921 10.548 1.00 0.00 C ATOM 50 C SER A -1 -28.173 -6.645 10.343 1.00 0.00 C ATOM 51 O SER A -1 -29.351 -6.693 9.990 1.00 0.00 O ATOM 52 CB SER A -1 -27.609 -8.887 9.388 1.00 0.00 C ATOM 53 OG SER A -1 -26.966 -10.130 9.613 1.00 0.00 O ATOM 0 H SER A -1 -28.657 -8.921 11.861 1.00 0.00 H new ATOM 0 HA SER A -1 -26.305 -7.659 10.575 1.00 0.00 H new ATOM 0 HB2 SER A -1 -28.680 -9.046 9.264 1.00 0.00 H new ATOM 0 HB3 SER A -1 -27.242 -8.447 8.461 1.00 0.00 H new ATOM 0 HG SER A -1 -27.418 -10.605 10.341 1.00 0.00 H new ATOM 59 N GLY A 0 -27.532 -5.502 10.566 1.00 0.00 N ATOM 60 CA GLY A 0 -28.206 -4.228 10.401 1.00 0.00 C ATOM 61 C GLY A 0 -27.955 -3.283 11.560 1.00 0.00 C ATOM 62 O GLY A 0 -28.399 -3.533 12.680 1.00 0.00 O ATOM 0 H GLY A 0 -26.557 -5.436 10.858 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -27.870 -3.760 9.476 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -29.278 -4.398 10.301 1.00 0.00 H new ATOM 66 N MET A 1 -27.239 -2.197 11.291 1.00 0.00 N ATOM 67 CA MET A 1 -26.929 -1.212 12.321 1.00 0.00 C ATOM 68 C MET A 1 -26.289 0.031 11.711 1.00 0.00 C ATOM 69 O MET A 1 -25.611 -0.048 10.687 1.00 0.00 O ATOM 70 CB MET A 1 -25.995 -1.818 13.371 1.00 0.00 C ATOM 71 CG MET A 1 -25.972 -1.047 14.681 1.00 0.00 C ATOM 72 SD MET A 1 -27.482 -1.266 15.642 1.00 0.00 S ATOM 73 CE MET A 1 -27.990 0.437 15.867 1.00 0.00 C ATOM 0 H MET A 1 -26.862 -1.976 10.369 1.00 0.00 H new ATOM 0 HA MET A 1 -27.863 -0.919 12.801 1.00 0.00 H new ATOM 0 HB2 MET A 1 -26.302 -2.845 13.569 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.984 -1.860 12.966 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.118 -1.372 15.275 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.830 0.013 14.472 1.00 0.00 H new ATOM 0 HE1 MET A 1 -28.806 0.481 16.588 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.148 1.022 16.236 1.00 0.00 H new ATOM 0 HE3 MET A 1 -28.326 0.845 14.914 1.00 0.00 H new ATOM 83 N ALA A 2 -26.511 1.177 12.346 1.00 0.00 N ATOM 84 CA ALA A 2 -25.954 2.436 11.866 1.00 0.00 C ATOM 85 C ALA A 2 -24.430 2.395 11.857 1.00 0.00 C ATOM 86 O ALA A 2 -23.786 2.630 12.880 1.00 0.00 O ATOM 87 CB ALA A 2 -26.448 3.592 12.722 1.00 0.00 C ATOM 0 H ALA A 2 -27.072 1.260 13.194 1.00 0.00 H new ATOM 0 HA ALA A 2 -26.293 2.587 10.841 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -26.024 4.526 12.352 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -27.536 3.643 12.673 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -26.139 3.437 13.756 1.00 0.00 H new ATOM 93 N THR A 3 -23.857 2.093 10.696 1.00 0.00 N ATOM 94 CA THR A 3 -22.408 2.019 10.555 1.00 0.00 C ATOM 95 C THR A 3 -21.997 2.028 9.087 1.00 0.00 C ATOM 96 O THR A 3 -22.608 1.354 8.257 1.00 0.00 O ATOM 97 CB THR A 3 -21.842 0.754 11.228 1.00 0.00 C ATOM 98 OG1 THR A 3 -20.417 0.848 11.327 1.00 0.00 O ATOM 99 CG2 THR A 3 -22.221 -0.492 10.442 1.00 0.00 C ATOM 0 H THR A 3 -24.375 1.896 9.840 1.00 0.00 H new ATOM 0 HA THR A 3 -21.997 2.899 11.049 1.00 0.00 H new ATOM 0 HB THR A 3 -22.270 0.678 12.227 1.00 0.00 H new ATOM 0 HG1 THR A 3 -20.065 0.041 11.757 1.00 0.00 H new ATOM 0 HG21 THR A 3 -21.810 -1.373 10.936 1.00 0.00 H new ATOM 0 HG22 THR A 3 -23.307 -0.576 10.394 1.00 0.00 H new ATOM 0 HG23 THR A 3 -21.818 -0.422 9.432 1.00 0.00 H new ATOM 107 N THR A 4 -20.957 2.793 8.773 1.00 0.00 N ATOM 108 CA THR A 4 -20.465 2.889 7.405 1.00 0.00 C ATOM 109 C THR A 4 -19.806 1.587 6.964 1.00 0.00 C ATOM 110 O THR A 4 -18.587 1.516 6.810 1.00 0.00 O ATOM 111 CB THR A 4 -19.452 4.040 7.251 1.00 0.00 C ATOM 112 OG1 THR A 4 -19.749 5.082 8.188 1.00 0.00 O ATOM 113 CG2 THR A 4 -19.480 4.600 5.837 1.00 0.00 C ATOM 0 H THR A 4 -20.439 3.355 9.448 1.00 0.00 H new ATOM 0 HA THR A 4 -21.330 3.088 6.773 1.00 0.00 H new ATOM 0 HB THR A 4 -18.455 3.646 7.449 1.00 0.00 H new ATOM 0 HG1 THR A 4 -19.100 5.809 8.085 1.00 0.00 H new ATOM 0 HG21 THR A 4 -18.757 5.411 5.753 1.00 0.00 H new ATOM 0 HG22 THR A 4 -19.226 3.812 5.128 1.00 0.00 H new ATOM 0 HG23 THR A 4 -20.478 4.979 5.615 1.00 0.00 H new ATOM 121 N LYS A 5 -20.621 0.556 6.763 1.00 0.00 N ATOM 122 CA LYS A 5 -20.118 -0.745 6.339 1.00 0.00 C ATOM 123 C LYS A 5 -19.822 -0.752 4.842 1.00 0.00 C ATOM 124 O LYS A 5 -20.237 -1.660 4.122 1.00 0.00 O ATOM 125 CB LYS A 5 -21.133 -1.840 6.673 1.00 0.00 C ATOM 126 CG LYS A 5 -20.568 -3.246 6.566 1.00 0.00 C ATOM 127 CD LYS A 5 -21.596 -4.292 6.965 1.00 0.00 C ATOM 128 CE LYS A 5 -20.930 -5.565 7.466 1.00 0.00 C ATOM 129 NZ LYS A 5 -21.926 -6.551 7.968 1.00 0.00 N ATOM 0 H LYS A 5 -21.633 0.597 6.887 1.00 0.00 H new ATOM 0 HA LYS A 5 -19.190 -0.941 6.876 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -21.504 -1.683 7.686 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -21.987 -1.749 6.002 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -20.239 -3.430 5.543 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -19.689 -3.336 7.205 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -22.244 -3.889 7.743 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -22.231 -4.524 6.110 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -20.350 -6.013 6.659 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -20.229 -5.319 8.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -21.433 -7.404 8.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -22.462 -6.133 8.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -22.580 -6.806 7.200 1.00 0.00 H new ATOM 143 N ARG A 6 -19.101 0.266 4.382 1.00 0.00 N ATOM 144 CA ARG A 6 -18.749 0.376 2.971 1.00 0.00 C ATOM 145 C ARG A 6 -17.237 0.482 2.795 1.00 0.00 C ATOM 146 O ARG A 6 -16.688 0.051 1.781 1.00 0.00 O ATOM 147 CB ARG A 6 -19.433 1.594 2.347 1.00 0.00 C ATOM 148 CG ARG A 6 -20.946 1.584 2.493 1.00 0.00 C ATOM 149 CD ARG A 6 -21.387 2.282 3.770 1.00 0.00 C ATOM 150 NE ARG A 6 -21.610 3.710 3.564 1.00 0.00 N ATOM 151 CZ ARG A 6 -22.648 4.203 2.897 1.00 0.00 C ATOM 152 NH1 ARG A 6 -23.552 3.387 2.374 1.00 0.00 N ATOM 153 NH2 ARG A 6 -22.782 5.515 2.752 1.00 0.00 N ATOM 0 H ARG A 6 -18.750 1.025 4.965 1.00 0.00 H new ATOM 0 HA ARG A 6 -19.094 -0.525 2.464 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -19.038 2.499 2.809 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -19.179 1.640 1.288 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -21.399 2.077 1.633 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -21.305 0.555 2.497 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -22.304 1.821 4.137 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -20.629 2.141 4.541 1.00 0.00 H new ATOM 0 HE ARG A 6 -20.932 4.365 3.953 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -23.452 2.378 2.483 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -24.348 3.768 1.862 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -22.088 6.146 3.153 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -23.579 5.893 2.240 1.00 0.00 H new ATOM 167 N VAL A 7 -16.570 1.060 3.789 1.00 0.00 N ATOM 168 CA VAL A 7 -15.121 1.222 3.744 1.00 0.00 C ATOM 169 C VAL A 7 -14.422 0.148 4.569 1.00 0.00 C ATOM 170 O VAL A 7 -14.700 -0.017 5.758 1.00 0.00 O ATOM 171 CB VAL A 7 -14.696 2.609 4.262 1.00 0.00 C ATOM 172 CG1 VAL A 7 -13.188 2.780 4.154 1.00 0.00 C ATOM 173 CG2 VAL A 7 -15.421 3.708 3.499 1.00 0.00 C ATOM 0 H VAL A 7 -17.009 1.424 4.635 1.00 0.00 H new ATOM 0 HA VAL A 7 -14.824 1.125 2.700 1.00 0.00 H new ATOM 0 HB VAL A 7 -14.972 2.685 5.314 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -12.906 3.766 4.524 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -12.691 2.013 4.749 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.885 2.684 3.111 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -15.109 4.681 3.878 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -15.178 3.636 2.439 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -16.497 3.595 3.633 1.00 0.00 H new ATOM 183 N LEU A 8 -13.512 -0.581 3.932 1.00 0.00 N ATOM 184 CA LEU A 8 -12.771 -1.641 4.607 1.00 0.00 C ATOM 185 C LEU A 8 -11.336 -1.207 4.889 1.00 0.00 C ATOM 186 O LEU A 8 -10.662 -0.654 4.020 1.00 0.00 O ATOM 187 CB LEU A 8 -12.773 -2.913 3.757 1.00 0.00 C ATOM 188 CG LEU A 8 -14.130 -3.343 3.197 1.00 0.00 C ATOM 189 CD1 LEU A 8 -13.993 -4.631 2.399 1.00 0.00 C ATOM 190 CD2 LEU A 8 -15.140 -3.515 4.322 1.00 0.00 C ATOM 0 H LEU A 8 -13.270 -0.457 2.949 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.263 -1.846 5.558 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.087 -2.770 2.922 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.376 -3.730 4.360 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.491 -2.562 2.528 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.968 -4.922 2.008 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.302 -4.474 1.571 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -13.611 -5.421 3.046 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -16.100 -3.821 3.906 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -14.786 -4.277 5.016 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.259 -2.570 4.852 1.00 0.00 H new ATOM 202 N TYR A 9 -10.875 -1.464 6.108 1.00 0.00 N ATOM 203 CA TYR A 9 -9.521 -1.100 6.506 1.00 0.00 C ATOM 204 C TYR A 9 -8.554 -2.256 6.269 1.00 0.00 C ATOM 205 O TYR A 9 -8.830 -3.397 6.640 1.00 0.00 O ATOM 206 CB TYR A 9 -9.491 -0.689 7.979 1.00 0.00 C ATOM 207 CG TYR A 9 -8.178 -0.988 8.665 1.00 0.00 C ATOM 208 CD1 TYR A 9 -7.877 -2.272 9.104 1.00 0.00 C ATOM 209 CD2 TYR A 9 -7.237 0.013 8.873 1.00 0.00 C ATOM 210 CE1 TYR A 9 -6.678 -2.549 9.732 1.00 0.00 C ATOM 211 CE2 TYR A 9 -6.035 -0.256 9.499 1.00 0.00 C ATOM 212 CZ TYR A 9 -5.760 -1.538 9.927 1.00 0.00 C ATOM 213 OH TYR A 9 -4.565 -1.811 10.551 1.00 0.00 O ATOM 0 H TYR A 9 -11.420 -1.923 6.838 1.00 0.00 H new ATOM 0 HA TYR A 9 -9.206 -0.255 5.894 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -9.695 0.379 8.054 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -10.293 -1.204 8.508 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -8.592 -3.067 8.952 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -7.449 1.018 8.540 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -6.461 -3.552 10.069 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -5.314 0.534 9.652 1.00 0.00 H new ATOM 0 HH TYR A 9 -4.031 -0.991 10.609 1.00 0.00 H new ATOM 223 N VAL A 10 -7.418 -1.953 5.649 1.00 0.00 N ATOM 224 CA VAL A 10 -6.409 -2.965 5.363 1.00 0.00 C ATOM 225 C VAL A 10 -5.106 -2.664 6.096 1.00 0.00 C ATOM 226 O VAL A 10 -4.634 -1.528 6.102 1.00 0.00 O ATOM 227 CB VAL A 10 -6.125 -3.064 3.853 1.00 0.00 C ATOM 228 CG1 VAL A 10 -5.277 -4.289 3.548 1.00 0.00 C ATOM 229 CG2 VAL A 10 -7.427 -3.098 3.067 1.00 0.00 C ATOM 0 H VAL A 10 -7.174 -1.014 5.335 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.808 -3.917 5.713 1.00 0.00 H new ATOM 0 HB VAL A 10 -5.566 -2.180 3.548 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -5.087 -4.342 2.476 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.329 -4.218 4.082 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.806 -5.187 3.867 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.207 -3.168 2.002 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -8.015 -3.963 3.374 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -7.993 -2.187 3.261 1.00 0.00 H new ATOM 239 N GLY A 11 -4.529 -3.691 6.713 1.00 0.00 N ATOM 240 CA GLY A 11 -3.286 -3.515 7.440 1.00 0.00 C ATOM 241 C GLY A 11 -2.301 -4.639 7.184 1.00 0.00 C ATOM 242 O GLY A 11 -2.657 -5.667 6.610 1.00 0.00 O ATOM 0 H GLY A 11 -4.900 -4.641 6.722 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -2.832 -2.566 7.154 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -3.498 -3.458 8.508 1.00 0.00 H new ATOM 246 N GLY A 12 -1.056 -4.442 7.608 1.00 0.00 N ATOM 247 CA GLY A 12 -0.036 -5.454 7.411 1.00 0.00 C ATOM 248 C GLY A 12 0.404 -5.559 5.964 1.00 0.00 C ATOM 249 O GLY A 12 0.880 -6.607 5.526 1.00 0.00 O ATOM 0 H GLY A 12 -0.736 -3.599 8.085 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.827 -5.221 8.034 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.418 -6.420 7.743 1.00 0.00 H new ATOM 253 N LEU A 13 0.244 -4.471 5.218 1.00 0.00 N ATOM 254 CA LEU A 13 0.627 -4.445 3.811 1.00 0.00 C ATOM 255 C LEU A 13 2.144 -4.417 3.660 1.00 0.00 C ATOM 256 O LEU A 13 2.876 -4.370 4.648 1.00 0.00 O ATOM 257 CB LEU A 13 0.011 -3.229 3.117 1.00 0.00 C ATOM 258 CG LEU A 13 -1.517 -3.187 3.066 1.00 0.00 C ATOM 259 CD1 LEU A 13 -1.999 -1.809 2.641 1.00 0.00 C ATOM 260 CD2 LEU A 13 -2.049 -4.255 2.122 1.00 0.00 C ATOM 0 H LEU A 13 -0.148 -3.595 5.564 1.00 0.00 H new ATOM 0 HA LEU A 13 0.251 -5.353 3.341 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.362 -2.330 3.624 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.390 -3.188 2.096 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.900 -3.391 4.066 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.089 -1.798 2.610 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.649 -1.065 3.356 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.606 -1.575 1.652 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.138 -4.210 2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.657 -4.083 1.120 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.734 -5.238 2.471 1.00 0.00 H new ATOM 272 N ALA A 14 2.611 -4.445 2.415 1.00 0.00 N ATOM 273 CA ALA A 14 4.041 -4.418 2.135 1.00 0.00 C ATOM 274 C ALA A 14 4.489 -3.028 1.698 1.00 0.00 C ATOM 275 O ALA A 14 3.704 -2.080 1.715 1.00 0.00 O ATOM 276 CB ALA A 14 4.388 -5.446 1.068 1.00 0.00 C ATOM 0 H ALA A 14 2.019 -4.486 1.585 1.00 0.00 H new ATOM 0 HA ALA A 14 4.571 -4.669 3.054 1.00 0.00 H new ATOM 0 HB1 ALA A 14 5.459 -5.416 0.868 1.00 0.00 H new ATOM 0 HB2 ALA A 14 4.112 -6.441 1.418 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.842 -5.219 0.153 1.00 0.00 H new ATOM 282 N GLU A 15 5.755 -2.913 1.310 1.00 0.00 N ATOM 283 CA GLU A 15 6.306 -1.637 0.871 1.00 0.00 C ATOM 284 C GLU A 15 6.012 -1.396 -0.607 1.00 0.00 C ATOM 285 O GLU A 15 6.042 -0.260 -1.079 1.00 0.00 O ATOM 286 CB GLU A 15 7.817 -1.598 1.114 1.00 0.00 C ATOM 287 CG GLU A 15 8.583 -0.818 0.059 1.00 0.00 C ATOM 288 CD GLU A 15 10.016 -0.538 0.467 1.00 0.00 C ATOM 289 OE1 GLU A 15 10.709 -1.489 0.887 1.00 0.00 O ATOM 290 OE2 GLU A 15 10.445 0.630 0.367 1.00 0.00 O ATOM 0 H GLU A 15 6.418 -3.688 1.291 1.00 0.00 H new ATOM 0 HA GLU A 15 5.831 -0.847 1.452 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.008 -1.155 2.091 1.00 0.00 H new ATOM 0 HB3 GLU A 15 8.198 -2.619 1.147 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.578 -1.378 -0.876 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.072 0.126 -0.132 1.00 0.00 H new ATOM 297 N GLU A 16 5.727 -2.474 -1.331 1.00 0.00 N ATOM 298 CA GLU A 16 5.429 -2.380 -2.755 1.00 0.00 C ATOM 299 C GLU A 16 3.925 -2.461 -3.002 1.00 0.00 C ATOM 300 O GLU A 16 3.482 -2.863 -4.079 1.00 0.00 O ATOM 301 CB GLU A 16 6.144 -3.494 -3.523 1.00 0.00 C ATOM 302 CG GLU A 16 6.517 -3.110 -4.945 1.00 0.00 C ATOM 303 CD GLU A 16 7.640 -2.093 -4.999 1.00 0.00 C ATOM 304 OE1 GLU A 16 8.626 -2.258 -4.250 1.00 0.00 O ATOM 305 OE2 GLU A 16 7.534 -1.132 -5.789 1.00 0.00 O ATOM 0 H GLU A 16 5.696 -3.422 -0.955 1.00 0.00 H new ATOM 0 HA GLU A 16 5.787 -1.415 -3.112 1.00 0.00 H new ATOM 0 HB2 GLU A 16 7.048 -3.774 -2.982 1.00 0.00 H new ATOM 0 HB3 GLU A 16 5.503 -4.375 -3.550 1.00 0.00 H new ATOM 0 HG2 GLU A 16 6.815 -4.004 -5.493 1.00 0.00 H new ATOM 0 HG3 GLU A 16 5.640 -2.705 -5.450 1.00 0.00 H new ATOM 312 N VAL A 17 3.145 -2.078 -1.997 1.00 0.00 N ATOM 313 CA VAL A 17 1.691 -2.106 -2.104 1.00 0.00 C ATOM 314 C VAL A 17 1.100 -0.710 -1.939 1.00 0.00 C ATOM 315 O VAL A 17 1.396 -0.011 -0.969 1.00 0.00 O ATOM 316 CB VAL A 17 1.068 -3.043 -1.052 1.00 0.00 C ATOM 317 CG1 VAL A 17 -0.448 -3.039 -1.164 1.00 0.00 C ATOM 318 CG2 VAL A 17 1.619 -4.453 -1.203 1.00 0.00 C ATOM 0 H VAL A 17 3.495 -1.744 -1.099 1.00 0.00 H new ATOM 0 HA VAL A 17 1.455 -2.482 -3.100 1.00 0.00 H new ATOM 0 HB VAL A 17 1.335 -2.677 -0.061 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.870 -3.707 -0.413 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -0.822 -2.028 -1.002 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.740 -3.379 -2.157 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.168 -5.102 -0.452 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.384 -4.831 -2.198 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.700 -4.438 -1.067 1.00 0.00 H new ATOM 328 N ASP A 18 0.265 -0.310 -2.891 1.00 0.00 N ATOM 329 CA ASP A 18 -0.370 1.002 -2.850 1.00 0.00 C ATOM 330 C ASP A 18 -1.762 0.952 -3.470 1.00 0.00 C ATOM 331 O ASP A 18 -2.213 -0.099 -3.926 1.00 0.00 O ATOM 332 CB ASP A 18 0.492 2.031 -3.583 1.00 0.00 C ATOM 333 CG ASP A 18 1.221 1.435 -4.771 1.00 0.00 C ATOM 334 OD1 ASP A 18 1.879 0.387 -4.599 1.00 0.00 O ATOM 335 OD2 ASP A 18 1.134 2.016 -5.873 1.00 0.00 O ATOM 0 H ASP A 18 0.012 -0.876 -3.701 1.00 0.00 H new ATOM 0 HA ASP A 18 -0.468 1.299 -1.806 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -0.138 2.853 -3.922 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.219 2.452 -2.889 1.00 0.00 H new ATOM 340 N ASP A 19 -2.440 2.095 -3.483 1.00 0.00 N ATOM 341 CA ASP A 19 -3.782 2.181 -4.047 1.00 0.00 C ATOM 342 C ASP A 19 -3.898 1.328 -5.307 1.00 0.00 C ATOM 343 O ASP A 19 -4.926 0.694 -5.548 1.00 0.00 O ATOM 344 CB ASP A 19 -4.131 3.636 -4.368 1.00 0.00 C ATOM 345 CG ASP A 19 -3.164 4.259 -5.355 1.00 0.00 C ATOM 346 OD1 ASP A 19 -3.197 3.873 -6.542 1.00 0.00 O ATOM 347 OD2 ASP A 19 -2.372 5.132 -4.941 1.00 0.00 O ATOM 0 H ASP A 19 -2.082 2.974 -3.110 1.00 0.00 H new ATOM 0 HA ASP A 19 -4.486 1.801 -3.306 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -5.141 3.683 -4.775 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -4.131 4.218 -3.447 1.00 0.00 H new ATOM 352 N LYS A 20 -2.838 1.318 -6.108 1.00 0.00 N ATOM 353 CA LYS A 20 -2.820 0.543 -7.343 1.00 0.00 C ATOM 354 C LYS A 20 -2.904 -0.951 -7.049 1.00 0.00 C ATOM 355 O LYS A 20 -3.724 -1.663 -7.629 1.00 0.00 O ATOM 356 CB LYS A 20 -1.550 0.846 -8.141 1.00 0.00 C ATOM 357 CG LYS A 20 -0.311 0.156 -7.597 1.00 0.00 C ATOM 358 CD LYS A 20 0.941 0.590 -8.342 1.00 0.00 C ATOM 359 CE LYS A 20 2.110 -0.341 -8.056 1.00 0.00 C ATOM 360 NZ LYS A 20 2.898 0.105 -6.874 1.00 0.00 N ATOM 0 H LYS A 20 -1.980 1.838 -5.924 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.690 0.828 -7.934 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -1.700 0.541 -9.177 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.383 1.923 -8.147 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -0.202 0.384 -6.537 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -0.429 -0.924 -7.680 1.00 0.00 H new ATOM 0 HD2 LYS A 20 0.741 0.606 -9.413 1.00 0.00 H new ATOM 0 HD3 LYS A 20 1.205 1.607 -8.051 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.737 -1.350 -7.884 1.00 0.00 H new ATOM 0 HE3 LYS A 20 2.760 -0.387 -8.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 3.856 -0.298 -6.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.959 1.143 -6.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 2.431 -0.219 -6.003 1.00 0.00 H new ATOM 374 N VAL A 21 -2.051 -1.421 -6.144 1.00 0.00 N ATOM 375 CA VAL A 21 -2.030 -2.830 -5.771 1.00 0.00 C ATOM 376 C VAL A 21 -3.314 -3.227 -5.053 1.00 0.00 C ATOM 377 O VAL A 21 -3.916 -4.258 -5.357 1.00 0.00 O ATOM 378 CB VAL A 21 -0.827 -3.153 -4.865 1.00 0.00 C ATOM 379 CG1 VAL A 21 -0.824 -4.627 -4.487 1.00 0.00 C ATOM 380 CG2 VAL A 21 0.475 -2.768 -5.551 1.00 0.00 C ATOM 0 H VAL A 21 -1.365 -0.846 -5.655 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.943 -3.401 -6.695 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.916 -2.568 -3.950 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.033 -4.837 -3.847 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.743 -4.868 -3.953 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.759 -5.234 -5.390 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.314 -3.003 -4.897 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.574 -3.325 -6.483 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.471 -1.699 -5.766 1.00 0.00 H new ATOM 390 N LEU A 22 -3.731 -2.403 -4.098 1.00 0.00 N ATOM 391 CA LEU A 22 -4.946 -2.667 -3.335 1.00 0.00 C ATOM 392 C LEU A 22 -6.180 -2.574 -4.227 1.00 0.00 C ATOM 393 O LEU A 22 -7.163 -3.286 -4.021 1.00 0.00 O ATOM 394 CB LEU A 22 -5.066 -1.680 -2.172 1.00 0.00 C ATOM 395 CG LEU A 22 -4.193 -1.971 -0.952 1.00 0.00 C ATOM 396 CD1 LEU A 22 -4.329 -0.861 0.079 1.00 0.00 C ATOM 397 CD2 LEU A 22 -4.560 -3.316 -0.341 1.00 0.00 C ATOM 0 H LEU A 22 -3.245 -1.546 -3.833 1.00 0.00 H new ATOM 0 HA LEU A 22 -4.884 -3.680 -2.938 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.820 -0.684 -2.540 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.107 -1.653 -1.851 1.00 0.00 H new ATOM 0 HG LEU A 22 -3.153 -2.013 -1.276 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.700 -1.086 0.941 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -4.016 0.085 -0.362 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.369 -0.786 0.398 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.928 -3.506 0.526 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.605 -3.302 -0.032 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -4.410 -4.104 -1.079 1.00 0.00 H new ATOM 409 N HIS A 23 -6.121 -1.691 -5.219 1.00 0.00 N ATOM 410 CA HIS A 23 -7.233 -1.507 -6.145 1.00 0.00 C ATOM 411 C HIS A 23 -7.472 -2.770 -6.967 1.00 0.00 C ATOM 412 O HIS A 23 -8.587 -3.288 -7.016 1.00 0.00 O ATOM 413 CB HIS A 23 -6.959 -0.324 -7.074 1.00 0.00 C ATOM 414 CG HIS A 23 -7.851 -0.289 -8.277 1.00 0.00 C ATOM 415 ND1 HIS A 23 -7.785 -1.223 -9.290 1.00 0.00 N ATOM 416 CD2 HIS A 23 -8.833 0.574 -8.627 1.00 0.00 C ATOM 417 CE1 HIS A 23 -8.688 -0.935 -10.210 1.00 0.00 C ATOM 418 NE2 HIS A 23 -9.338 0.151 -9.832 1.00 0.00 N ATOM 0 H HIS A 23 -5.316 -1.092 -5.402 1.00 0.00 H new ATOM 0 HA HIS A 23 -8.130 -1.301 -5.561 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -7.081 0.603 -6.514 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.920 -0.363 -7.403 