USER MOD reduce.3.24.130724 H: found=0, std=0, add=860, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 864 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: B 164 GLN : amide:sc= -1.03 K(o=-0.091,f=-0.83) USER MOD Set 1.2: B 168 SER OG : rot 72:sc= 0.939 USER MOD Set 2.1: A 98 SER OG : rot 180:sc= 0.35 USER MOD Set 2.2: B 159 LYS NZ :NH3+ -152:sc= 0.279 (180deg=-0.442) USER MOD Set 3.1: A 60 TYR OH : rot -150:sc= 2.11 USER MOD Set 3.2: A 64 ASN : amide:sc= 1.18 K(o=4.5,f=1.5) USER MOD Set 3.3: B 157 THR OG1 : rot -41:sc= 1.19 USER MOD Set 4.1: A 14 LYS NZ :NH3+ 178:sc= 0.0554 (180deg=-0.579) USER MOD Set 4.2: A 51 SER OG : rot 95:sc= 0.679 USER MOD Single : A 3 GLN : amide:sc= -0.959 X(o=-0.96,f=-0.67) USER MOD Single : A 7 THR OG1 : rot 81:sc= 0.933 USER MOD Single : A 10 SER OG : rot -112:sc= -0.0851 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot -157:sc= 1.2 USER MOD Single : A 19 SER OG : rot -44:sc= 0.708 USER MOD Single : A 21 SER OG : rot 180:sc= 0.0319 USER MOD Single : A 24 MET CE :methyl 171:sc= 0 (180deg=-0.111) USER MOD Single : A 26 SER OG : rot -55:sc= 0.638 USER MOD Single : A 28 THR OG1 : rot 171:sc= 1.11 USER MOD Single : A 30 LYS NZ :NH3+ -111:sc= 0.235 (180deg=-0.0113) USER MOD Single : A 32 MET CE :methyl -171:sc=-0.00631 (180deg=-0.145) USER MOD Single : A 40 SER OG : rot -43:sc= 1.03 USER MOD Single : A 41 LYS NZ :NH3+ -178:sc= 0.254 (180deg=0.248) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 1.17 K(o=1.2,f=-0.018) USER MOD Single : A 52 HIS : no HE2:sc= 1.09 K(o=1.1,f=-3.3!) USER MOD Single : A 56 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.019) USER MOD Single : A 62 ASN : amide:sc= 1.19 K(o=1.2,f=-0.0033) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 143:sc= -0.0617 (180deg=-0.906) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.018 USER MOD Single : A 86 MET CE :methyl 166:sc= -0.077 (180deg=-0.457) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : B 162 CYS SG : rot 147:sc= 0.112 USER MOD Single : B 171 LYS NZ :NH3+ 163:sc= 1.09 (180deg=0.66) USER MOD ----------------------------------------------------------------- ATOM 31 N GLN A 3 2.130 2.906 6.066 1.00 0.00 N ATOM 32 CA GLN A 3 3.414 3.549 5.871 1.00 0.00 C ATOM 33 C GLN A 3 4.337 3.187 7.034 1.00 0.00 C ATOM 34 O GLN A 3 4.444 3.933 8.005 1.00 0.00 O ATOM 35 CB GLN A 3 3.193 5.060 5.751 1.00 0.00 C ATOM 36 CG GLN A 3 4.452 5.789 5.273 1.00 0.00 C ATOM 