USER MOD reduce.3.24.130724 H: found=0, std=0, add=622, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 618 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 14 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 17 MET CE :methyl -150:sc= -0.192 (180deg=-0.671) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 136:sc= 1.18 USER MOD Single : A 13 CYS SG : rot -45:sc= 1.4 USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.534 USER MOD Single : A 27 SER OG : rot -90:sc= 0.536 USER MOD Single : A 28 GLN : amide:sc= 0.385 K(o=0.38,f=-0.42) USER MOD Single : A 29 TYR OH : rot 180:sc= -1.2 USER MOD Single : A 33 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.22) USER MOD Single : A 48 THR OG1 : rot -11:sc= 0.152 USER MOD Single : A 53 GLN : amide:sc= -0.0446 K(o=-0.045,f=-0.58) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 CYS SG : rot 180:sc= -0.4 USER MOD Single : A 66 LYS NZ :NH3+ -156:sc= -0.0141 (180deg=-0.245) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= -1.74! K(o=-1.7!,f=-0.66) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.0304 X(o=-0.03,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HD1:sc= -0.362 X(o=-0.36,f=-0.14) USER MOD Single : A 80 ASN : amide:sc= -0.011 X(o=-0.011,f=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.127 K(o=-0.13,f=-1.1) USER MOD Single : A 83 SER OG : rot 21:sc= 0.0298 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.079 10.826 2.289 1.00 0.00 N ATOM 2 CA GLY A 1 -15.614 10.322 3.569 1.00 0.00 C ATOM 3 C GLY A 1 -15.476 11.418 4.607 1.00 0.00 C ATOM 4 O GLY A 1 -16.389 11.653 5.398 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.157 10.039 1.614 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.010 11.273 2.409 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.403 11.528 1.926 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.310 9.566 3.933 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.651 9.830 3.434 1.00 0.00 H new ATOM 8 N SER A 2 -14.327 12.088 4.607 1.00 0.00 N ATOM 9 CA SER A 2 -14.069 13.161 5.560 1.00 0.00 C ATOM 10 C SER A 2 -13.450 14.369 4.863 1.00 0.00 C ATOM 11 O SER A 2 -13.890 15.503 5.054 1.00 0.00 O ATOM 12 CB SER A 2 -13.143 12.670 6.674 1.00 0.00 C ATOM 13 OG SER A 2 -13.497 13.242 7.921 1.00 0.00 O ATOM 0 H SER A 2 -13.561 11.907 3.958 1.00 0.00 H new ATOM 0 HA SER A 2 -15.021 13.464 5.996 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.194 11.583 6.741 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.111 12.926 6.433 1.00 0.00 H new ATOM 0 HG SER A 2 -12.891 12.911 8.617 1.00 0.00 H new ATOM 19 N SER A 3 -12.426 14.118 4.055 1.00 0.00 N ATOM 20 CA SER A 3 -11.743 15.184 3.331 1.00 0.00 C ATOM 21 C SER A 3 -11.698 14.884 1.836 1.00 0.00 C ATOM 22 O SER A 3 -12.161 15.678 1.018 1.00 0.00 O ATOM 23 CB SER A 3 -10.322 15.365 3.870 1.00 0.00 C ATOM 24 OG SER A 3 -10.258 16.442 4.789 1.00 0.00 O ATOM 0 H SER A 3 -12.050 13.185 3.885 1.00 0.00 H new ATOM 0 HA SER A 3 -12.302 16.108 3.481 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.995 14.447 4.358 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.636 15.548 3.043 1.00 0.00 H new ATOM 0 HG SER A 3 -9.340 16.536 5.120 1.00 0.00 H new ATOM 30 N GLY A 4 -11.136 13.731 1.487 1.00 0.00 N ATOM 31 CA GLY A 4 -11.041 13.345 0.091 1.00 0.00 C ATOM 32 C GLY A 4 -9.679 12.781 -0.263 1.00 0.00 C ATOM 33 O GLY A 4 -9.044 13.227 -1.218 1.00 0.00 O ATOM 0 H GLY A 4 -10.745 13.057 2.146 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.807 12.602 -0.130 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.246 14.212 -0.537 1.00 0.00 H new ATOM 37 N SER A 5 -9.228 11.797 0.510 1.00 0.00 N ATOM 38 CA SER A 5 -7.930 11.176 0.278 1.00 0.00 C ATOM 39 C SER A 5 -8.096 9.732 -0.187 1.00 0.00 C ATOM 40 O SER A 5 -9.135 9.111 0.038 1.00 0.00 O ATOM 41 CB SER A 5 -7.083 11.221 1.551 1.00 0.00 C ATOM 42 OG SER A 5 -5.702 11.277 1.242 1.00 0.00 O ATOM 0 H SER A 5 -9.743 11.413 1.302 1.00 0.00 H new ATOM 0 HA SER A 5 -7.421 11.736 -0.506 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.361 12.091 2.146 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.287 10.340 2.159 1.00 0.00 H new ATOM 0 HG SER A 5 -5.182 11.307 2.072 1.00 0.00 H new ATOM 48 N SER A 6 -7.064 9.203 -0.835 1.00 0.00 N ATOM 49 CA SER A 6 -7.094 7.833 -1.336 1.00 0.00 C ATOM 50 C SER A 6 -5.839 7.075 -0.918 1.00 0.00 C ATOM 51 O SER A 6 -4.920 6.886 -1.715 1.00 0.00 O ATOM 52 CB SER A 6 -7.225 7.827 -2.860 1.00 0.00 C ATOM 53 OG SER A 6 -6.243 8.655 -3.459 1.00 0.00 O ATOM 0 H SER A 6 -6.195 9.702 -1.026 1.00 0.00 H new ATOM 0 HA SER A 6 -7.960 7.333 -0.903 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.123 6.808 -3.233 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.219 8.172 -3.144 1.00 0.00 H new ATOM 0 HG SER A 6 -5.853 8.194 -4.231 1.00 0.00 H new ATOM 59 N GLY A 7 -5.807 6.641 0.338 1.00 0.00 N ATOM 60 CA GLY A 7 -4.660 5.908 0.841 1.00 0.00 C ATOM 61 C GLY A 7 -5.057 4.778 1.772 1.00 0.00 C ATOM 62 O GLY A 7 -5.772 4.994 2.751 1.00 0.00 O ATOM 0 H GLY A 7 -6.555 6.784 1.016 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.096 5.502 0.002 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.997 6.594 1.369 1.00 0.00 H new ATOM 66 N VAL A 8 -4.593 3.571 1.467 1.00 0.00 N ATOM 67 CA VAL A 8 -4.903 2.403 2.283 1.00 0.00 C ATOM 68 C VAL A 8 -3.635 1.655 2.678 1.00 0.00 C ATOM 69 O VAL A 8 -2.609 1.753 2.005 1.00 0.00 O ATOM 70 CB VAL A 8 -5.847 1.437 1.543 1.00 0.00 C ATOM 71 CG1 VAL A 8 -7.186 2.105 1.266 1.00 0.00 C ATOM 72 CG2 VAL A 8 -5.207 0.951 0.252 1.00 0.00 C ATOM 0 H VAL A 8 -4.000 3.376 0.660 1.00 0.00 H new ATOM 0 HA VAL A 8 -5.400 2.768 3.182 1.00 0.00 H new ATOM 0 HB VAL A 8 -6.025 0.572 2.181 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -7.839 1.407 0.743 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.648 2.398 2.209 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.030 2.989 0.648 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -5.888 0.269 -0.258 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -4.997 1.804 -0.393 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -4.277 0.431 0.480 1.00 0.00 H new ATOM 82 N PHE A 9 -3.712 0.908 3.774 1.00 0.00 N ATOM 83 CA PHE A 9 -2.570 0.143 4.260 1.00 0.00 C ATOM 84 C PHE A 9 -2.795 -1.353 4.063 1.00 0.00 C ATOM 85 O PHE A 9 -3.824 -1.897 4.466 1.00 0.00 O ATOM 86 CB PHE A 9 -2.320 0.443 5.739 1.00 0.00 C ATOM 87 CG PHE A 9 -1.636 1.759 5.976 1.00 0.00 C ATOM 88 CD1 PHE A 9 -0.314 1.944 5.605 1.00 0.00 C ATOM 89 CD2 PHE A 9 -2.315 2.810 6.571 1.00 0.00 C ATOM 90 CE1 PHE A 9 0.318 3.154 5.824 1.00 0.00 C ATOM 91 CE2 PHE A 9 -1.689 4.022 6.791 1.00 0.00 C ATOM 92 CZ PHE A 9 -0.370 4.194 6.416 1.00 0.00 C ATOM 0 H PHE A 9 -4.554 0.816 4.343 1.00 0.00 H new ATOM 0 HA PHE A 9 -1.694 0.440 3.684 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -3.273 0.437 6.269 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -1.713 -0.355 6.166 1.00 0.00 H new ATOM 0 HD1 PHE A 9 0.229 1.134 5.140 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -3.346 2.680 6.866 1.00 0.00 H new ATOM 0 HE1 PHE A 9 1.349 3.285 5.532 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -2.230 4.834 7.255 1.00 0.00 H new ATOM 0 HZ PHE A 9 0.122 5.140 6.586 1.00 0.00 H new ATOM 102 N VAL A 10 -1.824 -2.015 3.441 1.00 0.00 N ATOM 103 CA VAL A 10 -1.915 -3.449 3.192 1.00 0.00 C ATOM 104 C VAL A 10 -1.018 -4.231 4.145 1.00 0.00 C ATOM 105 O VAL A 10 0.115 -4.575 3.808 1.00 0.00 O ATOM 106 CB VAL A 10 -1.525 -3.792 1.741 1.00 0.00 C ATOM 107 CG1 VAL A 10 -1.694 -5.281 1.481 1.00 0.00 C ATOM 108 CG2 VAL A 10 -2.352 -2.973 0.761 1.00 0.00 C ATOM 0 H VAL A 10 -0.966 -1.581 3.101 1.00 0.00 H new ATOM 0 HA VAL A 10 -2.954 -3.734 3.359 1.00 0.00 H new ATOM 0 HB VAL A 10 -0.475 -3.540 1.595 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.414 -5.505 0.452 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.055 -5.844 2.161 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -2.734 -5.563 1.644 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.064 -3.227 -0.259 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.410 -3.193 0.905 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.175 -1.911 0.934 1.00 0.00 H new ATOM 118 N GLY A 11 -1.533 -4.510 5.339 1.00 0.00 N ATOM 119 CA GLY A 11 -0.765 -5.249 6.324 1.00 0.00 C ATOM 120 C GLY A 11 -0.676 -6.726 5.998 1.00 0.00 C ATOM 121 O GLY A 11 -1.198 -7.177 4.978 1.00 0.00 O ATOM 0 H GLY A 11 -2.468 -4.237 5.641 1.00 0.00 H new ATOM 0 HA2 GLY A 11 0.240 -4.832 6.384 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -1.222 -5.123 7.306 1.00 0.00 H new ATOM 125 N ARG A 12 -0.011 -7.483 6.866 1.00 0.00 N ATOM 126 CA ARG A 12 0.147 -8.918 6.663 1.00 0.00 C ATOM 127 C ARG A 12 0.905 -9.205 5.371 1.00 0.00 C ATOM 128 O ARG A 12 0.804 -10.295 4.809 1.00 0.00 O ATOM 129 CB ARG A 12 -1.220 -9.604 6.630 1.00 0.00 C ATOM 130 CG ARG A 12 -1.996 -9.483 7.930 1.00 0.00 C ATOM 131 CD ARG A 12 -2.735 -10.769 8.260 1.00 0.00 C ATOM 132 NE ARG A 12 -1.839 -11.923 8.291 1.00 0.00 N ATOM 133 CZ ARG A 12 -2.254 -13.179 8.167 1.00 0.00 C ATOM 134 NH1 ARG A 12 -3.543 -13.442 8.005 1.00 0.00 N ATOM 135 NH2 ARG A 12 -1.377 -14.174 8.206 1.00 0.00 N ATOM 0 H ARG A 12 0.426 -7.126 7.716 1.00 0.00 H new ATOM 0 HA ARG A 12 0.725 -9.316 7.497 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -1.813 -9.175 5.822 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -1.081 -10.660 6.397 