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -9.159 1.436 -8.063 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -8.865 -1.493 -11.118 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -10.092 0.602 -10.350 1.00 0.00 H new ATOM 426 N ALA A 24 -6.417 -3.260 -7.610 1.00 0.00 N ATOM 427 CA ALA A 24 -6.511 -4.462 -8.428 1.00 0.00 C ATOM 428 C ALA A 24 -6.603 -5.712 -7.559 1.00 0.00 C ATOM 429 O ALA A 24 -6.953 -6.789 -8.039 1.00 0.00 O ATOM 430 CB ALA A 24 -5.318 -4.557 -9.367 1.00 0.00 C ATOM 0 H ALA A 24 -5.487 -2.842 -7.580 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.422 -4.396 -9.022 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.402 -5.460 -9.972 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.298 -3.684 -10.019 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.398 -4.595 -8.784 1.00 0.00 H new ATOM 436 N ALA A 25 -6.286 -5.560 -6.277 1.00 0.00 N ATOM 437 CA ALA A 25 -6.335 -6.676 -5.341 1.00 0.00 C ATOM 438 C ALA A 25 -7.744 -6.874 -4.794 1.00 0.00 C ATOM 439 O ALA A 25 -8.098 -7.962 -4.340 1.00 0.00 O ATOM 440 CB ALA A 25 -5.351 -6.452 -4.201 1.00 0.00 C ATOM 0 H ALA A 25 -5.993 -4.675 -5.863 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.053 -7.581 -5.879 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.398 -7.293 -3.509 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -4.341 -6.369 -4.603 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.608 -5.534 -3.673 1.00 0.00 H new ATOM 446 N PHE A 26 -8.546 -5.815 -4.841 1.00 0.00 N ATOM 447 CA PHE A 26 -9.917 -5.872 -4.348 1.00 0.00 C ATOM 448 C PHE A 26 -10.911 -5.615 -5.477 1.00 0.00 C ATOM 449 O PHE A 26 -12.124 -5.622 -5.264 1.00 0.00 O ATOM 450 CB PHE A 26 -10.123 -4.848 -3.230 1.00 0.00 C ATOM 451 CG PHE A 26 -9.410 -5.200 -1.956 1.00 0.00 C ATOM 452 CD1 PHE A 26 -8.050 -5.462 -1.957 1.00 0.00 C ATOM 453 CD2 PHE A 26 -10.101 -5.271 -0.757 1.00 0.00 C ATOM 454 CE1 PHE A 26 -7.391 -5.787 -0.786 1.00 0.00 C ATOM 455 CE2 PHE A 26 -9.448 -5.594 0.417 1.00 0.00 C ATOM 456 CZ PHE A 26 -8.091 -5.854 0.402 1.00 0.00 C ATOM 0 H PHE A 26 -8.270 -4.907 -5.215 1.00 0.00 H new ATOM 0 HA PHE A 26 -10.093 -6.872 -3.952 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.777 -3.873 -3.573 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -11.190 -4.754 -3.026 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.498 -5.412 -2.884 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -11.162 -5.072 -0.740 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.330 -5.988 -0.801 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -9.998 -5.643 1.345 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.579 -6.109 1.318 1.00 0.00 H new ATOM 466 N ILE A 27 -10.389 -5.390 -6.678 1.00 0.00 N ATOM 467 CA ILE A 27 -11.230 -5.132 -7.840 1.00 0.00 C ATOM 468 C ILE A 27 -12.165 -6.305 -8.113 1.00 0.00 C ATOM 469 O ILE A 27 -13.283 -6.139 -8.601 1.00 0.00 O ATOM 470 CB ILE A 27 -10.383 -4.860 -9.098 1.00 0.00 C ATOM 471 CG1 ILE A 27 -11.214 -4.120 -10.148 1.00 0.00 C ATOM 472 CG2 ILE A 27 -9.844 -6.165 -9.665 1.00 0.00 C ATOM 473 CD1 ILE A 27 -11.528 -2.689 -9.771 1.00 0.00 C ATOM 0 H ILE A 27 -9.388 -5.381 -6.872 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.821 -4.245 -7.612 1.00 0.00 H new ATOM 0 HB ILE A 27 -9.538 -4.230 -8.821 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -10.677 -4.128 -11.096 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.148 -4.659 -10.306 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -9.248 -5.957 -10.553 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -9.222 -6.657 -8.917 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -10.676 -6.817 -9.931 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -12.119 -2.226 -10.561 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.093 -2.674 -8.839 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.599 -2.135 -9.641 1.00 0.00 H new ATOM 485 N PRO A 28 -11.699 -7.521 -7.790 1.00 0.00 N ATOM 486 CA PRO A 28 -12.478 -8.746 -7.990 1.00 0.00 C ATOM 487 C PRO A 28 -13.789 -8.732 -7.211 1.00 0.00 C ATOM 488 O PRO A 28 -14.858 -8.977 -7.771 1.00 0.00 O ATOM 489 CB PRO A 28 -11.554 -9.845 -7.461 1.00 0.00 C ATOM 490 CG PRO A 28 -10.190 -9.247 -7.508 1.00 0.00 C ATOM 491 CD PRO A 28 -10.375 -7.792 -7.205 1.00 0.00 C ATOM 0 HA PRO A 28 -12.768 -8.879 -9.032 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -11.824 -10.135 -6.446 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.614 -10.743 -8.076 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.531 -9.718 -6.779 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -9.734 -9.388 -8.488 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.354 -7.593 -6.134 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -9.596 -7.179 -7.658 1.00 0.00 H new ATOM 499 N PHE A 29 -13.700 -8.444 -5.917 1.00 0.00 N ATOM 500 CA PHE A 29 -14.880 -8.399 -5.060 1.00 0.00 C ATOM 501 C PHE A 29 -15.980 -7.553 -5.694 1.00 0.00 C ATOM 502 O PHE A 29 -16.979 -8.079 -6.183 1.00 0.00 O ATOM 503 CB PHE A 29 -14.516 -7.836 -3.685 1.00 0.00 C ATOM 504 CG PHE A 29 -13.604 -8.729 -2.893 1.00 0.00 C ATOM 505 CD1 PHE A 29 -14.100 -9.849 -2.245 1.00 0.00 C ATOM 506 CD2 PHE A 29 -12.251 -8.449 -2.797 1.00 0.00 C ATOM 507 CE1 PHE A 29 -13.263 -10.673 -1.516 1.00 0.00 C ATOM 508 CE2 PHE A 29 -11.409 -9.269 -2.070 1.00 0.00 C ATOM 509 CZ PHE A 29 -11.916 -10.382 -1.428 1.00 0.00 C ATOM 0 H PHE A 29 -12.823 -8.238 -5.438 1.00 0.00 H new ATOM 0 HA PHE A 29 -15.252 -9.417 -4.941 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -14.038 -6.865 -3.814 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -15.431 -7.668 -3.116 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.153 -10.081 -2.310 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -11.849 -7.580 -3.296 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -13.662 -11.543 -1.016 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -10.356 -9.040 -2.004 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.260 -11.023 -0.858 1.00 0.00 H new ATOM 519 N GLY A 30 -15.788 -6.238 -5.682 1.00 0.00 N ATOM 520 CA GLY A 30 -16.772 -5.339 -6.257 1.00 0.00 C ATOM 521 C GLY A 30 -16.152 -4.331 -7.204 1.00 0.00 C ATOM 522 O GLY A 30 -15.199 -4.644 -7.918 1.00 0.00 O ATOM 0 H GLY A 30 -14.969 -5.779 -5.284 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -17.523 -5.921 -6.791 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -17.289 -4.810 -5.456 1.00 0.00 H new ATOM 526 N ASP A 31 -16.695 -3.118 -7.213 1.00 0.00 N ATOM 527 CA ASP A 31 -16.190 -2.061 -8.081 1.00 0.00 C ATOM 528 C ASP A 31 -15.724 -0.862 -7.261 1.00 0.00 C ATOM 529 O ASP A 31 -16.446 0.125 -7.121 1.00 0.00 O ATOM 530 CB ASP A 31 -17.269 -1.627 -9.074 1.00 0.00 C ATOM 531 CG ASP A 31 -17.536 -2.677 -10.134 1.00 0.00 C ATOM 532 OD1 ASP A 31 -16.570 -3.337 -10.572 1.00 0.00 O ATOM 533 OD2 ASP A 31 -18.710 -2.840 -10.525 1.00 0.00 O ATOM 0 H ASP A 31 -17.485 -2.843 -6.629 1.00 0.00 H new ATOM 0 HA ASP A 31 -15.337 -2.455 -8.634 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -18.192 -1.417 -8.534 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -16.963 -0.698 -9.556 1.00 0.00 H new ATOM 538 N ILE A 32 -14.513 -0.955 -6.721 1.00 0.00 N ATOM 539 CA ILE A 32 -13.952 0.122 -5.915 1.00 0.00 C ATOM 540 C ILE A 32 -14.311 1.486 -6.494 1.00 0.00 C ATOM 541 O ILE A 32 -14.381 1.658 -7.711 1.00 0.00 O ATOM 542 CB ILE A 32 -12.419 0.008 -5.812 1.00 0.00 C ATOM 543 CG1 ILE A 32 -12.028 -1.323 -5.165 1.00 0.00 C ATOM 544 CG2 ILE A 32 -11.853 1.175 -5.018 1.00 0.00 C ATOM 545 CD1 ILE A 32 -10.535 -1.567 -5.143 1.00 0.00 C ATOM 0 H ILE A 32 -13.902 -1.765 -6.827 1.00 0.00 H new ATOM 0 HA ILE A 32 -14.383 0.028 -4.918 1.00 0.00 H new ATOM 0 HB ILE A 32 -11.998 0.040 -6.817 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -12.407 -1.347 -4.143 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -12.513 -2.137 -5.704 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -10.769 1.080 -4.954 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -12.107 2.111 -5.516 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -12.277 1.172 -4.014 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.330 -2.528 -4.671 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.153 -1.576 -6.164 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -10.045 -0.774 -4.579 1.00 0.00 H new ATOM 557 N THR A 33 -14.536 2.456 -5.613 1.00 0.00 N ATOM 558 CA THR A 33 -14.887 3.806 -6.036 1.00 0.00 C ATOM 559 C THR A 33 -13.856 4.819 -5.553 1.00 0.00 C ATOM 560 O THR A 33 -13.660 5.864 -6.173 1.00 0.00 O ATOM 561 CB THR A 33 -16.277 4.215 -5.512 1.00 0.00 C ATOM 562 OG1 THR A 33 -16.325 4.074 -4.088 1.00 0.00 O ATOM 563 CG2 THR A 33 -17.367 3.366 -6.148 1.00 0.00 C ATOM 0 H THR A 33 -14.481 2.332 -4.602 1.00 0.00 H new ATOM 0 HA THR A 33 -14.904 3.801 -7.126 1.00 0.00 H new ATOM 0 HB THR A 33 -16.449 5.258 -5.779 1.00 0.00 H new ATOM 0 HG1 THR A 33 -17.211 4.338 -3.763 1.00 0.00 H new ATOM 0 HG21 THR A 33 -18.339 3.673 -5.762 1.00 0.00 H new ATOM 0 HG22 THR A 33 -17.347 3.499 -7.230 1.00 0.00 H new ATOM 0 HG23 THR A 33 -17.197 2.316 -5.908 1.00 0.00 H new ATOM 571 N ASP A 34 -13.198 4.503 -4.443 1.00 0.00 N ATOM 572 CA ASP A 34 -12.184 5.386 -3.877 1.00 0.00 C ATOM 573 C ASP A 34 -11.280 4.627 -2.911 1.00 0.00 C ATOM 574 O ASP A 34 -11.728 3.718 -2.210 1.00 0.00 O ATOM 575 CB ASP A 34 -12.846 6.563 -3.158 1.00 0.00 C ATOM 576 CG ASP A 34 -11.863 7.670 -2.834 1.00 0.00 C ATOM 577 OD1 ASP A 34 -10.978 7.943 -3.672 1.00 0.00 O ATOM 578 OD2 ASP A 34 -11.978 8.264 -1.742 1.00 0.00 O ATOM 0 H ASP A 34 -13.348 3.642 -3.917 1.00 0.00 H new ATOM 0 HA ASP A 34 -11.572 5.767 -4.695 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -13.646 6.962 -3.781 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -13.307 6.209 -2.236 1.00 0.00 H new ATOM 583 N ILE A 35 -10.007 5.004 -2.880 1.00 0.00 N ATOM 584 CA ILE A 35 -9.041 4.358 -2.000 1.00 0.00 C ATOM 585 C ILE A 35 -8.088 5.379 -1.387 1.00 0.00 C ATOM 586 O ILE A 35 -7.435 6.139 -2.102 1.00 0.00 O ATOM 587 CB ILE A 35 -8.220 3.292 -2.751 1.00 0.00 C ATOM 588 CG1 ILE A 35 -9.151 2.287 -3.432 1.00 0.00 C ATOM 589 CG2 ILE A 35 -7.274 2.583 -1.794 1.00 0.00 C ATOM 590 CD1 ILE A 35 -8.447 1.387 -4.422 1.00 0.00 C ATOM 0 H ILE A 35 -9.620 5.753 -3.454 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.611 3.874 -1.207 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.625 3.786 -3.520 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.628 1.672 -2.669 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -9.944 2.829 -3.946 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.701 1.833 -2.338 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -6.593 3.309 -1.351 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -7.850 2.098 -1.006 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.168 0.701 -4.866 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.993 1.993 -5.206 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -7.672 0.817 -3.909 1.00 0.00 H new ATOM 602 N GLN A 36 -8.012 5.388 -0.060 1.00 0.00 N ATOM 603 CA GLN A 36 -7.137 6.314 0.648 1.00 0.00 C ATOM 604 C GLN A 36 -5.846 5.625 1.076 1.00 0.00 C ATOM 605 O GLN A 36 -5.854 4.456 1.463 1.00 0.00 O ATOM 606 CB GLN A 36 -7.852 6.888 1.873 1.00 0.00 C ATOM 607 CG GLN A 36 -8.958 7.871 1.526 1.00 0.00 C ATOM 608 CD GLN A 36 -8.713 8.587 0.213 1.00 0.00 C ATOM 609 OE1 GLN A 36 -8.207 9.710 0.189 1.00 0.00 O ATOM 610 NE2 GLN A 36 -9.070 7.940 -0.890 1.00 0.00 N ATOM 0 H GLN A 36 -8.546 4.765 0.546 1.00 0.00 H new ATOM 0 HA GLN A 36 -6.885 7.127 -0.032 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -8.275 6.068 2.454 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.121 7.386 2.510 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -9.908 7.339 1.473 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -9.048 8.607 2.325 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -9.486 7.011 -0.824 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -8.928 8.372 -1.803 1.00 0.00 H new ATOM 619 N ILE A 37 -4.739 6.356 1.002 1.00 0.00 N ATOM 620 CA ILE A 37 -3.440 5.814 1.382 1.00 0.00 C ATOM 621 C ILE A 37 -2.703 6.761 2.324 1.00 0.00 C ATOM 622 O ILE A 37 -2.459 7.926 2.007 1.00 0.00 O ATOM 623 CB ILE A 37 -2.558 5.548 0.148 1.00 0.00 C ATOM 624 CG1 ILE A 37 -3.239 4.542 -0.784 1.00 0.00 C ATOM 625 CG2 ILE A 37 -1.189 5.040 0.574 1.00 0.00 C ATOM 626 CD1 ILE A 37 -3.318 3.145 -0.211 1.00 0.00 C ATOM 0 H ILE A 37 -4.715 7.324 0.683 1.00 0.00 H new ATOM 0 HA ILE A 37 -3.630 4.870 1.894 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.424 6.485 -0.393 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -4.247 4.891 -1.008 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.696 4.508 -1.728 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.578 4.857 -0.310 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.703 5.786 1.203 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.303 4.112 1.135 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.812 2.486 -0.925 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.312 2.776 -0.013 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.887 3.165 0.718 1.00 0.00 H new ATOM 638 N PRO A 38 -2.339 6.252 3.509 1.00 0.00 N ATOM 639 CA PRO A 38 -1.622 7.035 4.521 1.00 0.00 C ATOM 640 C PRO A 38 -0.189 7.347 4.104 1.00 0.00 C ATOM 641 O PRO A 38 0.621 6.442 3.903 1.00 0.00 O ATOM 642 CB PRO A 38 -1.635 6.122 5.750 1.00 0.00 C ATOM 643 CG PRO A 38 -1.762 4.744 5.198 1.00 0.00 C ATOM 644 CD PRO A 38 -2.597 4.872 3.954 1.00 0.00 C ATOM 0 HA PRO A 38 -2.087 8.007 4.690 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -0.721 6.232 6.334 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -2.467 6.361 6.412 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -0.783 4.323 4.969 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -2.235 4.077 5.919 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -2.304 4.145 3.197 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -3.654 4.708 4.161 1.00 0.00 H new ATOM 652 N LEU A 39 0.117 8.633 3.976 1.00 0.00 N ATOM 653 CA LEU A 39 1.454 9.066 3.584 1.00 0.00 C ATOM 654 C LEU A 39 1.932 10.221 4.458 1.00 0.00 C ATOM 655 O LEU A 39 1.126 10.989 4.983 1.00 0.00 O ATOM 656 CB LEU A 39 1.464 9.486 2.113 1.00 0.00 C ATOM 657 CG LEU A 39 0.902 8.469 1.120 1.00 0.00 C ATOM 658 CD1 LEU A 39 0.921 9.034 -0.292 1.00 0.00 C ATOM 659 CD2 LEU A 39 1.688 7.168 1.186 1.00 0.00 C ATOM 0 H LEU A 39 -0.542 9.394 4.138 1.00 0.00 H new ATOM 0 HA LEU A 39 2.135 8.226 3.721 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.895 10.411 2.016 1.00 0.00 H new ATOM 0 HB3 LEU A 39 2.491 9.713 1.828 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.133 8.259 1.391 1.00 0.00 H new ATOM 0 HD11 LEU A 39 0.517 8.296 -0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.313 9.938 -0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 39 1.946 9.274 -0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 39 1.274 6.456 0.472 1.00 0.00 H new ATOM 0 HD22 LEU A 39 2.732 7.361 0.941 1.00 0.00 H new ATOM 0 HD23 LEU A 39 1.622 6.754 2.192 1.00 0.00 H new ATOM 671 N ASP A 40 3.246 10.338 4.608 1.00 0.00 N ATOM 672 CA ASP A 40 3.832 11.402 5.416 1.00 0.00 C ATOM 673 C ASP A 40 3.890 12.710 4.633 1.00 0.00 C ATOM 674 O ASP A 40 3.408 12.790 3.503 1.00 0.00 O ATOM 675 CB ASP A 40 5.235 11.007 5.878 1.00 0.00 C ATOM 676 CG ASP A 40 5.605 11.634 7.208 1.00 0.00 C ATOM 677 OD1 ASP A 40 4.749 12.327 7.794 1.00 0.00 O ATOM 678 OD2 ASP A 40 6.751 11.431 7.661 1.00 0.00 O ATOM 0 H ASP A 40 3.926 9.709 4.181 1.00 0.00 H new ATOM 0 HA ASP A 40 3.199 11.551 6.291 1.00 0.00 H new ATOM 0 HB2 ASP A 40 5.294 9.922 5.962 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.961 11.308 5.123 1.00 0.00 H new ATOM 683 N TYR A 41 4.481 13.732 5.241 1.00 0.00 N ATOM 684 CA TYR A 41 4.599 15.037 4.603 1.00 0.00 C ATOM 685 C TYR A 41 6.046 15.328 4.219 1.00 0.00 C ATOM 686 O TYR A 41 6.349 16.372 3.644 1.00 0.00 O ATOM 687 CB TYR A 41 4.077 16.133 5.534 1.00 0.00 C ATOM 688 CG TYR A 41 4.829 16.224 6.843 1.00 0.00 C ATOM 689 CD1 TYR A 41 4.506 15.397 7.912 1.00 0.00 C ATOM 690 CD2 TYR A 41 5.862 17.138 7.010 1.00 0.00 C ATOM 691 CE1 TYR A 41 5.190 15.478 9.109 1.00 0.00 C ATOM 692 CE2 TYR A 41 6.553 17.225 8.203 1.00 0.00 C ATOM 693 CZ TYR A 41 6.213 16.393 9.250 1.00 0.00 C ATOM 694 OH TYR A 41 6.897 16.477 10.441 1.00 0.00 O ATOM 0 H TYR A 41 4.886 13.682 6.176 1.00 0.00 H new ATOM 0 HA TYR A 41 3.997 15.024 3.695 1.00 0.00 H new ATOM 0 HB2 TYR A 41 4.139 17.093 5.022 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.023 15.950 5.742 1.00 0.00 H new ATOM 0 HD1 TYR A 41 3.707 14.679 7.805 1.00 0.00 H new ATOM 0 HD2 TYR A 41 6.129 17.792 6.193 1.00 0.00 H new ATOM 0 HE1 TYR A 41 4.926 14.829 9.930 1.00 0.00 H new ATOM 0 HE2 TYR A 41 7.355 17.940 8.316 1.00 0.00 H new ATOM 0 HH TYR A 41 7.587 17.170 10.374 1.00 0.00 H new ATOM 704 N GLU A 42 6.936 14.394 4.542 1.00 0.00 N ATOM 705 CA GLU A 42 8.352 14.549 4.231 1.00 0.00 C ATOM 706 C GLU A 42 8.840 13.414 3.336 1.00 0.00 C ATOM 707 O GLU A 42 9.790 13.576 2.569 1.00 0.00 O ATOM 708 CB GLU A 42 9.178 14.590 5.518 1.00 0.00 C ATOM 709 CG GLU A 42 8.886 13.437 6.465 1.00 0.00 C ATOM 710 CD GLU A 42 9.776 12.236 6.212 1.00 0.00 C ATOM 711 OE1 GLU A 42 10.987 12.431 5.982 1.00 0.00 O ATOM 712 OE2 GLU A 42 9.259 11.099 6.246 1.00 0.00 O ATOM 0 H GLU A 42 6.701 13.523 5.018 1.00 0.00 H new ATOM 0 HA GLU A 42 8.479 15.490 3.696 1.00 0.00 H new ATOM 0 HB2 GLU A 42 10.237 14.579 5.261 1.00 0.00 H new ATOM 0 HB3 GLU A 42 8.985 15.531 6.034 1.00 0.00 H new ATOM 0 HG2 GLU A 42 9.019 13.773 7.493 1.00 0.00 H new ATOM 0 HG3 GLU A 42 7.843 13.140 6.359 1.00 0.00 H new ATOM 719 N THR A 43 8.184 12.262 3.440 1.00 0.00 N ATOM 720 CA THR A 43 8.551 11.099 2.642 1.00 0.00 C ATOM 721 C THR A 43 7.395 10.654 1.754 1.00 0.00 C ATOM 722 O THR A 43 7.601 9.994 0.736 1.00 0.00 O ATOM 723 CB THR A 43 8.981 9.919 3.534 1.00 0.00 C ATOM 724 OG1 THR A 43 8.047 9.749 4.606 1.00 0.00 O ATOM 725 CG2 THR A 43 10.374 10.149 4.101 1.00 0.00 C ATOM 0 H THR A 43 7.396 12.110 4.069 1.00 0.00 H new ATOM 0 HA THR A 43 9.392 11.398 2.016 1.00 0.00 H new ATOM 0 HB THR A 43 8.999 9.017 2.922 1.00 0.00 H new ATOM 0 HG1 THR A 43 8.143 10.487 5.243 1.00 0.00 H new ATOM 0 HG21 THR A 43 10.656 9.303 4.728 1.00 0.00 H new ATOM 0 HG22 THR A 43 11.088 10.249 3.283 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.378 11.060 4.699 1.00 0.00 H new ATOM 733 N GLU A 44 6.179 11.021 2.146 1.00 0.00 N ATOM 734 CA GLU A 44 4.990 10.659 1.383 1.00 0.00 C ATOM 735 C GLU A 44 4.908 9.147 1.189 1.00 0.00 C ATOM 736 O GLU A 44 4.400 8.666 0.176 1.00 0.00 O ATOM 737 CB GLU A 44 4.996 11.359 0.023 1.00 0.00 C ATOM 738 CG GLU A 44 4.556 12.812 0.084 1.00 0.00 C ATOM 739 CD GLU A 44 5.066 13.626 -1.089 1.00 0.00 C ATOM 740 OE1 GLU A 44 6.292 13.623 -1.326 1.00 0.00 O ATOM 741 OE2 GLU A 44 4.238 14.266 -1.771 1.00 0.00 O ATOM 0 H GLU A 44 5.991 11.568 2.986 1.00 0.00 H new ATOM 0 HA GLU A 44 4.115 10.984 1.946 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.001 11.310 -0.397 1.00 0.00 H new ATOM 0 HB3 GLU A 44 4.339 10.818 -0.658 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.467 12.857 0.107 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.913 13.257 1.013 1.00 0.00 H new ATOM 748 N LYS A 45 5.412 8.403 2.168 1.00 0.00 N ATOM 749 CA LYS A 45 5.396 6.946 2.107 1.00 0.00 C ATOM 750 C LYS A 45 4.468 6.368 3.170 1.00 0.00 C ATOM 751 O LYS A 45 4.254 6.975 4.220 1.00 0.00 O ATOM 752 CB LYS A 45 6.810 6.392 2.294 1.00 0.00 C ATOM 753 CG LYS A 45 7.713 6.613 1.092 1.00 0.00 C ATOM 754 CD LYS A 45 8.771 5.528 0.983 1.00 0.00 C ATOM 755 CE LYS A 45 9.910 5.759 1.965 1.00 0.00 C ATOM 756 NZ LYS A 45 10.880 4.629 1.965 1.00 0.00 N ATOM 0 H LYS A 45 5.837 8.785 3.013 1.00 0.00 H new ATOM 0 HA LYS A 45 5.024 6.652 1.126 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.262 6.860 3.169 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.748 5.323 2.500 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.112 6.629 0.183 1.00 0.00 H new ATOM 0 HG3 LYS A 45 8.196 7.587 1.173 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.317 4.555 1.173 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.165 5.503 -0.033 1.00 0.00 H new ATOM 0 HE2 LYS A 45 10.429 6.683 1.709 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.504 5.889 2.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 11.641 4.824 2.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 10.391 3.752 2.