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -1.311 -9.237 8.742 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -2.709 -8.662 7.854 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -3.227 -10.666 9.227 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -3.518 -10.937 7.520 1.00 0.00 H new ATOM 0 HE ARG A 12 -0.841 -11.755 8.415 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -4.219 -12.679 7.975 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -3.859 -14.407 7.910 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -0.385 -13.974 8.331 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -1.695 -15.138 8.111 1.00 0.00 H new ATOM 149 N CYS A 13 1.662 -8.218 4.905 1.00 0.00 N ATOM 150 CA CYS A 13 2.437 -8.364 3.676 1.00 0.00 C ATOM 151 C CYS A 13 3.779 -9.031 3.956 1.00 0.00 C ATOM 152 O CYS A 13 4.029 -9.508 5.063 1.00 0.00 O ATOM 153 CB CYS A 13 2.659 -6.998 3.025 1.00 0.00 C ATOM 154 SG CYS A 13 2.036 -6.879 1.331 1.00 0.00 S ATOM 0 H CYS A 13 1.756 -7.309 5.358 1.00 0.00 H new ATOM 0 HA CYS A 13 1.873 -8.998 2.992 1.00 0.00 H new ATOM 0 HB2 CYS A 13 2.175 -6.234 3.634 1.00 0.00 H new ATOM 0 HB3 CYS A 13 3.726 -6.776 3.025 1.00 0.00 H new ATOM 0 HG CYS A 13 2.387 -7.938 0.664 1.00 0.00 H new ATOM 160 N THR A 14 4.640 -9.062 2.945 1.00 0.00 N ATOM 161 CA THR A 14 5.957 -9.674 3.080 1.00 0.00 C ATOM 162 C THR A 14 7.021 -8.853 2.360 1.00 0.00 C ATOM 163 O THR A 14 6.705 -7.941 1.598 1.00 0.00 O ATOM 164 CB THR A 14 5.968 -11.110 2.522 1.00 0.00 C ATOM 165 OG1 THR A 14 5.705 -11.092 1.115 1.00 0.00 O ATOM 166 CG2 THR A 14 4.931 -11.973 3.226 1.00 0.00 C ATOM 0 H THR A 14 4.450 -8.670 2.023 1.00 0.00 H new ATOM 0 HA THR A 14 6.185 -9.704 4.146 1.00 0.00 H new ATOM 0 HB THR A 14 6.955 -11.537 2.701 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.716 -12.009 0.768 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.958 -12.982 2.815 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.152 -12.010 4.293 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.939 -11.546 3.075 1.00 0.00 H new ATOM 174 N GLY A 15 8.285 -9.185 2.608 1.00 0.00 N ATOM 175 CA GLY A 15 9.376 -8.468 1.975 1.00 0.00 C ATOM 176 C GLY A 15 9.502 -8.788 0.498 1.00 0.00 C ATOM 177 O GLY A 15 9.642 -7.888 -0.329 1.00 0.00 O ATOM 0 H GLY A 15 8.572 -9.937 3.235 1.00 0.00 H new ATOM 0 HA2 GLY A 15 9.222 -7.396 2.099 1.00 0.00 H new ATOM 0 HA3 GLY A 15 10.310 -8.717 2.478 1.00 0.00 H new ATOM 181 N ASP A 16 9.453 -10.074 0.167 1.00 0.00 N ATOM 182 CA ASP A 16 9.562 -10.511 -1.220 1.00 0.00 C ATOM 183 C ASP A 16 8.709 -9.638 -2.134 1.00 0.00 C ATOM 184 O ASP A 16 9.177 -9.160 -3.167 1.00 0.00 O ATOM 185 CB ASP A 16 9.139 -11.974 -1.351 1.00 0.00 C ATOM 186 CG ASP A 16 10.032 -12.909 -0.560 1.00 0.00 C ATOM 187 OD1 ASP A 16 11.257 -12.666 -0.519 1.00 0.00 O ATOM 188 OD2 ASP A 16 9.508 -13.884 0.018 1.00 0.00 O ATOM 0 H ASP A 16 9.339 -10.832 0.840 1.00 0.00 H new ATOM 0 HA ASP A 16 10.604 -10.414 -1.524 1.00 0.00 H new ATOM 0 HB2 ASP A 16 8.110 -12.083 -1.009 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.158 -12.262 -2.402 1.00 0.00 H new ATOM 193 N MET A 17 7.454 -9.434 -1.746 1.00 0.00 N ATOM 194 CA MET A 17 6.535 -8.617 -2.530 1.00 0.00 C ATOM 195 C MET A 17 7.179 -7.288 -2.912 1.00 0.00 C ATOM 196 O MET A 17 7.917 -6.694 -2.125 1.00 0.00 O ATOM 197 CB MET A 17 5.246 -8.365 -1.746 1.00 0.00 C ATOM 198 CG MET A 17 4.187 -9.437 -1.956 1.00 0.00 C ATOM 199 SD MET A 17 2.666 -9.096 -1.051 1.00 0.00 S ATOM 200 CE MET A 17 2.342 -10.698 -0.319 1.00 0.00 C ATOM 0 H MET A 17 7.051 -9.823 -0.894 1.00 0.00 H new ATOM 0 HA MET A 17 6.295 -9.161 -3.444 1.00 0.00 H new ATOM 0 HB2 MET A 17 5.483 -8.303 -0.684 1.00 0.00 H new ATOM 0 HB3 MET A 17 4.836 -7.398 -2.038 1.00 0.00 H new ATOM 0 HG2 MET A 17 3.962 -9.517 -3.020 1.00 0.00 H new ATOM 0 HG3 MET A 17 4.584 -10.402 -1.641 1.00 0.00 H new ATOM 0 HE1 MET A 17 1.267 -10.832 -0.198 1.00 0.00 H new ATOM 0 HE2 MET A 17 2.735 -11.481 -0.968 1.00 0.00 H new ATOM 0 HE3 MET A 17 2.827 -10.758 0.655 1.00 0.00 H new ATOM 210 N THR A 18 6.896 -6.825 -4.126 1.00 0.00 N ATOM 211 CA THR A 18 7.449 -5.568 -4.613 1.00 0.00 C ATOM 212 C THR A 18 6.349 -4.647 -5.130 1.00 0.00 C ATOM 213 O THR A 18 5.375 -5.105 -5.727 1.00 0.00 O ATOM 214 CB THR A 18 8.477 -5.804 -5.736 1.00 0.00 C ATOM 215 OG1 THR A 18 7.906 -6.632 -6.756 1.00 0.00 O ATOM 216 CG2 THR A 18 9.736 -6.458 -5.189 1.00 0.00 C ATOM 0 H THR A 18 6.287 -7.303 -4.790 1.00 0.00 H new ATOM 0 HA THR A 18 7.948 -5.094 -3.768 1.00 0.00 H new ATOM 0 HB THR A 18 8.746 -4.837 -6.162 1.00 0.00 H new ATOM 0 HG1 THR A 18 8.565 -6.776 -7.467 1.00 0.00 H new ATOM 0 HG21 THR A 18 10.447 -6.615 -6.000 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.184 -5.811 -4.434 1.00 0.00 H new ATOM 0 HG23 THR A 18 9.482 -7.418 -4.739 1.00 0.00 H new ATOM 224 N GLU A 19 6.514 -3.349 -4.900 1.00 0.00 N ATOM 225 CA GLU A 19 5.533 -2.364 -5.343 1.00 0.00 C ATOM 226 C GLU A 19 4.921 -2.772 -6.681 1.00 0.00 C ATOM 227 O GLU A 19 3.732 -2.559 -6.922 1.00 0.00 O ATOM 228 CB GLU A 19 6.182 -0.985 -5.466 1.00 0.00 C ATOM 229 CG GLU A 19 6.493 -0.337 -4.128 1.00 0.00 C ATOM 230 CD GLU A 19 7.433 0.845 -4.257 1.00 0.00 C ATOM 231 OE1 GLU A 19 7.509 1.425 -5.361 1.00 0.00 O ATOM 232 OE2 GLU A 19 8.092 1.193 -3.254 1.00 0.00 O ATOM 0 H GLU A 19 7.317 -2.954 -4.410 1.00 0.00 H new ATOM 0 HA GLU A 19 4.739 -2.318 -4.598 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.105 -1.077 -6.039 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.519 -0.330 -6.032 1.00 0.00 H new ATOM 0 HG2 GLU A 19 5.564 -0.008 -3.663 1.00 0.00 H new ATOM 0 HG3 GLU A 19 6.937 -1.079 -3.464 1.00 0.00 H new ATOM 239 N ASP A 20 5.740 -3.357 -7.546 1.00 0.00 N ATOM 240 CA ASP A 20 5.281 -3.795 -8.860 1.00 0.00 C ATOM 241 C ASP A 20 4.195 -4.858 -8.728 1.00 0.00 C ATOM 242 O ASP A 20 3.116 -4.731 -9.306 1.00 0.00 O ATOM 243 CB ASP A 20 6.451 -4.343 -9.676 1.00 0.00 C ATOM 244 CG ASP A 20 6.106 -4.508 -11.143 1.00 0.00 C ATOM 245 OD1 ASP A 20 5.364 -5.456 -11.476 1.00 0.00 O ATOM 246 OD2 ASP A 20 6.578 -3.689 -11.959 1.00 0.00 O ATOM 0 H ASP A 20 6.726 -3.540 -7.362 1.00 0.00 H new ATOM 0 HA ASP A 20 4.861 -2.933 -9.377 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.304 -3.671 -9.580 1.00 0.00 H new ATOM 0 HB3 ASP A 20 6.756 -5.306 -9.267 1.00 0.00 H new ATOM 251 N GLU A 21 4.488 -5.907 -7.965 1.00 0.00 N ATOM 252 CA GLU A 21 3.537 -6.992 -7.760 1.00 0.00 C ATOM 253 C GLU A 21 2.180 -6.451 -7.321 1.00 0.00 C ATOM 254 O GLU A 21 1.173 -6.636 -8.007 1.00 0.00 O ATOM 255 CB GLU A 21 4.068 -7.976 -6.715 1.00 0.00 C ATOM 256 CG GLU A 21 5.442 -8.534 -7.047 1.00 0.00 C ATOM 257 CD GLU A 21 5.374 -9.762 -7.934 1.00 0.00 C ATOM 258 OE1 GLU A 21 4.691 -10.734 -7.548 1.00 0.00 O ATOM 259 OE2 GLU A 21 6.004 -9.751 -9.012 1.00 0.00 O ATOM 0 H GLU A 21 5.377 -6.028 -7.479 1.00 0.00 H new ATOM 0 HA GLU A 21 3.411 -7.514 -8.709 1.00 0.00 H new ATOM 0 HB2 GLU A 21 4.112 -7.476 -5.747 1.00 0.00 H new ATOM 0 HB3 GLU A 21 3.364 -8.802 -6.615 1.00 0.00 H new ATOM 0 HG2 GLU A 21 6.032 -7.764 -7.544 1.00 0.00 H new ATOM 0 HG3 GLU A 21 5.961 -8.787 -6.122 1.00 0.00 H new ATOM 266 N LEU A 22 2.159 -5.782 -6.174 1.00 0.00 N ATOM 267 CA LEU A 22 0.926 -5.213 -5.642 1.00 0.00 C ATOM 268 C LEU A 22 0.324 -4.208 -6.618 1.00 0.00 C ATOM 269 O LEU A 22 -0.851 -4.303 -6.975 1.00 0.00 O ATOM 270 CB LEU A 22 1.193 -4.536 -4.296 1.00 0.00 C ATOM 271 CG LEU A 22 1.684 -5.448 -3.172 1.00 0.00 C ATOM 272 CD1 LEU A 22 2.957 -4.893 -2.551 1.00 0.00 C ATOM 273 CD2 LEU A 22 0.604 -5.621 -2.114 1.00 0.00 C ATOM 0 H LEU A 22 2.982 -5.620 -5.594 1.00 0.00 H new ATOM 0 HA LEU A 22 0.213 -6.025 -5.499 1.00 0.00 H new ATOM 0 HB2 LEU A 22 1.932 -3.750 -4.448 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.274 -4.050 -3.968 1.00 0.00 H new ATOM 0 HG LEU A 22 1.908 -6.426 -3.597 1.00 0.00 H new ATOM 0 HD11 LEU A 22 3.291 -5.556 -1.753 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.733 -4.823 -3.313 1.00 0.00 H new ATOM 0 HD13 LEU A 22 2.760 -3.902 -2.141 1.00 0.00 H new ATOM 0 HD21 LEU A 22 0.972 -6.273 -1.322 1.00 0.00 H new ATOM 0 HD22 LEU A 22 0.348 -4.649 -1.693 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.282 -6.065 -2.568 1.00 0.00 H new ATOM 285 N ARG A 23 1.136 -3.248 -7.047 1.00 0.00 N ATOM 286 CA ARG A 23 0.684 -2.227 -7.984 1.00 0.00 C ATOM 287 C ARG A 23 -0.038 -2.858 -9.170 1.00 0.00 C ATOM 288 O ARG A 23 -0.964 -2.271 -9.730 1.00 0.00 O ATOM 289 CB ARG A 23 1.870 -1.396 -8.479 1.00 0.00 C ATOM 290 CG ARG A 23 1.520 -0.454 -9.618 1.00 0.00 C ATOM 291 CD ARG A 23 2.446 0.753 -9.647 1.00 0.00 C ATOM 292 NE ARG A 23 3.588 0.546 -10.532 1.00 0.00 N ATOM 293 CZ ARG A 23 4.705 -0.068 -10.158 1.00 0.00 C ATOM 294 NH1 ARG A 23 4.829 -0.533 -8.924 1.00 0.00 N ATOM 295 NH2 ARG A 23 5.702 -0.218 -11.023 1.00 0.00 N ATOM 0 H ARG A 23 2.111 -3.156 -6.761 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.015 -1.574 -7.460 1.00 0.00 H new ATOM 0 HB2 ARG A 23 2.268 -0.815 -7.647 1.00 0.00 H new ATOM 0 HB3 ARG A 23 2.663 -2.069 -8.806 1.00 0.00 H new ATOM 0 HG2 ARG A 23 1.586 -0.987 -10.566 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.488 -0.120 -9.511 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.888 1.630 -9.975 1.00 0.00 H new ATOM 0 HD3 ARG A 23 2.802 0.961 -8.638 1.00 0.00 H new ATOM 0 HE ARG A 23 3.525 0.892 -11.490 1.00 0.00 H new ATOM 0 HH11 ARG A 23 4.065 -0.420 -8.257 1.00 0.00 H new ATOM 0 HH12 ARG A 23 5.688 -1.004 -8.640 1.00 0.00 H new ATOM 0 HH21 ARG A 23 5.610 0.138 -11.974 1.00 0.00 H new ATOM 0 HH22 ARG A 23 6.560 -0.689 -10.736 1.00 0.00 H new ATOM 309 N GLU A 24 0.393 -4.058 -9.549 1.00 0.00 N ATOM 310 CA GLU A 24 -0.212 -4.767 -10.670 1.00 0.00 C ATOM 311 C GLU A 24 -1.370 -5.642 -10.199 1.00 0.00 C ATOM 312 O GLU A 24 -2.238 -6.018 -10.987 1.00 0.00 O ATOM 313 CB GLU A 24 0.835 -5.627 -11.383 1.00 0.00 C ATOM 314 CG GLU A 24 1.337 -5.022 -12.683 1.00 0.00 C ATOM 315 CD GLU A 24 0.447 -5.356 -13.863 1.00 0.00 C ATOM 316 OE1 GLU A 24 0.147 -6.552 -14.062 1.00 0.00 O ATOM 317 OE2 GLU A 24 0.049 -4.421 -14.590 1.00 0.00 O ATOM 0 H GLU A 24 1.158 -4.558 -9.096 1.00 0.00 H new ATOM 0 HA GLU A 24 -0.600 -4.026 -11.369 1.00 0.00 H new ATOM 0 HB2 GLU A 24 1.681 -5.783 -10.714 1.00 0.00 H new ATOM 0 HB3 GLU A 24 0.407 -6.608 -11.590 1.00 0.00 H new ATOM 0 HG2 GLU A 24 1.400 -3.939 -12.575 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.347 -5.382 -12.881 1.00 0.00 H new ATOM 324 N PHE A 25 -1.374 -5.963 -8.910 1.00 0.00 N ATOM 325 CA PHE A 25 -2.424 -6.795 -8.333 1.00 0.00 C ATOM 326 C PHE A 25 -3.673 -5.970 -8.039 1.00 0.00 C ATOM 327 O PHE A 25 -4.793 -6.477 -8.092 1.00 0.00 O ATOM 328 CB PHE A 25 -1.928 -7.463 -7.049 1.00 0.00 C ATOM 329 CG PHE A 25 -2.986 -8.254 -6.337 1.00 0.00 C ATOM 330 CD1 PHE A 25 -3.195 -9.589 -6.642 1.00 0.00 C ATOM 331 CD2 PHE A 25 -3.773 -7.664 -5.361 1.00 0.00 C ATOM 332 CE1 PHE A 25 -4.169 -10.321 -5.988 1.00 0.00 C ATOM 333 CE2 PHE A 25 -4.748 -8.391 -4.704 1.00 0.00 C ATOM 334 CZ PHE A 25 -4.947 -9.721 -5.019 1.00 0.00 C ATOM 0 H PHE A 25 -0.662 -5.660 -8.245 1.00 0.00 H new ATOM 0 HA PHE A 25 -2.681 -7.565 -9.060 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -1.094 -8.122 -7.291 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -1.544 -6.697 -6.376 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -2.590 -10.064 -7.400 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -3.623 -6.624 -5.111 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -4.321 -11.361 -6.235 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -5.354 -7.919 -3.945 1.00 0.00 H new ATOM 0 HZ PHE A 25 -5.710 -10.290 -4.508 1.00 0.00 H new ATOM 344 N PHE A 26 -3.472 -4.692 -7.730 1.00 0.00 N ATOM 345 CA PHE A 26 -4.581 -3.796 -7.427 1.00 0.00 C ATOM 346 C PHE A 26 -5.039 -3.054 -8.679 1.00 0.00 C ATOM 347 O PHE A 26 -5.984 -2.267 -8.637 1.00 0.00 O ATOM 348 CB PHE A 26 -4.172 -2.791 -6.347 1.00 0.00 C ATOM 349 CG PHE A 26 -4.028 -3.403 -4.983 1.00 0.00 C ATOM 350 CD1 PHE A 26 -5.147 -3.734 -4.236 1.00 0.00 C ATOM 351 CD2 PHE A 26 -2.773 -3.648 -4.448 1.00 0.00 C ATOM 352 CE1 PHE A 26 -5.017 -4.297 -2.980 1.00 0.00 C ATOM 353 CE2 PHE A 26 -2.637 -4.211 -3.193 1.00 0.00 C ATOM 354 CZ PHE A 26 -3.761 -4.536 -2.458 1.00 0.00 C ATOM 0 H PHE A 26 -2.552 -4.255 -7.683 1.00 0.00 H new ATOM 0 HA PHE A 26 -5.411 -4.398 -7.059 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -3.226 -2.329 -6.631 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -4.915 -1.995 -6.303 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.132 -3.550 -4.639 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -1.891 -3.396 -5.018 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.897 -4.550 -2.407 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -1.653 -4.397 -2.787 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.657 -4.976 -1.477 1.00 0.00 H new ATOM 364 N SER A 27 -4.362 -3.312 -9.793 1.00 0.00 N ATOM 365 CA SER A 27 -4.695 -2.666 -11.058 1.00 0.00 C ATOM 366 C SER A 27 -6.038 -3.164 -11.583 1.00 0.00 C ATOM 367 O SER A 27 -6.774 -2.423 -12.235 1.00 0.00 O ATOM 368 CB SER A 27 -3.600 -2.929 -12.093 1.00 0.00 C ATOM 369 OG SER A 27 -3.788 -4.183 -12.726 1.00 0.00 O ATOM 0 H SER A 27 -3.579 -3.964 -9.846 1.00 0.00 H new ATOM 0 HA SER A 27 -4.768 -1.593 -10.883 1.00 0.00 H new ATOM 0 HB2 SER A 27 -3.604 -2.136 -12.841 1.00 0.00 H new ATOM 0 HB3 SER A 27 -2.624 -2.905 -11.609 1.00 0.00 H new ATOM 0 HG SER A 27 -3.308 -4.877 -12.227 1.00 0.00 H new ATOM 375 N GLN A 28 -6.350 -4.423 -11.294 1.00 0.00 N ATOM 376 CA GLN A 28 -7.604 -5.020 -11.738 1.00 0.00 C ATOM 377 C GLN A 28 -8.790 -4.410 -10.998 1.00 0.00 C ATOM 378 O GLN A 28 -9.843 -4.166 -11.586 1.00 0.00 O ATOM 379 CB GLN A 28 -7.577 -6.534 -11.522 1.00 0.00 C ATOM 380 CG GLN A 28 -7.738 -6.945 -10.068 1.00 0.00 C ATOM 381 CD GLN A 28 -7.396 -8.403 -9.832 1.00 0.00 C ATOM 382 OE1 GLN A 28 -7.486 -9.228 -10.741 1.00 0.00 O ATOM 383 NE2 GLN A 28 -7.000 -8.727 -8.607 1.00 0.00 N ATOM 0 H GLN A 28 -5.752 -5.049 -10.755 1.00 0.00 H new ATOM 0 HA GLN A 28 -7.718 -4.814 -12.802 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -8.373 -6.991 -12.110 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -6.634 -6.930 -11.900 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -7.098 -6.320 -9.445 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -8.766 -6.761 -9.754 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -6.940 -8.010 -7.884 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -6.756 -9.693 -8.389 1.00 0.00 H new ATOM 392 N TYR A 29 -8.611 -4.167 -9.704 1.00 0.00 N ATOM 393 CA TYR A 29 -9.668 -3.588 -8.882 1.00 0.00 C ATOM 394 C TYR A 29 -10.008 -2.176 -9.347 1.00 0.00 C ATOM 395 O TYR A 29 -11.155 -1.878 -9.676 1.00 0.00 O ATOM 396 CB TYR A 29 -9.244 -3.565 -7.413 1.00 0.00 C ATOM 397 CG TYR A 29 -9.280 -4.924 -6.750 1.00 0.00 C ATOM 398 CD1 TYR A 29 -10.455 -5.417 -6.197 1.00 0.00 C ATOM 399 CD2 TYR A 29 -8.140 -5.714 -6.678 1.00 0.00 C ATOM 400 CE1 TYR A 29 -10.493 -6.658 -5.590 1.00 0.00 C ATOM 401 CE2 TYR A 29 -8.169 -6.956 -6.076 1.00 0.00 C ATOM 402 CZ TYR A 29 -9.346 -7.424 -5.532 1.00 0.00 C ATOM 403 OH TYR A 29 -9.380 -8.660 -4.930 1.00 0.00 O ATOM 0 H TYR A 29 -7.745 -4.362 -9.202 1.00 0.00 H new ATOM 0 HA TYR A 29 -10.557 -4.209 -8.987 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -8.234 -3.162 -7.342 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -9.898 -2.886 -6.866 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -11.354 -4.820 -6.242 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -7.215 -5.350 -7.100 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -11.414 -7.026 -5.164 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -7.274 -7.558 -6.031 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.491 -9.070 -4.974 1.00 0.00 H new ATOM 413 N GLY A 30 -9.000 -1.309 -9.372 1.00 0.00 N ATOM 414 CA GLY A 30 -9.211 0.062 -9.799 1.00 0.00 C ATOM 415 C GLY A 30 -7.940 0.713 -10.306 1.00 0.00 C ATOM 416 O GLY A 30 -6.878 0.091 -10.320 1.00 0.00 O ATOM 0 H GLY A 30 -8.041 -1.532 -9.104 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -9.965 0.082 -10.586 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -9.605 0.643 -8.965 1.00 0.00 H new ATOM 420 N ASP A 31 -8.047 1.970 -10.726 1.00 0.00 N ATOM 421 CA ASP A 31 -6.897 2.707 -11.237 1.00 0.00 C ATOM 422 C ASP A 31 -5.934 3.062 -10.109 1.00 0.00 C ATOM 423 O ASP A 31 -5.929 4.190 -9.615 1.00 0.00 O ATOM 424 CB ASP A 31 -7.356 3.979 -11.952 1.00 0.00 C ATOM 425 CG ASP A 31 -7.457 3.794 -13.453 1.00 0.00 C ATOM 426 OD1 ASP A 31 -6.400 3.680 -14.108 1.00 0.00 O ATOM 427 OD2 ASP A 31 -8.592 3.766 -13.973 1.00 0.00 O ATOM 0 H ASP A 31 -8.919 2.499 -10.722 1.00 0.00 H new ATOM 0 HA ASP A 31 -6.374 2.068 -11.949 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -8.327 4.283 -11.560 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -6.657 4.787 -11.734 1.00 0.00 H new ATOM 432 N VAL A 32 -5.121 2.090 -9.704 1.00 0.00 N ATOM 433 CA VAL A 32 -4.153 2.301 -8.634 1.00 0.00 C ATOM 434 C VAL A 32 -3.121 3.353 -9.025 1.00 0.00 C ATOM 435 O VAL A 32 -2.201 3.079 -9.795 1.00 0.00 O ATOM 436 CB VAL A 32 -3.425 0.993 -8.271 1.00 0.00 C ATOM 437 CG1 VAL A 32 -2.762 0.392 -9.501 1.00 0.00 C ATOM 438 CG2 VAL A 32 -2.403 1.240 -7.172 1.00 0.00 C ATOM 0 H VAL A 32 -5.114 1.150 -10.100 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.712 2.651 -7.766 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.160 0.280 -7.899 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.253 -0.531 -9.225 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.520 0.177 -10.255 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.038 1.099 -9.906 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.898 0.305 -6.928 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -1.670 1.970 -7.515 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -2.908 1.622 -6.285 1.00 0.00 H new ATOM 448 N MET A 33 -3.281 4.558 -8.489 1.00 0.00 N ATOM 449 CA MET A 33 -2.362 5.652 -8.780 1.00 0.00 C ATOM 450 C MET A 33 -0.913 5.187 -8.675 1.00 0.00 C ATOM 451 O MET A 33 -0.148 5.283 -9.635 1.00 0.00 O ATOM 452 CB MET A 33 -2.605 6.821 -7.823 1.00 0.00 C ATOM 453 CG MET A 33 -3.702 7.766 -8.286 1.00 0.00 C ATOM 454 SD MET A 33 -3.309 8.574 -9.850 1.00 0.00 S ATOM 455 CE MET A 33 -3.001 10.249 -9.298 1.00 0.00 C ATOM 0 H MET A 33 -4.038 4.802 -7.851 1.00 0.00 H new ATOM 0 HA MET A 33 -2.546 5.985 -9.802 1.00 0.00 H new ATOM 0 HB2 MET A 33 -2.866 6.428 -6.841 1.00 0.00 H new ATOM 0 HB3 MET A 33 -1.678 7.383 -7.706 1.00 0.00 H new ATOM 0 HG2 MET A 33 -4.634 7.210 -8.393 1.00 0.00 H new ATOM 0 HG3 MET A 33 -3.869 8.525 -7.521 1.00 0.00 H new ATOM 0 HE1 MET A 33 -2.744 10.873 -10.154 1.00 0.00 H new ATOM 0 HE2 MET A 33 -3.896 10.644 -8.816 1.00 0.00 H new ATOM 0 HE3 MET A 33 -2.175 10.252 -8.587 1.00 0.00 H new ATOM 465 N ASP A 34 -0.542 