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.287 4.521 1.014 1.00 0.00 H new ATOM 770 N HIS A 46 3.919 5.189 2.893 1.00 0.00 N ATOM 771 CA HIS A 46 3.015 4.527 3.827 1.00 0.00 C ATOM 772 C HIS A 46 3.770 3.527 4.698 1.00 0.00 C ATOM 773 O HIS A 46 4.883 3.117 4.366 1.00 0.00 O ATOM 774 CB HIS A 46 1.895 3.815 3.068 1.00 0.00 C ATOM 775 CG HIS A 46 2.242 2.417 2.659 1.00 0.00 C ATOM 776 ND1 HIS A 46 2.572 1.429 3.563 1.00 0.00 N ATOM 777 CD2 HIS A 46 2.309 1.843 1.435 1.00 0.00 C ATOM 778 CE1 HIS A 46 2.828 0.308 2.912 1.00 0.00 C ATOM 779 NE2 HIS A 46 2.675 0.532 1.620 1.00 0.00 N ATOM 0 H HIS A 46 4.085 4.673 2.029 1.00 0.00 H new ATOM 0 HA HIS A 46 2.579 5.289 4.473 1.00 0.00 H new ATOM 0 HB2 HIS A 46 1.002 3.791 3.693 1.00 0.00 H new ATOM 0 HB3 HIS A 46 1.646 4.393 2.178 1.00 0.00 H new ATOM 0 HD2 HIS A 46 2.112 2.326 0.489 1.00 0.00 H new ATOM 0 HE1 HIS A 46 3.114 -0.632 3.361 1.00 0.00 H new ATOM 0 HE2 HIS A 46 2.807 -0.157 0.879 1.00 0.00 H new ATOM 787 N ARG A 47 3.159 3.141 5.812 1.00 0.00 N ATOM 788 CA ARG A 47 3.774 2.191 6.731 1.00 0.00 C ATOM 789 C ARG A 47 3.341 0.764 6.409 1.00 0.00 C ATOM 790 O ARG A 47 4.154 -0.159 6.416 1.00 0.00 O ATOM 791 CB ARG A 47 3.404 2.534 8.176 1.00 0.00 C ATOM 792 CG ARG A 47 3.882 1.505 9.187 1.00 0.00 C ATOM 793 CD ARG A 47 4.024 2.112 10.574 1.00 0.00 C ATOM 794 NE ARG A 47 4.947 1.350 11.412 1.00 0.00 N ATOM 795 CZ ARG A 47 5.177 1.628 12.691 1.00 0.00 C ATOM 796 NH1 ARG A 47 4.556 2.643 13.275 1.00 0.00 N ATOM 797 NH2 ARG A 47 6.031 0.889 13.388 1.00 0.00 N ATOM 0 H ARG A 47 2.238 3.471 6.101 1.00 0.00 H new ATOM 0 HA ARG A 47 4.856 2.259 6.614 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.829 3.505 8.430 1.00 0.00 H new ATOM 0 HB3 ARG A 47 2.321 2.630 8.252 1.00 0.00 H new ATOM 0 HG2 ARG A 47 3.178 0.674 9.223 1.00 0.00 H new ATOM 0 HG3 ARG A 47 4.841 1.097 8.867 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.378 3.139 10.486 1.00 0.00 H new ATOM 0 HD3 ARG A 47 3.046 2.152 11.054 1.00 0.00 H new ATOM 0 HE ARG A 47 5.441 0.562 10.993 1.00 0.00 H new ATOM 0 HH11 ARG A 47 3.899 3.214 12.743 1.00 0.00 H new ATOM 0 HH12 ARG A 47 4.735 2.854 14.257 1.00 0.00 H new ATOM 0 HH21 ARG A 47 6.511 0.107 12.942 1.00 0.00 H new ATOM 0 HH22 ARG A 47 6.207 1.103 14.370 1.00 0.00 H new ATOM 811 N GLY A 48 2.053 0.591 6.127 1.00 0.00 N ATOM 812 CA GLY A 48 1.534 -0.726 5.807 1.00 0.00 C ATOM 813 C GLY A 48 0.053 -0.854 6.105 1.00 0.00 C ATOM 814 O GLY A 48 -0.371 -1.781 6.794 1.00 0.00 O ATOM 0 H GLY A 48 1.360 1.339 6.114 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.708 -0.935 4.752 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.082 -1.477 6.376 1.00 0.00 H new ATOM 818 N PHE A 49 -0.736 0.080 5.585 1.00 0.00 N ATOM 819 CA PHE A 49 -2.178 0.070 5.801 1.00 0.00 C ATOM 820 C PHE A 49 -2.867 1.108 4.920 1.00 0.00 C ATOM 821 O PHE A 49 -2.228 2.029 4.412 1.00 0.00 O ATOM 822 CB PHE A 49 -2.497 0.341 7.273 1.00 0.00 C ATOM 823 CG PHE A 49 -2.207 1.751 7.699 1.00 0.00 C ATOM 824 CD1 PHE A 49 -0.901 2.200 7.814 1.00 0.00 C ATOM 825 CD2 PHE A 49 -3.240 2.629 7.984 1.00 0.00 C ATOM 826 CE1 PHE A 49 -0.631 3.497 8.207 1.00 0.00 C ATOM 827 CE2 PHE A 49 -2.976 3.928 8.377 1.00 0.00 C ATOM 828 CZ PHE A 49 -1.670 4.362 8.488 1.00 0.00 C ATOM 0 H PHE A 49 -0.401 0.854 5.011 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.554 -0.917 5.531 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.550 0.124 7.454 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -1.919 -0.344 7.894 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.084 1.528 7.594 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.263 2.295 7.898 1.00 0.00 H new ATOM 0 HE1 PHE A 49 0.391 3.834 8.294 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.790 4.602 8.597 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.461 5.376 8.794 1.00 0.00 H new ATOM 838 N ALA A 50 -4.175 0.951 4.744 1.00 0.00 N ATOM 839 CA ALA A 50 -4.952 1.875 3.926 1.00 0.00 C ATOM 840 C ALA A 50 -6.446 1.603 4.060 1.00 0.00 C ATOM 841 O ALA A 50 -6.863 0.738 4.831 1.00 0.00 O ATOM 842 CB ALA A 50 -4.524 1.778 2.469 1.00 0.00 C ATOM 0 H ALA A 50 -4.719 0.193 5.157 1.00 0.00 H new ATOM 0 HA ALA A 50 -4.760 2.887 4.283 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.112 2.473 1.870 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.467 2.029 2.383 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.686 0.762 2.109 1.00 0.00 H new ATOM 848 N PHE A 51 -7.248 2.346 3.305 1.00 0.00 N ATOM 849 CA PHE A 51 -8.697 2.186 3.341 1.00 0.00 C ATOM 850 C PHE A 51 -9.262 2.025 1.932 1.00 0.00 C ATOM 851 O PHE A 51 -8.834 2.703 0.999 1.00 0.00 O ATOM 852 CB PHE A 51 -9.348 3.388 4.029 1.00 0.00 C ATOM 853 CG PHE A 51 -8.818 3.647 5.410 1.00 0.00 C ATOM 854 CD1 PHE A 51 -9.144 2.804 6.460 1.00 0.00 C ATOM 855 CD2 PHE A 51 -7.995 4.733 5.659 1.00 0.00 C ATOM 856 CE1 PHE A 51 -8.658 3.040 7.733 1.00 0.00 C ATOM 857 CE2 PHE A 51 -7.507 4.975 6.929 1.00 0.00 C ATOM 858 CZ PHE A 51 -7.838 4.127 7.967 1.00 0.00 C ATOM 0 H PHE A 51 -6.919 3.065 2.661 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.923 1.284 3.910 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.192 4.276 3.416 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.424 3.225 4.086 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -9.785 1.953 6.282 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.731 5.399 4.851 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.919 2.375 8.543 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.867 5.826 7.109 1.00 0.00 H new ATOM 0 HZ PHE A 51 -7.457 4.313 8.960 1.00 0.00 H new ATOM 868 N VAL A 52 -10.225 1.120 1.787 1.00 0.00 N ATOM 869 CA VAL A 52 -10.849 0.869 0.494 1.00 0.00 C ATOM 870 C VAL A 52 -12.362 1.041 0.571 1.00 0.00 C ATOM 871 O VAL A 52 -12.996 0.617 1.537 1.00 0.00 O ATOM 872 CB VAL A 52 -10.530 -0.549 -0.018 1.00 0.00 C ATOM 873 CG1 VAL A 52 -11.007 -0.719 -1.452 1.00 0.00 C ATOM 874 CG2 VAL A 52 -9.039 -0.832 0.094 1.00 0.00 C ATOM 0 H VAL A 52 -10.590 0.549 2.549 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.438 1.600 -0.203 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.061 -1.270 0.604 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -10.773 -1.726 -1.796 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.084 -0.561 -1.498 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -10.506 0.008 -2.091 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -8.831 -1.838 -0.272 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -8.485 -0.107 -0.503 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.731 -0.754 1.137 1.00 0.00 H new ATOM 884 N GLU A 53 -12.934 1.665 -0.454 1.00 0.00 N ATOM 885 CA GLU A 53 -14.374 1.893 -0.501 1.00 0.00 C ATOM 886 C GLU A 53 -15.036 0.980 -1.529 1.00 0.00 C ATOM 887 O GLU A 53 -14.549 0.834 -2.651 1.00 0.00 O ATOM 888 CB GLU A 53 -14.670 3.357 -0.837 1.00 0.00 C ATOM 889 CG GLU A 53 -16.148 3.704 -0.791 1.00 0.00 C ATOM 890 CD GLU A 53 -16.597 4.165 0.582 1.00 0.00 C ATOM 891 OE1 GLU A 53 -16.082 5.198 1.059 1.00 0.00 O ATOM 892 OE2 GLU A 53 -17.464 3.493 1.178 1.00 0.00 O ATOM 0 H GLU A 53 -12.423 2.021 -1.262 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.785 1.663 0.482 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -14.133 3.997 -0.137 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.284 3.578 -1.832 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -16.356 4.488 -1.519 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -16.731 2.832 -1.086 1.00 0.00 H new ATOM 899 N PHE A 54 -16.148 0.367 -1.138 1.00 0.00 N ATOM 900 CA PHE A 54 -16.877 -0.533 -2.024 1.00 0.00 C ATOM 901 C PHE A 54 -18.153 0.126 -2.539 1.00 0.00 C ATOM 902 O PHE A 54 -18.866 0.791 -1.788 1.00 0.00 O ATOM 903 CB PHE A 54 -17.219 -1.834 -1.294 1.00 0.00 C ATOM 904 CG PHE A 54 -16.073 -2.802 -1.224 1.00 0.00 C ATOM 905 CD1 PHE A 54 -14.828 -2.390 -0.777 1.00 0.00 C ATOM 906 CD2 PHE A 54 -16.240 -4.123 -1.607 1.00 0.00 C ATOM 907 CE1 PHE A 54 -13.771 -3.278 -0.711 1.00 0.00 C ATOM 908 CE2 PHE A 54 -15.187 -5.016 -1.543 1.00 0.00 C ATOM 909 CZ PHE A 54 -13.950 -4.593 -1.095 1.00 0.00 C ATOM 0 H PHE A 54 -16.564 0.477 -0.213 1.00 0.00 H new ATOM 0 HA PHE A 54 -16.238 -0.760 -2.877 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -17.547 -1.598 -0.282 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -18.059 -2.313 -1.797 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -14.682 -1.363 -0.477 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -17.204 -4.459 -1.960 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -12.806 -2.944 -0.360 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -15.331 -6.044 -1.843 1.00 0.00 H new ATOM 0 HZ PHE A 54 -13.125 -5.289 -1.045 1.00 0.00 H new ATOM 919 N GLU A 55 -18.433 -0.065 -3.824 1.00 0.00 N ATOM 920 CA GLU A 55 -19.623 0.512 -4.439 1.00 0.00 C ATOM 921 C GLU A 55 -20.861 0.241 -3.589 1.00 0.00 C ATOM 922 O GLU A 55 -21.810 1.026 -3.587 1.00 0.00 O ATOM 923 CB GLU A 55 -19.822 -0.056 -5.846 1.00 0.00 C ATOM 924 CG GLU A 55 -20.936 0.624 -6.624 1.00 0.00 C ATOM 925 CD GLU A 55 -20.962 0.214 -8.084 1.00 0.00 C ATOM 926 OE1 GLU A 55 -21.193 -0.981 -8.362 1.00 0.00 O ATOM 927 OE2 GLU A 55 -20.752 1.090 -8.949 1.00 0.00 O ATOM 0 H GLU A 55 -17.853 -0.614 -4.459 1.00 0.00 H new ATOM 0 HA GLU A 55 -19.480 1.590 -4.507 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.890 0.040 -6.403 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -20.040 -1.121 -5.771 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -21.895 0.382 -6.165 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -20.814 1.705 -6.556 1.00 0.00 H new ATOM 934 N LEU A 56 -20.844 -0.875 -2.869 1.00 0.00 N ATOM 935 CA LEU A 56 -21.965 -1.251 -2.014 1.00 0.00 C ATOM 936 C LEU A 56 -21.472 -1.779 -0.671 1.00 0.00 C ATOM 937 O LEU A 56 -20.287 -2.062 -0.501 1.00 0.00 O ATOM 938 CB LEU A 56 -22.827 -2.308 -2.706 1.00 0.00 C ATOM 939 CG LEU A 56 -23.447 -1.899 -4.043 1.00 0.00 C ATOM 940 CD1 LEU A 56 -24.099 -3.096 -4.717 1.00 0.00 C ATOM 941 CD2 LEU A 56 -24.459 -0.781 -3.841 1.00 0.00 C ATOM 0 H LEU A 56 -20.067 -1.535 -2.860 1.00 0.00 H new ATOM 0 HA LEU A 56 -22.568 -0.361 -1.834 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -22.217 -3.196 -2.868 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -23.631 -2.593 -2.028 1.00 0.00 H new ATOM 0 HG LEU A 56 -22.653 -1.530 -4.693 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -24.535 -2.786 -5.667 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -23.349 -3.866 -4.896 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -24.882 -3.495 -4.072 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -24.890 -0.502 -4.803 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -25.250 -1.123 -3.174 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -23.962 0.084 -3.402 1.00 0.00 H new ATOM 953 N ALA A 57 -22.391 -1.911 0.280 1.00 0.00 N ATOM 954 CA ALA A 57 -22.051 -2.410 1.607 1.00 0.00 C ATOM 955 C ALA A 57 -21.929 -3.930 1.607 1.00 0.00 C ATOM 956 O ALA A 57 -20.941 -4.481 2.092 1.00 0.00 O ATOM 957 CB ALA A 57 -23.092 -1.962 2.622 1.00 0.00 C ATOM 0 H ALA A 57 -23.377 -1.679 0.156 1.00 0.00 H new ATOM 0 HA ALA A 57 -21.083 -1.994 1.888 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -22.825 -2.342 3.608 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -23.128 -0.873 2.650 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -24.070 -2.350 2.336 1.00 0.00 H new ATOM 963 N GLU A 58 -22.938 -4.600 1.062 1.00 0.00 N ATOM 964 CA GLU A 58 -22.943 -6.057 1.002 1.00 0.00 C ATOM 965 C GLU A 58 -21.606 -6.585 0.488 1.00 0.00 C ATOM 966 O GLU A 58 -20.987 -7.448 1.111 1.00 0.00 O ATOM 967 CB GLU A 58 -24.077 -6.549 0.100 1.00 0.00 C ATOM 968 CG GLU A 58 -24.009 -6.005 -1.316 1.00 0.00 C ATOM 969 CD GLU A 58 -25.243 -6.341 -2.131 1.00 0.00 C ATOM 970 OE1 GLU A 58 -26.232 -5.584 -2.049 1.00 0.00 O ATOM 971 OE2 GLU A 58 -25.219 -7.362 -2.850 1.00 0.00 O ATOM 0 H GLU A 58 -23.763 -4.158 0.656 1.00 0.00 H new ATOM 0 HA GLU A 58 -23.101 -6.436 2.012 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -24.054 -7.638 0.063 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -25.031 -6.265 0.543 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -23.886 -4.923 -1.280 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -23.128 -6.409 -1.814 1.00 0.00 H new ATOM 978 N ASP A 59 -21.168 -6.060 -0.651 1.00 0.00 N ATOM 979 CA ASP A 59 -19.904 -6.477 -1.248 1.00 0.00 C ATOM 980 C ASP A 59 -18.762 -6.352 -0.245 1.00 0.00 C ATOM 981 O ASP A 59 -17.945 -7.262 -0.104 1.00 0.00 O ATOM 982 CB ASP A 59 -19.603 -5.638 -2.491 1.00 0.00 C ATOM 983 CG ASP A 59 -20.673 -5.775 -3.556 1.00 0.00 C ATOM 984 OD1 ASP A 59 -21.412 -6.781 -3.529 1.00 0.00 O ATOM 985 OD2 ASP A 59 -20.773 -4.875 -4.416 1.00 0.00 O ATOM 0 H ASP A 59 -21.669 -5.345 -1.179 1.00 0.00 H new ATOM 0 HA ASP A 59 -19.994 -7.524 -1.538 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -19.512 -4.590 -2.205 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -18.641 -5.940 -2.906 1.00 0.00 H new ATOM 990 N ALA A 60 -18.710 -5.219 0.447 1.00 0.00 N ATOM 991 CA ALA A 60 -17.668 -4.975 1.437 1.00 0.00 C ATOM 992 C ALA A 60 -17.623 -6.093 2.473 1.00 0.00 C ATOM 993 O ALA A 60 -16.574 -6.692 2.709 1.00 0.00 O ATOM 994 CB ALA A 60 -17.889 -3.632 2.117 1.00 0.00 C ATOM 0 H ALA A 60 -19.377 -4.455 0.340 1.00 0.00 H new ATOM 0 HA ALA A 60 -16.708 -4.954 0.920 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -17.103 -3.463 2.854 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -17.863 -2.838 1.371 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -18.859 -3.631 2.614 1.00 0.00 H new ATOM 1000 N ALA A 61 -18.768 -6.369 3.090 1.00 0.00 N ATOM 1001 CA ALA A 61 -18.859 -7.416 4.100 1.00 0.00 C ATOM 1002 C ALA A 61 -18.278 -8.728 3.584 1.00 0.00 C ATOM 1003 O ALA A 61 -17.522 -9.400 4.285 1.00 0.00 O ATOM 1004 CB ALA A 61 -20.306 -7.610 4.530 1.00 0.00 C ATOM 0 H ALA A 61 -19.645 -5.882 2.908 1.00 0.00 H new ATOM 0 HA ALA A 61 -18.273 -7.105 4.965 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -20.359 -8.395 5.285 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -20.690 -6.679 4.947 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -20.907 -7.895 3.667 1.00 0.00 H new ATOM 1010 N ALA A 62 -18.636 -9.086 2.356 1.00 0.00 N ATOM 1011 CA ALA A 62 -18.149 -10.317 1.746 1.00 0.00 C ATOM 1012 C ALA A 62 -16.629 -10.303 1.621 1.00 0.00 C ATOM 1013 O ALA A 62 -15.970 -11.320 1.834 1.00 0.00 O ATOM 1014 CB ALA A 62 -18.791 -10.522 0.383 1.00 0.00 C ATOM 0 H ALA A 62 -19.262 -8.541 1.763 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.427 -11.149 2.394 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -18.417 -11.445 -0.060 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.873 -10.586 0.496 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.543 -9.682 -0.266 1.00 0.00 H new ATOM 1020 N ALA A 63 -16.080 -9.145 1.271 1.00 0.00 N ATOM 1021 CA ALA A 63 -14.637 -8.999 1.118 1.00 0.00 C ATOM 1022 C ALA A 63 -13.915 -9.279 2.431 1.00 0.00 C ATOM 1023 O ALA A 63 -12.859 -9.912 2.446 1.00 0.00 O ATOM 1024 CB ALA A 63 -14.299 -7.603 0.615 1.00 0.00 C ATOM 0 H ALA A 63 -16.612 -8.294 1.088 1.00 0.00 H new ATOM 0 HA ALA A 63 -14.298 -9.730 0.384 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -13.219 -7.507 0.505 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -14.778 -7.438 -0.350 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -14.658 -6.862 1.329 1.00 0.00 H new ATOM 1030 N ILE A 64 -14.490 -8.804 3.531 1.00 0.00 N ATOM 1031 CA ILE A 64 -13.900 -9.005 4.849 1.00 0.00 C ATOM 1032 C ILE A 64 -13.913 -10.479 5.238 1.00 0.00 C ATOM 1033 O ILE A 64 -12.862 -11.090 5.434 1.00 0.00 O ATOM 1034 CB ILE A 64 -14.641 -8.193 5.927 1.00 0.00 C ATOM 1035 CG1 ILE A 64 -14.553 -6.697 5.621 1.00 0.00 C ATOM 1036 CG2 ILE A 64 -14.067 -8.493 7.304 1.00 0.00 C ATOM 1037 CD1 ILE A 64 -15.395 -5.841 6.541 1.00 0.00 C ATOM 0 H ILE A 64 -15.364 -8.277 3.536 1.00 0.00 H new ATOM 0 HA ILE A 64 -12.869 -8.657 4.790 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.691 -8.484 5.922 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.513 -6.380 5.694 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -14.866 -6.526 4.591 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -14.601 -7.911 8.055 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -14.178 -9.555 7.521 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -13.010 -8.227 7.323 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.284 -4.792 6.265 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -16.442 -6.131 6.451 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -15.067 -5.982 7.571 1.00 0.00 H new ATOM 1049 N ASP A 65 -15.110 -11.045 5.348 1.00 0.00 N ATOM 1050 CA ASP A 65 -15.262 -12.449 5.712 1.00 0.00 C ATOM 1051 C ASP A 65 -14.203 -13.306 5.023 1.00 0.00 C ATOM 1052 O ASP A 65 -13.847 -14.378 5.509 1.00 0.00 O ATOM 1053 CB ASP A 65 -16.659 -12.946 5.340 1.00 0.00 C ATOM 1054 CG ASP A 65 -16.842 -14.425 5.622 1.00 0.00 C ATOM 1055 OD1 ASP A 65 -16.943 -14.794 6.810 1.00 0.00 O ATOM 1056 OD2 ASP A 65 -16.884 -15.212 4.653 1.00 0.00 O ATOM 0 H ASP A 65 -15.989 -10.553 5.190 1.00 0.00 H new ATOM 0 HA ASP A 65 -15.130 -12.536 6.790 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -17.404 -12.378 5.897 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -16.839 -12.756 4.282 1.00 0.00 H new ATOM 1061 N ASN A 66 -13.706 -12.824 3.889 1.00 0.00 N ATOM 1062 CA ASN A 66 -12.689 -13.547 3.133 1.00 0.00 C ATOM 1063 C ASN A 66 -11.309 -12.936 3.355 1.00 0.00 C ATOM 1064 O ASN A 66 -10.478 -13.499 4.067 1.00 0.00 O ATOM 1065 CB ASN A 66 -13.030 -13.536 1.641 1.00 0.00 C ATOM 1066 CG ASN A 66 -14.262 -14.361 1.324 1.00 0.00 C ATOM 1067 OD1 ASN A 66 -14.192 -15.341 0.582 1.00 0.00 O ATOM 1068 ND2 ASN A 66 -15.399 -13.967 1.885 1.00 0.00 N ATOM 0 H ASN A 66 -13.990 -11.937 3.473 1.00 0.00 H new ATOM 0 HA ASN A 66 -12.672 -14.577 3.488 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -13.191 -12.508 1.315 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -12.182 -13.921 1.074 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -16.261 -14.483 1.707 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -15.411 -13.149 2.494 1.00 0.00 H new ATOM 1075 N MET A 67 -11.073 -11.781 2.741 1.00 0.00 N ATOM 1076 CA MET A 67 -9.794 -11.093 2.874 1.00 0.00 C ATOM 1077 C MET A 67 -9.208 -11.299 4.267 1.00 0.00 C ATOM 1078 O MET A 67 -8.036 -11.646 4.412 1.00 0.00 O ATOM 1079 CB MET A 67 -9.964 -9.598 2.595 1.00 0.00 C ATOM 1080 CG MET A 67 -10.232 -9.279 1.133 1.00 0.00 C ATOM 1081 SD MET A 67 -9.007 -10.006 0.028 1.00 0.00 S ATOM 1082 CE MET A 67 -7.506 -9.238 0.633 1.00 0.00 C ATOM 0 H MET A 67 -11.750 -11.302 2.147 1.00 0.00 H new ATOM 0 HA MET A 67 -9.104 -11.516 2.143 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.787 -9.215 3.199 1.00 0.00 H new ATOM 0 HB3 MET A 67 -9.064 -9.073 2.914 1.00 0.00 H new ATOM 0 HG2 MET A 67 -11.223 -9.644 0.861 1.00 0.00 H new ATOM 0 HG3 MET A 67 -10.242 -8.198 0.997 1.00 0.00 H new ATOM 0 HE1 MET A 67 -7.169 -8.487 -0.081 1.00 0.00 H new ATOM 0 HE2 MET A 67 -7.702 -8.763 1.594 1.00 0.00 H new ATOM 0 HE3 MET A 67 -6.733 -9.996 0.754 1.00 0.00 H new ATOM 1092 N ASN A 68 -10.030 -11.083 5.288 1.00 0.00 N ATOM 1093 CA ASN A 68 -9.592 -11.245 6.670 1.00 0.00 C ATOM 1094 C ASN A 68 -8.590 -12.389 6.792 1.00 0.00 C ATOM 1095 O ASN A 68 -8.922 -13.546 6.538 1.00 0.00 O ATOM 1096 CB ASN A 68 -10.793 -11.504 7.581 1.00 0.00 C ATOM 1097 CG ASN A 68 -11.251 -12.949 7.537 1.00 0.00 C ATOM 1098 OD1 ASN A 68 -11.720 -13.432 6.507 1.00 0.00 O ATOM 1099 ND2 ASN A 68 -11.117 -13.646 8.659 1.00 0.00 N ATOM 0 H ASN A 68 -11.003 -10.795 5.185 1.00 0.00 H new ATOM 0 HA ASN A 68 -9.102 -10.322 6.980 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -10.532 -11.239 8.606 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.617 -10.855 7.284 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -11.408 -14.623 8.690 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -10.723 -13.204 9.490 1.00 0.00 H new ATOM 1106 N GLU A 69 -7.364 -12.056 7.184 1.00 0.00 N ATOM 1107 CA GLU A 69 -6.315 -13.056 7.341 1.00 0.00 C ATOM 1108 C GLU A 69 -5.962 -13.688 5.997 1.00 0.00 C ATOM 1109 O GLU A 69 -5.781 -14.902 5.899 1.00 0.00 O ATOM 1110 CB GLU A 69 -6.755 -14.140 8.327 1.00 0.00 C ATOM 1111 CG GLU A 69 -7.170 -13.596 9.684 1.00 0.00 C ATOM 1112 CD GLU A 69 -7.817 -14.649 10.561 1.00 0.00 C ATOM 1113 OE1 GLU A 69 -7.314 -15.792 10.584 1.00 0.00 O ATOM 1114 OE2 GLU A 69 -8.826 -14.332 11.224 1.00 0.00 O ATOM 0 H GLU A 69 -7.073 -11.102 7.398 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.429 -12.557 7.734 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.589 -14.694 7.896 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.938 -14.849 8.463 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -6.294 -13.193 10.193 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.866 -12.769 9.542 1.00 0.00 H new ATOM 1121 N SER A 70 -5.866 -12.856 4.965 1.00 0.00 N ATOM 1122 CA SER A 70 -5.539 -13.333 3.627 1.00 0.00 C ATOM 1123 C SER A 70 -4.038 -13.238 3.367 1.00 0.00 C ATOM 1124 O SER A 70 -3.288 -12.716 4.191 1.00 0.00 O ATOM 1125 CB SER A 70 -6.302 -12.526 2.574 1.00 0.00 C ATOM 1126 OG SER A 70 -6.170 -11.134 2.804 1.00 0.00 O ATOM 0 H SER A 70 -6.010 -11.848 5.030 1.00 0.00 H new ATOM 0 HA SER A 70 -5.836 -14.379 3.559 1.00 0.00 H new ATOM 0 HB2 SER A 70 -5.926 -12.771 1.581 1.00 0.00 H new ATOM 0 HB3 SER A 70 -7.356 -12.803 2.593 1.00 0.00 H new ATOM 0 HG SER A 70 -6.821 -10.851 3.480 1.00 0.00 H new ATOM 1132 N GLU A 71 -3.610 -13.746 2.216 1.00 0.00 N ATOM 1133 CA GLU A 71 -2.199 -13.719 1.848 1.00 0.00 C ATOM 1134 C GLU A 71 -1.945 -12.702 0.739 1.00 0.00 C ATOM 1135 O GLU A 71 -2.408 -12.870 -0.390 1.00 0.00 O ATOM 1136 CB GLU A 71 -1.740 -15.107 1.398 1.00 0.00 C ATOM 1137 CG GLU A 71 -0.240 -15.211 1.181 1.00 0.00 C ATOM 1138 CD GLU A 71 0.208 -16.626 0.868 1.00 0.00 C ATOM 1139 OE1 GLU A 71 0.101 -17.492 1.762 1.00 0.00 O ATOM 1140 OE2 GLU A 71 0.665 -16.867 -0.269 1.00 0.00 O ATOM 0 H GLU A 71 -4.219 -14.181 1.523 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.626 -13.422 2.727 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -2.042 -15.840 2.146 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.252 -15.367 0.471 1.00 0.00 H new ATOM 0 HG2 GLU A 71 0.051 -14.552 0.363 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.278 -14.859 2.073 1.00 0.00 H new ATOM 1147 N LEU A 72 -1.207 -11.648 1.068 1.00 0.00 N ATOM 1148 CA LEU A 72 -0.892 -10.603 0.101 1.00 0.00 C ATOM 1149 C LEU A 72 0.611 -10.344 0.049 1.00 0.00 C ATOM 1150 O LEU A 72 1.234 -10.038 1.066 1.00 0.00 O ATOM 1151 CB LEU A 72 -1.631 -9.311 0.456 1.00 0.00 C ATOM 1152 CG LEU A 72 -1.749 -8.276 -0.663 1.00 0.00 C ATOM 1153 CD1 LEU A 72 -2.677 -8.778 -1.759 1.00 0.00 C ATOM 1154 CD2 LEU A 72 -2.244 -6.947 -0.110 1.00 0.00 C ATOM 0 H LEU A 72 -0.815 -11.494 1.997 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.218 -10.943 -0.882 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.635 -9.571 0.791 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.123 -8.846 1.301 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.760 -8.122 -1.095 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.749 -8.028 -2.547 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.281 -9.704 -2.175 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.667 -8.962 -1.342 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.322 -6.222 -0.920 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.223 -7.086 0.348 