4.684 -7.503 1.00 0.00 N ATOM 466 CA ASP A 34 0.816 4.203 -7.272 1.00 0.00 C ATOM 467 C ASP A 34 0.917 3.482 -5.932 1.00 0.00 C ATOM 468 O ASP A 34 0.011 3.561 -5.103 1.00 0.00 O ATOM 469 CB ASP A 34 1.806 5.368 -7.315 1.00 0.00 C ATOM 470 CG ASP A 34 3.012 5.071 -8.185 1.00 0.00 C ATOM 471 OD1 ASP A 34 2.818 4.613 -9.329 1.00 0.00 O ATOM 472 OD2 ASP A 34 4.149 5.298 -7.721 1.00 0.00 O ATOM 0 H ASP A 34 -1.162 4.598 -6.698 1.00 0.00 H new ATOM 0 HA ASP A 34 1.064 3.496 -8.063 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.300 6.257 -7.691 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.139 5.595 -6.302 1.00 0.00 H new ATOM 477 N VAL A 35 2.025 2.777 -5.727 1.00 0.00 N ATOM 478 CA VAL A 35 2.246 2.042 -4.487 1.00 0.00 C ATOM 479 C VAL A 35 3.597 2.389 -3.875 1.00 0.00 C ATOM 480 O VAL A 35 4.635 2.267 -4.526 1.00 0.00 O ATOM 481 CB VAL A 35 2.173 0.520 -4.718 1.00 0.00 C ATOM 482 CG1 VAL A 35 2.395 -0.228 -3.412 1.00 0.00 C ATOM 483 CG2 VAL A 35 0.838 0.139 -5.338 1.00 0.00 C ATOM 0 H VAL A 35 2.784 2.699 -6.404 1.00 0.00 H new ATOM 0 HA VAL A 35 1.454 2.336 -3.798 1.00 0.00 H new ATOM 0 HB VAL A 35 2.964 0.237 -5.412 1.00 0.00 H new ATOM 0 HG11 VAL A 35 2.340 -1.301 -3.594 1.00 0.00 H new ATOM 0 HG12 VAL A 35 3.377 0.023 -3.012 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.627 0.058 -2.694 1.00 0.00 H new ATOM 0 HG21 VAL A 35 0.804 -0.939 -5.494 1.00 0.00 H new ATOM 0 HG22 VAL A 35 0.029 0.435 -4.670 1.00 0.00 H new ATOM 0 HG23 VAL A 35 0.723 0.648 -6.295 1.00 0.00 H new ATOM 493 N PHE A 36 3.579 2.821 -2.619 1.00 0.00 N ATOM 494 CA PHE A 36 4.804 3.186 -1.917 1.00 0.00 C ATOM 495 C PHE A 36 4.969 2.358 -0.645 1.00 0.00 C ATOM 496 O PHE A 36 3.997 1.833 -0.103 1.00 0.00 O ATOM 497 CB PHE A 36 4.794 4.677 -1.572 1.00 0.00 C ATOM 498 CG PHE A 36 5.896 5.082 -0.635 1.00 0.00 C ATOM 499 CD1 PHE A 36 7.224 4.951 -1.010 1.00 0.00 C ATOM 500 CD2 PHE A 36 5.605 5.595 0.618 1.00 0.00 C ATOM 501 CE1 PHE A 36 8.241 5.323 -0.150 1.00 0.00 C ATOM 502 CE2 PHE A 36 6.617 5.970 1.481 1.00 0.00 C ATOM 503 CZ PHE A 36 7.937 5.832 1.097 1.00 0.00 C ATOM 0 H PHE A 36 2.729 2.927 -2.066 1.00 0.00 H new ATOM 0 HA PHE A 36 5.647 2.979 -2.576 1.00 0.00 H new ATOM 0 HB2 PHE A 36 4.879 5.255 -2.492 1.00 0.00 H new ATOM 0 HB3 PHE A 36 3.834 4.932 -1.123 1.00 0.00 H new ATOM 0 HD1 PHE A 36 7.467 4.554 -1.985 1.00 0.00 H new ATOM 0 HD2 PHE A 36 4.575 5.703 0.924 1.00 0.00 H new ATOM 0 HE1 PHE A 36 9.272 5.216 -0.453 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.376 6.371 2.455 1.00 0.00 H new ATOM 0 HZ PHE A 36 8.730 6.122 1.771 1.00 0.00 H new ATOM 513 N ILE A 37 6.208 2.248 -0.176 1.00 0.00 N ATOM 514 CA ILE A 37 6.502 1.486 1.031 1.00 0.00 C ATOM 515 C ILE A 37 7.343 2.304 2.006 1.00 0.00 C ATOM 516 O ILE A 37 8.568 2.370 1.903 1.00 0.00 O ATOM 517 CB ILE A 37 7.242 0.177 0.704 1.00 0.00 C ATOM 518 CG1 ILE A 37 6.405 -0.686 -0.243 1.00 0.00 C ATOM 519 CG2 ILE A 37 7.561 -0.585 1.982 1.00 0.00 C ATOM 520 CD1 ILE A 37 7.179 -1.827 -0.864 1.00 0.00 C ATOM 0 H ILE A 37 7.023 2.677 -0.614 1.00 0.00 H new ATOM 0 HA ILE A 37 5.545 1.246 1.494 1.00 0.00 H new ATOM 0 HB ILE A 37 8.180 0.422 0.207 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.554 -1.091 0.304 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.003 -0.056 -1.037 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.084 -1.508 1.734 1.00 0.00 H new ATOM 0 HG22 ILE A 37 8.193 0.029 2.624 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.635 -0.822 2.505 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.523 -2.396 -1.523 1.00 0.00 H new ATOM 0 HD12 ILE A 37 8.015 -1.429 -1.439 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.558 -2.480 -0.078 1.00 0.00 H new ATOM 532 N PRO A 38 6.672 2.940 2.978 1.00 0.00 N ATOM 533 CA PRO A 38 7.338 3.762 3.992 1.00 0.00 C ATOM 534 C PRO A 38 8.156 2.926 4.970 1.00 0.00 C ATOM 535 O PRO A 38 7.740 1.840 5.375 1.00 0.00 O ATOM 536 CB PRO A 38 6.174 4.444 4.716 1.00 0.00 C ATOM 537 CG PRO A 38 5.015 3.530 4.514 1.00 0.00 C ATOM 538 CD PRO A 38 5.211 2.904 3.162 1.00 0.00 C ATOM 0 HA PRO A 38 8.050 4.459 3.549 1.00 0.00 H new ATOM 0 HB2 PRO A 38 6.392 4.579 5.775 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.975 5.433 4.302 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.977 2.770 5.294 1.00 0.00 H new ATOM 0 HG3 PRO A 38 4.074 4.078 4.557 1.00 0.00 H new ATOM 0 HD2 PRO A 38 4.827 1.884 3.132 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.694 3.462 2.382 1.00 0.00 H new ATOM 546 N LYS A 39 9.323 3.438 5.347 1.00 0.00 N ATOM 547 CA LYS A 39 10.200 2.741 6.279 1.00 0.00 C ATOM 548 C LYS A 39 10.137 3.375 7.665 1.00 0.00 C ATOM 549 O LYS A 39 9.856 4.564 7.818 1.00 0.00 O ATOM 550 CB LYS A 39 11.642 2.757 5.764 1.00 0.00 C ATOM 551 CG LYS A 39 11.829 2.008 4.457 1.00 0.00 C ATOM 552 CD LYS A 39 11.799 0.504 4.666 1.00 0.00 C ATOM 553 CE LYS A 39 12.625 -0.222 3.616 1.00 0.00 C ATOM 554 NZ LYS A 39 11.900 -1.394 3.052 1.00 0.00 N ATOM 0 H LYS A 39 9.683 4.335 5.020 1.00 0.00 H new ATOM 0 HA LYS A 39 9.859 1.709 6.356 1.00 0.00 H new ATOM 0 HB2 LYS A 39 11.959 3.791 5.629 1.00 0.00 H new ATOM 0 HB3 LYS A 39 12.294 2.320 6.520 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.044 2.294 3.757 1.00 0.00 H new ATOM 0 HG3 LYS A 39 12.779 2.294 4.005 1.00 0.00 H new ATOM 0 HD2 LYS A 39 12.181 0.266 5.659 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.768 0.151 4.628 1.00 0.00 H new ATOM 0 HE2 LYS A 39 12.879 0.469 2.812 1.00 0.00 H new ATOM 0 HE3 LYS A 39 13.564 -0.555 4.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 12.400 -1.738 2.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.859 -2.152 3.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 10.934 -1.112 2.791 1.00 0.00 H new ATOM 568 N PRO A 40 10.405 2.565 8.700 1.00 0.00 N ATOM 569 CA PRO A 40 10.740 1.148 8.531 1.00 0.00 C ATOM 570 C PRO A 40 9.546 0.321 8.067 1.00 0.00 C ATOM 571 O PRO A 40 8.436 0.473 8.580 1.00 0.00 O ATOM 572 CB PRO A 40 11.177 0.717 9.933 1.00 0.00 C ATOM 573 CG PRO A 40 10.485 1.662 10.853 1.00 0.00 C ATOM 574 CD PRO A 40 10.400 2.971 10.116 1.00 0.00 C ATOM 0 HA PRO A 40 11.503 0.998 7.767 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.891 -0.315 10.137 1.00 0.00 H new ATOM 0 HB3 PRO A 40 12.260 0.776 10.046 1.00 0.00 H new ATOM 0 HG2 PRO A 40 9.492 1.296 11.114 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.038 1.774 11.785 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.494 3.519 10.374 1.00 0.00 H new ATOM 0 HD3 PRO A 40 11.243 3.620 10.351 1.00 0.00 H new ATOM 582 N PHE A 41 9.779 -0.554 7.095 1.00 0.00 N ATOM 583 CA PHE A 41 8.722 -1.405 6.562 1.00 0.00 C ATOM 584 C PHE A 41 8.446 -2.579 7.497 1.00 0.00 C ATOM 585 O PHE A 41 9.356 -3.320 7.866 1.00 0.00 O ATOM 586 CB PHE A 41 9.106 -1.923 5.175 1.00 0.00 C ATOM 587 CG PHE A 41 8.422 -3.208 4.804 1.00 0.00 C ATOM 588 CD1 PHE A 41 7.164 -3.197 4.224 1.00 0.00 C ATOM 589 CD2 PHE A 41 9.038 -4.427 5.036 1.00 0.00 C ATOM 590 CE1 PHE A 41 6.533 -4.377 3.882 1.00 0.00 C ATOM 591 CE2 PHE A 41 8.412 -5.610 4.695 1.00 0.00 C ATOM 592 CZ PHE A 41 7.157 -5.586 4.118 1.00 0.00 C ATOM 0 H PHE A 41 10.691 -0.692 6.660 1.00 0.00 H new ATOM 0 HA PHE A 41 7.815 -0.807 6.480 1.00 0.00 H new ATOM 0 HB2 PHE A 41 8.862 -1.163 4.432 1.00 0.00 H new ATOM 0 HB3 PHE A 41 10.185 -2.071 5.137 1.00 0.00 H new ATOM 0 HD1 PHE A 41 6.671 -2.255 4.037 1.00 0.00 H new ATOM 0 HD2 PHE A 41 10.018 -4.453 5.488 1.00 0.00 H new ATOM 0 HE1 PHE A 41 5.552 -4.354 3.430 1.00 0.00 H new ATOM 0 HE2 PHE A 41 8.904 -6.554 4.879 1.00 0.00 H new ATOM 0 HZ PHE A 41 6.665 -6.510 3.852 1.00 0.00 H new ATOM 602 N ARG A 42 7.182 -2.741 7.876 1.00 0.00 N ATOM 603 CA ARG A 42 6.784 -3.823 8.768 1.00 0.00 C ATOM 604 C ARG A 42 5.590 -4.585 8.201 1.00 0.00 C ATOM 605 O ARG A 42 4.444 -4.324 8.569 1.00 0.00 O ATOM 606 CB ARG A 42 6.441 -3.270 10.153 1.00 0.00 C ATOM 607 CG ARG A 42 7.658 -2.864 10.966 1.00 0.00 C ATOM 608 CD ARG A 42 7.322 -1.764 11.961 1.00 0.00 C ATOM 609 NE ARG A 42 7.573 -2.177 13.339 1.00 0.00 N ATOM 610 CZ ARG A 42 7.684 -1.326 14.353 1.00 0.00 C ATOM 611 NH1 ARG A 42 7.567 -0.021 14.143 1.00 0.00 N ATOM 612 NH2 ARG A 42 7.912 -1.779 15.579 1.00 0.00 N ATOM 0 H ARG A 42 6.416 -2.136 7.579 1.00 0.00 H new ATOM 0 HA ARG A 42 7.623 -4.514 8.858 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.787 -2.406 10.038 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.880 -4.023 10.706 1.00 0.00 H new ATOM 0 HG2 ARG A 42 8.047 -3.732 11.499 1.00 0.00 H new ATOM 0 HG3 ARG A 42 8.447 -2.522 10.296 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.914 -0.877 11.735 1.00 0.00 H new ATOM 0 HD3 ARG A 42 6.274 -1.484 11.852 1.00 0.00 H new ATOM 0 HE ARG A 42 7.668 -3.174 13.534 1.00 0.00 H new ATOM 0 HH11 ARG A 42 7.391 0.330 13.202 1.00 0.00 H new ATOM 0 HH12 ARG A 42 7.653 0.631 14.923 1.00 0.00 H new ATOM 0 HH21 ARG A 42 8.002 -2.782 15.744 1.00 0.00 H new ATOM 0 HH22 ARG A 42 7.997 -1.125 16.357 1.00 0.00 H new ATOM 626 N ALA A 43 5.866 -5.526 7.304 1.00 0.00 N ATOM 627 CA ALA A 43 4.815 -6.326 6.689 1.00 0.00 C ATOM 628 C ALA A 43 3.592 -5.474 6.370 1.00 0.00 C ATOM 629 O ALA A 43 2.455 -5.933 6.486 1.00 0.00 O ATOM 630 CB ALA A 43 4.431 -7.484 7.598 1.00 0.00 C ATOM 0 H ALA A 43 6.809 -5.753 6.987 1.00 0.00 H new ATOM 0 HA ALA A 43 5.201 -6.727 5.752 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.645 -8.073 7.125 1.00 0.00 H new ATOM 0 HB2 ALA A 43 5.303 -8.115 7.771 