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.542 -6.580 0.639 1.00 0.00 H new ATOM 1166 N PHE A 73 1.187 -10.467 -1.142 1.00 0.00 N ATOM 1167 CA PHE A 73 2.616 -10.246 -1.326 1.00 0.00 C ATOM 1168 C PHE A 73 3.429 -11.105 -0.362 1.00 0.00 C ATOM 1169 O PHE A 73 4.401 -10.641 0.232 1.00 0.00 O ATOM 1170 CB PHE A 73 2.956 -8.768 -1.120 1.00 0.00 C ATOM 1171 CG PHE A 73 2.751 -7.929 -2.349 1.00 0.00 C ATOM 1172 CD1 PHE A 73 1.496 -7.817 -2.926 1.00 0.00 C ATOM 1173 CD2 PHE A 73 3.813 -7.253 -2.927 1.00 0.00 C ATOM 1174 CE1 PHE A 73 1.304 -7.045 -4.057 1.00 0.00 C ATOM 1175 CE2 PHE A 73 3.627 -6.480 -4.058 1.00 0.00 C ATOM 1176 CZ PHE A 73 2.371 -6.377 -4.624 1.00 0.00 C ATOM 0 H PHE A 73 0.686 -10.719 -1.994 1.00 0.00 H new ATOM 0 HA PHE A 73 2.873 -10.533 -2.346 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.341 -8.371 -0.312 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.995 -8.683 -0.801 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.658 -8.339 -2.487 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.797 -7.331 -2.489 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.321 -6.965 -4.496 1.00 0.00 H new ATOM 0 HE2 PHE A 73 4.463 -5.957 -4.499 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.224 -5.775 -5.509 1.00 0.00 H new ATOM 1186 N GLY A 74 3.021 -12.362 -0.212 1.00 0.00 N ATOM 1187 CA GLY A 74 3.721 -13.267 0.682 1.00 0.00 C ATOM 1188 C GLY A 74 3.651 -12.822 2.129 1.00 0.00 C ATOM 1189 O GLY A 74 4.594 -13.023 2.894 1.00 0.00 O ATOM 0 H GLY A 74 2.219 -12.769 -0.693 1.00 0.00 H new ATOM 0 HA2 GLY A 74 3.293 -14.265 0.591 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.765 -13.338 0.377 1.00 0.00 H new ATOM 1193 N ARG A 75 2.530 -12.216 2.506 1.00 0.00 N ATOM 1194 CA ARG A 75 2.341 -11.739 3.871 1.00 0.00 C ATOM 1195 C ARG A 75 0.887 -11.899 4.306 1.00 0.00 C ATOM 1196 O ARG A 75 0.002 -12.131 3.482 1.00 0.00 O ATOM 1197 CB ARG A 75 2.760 -10.272 3.984 1.00 0.00 C ATOM 1198 CG ARG A 75 4.218 -10.026 3.633 1.00 0.00 C ATOM 1199 CD ARG A 75 4.552 -8.542 3.649 1.00 0.00 C ATOM 1200 NE ARG A 75 4.933 -8.081 4.981 1.00 0.00 N ATOM 1201 CZ ARG A 75 5.590 -6.949 5.207 1.00 0.00 C ATOM 1202 NH1 ARG A 75 5.937 -6.167 4.194 1.00 0.00 N ATOM 1203 NH2 ARG A 75 5.901 -6.597 6.448 1.00 0.00 N ATOM 0 H ARG A 75 1.739 -12.044 1.886 1.00 0.00 H new ATOM 0 HA ARG A 75 2.968 -12.340 4.530 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.131 -9.672 3.327 1.00 0.00 H new ATOM 0 HB3 ARG A 75 2.577 -9.928 5.002 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.858 -10.552 4.342 1.00 0.00 H new ATOM 0 HG3 ARG A 75 4.430 -10.437 2.646 1.00 0.00 H new ATOM 0 HD2 ARG A 75 5.366 -8.346 2.951 1.00 0.00 H new ATOM 0 HD3 ARG A 75 3.690 -7.973 3.301 1.00 0.00 H new ATOM 0 HE ARG A 75 4.681 -8.660 5.782 1.00 0.00 H new ATOM 0 HH11 ARG A 75 5.699 -6.434 3.239 1.00 0.00 H new ATOM 0 HH12 ARG A 75 6.441 -5.298 4.370 1.00 0.00 H new ATOM 0 HH21 ARG A 75 5.636 -7.196 7.230 1.00 0.00 H new ATOM 0 HH22 ARG A 75 6.406 -5.727 6.620 1.00 0.00 H new ATOM 1217 N THR A 76 0.648 -11.774 5.608 1.00 0.00 N ATOM 1218 CA THR A 76 -0.697 -11.907 6.154 1.00 0.00 C ATOM 1219 C THR A 76 -1.268 -10.549 6.546 1.00 0.00 C ATOM 1220 O THR A 76 -0.875 -9.970 7.559 1.00 0.00 O ATOM 1221 CB THR A 76 -0.715 -12.833 7.384 1.00 0.00 C ATOM 1222 OG1 THR A 76 -0.057 -14.068 7.078 1.00 0.00 O ATOM 1223 CG2 THR A 76 -2.143 -13.111 7.831 1.00 0.00 C ATOM 0 H THR A 76 1.368 -11.581 6.304 1.00 0.00 H new ATOM 0 HA THR A 76 -1.314 -12.345 5.370 1.00 0.00 H new ATOM 0 HB THR A 76 -0.187 -12.332 8.196 1.00 0.00 H new ATOM 0 HG1 THR A 76 -0.071 -14.650 7.866 1.00 0.00 H new ATOM 0 HG21 THR A 76 -2.131 -13.767 8.701 1.00 0.00 H new ATOM 0 HG22 THR A 76 -2.632 -12.172 8.091 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.691 -13.593 7.021 1.00 0.00 H new ATOM 1231 N ILE A 77 -2.195 -10.047 5.738 1.00 0.00 N ATOM 1232 CA ILE A 77 -2.821 -8.757 6.003 1.00 0.00 C ATOM 1233 C ILE A 77 -4.077 -8.919 6.852 1.00 0.00 C ATOM 1234 O ILE A 77 -4.516 -10.037 7.121 1.00 0.00 O ATOM 1235 CB ILE A 77 -3.189 -8.031 4.695 1.00 0.00 C ATOM 1236 CG1 ILE A 77 -4.114 -8.904 3.845 1.00 0.00 C ATOM 1237 CG2 ILE A 77 -1.932 -7.668 3.919 1.00 0.00 C ATOM 1238 CD1 ILE A 77 -4.882 -8.128 2.797 1.00 0.00 C ATOM 0 H ILE A 77 -2.529 -10.513 4.895 1.00 0.00 H new ATOM 0 HA ILE A 77 -2.092 -8.159 6.549 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.717 -7.110 4.943 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.522 -9.675 3.353 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.821 -9.414 4.499 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.209 -7.156 2.997 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.307 -7.012 4.525 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.379 -8.576 3.678 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.517 -8.810 2.232 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.501 -7.374 3.283 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.181 -7.640 2.120 1.00 0.00 H new ATOM 1250 N ARG A 78 -4.651 -7.796 7.271 1.00 0.00 N ATOM 1251 CA ARG A 78 -5.857 -7.813 8.089 1.00 0.00 C ATOM 1252 C ARG A 78 -6.926 -6.896 7.502 1.00 0.00 C ATOM 1253 O ARG A 78 -6.627 -5.798 7.032 1.00 0.00 O ATOM 1254 CB ARG A 78 -5.533 -7.384 9.522 1.00 0.00 C ATOM 1255 CG ARG A 78 -5.181 -8.543 10.439 1.00 0.00 C ATOM 1256 CD ARG A 78 -6.415 -9.104 11.127 1.00 0.00 C ATOM 1257 NE ARG A 78 -6.707 -8.411 12.379 1.00 0.00 N ATOM 1258 CZ ARG A 78 -7.583 -8.851 13.275 1.00 0.00 C ATOM 1259 NH1 ARG A 78 -8.249 -9.977 13.060 1.00 0.00 N ATOM 1260 NH2 ARG A 78 -7.794 -8.164 14.391 1.00 0.00 N ATOM 0 H ARG A 78 -4.300 -6.863 7.057 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.243 -8.832 8.100 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -4.700 -6.681 9.502 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -6.390 -6.852 9.935 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.695 -9.330 9.862 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -4.465 -8.210 11.190 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -7.272 -9.021 10.458 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -6.268 -10.165 11.326 1.00 0.00 H new ATOM 0 HE ARG A 78 -6.211 -7.542 12.576 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -8.089 -10.508 12.204 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -8.921 -10.312 13.750 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -7.283 -7.298 14.561 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -8.467 -8.502 15.079 1.00 0.00 H new ATOM 1274 N VAL A 79 -8.173 -7.354 7.532 1.00 0.00 N ATOM 1275 CA VAL A 79 -9.287 -6.576 7.003 1.00 0.00 C ATOM 1276 C VAL A 79 -10.393 -6.424 8.041 1.00 0.00 C ATOM 1277 O VAL A 79 -10.870 -7.408 8.603 1.00 0.00 O ATOM 1278 CB VAL A 79 -9.873 -7.225 5.735 1.00 0.00 C ATOM 1279 CG1 VAL A 79 -10.923 -6.320 5.109 1.00 0.00 C ATOM 1280 CG2 VAL A 79 -8.768 -7.542 4.739 1.00 0.00 C ATOM 0 H VAL A 79 -8.438 -8.261 7.917 1.00 0.00 H new ATOM 0 HA VAL A 79 -8.893 -5.592 6.749 1.00 0.00 H new ATOM 0 HB VAL A 79 -10.356 -8.161 6.017 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -11.326 -6.795 4.214 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.728 -6.149 5.823 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.468 -5.367 4.840 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.200 -8.000 3.849 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -8.254 -6.622 4.460 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -8.056 -8.232 5.193 1.00 0.00 H new ATOM 1290 N ASN A 80 -10.796 -5.182 8.290 1.00 0.00 N ATOM 1291 CA ASN A 80 -11.847 -4.900 9.262 1.00 0.00 C ATOM 1292 C ASN A 80 -12.478 -3.536 8.999 1.00 0.00 C ATOM 1293 O ASN A 80 -11.896 -2.690 8.319 1.00 0.00 O ATOM 1294 CB ASN A 80 -11.282 -4.948 10.683 1.00 0.00 C ATOM 1295 CG ASN A 80 -12.367 -5.107 11.731 1.00 0.00 C ATOM 1296 OD1 ASN A 80 -13.141 -6.064 11.698 1.00 0.00 O ATOM 1297 ND2 ASN A 80 -12.427 -4.168 12.667 1.00 0.00 N ATOM 0 H ASN A 80 -10.411 -4.355 7.833 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.618 -5.663 9.159 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.578 -5.777 10.764 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.722 -4.034 10.880 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -13.136 -4.222 13.399 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -11.764 -3.393 12.655 1.00 0.00 H new ATOM 1304 N LEU A 81 -13.673 -3.329 9.543 1.00 0.00 N ATOM 1305 CA LEU A 81 -14.384 -2.068 9.368 1.00 0.00 C ATOM 1306 C LEU A 81 -13.489 -0.884 9.719 1.00 0.00 C ATOM 1307 O LEU A 81 -12.850 -0.866 10.770 1.00 0.00 O ATOM 1308 CB LEU A 81 -15.642 -2.045 10.238 1.00 0.00 C ATOM 1309 CG LEU A 81 -16.854 -2.796 9.686 1.00 0.00 C ATOM 1310 CD1 LEU A 81 -18.074 -2.560 10.563 1.00 0.00 C ATOM 1311 CD2 LEU A 81 -17.136 -2.372 8.252 1.00 0.00 C ATOM 0 H LEU A 81 -14.169 -4.018 10.108 1.00 0.00 H new ATOM 0 HA LEU A 81 -14.671 -1.984 8.320 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.393 -2.464 11.213 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -15.927 -1.006 10.402 1.00 0.00 H new ATOM 0 HG LEU A 81 -16.629 -3.863 9.691 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -18.926 -3.102 10.154 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -17.870 -2.914 11.574 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -18.302 -1.494 10.591 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -18.002 -2.917 7.875 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -17.339 -1.302 8.222 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -16.269 -2.594 7.630 1.00 0.00 H new ATOM 1323 N ALA A 82 -13.448 0.104 8.831 1.00 0.00 N ATOM 1324 CA ALA A 82 -12.635 1.294 9.048 1.00 0.00 C ATOM 1325 C ALA A 82 -12.830 1.843 10.457 1.00 0.00 C ATOM 1326 O ALA A 82 -13.876 2.410 10.775 1.00 0.00 O ATOM 1327 CB ALA A 82 -12.969 2.358 8.014 1.00 0.00 C ATOM 0 H ALA A 82 -13.969 0.104 7.954 1.00 0.00 H new ATOM 0 HA ALA A 82 -11.588 1.013 8.938 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -12.354 3.241 8.189 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.771 1.970 7.015 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -14.022 2.627 8.096 1.00 0.00 H new ATOM 1333 N LYS A 83 -11.818 1.670 11.300 1.00 0.00 N ATOM 1334 CA LYS A 83 -11.877 2.148 12.676 1.00 0.00 C ATOM 1335 C LYS A 83 -12.318 3.608 12.726 1.00 0.00 C ATOM 1336 O LYS A 83 -12.105 4.378 11.790 1.00 0.00 O ATOM 1337 CB LYS A 83 -10.512 1.994 13.351 1.00 0.00 C ATOM 1338 CG LYS A 83 -9.605 3.199 13.174 1.00 0.00 C ATOM 1339 CD LYS A 83 -8.311 3.044 13.955 1.00 0.00 C ATOM 1340 CE LYS A 83 -7.483 4.319 13.920 1.00 0.00 C ATOM 1341 NZ LYS A 83 -6.958 4.602 12.556 1.00 0.00 N ATOM 0 H LYS A 83 -10.946 1.202 11.054 1.00 0.00 H new ATOM 0 HA LYS A 83 -12.611 1.546 13.212 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.661 1.816 14.416 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -10.014 1.113 12.947 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -9.379 3.332 12.116 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.125 4.098 13.505 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -8.538 2.784 14.989 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -7.730 2.220 13.540 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -8.093 5.158 14.255 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -6.651 4.231 14.