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.070 -7.095 8.550 1.00 0.00 H new ATOM 636 N PHE A 44 3.831 -4.230 5.969 1.00 0.00 N ATOM 637 CA PHE A 44 2.749 -3.312 5.634 1.00 0.00 C ATOM 638 C PHE A 44 3.214 -2.265 4.626 1.00 0.00 C ATOM 639 O PHE A 44 4.326 -1.746 4.723 1.00 0.00 O ATOM 640 CB PHE A 44 2.226 -2.624 6.897 1.00 0.00 C ATOM 641 CG PHE A 44 2.939 -1.341 7.219 1.00 0.00 C ATOM 642 CD1 PHE A 44 2.803 -0.233 6.397 1.00 0.00 C ATOM 643 CD2 PHE A 44 3.743 -1.242 8.343 1.00 0.00 C ATOM 644 CE1 PHE A 44 3.458 0.948 6.690 1.00 0.00 C ATOM 645 CE2 PHE A 44 4.400 -0.064 8.641 1.00 0.00 C ATOM 646 CZ PHE A 44 4.256 1.033 7.814 1.00 0.00 C ATOM 0 H PHE A 44 4.766 -3.834 5.868 1.00 0.00 H new ATOM 0 HA PHE A 44 1.943 -3.891 5.183 1.00 0.00 H new ATOM 0 HB2 PHE A 44 1.162 -2.419 6.776 1.00 0.00 H new ATOM 0 HB3 PHE A 44 2.325 -3.307 7.741 1.00 0.00 H new ATOM 0 HD1 PHE A 44 2.178 -0.293 5.518 1.00 0.00 H new ATOM 0 HD2 PHE A 44 3.857 -2.096 8.994 1.00 0.00 H new ATOM 0 HE1 PHE A 44 3.346 1.804 6.041 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.025 -0.001 9.519 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.767 1.956 8.046 1.00 0.00 H new ATOM 656 N ALA A 45 2.355 -1.961 3.659 1.00 0.00 N ATOM 657 CA ALA A 45 2.677 -0.976 2.634 1.00 0.00 C ATOM 658 C ALA A 45 1.516 -0.011 2.416 1.00 0.00 C ATOM 659 O ALA A 45 0.370 -0.317 2.749 1.00 0.00 O ATOM 660 CB ALA A 45 3.039 -1.671 1.330 1.00 0.00 C ATOM 0 H ALA A 45 1.431 -2.382 3.564 1.00 0.00 H new ATOM 0 HA ALA A 45 3.536 -0.399 2.977 1.00 0.00 H new ATOM 0 HB1 ALA A 45 3.277 -0.924 0.573 1.00 0.00 H new ATOM 0 HB2 ALA A 45 3.904 -2.315 1.489 1.00 0.00 H new ATOM 0 HB3 ALA A 45 2.196 -2.273 0.992 1.00 0.00 H new ATOM 666 N PHE A 46 1.819 1.156 1.858 1.00 0.00 N ATOM 667 CA PHE A 46 0.801 2.167 1.598 1.00 0.00 C ATOM 668 C PHE A 46 0.461 2.226 0.111 1.00 0.00 C ATOM 669 O PHE A 46 1.334 2.440 -0.729 1.00 0.00 O ATOM 670 CB PHE A 46 1.280 3.538 2.078 1.00 0.00 C ATOM 671 CG PHE A 46 0.299 4.644 1.806 1.00 0.00 C ATOM 672 CD1 PHE A 46 -0.867 4.751 2.546 1.00 0.00 C ATOM 673 CD2 PHE A 46 0.545 5.577 0.812 1.00 0.00 C ATOM 674 CE1 PHE A 46 -1.771 5.766 2.298 1.00 0.00 C ATOM 675 CE2 PHE A 46 -0.354 6.596 0.560 1.00 0.00 C ATOM 676 CZ PHE A 46 -1.514 6.691 1.305 1.00 0.00 C ATOM 0 H PHE A 46 2.762 1.425 1.577 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.099 1.891 2.148 1.00 0.00 H new ATOM 0 HB2 PHE A 46 1.475 3.491 3.149 1.00 0.00 H new ATOM 0 HB3 PHE A 46 2.226 3.774 1.592 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -1.072 4.033 3.326 1.00 0.00 H new ATOM 0 HD2 PHE A 46 1.450 5.507 0.227 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -2.678 5.836 2.880 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -0.150 7.317 -0.218 1.00 0.00 H new ATOM 0 HZ PHE A 46 -2.218 7.487 1.111 1.00 0.00 H new ATOM 686 N VAL A 47 -0.816 2.033 -0.205 1.00 0.00 N ATOM 687 CA VAL A 47 -1.274 2.065 -1.589 1.00 0.00 C ATOM 688 C VAL A 47 -2.170 3.272 -1.844 1.00 0.00 C ATOM 689 O VAL A 47 -3.069 3.569 -1.057 1.00 0.00 O ATOM 690 CB VAL A 47 -2.042 0.782 -1.956 1.00 0.00 C ATOM 691 CG1 VAL A 47 -2.425 0.790 -3.428 1.00 0.00 C ATOM 692 CG2 VAL A 47 -1.214 -0.449 -1.619 1.00 0.00 C ATOM 0 H VAL A 47 -1.551 1.853 0.479 1.00 0.00 H new ATOM 0 HA VAL A 47 -0.385 2.138 -2.215 1.00 0.00 H new ATOM 0 HB VAL A 47 -2.959 0.748 -1.367 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.967 -0.125 -3.668 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -3.059 1.652 -3.634 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -1.524 0.848 -4.038 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -1.772 -1.347 -1.885 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -0.279 -0.423 -2.179 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.997 -0.460 -0.551 1.00 0.00 H new ATOM 702 N THR A 48 -1.920 3.964 -2.951 1.00 0.00 N ATOM 703 CA THR A 48 -2.703 5.140 -3.311 1.00 0.00 C ATOM 704 C THR A 48 -3.526 4.888 -4.569 1.00 0.00 C ATOM 705 O THR A 48 -2.999 4.440 -5.588 1.00 0.00 O ATOM 706 CB THR A 48 -1.803 6.368 -3.537 1.00 0.00 C ATOM 707 OG1 THR A 48 -1.072 6.666 -2.342 1.00 0.00 O ATOM 708 CG2 THR A 48 -2.629 7.578 -3.947 1.00 0.00 C ATOM 0 H THR A 48 -1.181 3.730 -3.614 1.00 0.00 H new ATOM 0 HA THR A 48 -3.373 5.341 -2.475 1.00 0.00 H new ATOM 0 HB THR A 48 -1.105 6.136 -4.342 1.00 0.00 H new ATOM 0 HG1 THR A 48 -1.432 6.139 -1.598 1.00 0.00 H new ATOM 0 HG21 THR A 48 -1.970 8.433 -4.101 1.00 0.00 H new ATOM 0 HG22 THR A 48 -3.161 7.359 -4.873 1.00 0.00 H new ATOM 0 HG23 THR A 48 -3.348 7.811 -3.162 1.00 0.00 H new ATOM 716 N PHE A 49 -4.820 5.179 -4.492 1.00 0.00 N ATOM 717 CA PHE A 49 -5.716 4.984 -5.626 1.00 0.00 C ATOM 718 C PHE A 49 -6.132 6.323 -6.228 1.00 0.00 C ATOM 719 O PHE A 49 -6.057 7.361 -5.570 1.00 0.00 O ATOM 720 CB PHE A 49 -6.957 4.199 -5.194 1.00 0.00 C ATOM 721 CG PHE A 49 -6.725 2.719 -5.095 1.00 0.00 C ATOM 722 CD1 PHE A 49 -6.646 1.938 -6.237 1.00 0.00 C ATOM 723 CD2 PHE A 49 -6.585 2.107 -3.860 1.00 0.00 C ATOM 724 CE1 PHE A 49 -6.433 0.576 -6.149 1.00 0.00 C ATOM 725 CE2 PHE A 49 -6.373 0.745 -3.765 1.00 0.00 C ATOM 726 CZ PHE A 49 -6.295 -0.021 -4.911 1.00 0.00 C ATOM 0 H PHE A 49 -5.272 5.551 -3.656 1.00 0.00 H new ATOM 0 HA PHE A 49 -5.180 4.415 -6.386 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.294 4.571 -4.227 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -7.761 4.386 -5.906 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -6.752 2.400 -7.208 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -6.642 2.702 -2.960 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -6.374 -0.021 -7.047 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -6.268 0.280 -2.796 1.00 0.00 H new ATOM 0 HZ PHE A 49 -6.126 -1.085 -4.840 1.00 0.00 H new ATOM 736 N ALA A 50 -6.570 6.291 -7.482 1.00 0.00 N ATOM 737 CA ALA A 50 -6.999 7.501 -8.173 1.00 0.00 C ATOM 738 C ALA A 50 -8.363 7.966 -7.671 1.00 0.00 C ATOM 739 O ALA A 50 -8.725 9.133 -7.821 1.00 0.00 O ATOM 740 CB ALA A 50 -7.039 7.266 -9.675 1.00 0.00 C ATOM 0 H ALA A 50 -6.637 5.440 -8.041 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.275 8.287 -7.959 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.361 8.178 -10.178 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.045 6.990 -10.027 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.740 6.462 -9.899 1.00 0.00 H new ATOM 746 N ASP A 51 -9.113 7.045 -7.077 1.00 0.00 N ATOM 747 CA ASP A 51 -10.437 7.361 -6.553 1.00 0.00 C ATOM 748 C ASP A 51 -10.562 6.926 -5.096 1.00 0.00 C ATOM 749 O ASP A 51 -10.257 5.785 -4.749 1.00 0.00 O ATOM 750 CB ASP A 51 -11.517 6.680 -7.396 1.00 0.00 C ATOM 751 CG ASP A 51 -12.692 7.597 -7.680 1.00 0.00 C ATOM 752 OD1 ASP A 51 -13.178 8.250 -6.734 1.00 0.00 O ATOM 753 OD2 ASP A 51 -13.123 7.660 -8.850 1.00 0.00 O ATOM 0 H ASP A 51 -8.828 6.075 -6.946 1.00 0.00 H new ATOM 0 HA ASP A 51 -10.574 8.441 -6.604 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -11.083 6.348 -8.339 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -11.872 5.789 -6.877 1.00 0.00 H new ATOM 758 N ASP A 52 -11.013 7.843 -4.248 1.00 0.00 N ATOM 759 CA ASP A 52 -11.180 7.556 -2.828 1.00 0.00 C ATOM 760 C ASP A 52 -12.144 6.392 -2.618 1.00 0.00 C ATOM 761 O ASP A 52 -12.030 5.648 -1.645 1.00 0.00 O ATOM 762 CB ASP A 52 -11.688 8.796 -2.090 1.00 0.00 C ATOM 763 CG ASP A 52 -13.200 8.893 -2.096 1.00 0.00 C ATOM 764 OD1 ASP A 52 -13.838 8.288 -1.208 1.00 0.00 O ATOM 765 OD2 ASP A 52 -13.748 9.574 -2.988 1.00 0.00 O ATOM 0 H ASP A 52 -11.270 8.792 -4.519 1.00 0.00 H new ATOM 0 HA ASP A 52 -10.208 7.276 -2.423 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -11.332 8.774 -1.060 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -11.268 9.689 -2.553 1.00 0.00 H new ATOM 770 N GLN A 53 -13.093 6.245 -3.537 1.00 0.00 N ATOM 771 CA GLN A 53 -14.078 5.173 -3.451 1.00 0.00 C ATOM 772 C GLN A 53 -13.408 3.808 -3.557 1.00 0.00 C ATOM 773 O GLN A 53 -13.878 2.828 -2.979 1.00 0.00 O ATOM 774 CB GLN A 53 -15.127 5.327 -4.553 1.00 0.00 C ATOM 775 CG GLN A 53 -15.904 6.631 -4.475 1.00 0.00 C ATOM 776 CD GLN A 53 -17.345 6.428 -4.048 1.00 0.00 C ATOM 777 OE1 GLN A 53 -17.656 5.505 -3.293 1.00 0.00 O ATOM 778 NE2 GLN A 53 -18.233 7.289 -4.529 1.00 0.00 N ATOM 0 H GLN A 53 -13.201 6.854 -4.348 1.00 0.00 H new ATOM 0 HA GLN A 53 -14.569 5.241 -2.480 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -14.634 5.265 -5.523 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -15.826 4.493 -4.496 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -15.411 7.301 -3.771 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.883 7.121 -5.449 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -17.931 8.039 -5.151 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -19.217 7.201 -4.276 1.00 0.00 H new ATOM 787 N ILE A 54 -12.307 3.750 -4.300 1.00 0.00 N ATOM 788 CA ILE A 54 -11.572 2.505 -4.481 1.00 0.00 C ATOM 789 C ILE A 54 -10.766 2.156 -3.234 1.00 0.00 C ATOM 790 O ILE A 54 -10.623 0.985 -2.882 1.00 0.00 O ATOM 791 CB ILE A 54 -10.620 2.584 -5.689 1.00 0.00 C ATOM 792 CG1 ILE A 54 -11.390 2.990 -6.947 1.00 0.00 C ATOM 793 CG2 ILE A 54 -9.918 1.250 -5.898 1.00 0.00 C ATOM 794 CD1 ILE A 54 -10.499 3.461 -8.075 1.00 0.00 C ATOM 0 H ILE A 54 -11.905 4.551 -4.786 1.00 0.00 H new ATOM 0 HA ILE A 54 -12.312 1.725 -4.662 1.00 0.00 H new ATOM 0 HB ILE A 54 -9.864 3.343 -5.488 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -11.981 2.141 -7.292 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -12.092 3.784 -6.693 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -9.249 1.321 -6.755 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -9.342 0.999 -5.008 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -10.660 0.473 -6.081 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -11.112 3.732 -8.934 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -9.927 4.330 -7.749 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -9.814 2.661 -8.356 1.00 0.00 H new ATOM 806 N ALA A 55 -10.242 3.180 -2.569 1.00 0.00 N ATOM 807 CA ALA A 55 -9.453 2.982 -1.360 1.00 0.00 C ATOM 808 C ALA A 55 -10.337 2.556 -0.192 1.00 0.00 C ATOM 809 O ALA A 55 -9.930 1.745 0.641 1.00 0.00 O ATOM 810 CB ALA A 55 -8.693 4.254 -1.010 1.00 0.00 C ATOM 0 H ALA A 55 -10.350 4.155 -2.847 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.736 2.184 -1.551 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.108 4.091 -0.105 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.026 4.517 -1.831 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.400 5.066 -0.844 1.00 0.00 H new ATOM 816 N GLN A 56 -11.545 3.107 -0.137 1.00 0.00 N ATOM 817 CA GLN A 56 -12.484 2.782 0.930 1.00 0.00 C ATOM 818 C GLN A 56 -13.258 1.509 0.606 1.00 0.00 C ATOM 819 O GLN A 56 -13.242 0.548 1.375 1.00 0.00 O ATOM 820 CB GLN A 56 -13.457 3.942 1.151 1.00 0.00 C ATOM 821 CG GLN A 56 -13.327 4.592 2.519 1.00 0.00 C ATOM 822 CD GLN A 56 -14.287 5.751 2.708 1.00 0.00 C ATOM 823 OE1 GLN A 56 -14.009 6.875 2.290 1.00 0.00 O ATOM 824 NE2 GLN A 56 -15.423 5.482 3.339 1.00 0.00 N ATOM 0 H GLN A 56 -11.896 3.780 -0.818 1.00 0.00 H new ATOM 0 HA GLN A 56 -11.913 2.615 1.844 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -13.291 4.696 0.382 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -14.477 3.579 1.026 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -13.509 3.844 3.291 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -12.305 4.946 2.653 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -15.612 4.535 3.668 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -16.108 6.222 3.495 1.00 0.00 H new ATOM 833 N SER A 57 -13.935 1.508 -0.538 1.00 0.00 N ATOM 834 CA SER A 57 -14.719 0.354 -0.963 1.00 0.00 C ATOM 835 C SER A 57 -13.937 -0.939 -0.757 1.00 0.00 C ATOM 836 O SER A 57 -14.519 -2.012 -0.586 1.00 0.00 O ATOM 837 CB SER A 57 -15.117 0.494 -2.433 1.00 0.00 C ATOM 838 OG SER A 57 -15.994 -0.548 -2.825 1.00 0.00 O ATOM 0 H SER A 57 -13.956 2.294 -1.188 1.00 0.00 H new ATOM 0 HA SER A 57 -15.621 0.314 -0.352 1.00 0.00 H new ATOM 0 HB2 SER A 57 -15.599 1.459 -2.592 1.00 0.00 H new ATOM 0 HB3 SER A 57 -14.224 0.477 -3.058 1.00 0.00 H new ATOM 0 HG SER A 57 -16.235 -0.435 -3.768 1.00 0.00 H new ATOM 844 N LEU A 58 -12.613 -0.831 -0.773 1.00 0.00 N ATOM 845 CA LEU A 58 -11.748 -1.992 -0.589 1.00 0.00 C ATOM 846 C LEU A 58 -11.641 -2.362 0.887 1.00 0.00 C ATOM 847 O LEU A 58 -11.661 -3.541 1.244 1.00 0.00 O ATOM 848 CB LEU A 58 -10.356 -1.710 -1.156 1.00 0.00 C ATOM 849 CG LEU A 58 -10.028 -2.379 -2.492 1.00 0.00 C ATOM 850 CD1 LEU A 58 -8.732 -1.824 -3.063 1.00 0.00 C ATOM 851 CD2 LEU A 58 -9.936 -3.889 -2.324 1.00 0.00 C ATOM 0 H LEU A 58 -12.115 0.048 -0.911 1.00 0.00 H new ATOM 0 HA LEU A 58 -12.190 -2.832 -1.125 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -10.245 -0.632 -1.275 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -9.615 -2.027 -0.422 1.00 0.00 H new ATOM 0 HG LEU A 58 -10.833 -2.160 -3.194 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -8.515 -2.312 -4.013 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -8.834 -0.750 -3.221 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -7.917 -2.012 -2.364 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -9.702 -4.348 -3.284 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -9.151 -4.128 -1.607 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -10.889 -4.273 -1.961 1.00 0.00 H new ATOM 863 N CYS A 59 -11.533 -1.349 1.740 1.00 0.00 N ATOM 864 CA CYS A 59 -11.425 -1.569 3.178 1.00 0.00 C ATOM 865 C CYS A 59 -12.430 -2.617 3.645 1.00 0.00 C ATOM 866 O CYS A 59 -13.628 -2.501 3.388 1.00 0.00 O ATOM 867 CB CYS A 59 -11.649 -0.257 3.933 1.00 0.00 C ATOM 868 SG CYS A 59 -11.656 -0.434 5.732 1.00 0.00 S ATOM 0 H CYS A 59 -11.518 -0.368 1.461 1.00 0.00 H new ATOM 0 HA CYS A 59 -10.421 -1.936 3.391 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -10.869 0.450 3.651 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -12.599 0.174 3.617 1.00 0.00 H new ATOM 0 HG CYS A 59 -11.850 0.728 6.282 1.00 0.00 H new ATOM 874 N GLY A 60 -11.933 -3.642 4.330 1.00 0.00 N ATOM 875 CA GLY A 60 -12.800 -4.697 4.820 1.00 0.00 C ATOM 876 C GLY A 60 -12.749 -5.939 3.954 1.00 0.00 C ATOM 877 O GLY A 60 -13.068 -7.036 4.411 1.00 0.00 O ATOM 0 H GLY A 60 -10.945 -3.761 4.554 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.511 -4.956 5.839 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -13.825 -4.330 4.863 1.00 0.00 H new ATOM 881 N GLU A 61 -12.348 -5.767 2.698 1.00 0.00 N ATOM 882 CA GLU A 61 -12.258 -6.885 1.765 1.00 0.00 C ATOM 883 C GLU A 61 -10.953 -7.652 1.960 1.00 0.00 C ATOM 884 O GLU A 61 -9.874 -7.062 1.998 1.00 0.00 O ATOM 885 CB GLU A 61 -12.357 -6.383 0.324 1.00 0.00 C ATOM 886 CG GLU A 61 -13.714 -5.794 -0.025 1.00 0.00 C ATOM 887 CD GLU A 61 -14.738 -6.857 -0.376 1.00 0.00 C ATOM 888 OE1 GLU A 61 -15.013 -7.722 0.482 1.00 0.00 O ATOM 889 OE2 GLU A 61 -15.262 -6.825 -1.509 1.00 0.00 O ATOM 0 H GLU A 61 -12.081 -4.865 2.303 1.00 0.00 H new ATOM 0 HA GLU A 61 -13.090 -7.561 1.965 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -11.589 -5.627 0.158 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.144 -7.209 -0.355 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -14.079 -5.207 0.818 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.604 -5.109 -0.866 1.00 0.00 H new ATOM 896 N ASP A 62 -11.063 -8.970 2.082 1.00 0.00 N ATOM 897 CA ASP A 62 -9.893 -9.820 2.272 1.00 0.00 C ATOM 898 C ASP A 62 -9.352 -10.308 0.932 1.00 0.00 C ATOM 899 O ASP A 62 -9.992 -11.106 0.246 1.00 0.00 O ATOM 900 CB ASP A 62 -10.242 -11.014 3.161 1.00 0.00 C ATOM 901 CG ASP A 62 -11.003 -10.606 4.408 1.00 0.00 C ATOM 902 OD1 ASP A 62 -10.351 -10.227 5.404 1.00 0.00 O ATOM 903 OD2 ASP A 62 -12.250 -10.663 4.387 1.00 0.00 O ATOM 0 H ASP A 62 -11.950 -9.473 2.053 1.00 0.00 H new ATOM 0 HA ASP A 62 -9.120 -9.227 2.761 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -10.840 -11.725 2.591 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -9.325 -11.528 3.450 1.00 0.00 H new ATOM 908 N LEU A 63 -8.171 -9.824 0.564 1.00 0.00 N ATOM 909 CA LEU A 63 -7.544 -10.210 -0.695 1.00 0.00 C ATOM 910 C LEU A 63 -6.364 -11.146 -0.451 1.00 0.00 C ATOM 911 O LEU A 63 -5.601 -10.964 0.497 1.00 0.00 O ATOM 912 CB LEU A 63 -7.077 -8.968 -1.456 1.00 0.00 C ATOM 913 CG LEU A 63 -7.932 -7.713 -1.282 1.00 0.00 C ATOM 914 CD1 LEU A 63 -7.345 -6.553 -2.071 1.00 0.00 C ATOM 915 CD2 LEU A 63 -9.367 -7.981 -1.714 1.00 0.00 C ATOM 0 H LEU A 63 -7.628 -9.163 1.120 1.00 0.00 H new ATOM 0 HA LEU A 63 -8.285 -10.739 -1.295 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.059 -8.736 -1.143 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -7.036 -9.211 -2.518 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.935 -7.443 -0.226 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -7.967 -5.668 -1.935 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.336 -6.345 -1.716 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -7.311 -6.813 -3.129 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.961 -7.077 -1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -9.382 -8.277 -2.763 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -9.787 -8.782 -1.105 1.00 0.00 H new ATOM 927 N ILE A 64 -6.220 -12.144 -1.315 1.00 0.00 N ATOM 928 CA ILE A 64 -5.132 -13.107 -1.195 1.00 0.00 C ATOM 929 C ILE A 64 -4.043 -12.835 -2.228 1.00 0.00 C ATOM 930 O ILE A 64 -4.316 -12.750 -3.425 1.00 0.00 O ATOM 931 CB ILE A 64 -5.635 -14.552 -1.366 1.00 0.00 C ATOM 932 CG1 ILE A 64 -6.823 -14.814 -0.436 1.00 0.00 C ATOM 933 CG2 ILE A 64 -4.512 -15.541 -1.090 1.00 0.00 C ATOM 934 CD1 ILE A 64 -6.420 -15.104 0.993 1.00 0.00 C ATOM 0 H ILE A 64 -6.843 -12.307 -2.106 1.00 0.00 H new ATOM 0 HA ILE A 64 -4.719 -12.992 -0.193 1.00 0.00 H new ATOM 0 HB ILE A 64 -5.966 -14.687 -2.396 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -7.483 -13.947 -0.450 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -7.397 -15.657 -0.821 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -4.884 -16.558 -1.215 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -3.693 -15.366 -1.788 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -4.153 -15.409 -0.069 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -7.312 -15.280 1.594 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -5.785 -15.989 1.019 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -5.872 -14.252 1.397 1.00 0.00 H new ATOM 946 N ILE A 65 -2.807 -12.702 -1.756 1.00 0.00 N ATOM 947 CA ILE A 65 -1.676 -12.444 -2.639 1.00 0.00 C ATOM 948 C ILE A 65 -0.592 -13.500 -2.465 1.00 0.00 C ATOM 949 O ILE A 65 0.061 -13.571 -1.423 1.00 0.00 O ATOM 950 CB ILE A 65 -1.069 -11.052 -2.382 1.00 0.00 C ATOM 951 CG1 ILE A 65 -2.115 -9.962 -2.622 1.00 0.00 C ATOM 952 CG2 ILE A 65 0.146 -10.833 -3.270 1.00 0.00 C ATOM 953 CD1 ILE A 65 -1.788 -8.651 -1.942 1.00 0.00 C ATOM 0 H ILE A 65 -2.564 -12.769 -0.768 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.056 -12.483 -3.660 1.00 0.00 H new ATOM 0 HB ILE A 65 -0.749 -10.998 -1.341 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.211 -9.792 -3.694 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.083 -10.315 -2.267 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.564 -9.845 -3.077 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.897 -11.593 -3.054 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -0.151 -10.903 -4.316 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.572 -7.925 -2.155 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.721 -8.806 -0.865 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.835 -8.276 -2.315 1.00 0.00 H new ATOM 965 N LYS A 66 -0.401 -14.320 -3.494 1.00 0.00 N ATOM 966 CA LYS A 66 0.608 -15.372 -3.459 1.00 0.00 C ATOM 967 C LYS A 66 0.247 -16.437 -2.427 1.00 0.00 C ATOM 968 O LYS A 66 1.010 -17.374 -2.196 1.00 0.00 O ATOM 969 CB LYS A 66 1.981 -14.779 -3.136 1.00 0.00 C ATOM 970 CG LYS A 66 2.364 -13.612 -4.029 1.00 0.00 C ATOM 971 CD LYS A 66 3.862 -13.575 -4.286 1.00 0.00 C ATOM 972 CE LYS A 66 4.275 -14.612 -5.320 1.00 0.00 C ATOM 973 NZ LYS A 66 5.044 -15.730 -4.707 1.00 0.00 N ATOM 0 H LYS A 66 -0.933 -14.276 -4.363 1.00 0.00 H new ATOM 0 HA LYS A 66 0.644 -15.841 -4.442 1.00 0.00 H new ATOM 0 HB2 LYS A 66 1.990 -14.449 -2.097 1.00 0.00 H new ATOM 0 HB3 LYS A 66 2.736 -15.560 -3.229 1.00 0.00 H new ATOM 0 HG2 LYS A 66 1.833 -13.689 -4.978 1.00 0.00 H new ATOM 0 HG3 LYS A 66 2.051 -12.678 -3.563 1.00 0.00 H new ATOM 0 HD2 LYS A 66 4.149 -12.581 -4.631 1.00 0.00 H new ATOM 0 HD3 LYS A 66 4.397 -13.756 -3.354 1.00 0.00 H new ATOM 0 HE2 LYS A 66 3.387 -15.009 -5.811 1.00 0.00 H new ATOM 0 HE3 LYS A 66 4.880 -14.135 -6.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 5.640 -16.180 -5.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 5.646 -15.360 -3.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 4.384 -16.432 -4.317 1.00 0.00 H new ATOM 987 N GLY A 67 -0.922 -16.287 -1.812 1.00 0.00 N ATOM 988 CA GLY A 67 -1.364 -17.244 -0.815 1.00 0.00 C ATOM 989 C GLY A 67 -1.704 -16.587 0.509 1.00 0.00 C ATOM 990 O GLY A 67 -2.609 -17.031 1.214 1.00 0.00 O ATOM 0 H GLY A 67 -1.571 -15.520 -1.987 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.239 -17.775 -1.189 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.583 -17.988 -0.658 1.00 0.00 H new ATOM 994 N ILE A 68 -0.977 -15.528 0.845 1.00 0.00 N ATOM 995 CA ILE A 68 -1.206 -14.810 2.092 1.00 0.00 C ATOM 996 C ILE A 68 -2.431 -13.908 1.991 1.00 0.00 C ATOM 997 O ILE A 68 -2.851 -13.536 0.895 1.00 0.00 O ATOM 998 CB ILE A 68 0.014 -13.956 2.484 1.00 0.00 C ATOM 999 CG1 ILE A 68 0.105 -12.716 1.591 1.00 0.00 C ATOM 1000 CG2 ILE A 68 1.290 -14.779 2.387 1.00 0.00 C ATOM 1001 CD1 ILE A 68 -0.371 -11.450 2.268 1.00 0.00 C ATOM 0 H ILE A 68 -0.224 -15.148 0.271 1.00 0.00 H new ATOM 0 HA ILE A 68 -1.374 -15.563 2.862 1.00 0.00 H new ATOM 0 HB ILE A 68 -0.107 -13.629 3.517 1.00 0.00 H new ATOM 0 HG12 ILE A 68 1.139 -12.582 1.273 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.487 -12.882 0.691 1.00 0.00 H new ATOM 0 HG21 ILE A 68 2.143 -14.161 2.667 1.00 0.00 H new ATOM 0 HG22 ILE A 68 1.224 -15.634 3.060 1.00 0.00 H new ATOM 0 HG23 ILE A 68 1.418 -15.132 1.364 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.279 -10.611 1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -1.414 -11.565 2.562 1.00 0.00 H new ATOM 0 HD13 ILE A 68 0.236 -11.260 3.153 1.00 0.00 H new ATOM 1013 N SER A 69 -3.000 -13.559 3.140 1.00 0.00 N ATOM 1014 CA SER A 69 -4.179 -12.701 3.180 1.00 0.00 C ATOM 1015 C SER A 69 -3.848 -11.353 3.812 1.00 0.00 C ATOM 1016 O SER A 69 -3.210 -11.285 4.862 1.00 0.00 O ATOM 1017 CB SER A 69 -5.304 -13.382 3.963 1.00 0.00 C ATOM 1018 OG SER A 69 -6.550 -12.755 3.712 1.00 0.00 O ATOM 0 H SER A 69 -2.664 -13.857 4.056 1.00 0.00 H new ATOM 0 HA SER A 69 -4.510 -12.531 2.155 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.360 -14.434 3.685 1.00 0.00 H new ATOM 0 HB3 SER A 69 -5.083 -13.346 5.030 1.00 0.00 H new ATOM 0 HG SER A 69 -7.253 -13.209 4.222 1.00 0.00 H new ATOM 1024 N VAL A 70 -4.289 -10.279 3.164 1.00 0.00 N ATOM 1025 CA VAL A 70 -4.042 -8.931 3.661 1.00 0.00 C ATOM 1026 C VAL A 70 -5.350 -8.187 3.904 1.00 0.00 C ATOM 1027 O VAL A 70 -6.278 -8.258 3.097 1.00 0.00 O ATOM 1028 CB VAL A 70 -3.178 -8.119 2.677 1.00 0.00 C ATOM 1029 CG1 VAL A 70 -1.815 -8.771 2.501 1.00 0.00 C ATOM 1030 CG2 VAL A 70 -3.887 -7.976 1.339 1.00 0.00 C ATOM 0 H VAL A 70 -4.819 -10.317 2.293 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.505 -9.035 4.604 1.00 0.00 H new ATOM 0 HB VAL A 70 -3.027 -7.122 3.090 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.218 -8.184 1.803 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -1.306 -8.816 3.464 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -1.942 -9.780 2.110 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.263 -7.400 0.656 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.070 -8.964 0.917 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.837 -7.461 1.484 1.00 0.00 H new ATOM 1040 N HIS A 71 -5.418 -7.471 5.023 1.00 0.00 N ATOM 1041 CA HIS A 71 -6.613 -6.711 5.373 1.00 0.00 C ATOM 1042 C HIS A 71 -6.470 -5.251 4.957 1.00 0.00 C ATOM 1043 O HIS A 71 -5.619 -4.528 5.476 1.00 0.00 O ATOM 1044 CB HIS A 71 -6.878 -6.802 6.876 1.00 0.00 C ATOM 1045 CG HIS A 71 -7.876 -5.800 7.370 1.00 0.00 C ATOM 1046 ND1 HIS A 71 -9.120 -6.150 7.848 1.00 0.00 N ATOM 1047 CD2 HIS A 71 -7.805 -4.451 7.460 1.00 0.00 C ATOM 1048 CE1 HIS A 71 -9.775 -5.060 8.208 1.00 0.00 C ATOM 1049 NE2 HIS A 71 -8.998 -4.015 7.984 1.00 0.00 N ATOM 0 H HIS A 71 -4.660 -7.402 5.702 1.00 0.00 H new ATOM 0 HA HIS A 71 -7.458 -7.142 4.836 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -7.234 -7.804 7.114 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.939 -6.662 7.411 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -6.967 -3.833 7.173 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.775 -5.029 8.616 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -9.244 -3.043 8.170 1.00 0.00 H new ATOM 1057 N ILE A 72 -7.305 -4.824 4.016 1.00 0.00 N ATOM 1058 CA ILE A 72 -7.272 -3.450 3.531 1.00 0.00 C ATOM 1059 C ILE A 72 -7.933 -2.500 4.524 1.00 0.00 C ATOM 1060 O ILE A 72 -9.011 -2.783 5.046 1.00 0.00 O ATOM 1061 CB ILE A 72 -7.972 -3.317 2.166 1.00 0.00 C ATOM 1062 CG1 ILE A 72 -7.496 -4.418 1.216 1.00 0.00 C ATOM 1063 CG2 ILE A 72 -7.709 -1.944 1.567 1.00 0.00 C ATOM 1064 CD1 ILE A 72 -6.031 -4.314 0.856 1.00 0.00 C ATOM 0 H ILE A 72 -8.013 -5.410 3.574 1.00 0.00 H new ATOM 0 HA ILE A 72 -6.222 -3.181 3.419 1.00 0.00 H new ATOM 0 HB ILE A 72 -9.046 -3.428 2.313 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.681 -5.389 1.676 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -8.090 -4.380 0.303 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -8.210 -1.866 0.602 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -8.091 -1.175 2.238 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -6.636 -1.806 1.431 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -5.764 -5.126 0.180 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -5.844 -3.358 0.367 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -5.428 -4.382 1.761 1.00 0.00 H new ATOM 1076 N SER A 73 -7.282 -1.370 4.778 1.00 0.00 N ATOM 1077 CA SER A 73 -7.805 -0.378 5.710 1.00 0.00 C ATOM 1078 C SER A 73 -7.478 1.035 5.239 1.00 0.00 C ATOM 1079 O SER A 73 -6.672 1.228 4.330 1.00 0.00 O ATOM 1080 CB SER A 73 -7.232 -0.608 7.109 1.00 0.00 C ATOM 1081 OG SER A 73 -5.820 -0.714 7.070 1.00 0.00 O ATOM 0 H SER A 73 -6.391 -1.118 4.351 1.00 0.00 H new ATOM 0 HA SER A 73 -8.889 -0.488 5.748 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.520 0.215 7.763 1.00 0.00 H new ATOM 0 HB3 SER A 73 -7.657 -1.517 7.534 1.00 0.00 H new ATOM 0 HG SER A 73 -5.478 -0.859 7.977 1.00 0.00 H new ATOM 1087 N ASN A 74 -8.109 2.023 5.867 1.00 0.00 N ATOM 1088 CA ASN A 74 -7.885 3.420 5.513 1.00 0.00 C ATOM 1089 C ASN A 74 -7.413 4.219 6.723 1.00 0.00 C ATOM 1090 O ASN A 74 -8.191 4.506 7.632 1.00 0.00 O ATOM 1091 CB ASN A 74 -9.167 4.036 4.949 1.00 0.00 C ATOM 1092 CG ASN A 74 -8.986 5.491 4.558 1.00 0.00 C ATOM 1093 OD1 ASN A 74 -8.544 5.797 3.452 1.00 0.00 O ATOM 1094 ND2 ASN A 74 -9.327 6.395 5.470 1.00 0.00 N ATOM 0 H ASN A 74 -8.779 1.882 6.623 1.00 0.00 H new ATOM 0 HA ASN A 74 -7.107 3.456 4.751 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -9.488 3.466 4.077 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -9.961 3.958 5.691 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -9.226 7.389 5.265 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -9.690 6.095 6.375 1.00 0.00 H new ATOM 1101 N ALA A 75 -6.132 4.573 6.728 1.00 0.00 N ATOM 1102 CA ALA A 75 -5.556 5.342 7.825 1.00 0.00 C ATOM 1103 C ALA A 75 -4.647 6.448 7.304 1.00 0.00 C ATOM 1104 O ALA A 75 -4.104 6.350 6.203 1.00 0.00 O ATOM 1105 CB ALA A 75 -4.788 4.425 8.766 1.00 0.00 C ATOM 0 H ALA A 75 -5.473 4.340 5.985 1.00 0.00 H new ATOM 0 HA ALA A 75 -6.373 5.809 8.375 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.363 5.012 9.580 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -5.464 3.674 9.175 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -3.986 3.931 8.218 1.00 0.00 H new ATOM 1111 N GLU A 76 -4.486 7.501 8.099 