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -6.385 5.470 12.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -6.369 3.806 12.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -7.753 4.728 11.897 1.00 0.00 H new ATOM 1355 N PRO A 84 -12.946 3.999 13.845 1.00 0.00 N ATOM 1356 CA PRO A 84 -13.428 5.369 14.044 1.00 0.00 C ATOM 1357 C PRO A 84 -12.287 6.365 14.220 1.00 0.00 C ATOM 1358 O PRO A 84 -11.663 6.427 15.279 1.00 0.00 O ATOM 1359 CB PRO A 84 -14.255 5.271 15.329 1.00 0.00 C ATOM 1360 CG PRO A 84 -13.684 4.104 16.059 1.00 0.00 C ATOM 1361 CD PRO A 84 -13.234 3.134 15.001 1.00 0.00 C ATOM 0 HA PRO A 84 -13.992 5.732 13.184 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -14.178 6.184 15.920 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -15.312 5.122 15.109 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -12.849 4.409 16.690 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -14.429 3.650 16.713 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -12.351 2.577 15.316 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -14.008 2.402 14.772 1.00 0.00 H new ATOM 1369 N MET A 85 -12.020 7.143 13.176 1.00 0.00 N ATOM 1370 CA MET A 85 -10.955 8.137 13.217 1.00 0.00 C ATOM 1371 C MET A 85 -11.253 9.211 14.258 1.00 0.00 C ATOM 1372 O MET A 85 -12.414 9.501 14.549 1.00 0.00 O ATOM 1373 CB MET A 85 -10.776 8.780 11.840 1.00 0.00 C ATOM 1374 CG MET A 85 -9.893 10.018 11.858 1.00 0.00 C ATOM 1375 SD MET A 85 -9.082 10.315 10.275 1.00 0.00 S ATOM 1376 CE MET A 85 -7.603 11.174 10.808 1.00 0.00 C ATOM 0 H MET A 85 -12.527 7.104 12.292 1.00 0.00 H new ATOM 0 HA MET A 85 -10.031 7.632 13.497 1.00 0.00 H new ATOM 0 HB2 MET A 85 -10.345 8.046 11.159 1.00 0.00 H new ATOM 0 HB3 MET A 85 -11.755 9.048 11.443 1.00 0.00 H new ATOM 0 HG2 MET A 85 -10.497 10.886 12.121 1.00 0.00 H new ATOM 0 HG3 MET A 85 -9.136 9.909 12.635 1.00 0.00 H new ATOM 0 HE1 MET A 85 -7.566 12.158 10.341 1.00 0.00 H new ATOM 0 HE2 MET A 85 -7.618 11.287 11.892 1.00 0.00 H new ATOM 0 HE3 MET A 85 -6.724 10.600 10.515 1.00 0.00 H new ATOM 1386 N ARG A 86 -10.199 9.799 14.815 1.00 0.00 N ATOM 1387 CA ARG A 86 -10.349 10.839 15.824 1.00 0.00 C ATOM 1388 C ARG A 86 -9.276 11.912 15.664 1.00 0.00 C ATOM 1389 O ARG A 86 -8.081 11.628 15.762 1.00 0.00 O ATOM 1390 CB ARG A 86 -10.274 10.234 17.227 1.00 0.00 C ATOM 1391 CG ARG A 86 -11.620 9.775 17.765 1.00 0.00 C ATOM 1392 CD ARG A 86 -11.669 9.855 19.283 1.00 0.00 C ATOM 1393 NE ARG A 86 -12.939 9.368 19.816 1.00 0.00 N ATOM 1394 CZ ARG A 86 -13.098 8.947 21.066 1.00 0.00 C ATOM 1395 NH1 ARG A 86 -12.074 8.954 21.907 1.00 0.00 N ATOM 1396 NH2 ARG A 86 -14.285 8.518 21.476 1.00 0.00 N ATOM 0 H ARG A 86 -9.232 9.572 14.584 1.00 0.00 H new ATOM 0 HA ARG A 86 -11.326 11.303 15.687 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -9.590 9.386 17.212 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -9.852 10.972 17.910 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -12.412 10.392 17.341 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -11.810 8.750 17.447 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -10.851 9.270 19.703 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -11.516 10.888 19.597 1.00 0.00 H new ATOM 0 HE ARG A 86 -13.748 9.350 19.195 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -11.160 9.283 21.595 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -12.199 8.630 22.866 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -15.075 8.511 20.831 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -14.407 8.195 22.436 1.00 0.00 H new ATOM 1410 N ILE A 87 -9.709 13.143 15.416 1.00 0.00 N ATOM 1411 CA ILE A 87 -8.785 14.257 15.242 1.00 0.00 C ATOM 1412 C ILE A 87 -8.911 15.259 16.385 1.00 0.00 C ATOM 1413 O ILE A 87 -9.889 15.246 17.132 1.00 0.00 O ATOM 1414 CB ILE A 87 -9.026 14.985 13.907 1.00 0.00 C ATOM 1415 CG1 ILE A 87 -10.198 15.960 14.036 1.00 0.00 C ATOM 1416 CG2 ILE A 87 -9.287 13.980 12.795 1.00 0.00 C ATOM 1417 CD1 ILE A 87 -11.497 15.294 14.433 1.00 0.00 C ATOM 0 H ILE A 87 -10.694 13.394 15.331 1.00 0.00 H new ATOM 0 HA ILE A 87 -7.780 13.836 15.240 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.131 15.554 13.654 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -9.948 16.720 14.776 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -10.338 16.474 13.085 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.456 14.510 11.858 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -8.425 13.322 12.690 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -10.168 13.387 13.040 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -12.284 16.045 14.506 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -11.771 14.553 13.682 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -11.374 14.803 15.398 1.00 0.00 H new ATOM 1429 N LYS A 88 -7.915 16.129 16.513 1.00 0.00 N ATOM 1430 CA LYS A 88 -7.915 17.142 17.563 1.00 0.00 C ATOM 1431 C LYS A 88 -8.732 18.360 17.144 1.00 0.00 C ATOM 1432 O LYS A 88 -9.220 18.433 16.017 1.00 0.00 O ATOM 1433 CB LYS A 88 -6.481 17.565 17.891 1.00 0.00 C ATOM 1434 CG LYS A 88 -5.807 18.346 16.776 1.00 0.00 C ATOM 1435 CD LYS A 88 -5.067 17.425 15.819 1.00 0.00 C ATOM 1436 CE LYS A 88 -3.870 18.121 15.190 1.00 0.00 C ATOM 1437 NZ LYS A 88 -4.251 18.890 13.973 1.00 0.00 N ATOM 0 H LYS A 88 -7.098 16.153 15.903 1.00 0.00 H new ATOM 0 HA LYS A 88 -8.372 16.708 18.452 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -6.488 18.173 18.796 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -5.890 16.676 18.109 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -6.555 18.918 16.227 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -5.108 19.064 17.205 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -4.733 16.536 16.353 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -5.747 17.090 15.036 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -3.418 18.794 15.918 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -3.115 17.380 14.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -3.407 19.349 13.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -4.659 18.244 13.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -4.953 19.615 14.226 1.00 0.00 H new ATOM 1451 N GLU A 89 -8.875 19.314 18.058 1.00 0.00 N ATOM 1452 CA GLU A 89 -9.633 20.529 17.781 1.00 0.00 C ATOM 1453 C GLU A 89 -9.203 21.661 18.710 1.00 0.00 C ATOM 1454 O GLU A 89 -8.908 21.438 19.884 1.00 0.00 O ATOM 1455 CB GLU A 89 -11.133 20.268 17.938 1.00 0.00 C ATOM 1456 CG GLU A 89 -12.006 21.339 17.307 1.00 0.00 C ATOM 1457 CD GLU A 89 -13.486 21.067 17.489 1.00 0.00 C ATOM 1458 OE1 GLU A 89 -14.028 21.419 18.557 1.00 0.00 O ATOM 1459 OE2 GLU A 89 -14.103 20.502 16.561 1.00 0.00 O ATOM 0 H GLU A 89 -8.477 19.270 18.996 1.00 0.00 H new ATOM 0 HA GLU A 89 -9.429 20.828 16.753 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -11.374 19.304 17.490 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -11.372 20.195 18.999 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.762 22.307 17.746 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -11.781 21.405 16.243 1.00 0.00 H new ATOM 1466 N SER A 90 -9.170 22.877 18.174 1.00 0.00 N ATOM 1467 CA SER A 90 -8.773 24.045 18.952 1.00 0.00 C ATOM 1468 C SER A 90 -9.708 25.220 18.684 1.00 0.00 C ATOM 1469 O SER A 90 -9.994 25.551 17.534 1.00 0.00 O ATOM 1470 CB SER A 90 -7.332 24.438 18.620 1.00 0.00 C ATOM 1471 OG SER A 90 -6.880 25.481 19.467 1.00 0.00 O ATOM 0 H SER A 90 -9.413 23.079 17.204 1.00 0.00 H new ATOM 0 HA SER A 90 -8.838 23.787 20.009 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.681 23.570 18.727 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.269 24.757 17.580 1.00 0.00 H new ATOM 0 HG SER A 90 -5.956 25.713 19.236 1.00 0.00 H new ATOM 1477 N GLY A 91 -10.180 25.849 19.756 1.00 0.00 N ATOM 1478 CA GLY A 91 -11.078 26.980 19.617 1.00 0.00 C ATOM 1479 C GLY A 91 -11.197 27.787 20.895 1.00 0.00 C ATOM 1480 O GLY A 91 -12.118 27.598 21.690 1.00 0.00 O ATOM 0 H GLY A 91 -9.956 25.595 20.718 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -10.722 27.626 18.815 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -12.065 26.622 19.324 1.00 0.00 H new ATOM 1484 N PRO A 92 -10.247 28.709 21.108 1.00 0.00 N ATOM 1485 CA PRO A 92 -10.227 29.565 22.298 1.00 0.00 C ATOM 1486 C PRO A 92 -11.357 30.588 22.295 1.00 0.00 C ATOM 1487 O PRO A 92 -12.019 30.794 21.278 1.00 0.00 O ATOM 1488 CB PRO A 92 -8.869 30.267 22.206 1.00 0.00 C ATOM 1489 CG PRO A 92 -8.536 30.259 20.755 1.00 0.00 C ATOM 1490 CD PRO A 92 -9.119 28.988 20.202 1.00 0.00 C ATOM 0 HA PRO A 92 -10.365 28.992 23.215 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -8.922 31.284 22.594 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -8.112 29.742 22.789 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -8.956 31.131 20.254 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -7.457 30.292 20.602 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -9.452 29.113 19.172 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.391 28.177 20.205 1.00 0.00 H new ATOM 1498 N SER A 93 -11.573 31.227 23.441 1.00 0.00 N ATOM 1499 CA SER A 93 -12.627 32.227 23.571 1.00 0.00 C ATOM 1500 C SER A 93 -12.068 33.536 24.121 1.00 0.00 C ATOM 1501 O SER A 93 -12.029 33.746 25.334 1.00 0.00 O ATOM 1502 CB SER A 93 -13.739 31.710 24.485 1.00 0.00 C ATOM 1503 OG SER A 93 -13.253 31.469 25.794 1.00 0.00 O ATOM 0 H SER A 93 -11.033 31.070 24.292 1.00 0.00 H new ATOM 0 HA SER A 93 -13.040 32.416 22.580 1.00 0.00 H new ATOM 0 HB2 SER A 93 -14.550 32.437 24.523 1.00 0.00 H new ATOM 0 HB3 SER A 93 -14.154 30.790 24.073 1.00 0.00 H new ATOM 0 HG SER A 93 -12.788 32.267 26.123 1.00 0.00 H new ATOM 1509 N SER A 94 -11.636 34.413 23.220 1.00 0.00 N ATOM 1510 CA SER A 94 -11.076 35.700 23.614 1.00 0.00 C ATOM 1511 C SER A 94 -10.960 36.633 22.412 1.00 0.00 C ATOM 1512 O SER A 94 -10.101 36.449 21.551 1.00 0.00 O ATOM 1513 CB SER A 94 -9.702 35.507 24.258 1.00 0.00 C ATOM 1514 OG SER A 94 -9.128 36.751 24.620 1.00 0.00 O ATOM 0 H SER A 94 -11.663 34.255 22.213 1.00 0.00 H new ATOM 0 HA SER A 94 -11.750 36.154 24.341 1.00 0.00 H new ATOM 0 HB2 SER A 94 -9.797 34.876 25.142 1.00 0.00 H new ATOM 0 HB3 SER A 94 -9.042 34.987 23.564 1.00 0.00 H new ATOM 0 HG SER A 94 -8.251 36.600 25.031 1.00 0.00 H new ATOM 1520 N GLY A 95 -11.832 37.635 22.362 1.00 0.00 N ATOM 1521 CA GLY A 95 -11.812 38.582 21.263 1.00 0.00 C ATOM 1522 C GLY A 95 -12.257 39.969 21.684 1.00 0.00 C ATOM 1523 O GLY A 95 -13.418 40.174 22.038 1.00 0.00 O ATOM 0 H GLY A 95 -12.552 37.808 23.063 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -10.804 38.636 20.853 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -12.462 38.222 20.465 1.00 0.00 H new TER 1527 GLY A 95