1.00 0.00 N ATOM 1112 CA GLU A 76 -3.643 8.627 7.715 1.00 0.00 C ATOM 1113 C GLU A 76 -2.848 9.145 8.911 1.00 0.00 C ATOM 1114 O GLU A 76 -3.306 9.999 9.669 1.00 0.00 O ATOM 1115 CB GLU A 76 -4.496 9.754 7.127 1.00 0.00 C ATOM 1116 CG GLU A 76 -5.260 9.351 5.878 1.00 0.00 C ATOM 1117 CD GLU A 76 -6.617 10.021 5.782 1.00 0.00 C ATOM 1118 OE1 GLU A 76 -6.693 11.242 6.033 1.00 0.00 O ATOM 1119 OE2 GLU A 76 -7.601 9.325 5.458 1.00 0.00 O ATOM 0 H GLU A 76 -4.928 7.598 9.013 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.940 8.280 6.957 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -5.205 10.094 7.882 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.851 10.601 6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.670 9.606 4.998 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -5.392 8.269 5.871 1.00 0.00 H new ATOM 1126 N PRO A 77 -1.628 8.615 9.084 1.00 0.00 N ATOM 1127 CA PRO A 77 -0.744 9.009 10.184 1.00 0.00 C ATOM 1128 C PRO A 77 -0.212 10.429 10.022 1.00 0.00 C ATOM 1129 O PRO A 77 0.090 10.866 8.911 1.00 0.00 O ATOM 1130 CB PRO A 77 0.401 7.996 10.099 1.00 0.00 C ATOM 1131 CG PRO A 77 0.414 7.558 8.675 1.00 0.00 C ATOM 1132 CD PRO A 77 -1.018 7.593 8.217 1.00 0.00 C ATOM 0 HA PRO A 77 -1.262 9.008 11.143 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.351 8.448 10.383 1.00 0.00 H new ATOM 0 HB3 PRO A 77 0.235 7.154 10.771 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.034 8.219 8.069 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.830 6.555 8.579 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -1.097 7.861 7.163 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -1.502 6.624 8.336 1.00 0.00 H new ATOM 1140 N LYS A 78 -0.098 11.144 11.136 1.00 0.00 N ATOM 1141 CA LYS A 78 0.399 12.515 11.117 1.00 0.00 C ATOM 1142 C LYS A 78 1.916 12.545 11.279 1.00 0.00 C ATOM 1143 O LYS A 78 2.443 12.229 12.346 1.00 0.00 O ATOM 1144 CB LYS A 78 -0.260 13.333 12.230 1.00 0.00 C ATOM 1145 CG LYS A 78 -0.224 14.832 11.987 1.00 0.00 C ATOM 1146 CD LYS A 78 -0.811 15.601 13.158 1.00 0.00 C ATOM 1147 CE LYS A 78 -2.205 16.120 12.841 1.00 0.00 C ATOM 1148 NZ LYS A 78 -3.267 15.231 13.391 1.00 0.00 N ATOM 0 H LYS A 78 -0.343 10.797 12.063 1.00 0.00 H new ATOM 0 HA LYS A 78 0.145 12.955 10.152 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -1.297 13.016 12.337 1.00 0.00 H new ATOM 0 HB3 LYS A 78 0.239 13.114 13.174 1.00 0.00 H new ATOM 0 HG2 LYS A 78 0.805 15.150 11.821 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -0.781 15.068 11.080 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.853 14.955 14.035 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -0.159 16.437 13.409 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.322 17.123 13.253 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -2.325 16.203 11.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -4.202 15.619 13.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -3.172 14.281 12.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -3.169 15.172 14.425 1.00 0.00 H new ATOM 1162 N HIS A 79 2.611 12.930 10.214 1.00 0.00 N ATOM 1163 CA HIS A 79 4.068 13.003 10.238 1.00 0.00 C ATOM 1164 C HIS A 79 4.550 14.377 9.780 1.00 0.00 C ATOM 1165 O HIS A 79 4.616 14.655 8.584 1.00 0.00 O ATOM 1166 CB HIS A 79 4.670 11.916 9.349 1.00 0.00 C ATOM 1167 CG HIS A 79 5.123 10.706 10.106 1.00 0.00 C ATOM 1168 ND1 HIS A 79 5.282 9.467 9.521 1.00 0.00 N ATOM 1169 CD2 HIS A 79 5.455 10.549 11.410 1.00 0.00 C ATOM 1170 CE1 HIS A 79 5.688 8.601 10.432 1.00 0.00 C ATOM 1171 NE2 HIS A 79 5.801 9.233 11.586 1.00 0.00 N ATOM 0 H HIS A 79 2.190 13.196 9.324 1.00 0.00 H new ATOM 0 HA HIS A 79 4.398 12.845 11.265 1.00 0.00 H new ATOM 0 HB2 HIS A 79 3.931 11.614 8.607 1.00 0.00 H new ATOM 0 HB3 HIS A 79 5.517 12.332 8.804 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.449 11.317 12.170 1.00 0.00 H new ATOM 0 HE1 HIS A 79 5.893 7.554 10.262 1.00 0.00 H new ATOM 0 HE2 HIS A 79 6.098 8.811 12.466 1.00 0.00 H new ATOM 1179 N ASN A 80 4.886 15.231 10.741 1.00 0.00 N ATOM 1180 CA ASN A 80 5.361 16.576 10.436 1.00 0.00 C ATOM 1181 C ASN A 80 4.357 17.323 9.563 1.00 0.00 C ATOM 1182 O ASN A 80 4.539 17.440 8.351 1.00 0.00 O ATOM 1183 CB ASN A 80 6.718 16.512 9.732 1.00 0.00 C ATOM 1184 CG ASN A 80 7.452 17.839 9.771 1.00 0.00 C ATOM 1185 OD1 ASN A 80 7.649 18.483 8.740 1.00 0.00 O ATOM 1186 ND2 ASN A 80 7.862 18.254 10.964 1.00 0.00 N ATOM 0 H ASN A 80 4.838 15.016 11.737 1.00 0.00 H new ATOM 0 HA ASN A 80 5.471 17.117 11.376 1.00 0.00 H new ATOM 0 HB2 ASN A 80 7.333 15.745 10.203 1.00 0.00 H new ATOM 0 HB3 ASN A 80 6.572 16.211 8.695 1.00 0.00 H new ATOM 0 HD21 ASN A 80 8.362 19.139 11.052 1.00 0.00 H new ATOM 0 HD22 ASN A 80 7.677 17.688 11.792 1.00 0.00 H new ATOM 1193 N SER A 81 3.297 17.825 10.187 1.00 0.00 N ATOM 1194 CA SER A 81 2.262 18.559 9.467 1.00 0.00 C ATOM 1195 C SER A 81 2.731 19.969 9.127 1.00 0.00 C ATOM 1196 O SER A 81 3.565 20.543 9.826 1.00 0.00 O ATOM 1197 CB SER A 81 0.981 18.622 10.299 1.00 0.00 C ATOM 1198 OG SER A 81 0.072 17.605 9.916 1.00 0.00 O ATOM 0 H SER A 81 3.132 17.737 11.190 1.00 0.00 H new ATOM 0 HA SER A 81 2.057 18.030 8.536 1.00 0.00 H new ATOM 0 HB2 SER A 81 1.225 18.516 11.356 1.00 0.00 H new ATOM 0 HB3 SER A 81 0.512 19.598 10.176 1.00 0.00 H new ATOM 0 HG SER A 81 -0.738 17.667 10.464 1.00 0.00 H new ATOM 1204 N ASN A 82 2.190 20.522 8.045 1.00 0.00 N ATOM 1205 CA ASN A 82 2.554 21.865 7.611 1.00 0.00 C ATOM 1206 C ASN A 82 4.040 21.943 7.269 1.00 0.00 C ATOM 1207 O ASN A 82 4.895 21.652 8.104 1.00 0.00 O ATOM 1208 CB ASN A 82 2.216 22.886 8.700 1.00 0.00 C ATOM 1209 CG ASN A 82 1.635 24.166 8.132 1.00 0.00 C ATOM 1210 OD1 ASN A 82 1.752 24.437 6.937 1.00 0.00 O ATOM 1211 ND2 ASN A 82 1.004 24.960 8.989 1.00 0.00 N ATOM 0 H ASN A 82 1.499 20.060 7.454 1.00 0.00 H new ATOM 0 HA ASN A 82 1.980 22.097 6.714 1.00 0.00 H new ATOM 0 HB2 ASN A 82 1.504 22.446 9.399 1.00 0.00 H new ATOM 0 HB3 ASN A 82 3.117 23.120 9.267 1.00 0.00 H new ATOM 0 HD21 ASN A 82 0.592 25.835 8.665 1.00 0.00 H new ATOM 0 HD22 ASN A 82 0.931 24.695 9.971 1.00 0.00 H new ATOM 1218 N SER A 83 4.337 22.339 6.035 1.00 0.00 N ATOM 1219 CA SER A 83 5.718 22.452 5.581 1.00 0.00 C ATOM 1220 C SER A 83 5.890 23.656 4.661 1.00 0.00 C ATOM 1221 O SER A 83 5.152 23.819 3.689 1.00 0.00 O ATOM 1222 CB SER A 83 6.145 21.176 4.854 1.00 0.00 C ATOM 1223 OG SER A 83 6.534 20.170 5.776 1.00 0.00 O ATOM 0 H SER A 83 3.640 22.587 5.333 1.00 0.00 H new ATOM 0 HA SER A 83 6.352 22.592 6.457 1.00 0.00 H new ATOM 0 HB2 SER A 83 5.322 20.812 4.239 1.00 0.00 H new ATOM 0 HB3 SER A 83 6.973 21.397 4.181 1.00 0.00 H new ATOM 0 HG SER A 83 6.152 20.368 6.657 1.00 0.00 H new ATOM 1229 N GLY A 84 6.871 24.498 4.974 1.00 0.00 N ATOM 1230 CA GLY A 84 7.123 25.677 4.166 1.00 0.00 C ATOM 1231 C GLY A 84 8.564 26.138 4.246 1.00 0.00 C ATOM 1232 O GLY A 84 9.466 25.371 4.587 1.00 0.00 O ATOM 0 H GLY A 84 7.495 24.384 5.773 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.871 25.463 3.128 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.468 26.484 4.493 1.00 0.00 H new ATOM 1236 N PRO A 85 8.800 27.419 3.928 1.00 0.00 N ATOM 1237 CA PRO A 85 10.140 28.010 3.958 1.00 0.00 C ATOM 1238 C PRO A 85 10.675 28.164 5.378 1.00 0.00 C ATOM 1239 O PRO A 85 10.203 29.006 6.141 1.00 0.00 O ATOM 1240 CB PRO A 85 9.938 29.383 3.311 1.00 0.00 C ATOM 1241 CG PRO A 85 8.502 29.705 3.548 1.00 0.00 C ATOM 1242 CD PRO A 85 7.772 28.391 3.514 1.00 0.00 C ATOM 0 HA PRO A 85 10.871 27.385 3.445 1.00 0.00 H new ATOM 0 HB2 PRO A 85 10.591 30.132 3.759 1.00 0.00 H new ATOM 0 HB3 PRO A 85 10.167 29.356 2.246 1.00 0.00 H new ATOM 0 HG2 PRO A 85 8.367 30.202 4.509 1.00 0.00 H new ATOM 0 HG3 PRO A 85 8.122 30.382 2.783 1.00 0.00 H new ATOM 0 HD2 PRO A 85 6.919 28.387 4.193 1.00 0.00 H new ATOM 0 HD3 PRO A 85 7.388 28.170 2.518 1.00 0.00 H new ATOM 1250 N SER A 86 11.662 27.344 5.725 1.00 0.00 N ATOM 1251 CA SER A 86 12.258 27.387 7.055 1.00 0.00 C ATOM 1252 C SER A 86 13.278 28.518 7.158 1.00 0.00 C ATOM 1253 O SER A 86 13.920 28.879 6.172 1.00 0.00 O ATOM 1254 CB SER A 86 12.928 26.050 7.381 1.00 0.00 C ATOM 1255 OG SER A 86 12.610 25.628 8.696 1.00 0.00 O ATOM 0 H SER A 86 12.065 26.642 5.104 1.00 0.00 H new ATOM 0 HA SER A 86 11.462 27.572 7.776 1.00 0.00 H new ATOM 0 HB2 SER A 86 12.606 25.294 6.665 1.00 0.00 H new ATOM 0 HB3 SER A 86 14.009 26.146 7.278 1.00 0.00 H new ATOM 0 HG SER A 86 13.048 24.771 8.880 1.00 0.00 H new ATOM 1261 N SER A 87 13.420 29.071 8.358 1.00 0.00 N ATOM 1262 CA SER A 87 14.358 30.162 8.589 1.00 0.00 C ATOM 1263 C SER A 87 15.618 29.658 9.286 1.00 0.00 C ATOM 1264 O SER A 87 15.613 28.597 9.910 1.00 0.00 O ATOM 1265 CB SER A 87 13.701 31.258 9.432 1.00 0.00 C ATOM 1266 OG SER A 87 13.566 30.852 10.782 1.00 0.00 O ATOM 0 H SER A 87 12.898 28.781 9.185 1.00 0.00 H new ATOM 0 HA SER A 87 14.640 30.576 7.621 1.00 0.00 H new ATOM 0 HB2 SER A 87 14.299 32.168 9.381 1.00 0.00 H new ATOM 0 HB3 SER A 87 12.720 31.498 9.021 1.00 0.00 H new ATOM 0 HG SER A 87 13.145 31.570 11.299 1.00 0.00 H new ATOM 1272 N GLY A 88 16.698 30.427 9.175 1.00 0.00 N ATOM 1273 CA GLY A 88 17.950 30.041 9.798 1.00 0.00 C ATOM 1274 C GLY A 88 18.470 28.713 9.283 1.00 0.00 C ATOM 1275 O GLY A 88 19.118 27.967 10.017 1.00 0.00 O ATOM 0 H GLY A 88 16.727 31.310 8.665 1.00 0.00 H new ATOM 0 HA2 GLY A 88 18.696 30.815 9.616 1.00 0.00 H new ATOM 0 HA3 GLY A 88 17.811 29.979 10.877 1.00 0.00 H new TER 1279 GLY A 88