37 CD GLN A 3 4.277 7.284 5.491 1.00 0.00 C ATOM 38 OE1 GLN A 3 3.733 7.987 4.647 1.00 0.00 O ATOM 39 NE2 GLN A 3 4.702 7.776 6.646 1.00 0.00 N ATOM 0 HA GLN A 3 3.893 3.206 4.954 1.00 0.00 H new ATOM 0 HB2 GLN A 3 2.377 5.253 5.055 1.00 0.00 H new ATOM 0 HB3 GLN A 3 2.888 5.460 6.718 1.00 0.00 H new ATOM 0 HG2 GLN A 3 5.324 5.429 5.819 1.00 0.00 H new ATOM 0 HG3 GLN A 3 4.628 5.581 4.218 1.00 0.00 H new ATOM 0 HE21 GLN A 3 5.151 7.163 7.327 1.00 0.00 H new ATOM 0 HE22 GLN A 3 4.580 8.767 6.854 1.00 0.00 H new ATOM 48 N ASP A 4 5.032 2.051 6.931 1.00 0.00 N ATOM 49 CA ASP A 4 5.900 1.528 7.985 1.00 0.00 C ATOM 50 C ASP A 4 7.193 2.347 8.197 1.00 0.00 C ATOM 51 O ASP A 4 8.215 1.787 8.586 1.00 0.00 O ATOM 52 CB ASP A 4 6.198 0.046 7.688 1.00 0.00 C ATOM 53 CG ASP A 4 6.950 -0.670 8.813 1.00 0.00 C ATOM 54 OD1 ASP A 4 6.614 -0.416 9.991 1.00 0.00 O ATOM 55 OD2 ASP A 4 7.848 -1.471 8.474 1.00 0.00 O ATOM 0 H ASP A 4 5.006 1.461 6.099 1.00 0.00 H new ATOM 0 HA ASP A 4 5.368 1.619 8.932 1.00 0.00 H new ATOM 0 HB2 ASP A 4 5.258 -0.474 7.503 1.00 0.00 H new ATOM 0 HB3 ASP A 4 6.784 -0.021 6.772 1.00 0.00 H new ATOM 60 N PHE A 5 7.172 3.671 8.009 1.00 0.00 N ATOM 61 CA PHE A 5 8.275 4.572 8.319 1.00 0.00 C ATOM 62 C PHE A 5 7.716 5.949 8.678 1.00 0.00 C ATOM 63 O PHE A 5 6.689 6.358 8.131 1.00 0.00 O ATOM 64 CB PHE A 5 9.237 4.692 7.125 1.00 0.00 C ATOM 65 CG PHE A 5 10.447 3.781 7.198 1.00 0.00 C ATOM 66 CD1 PHE A 5 11.614 4.225 7.846 1.00 0.00 C ATOM 67 CD2 PHE A 5 10.421 2.508 6.602 1.00 0.00 C ATOM 68 CE1 PHE A 5 12.767 3.421 7.858 1.00 0.00 C ATOM 69 CE2 PHE A 5 11.572 1.698 6.620 1.00 0.00 C ATOM 70 CZ PHE A 5 12.751 2.164 7.227 1.00 0.00 C ATOM 0 H PHE A 5 6.360 4.155 7.625 1.00 0.00 H new ATOM 0 HA PHE A 5 8.832 4.168 9.164 1.00 0.00 H new ATOM 0 HB2 PHE A 5 8.688 4.473 6.209 1.00 0.00 H new ATOM 0 HB3 PHE A 5 9.579 5.724 7.053 1.00 0.00 H new ATOM 0 HD1 PHE A 5 11.624 5.187 8.336 1.00 0.00 H new ATOM 0 HD2 PHE A 5 9.517 2.151 6.130 1.00 0.00 H new ATOM 0 HE1 PHE A 5 13.663 3.768 8.351 1.00 0.00 H new ATOM 0 HE2 PHE A 5 11.549 0.718 6.167 1.00 0.00 H new ATOM 0 HZ PHE A 5 13.644 1.557 7.209 1.00 0.00 H new ATOM 80 N VAL A 6 8.413 6.664 9.567 1.00 0.00 N ATOM 81 CA VAL A 6 8.164 8.063 9.874 1.00 0.00 C ATOM 82 C VAL A 6 9.537 8.724 9.977 1.00 0.00 C ATOM 83 O VAL A 6 10.439 8.152 10.587 1.00 0.00 O ATOM 84 CB VAL A 6 7.379 8.225 11.190 1.00 0.00 C ATOM 85 CG1 VAL A 6 6.763 9.630 11.233 1.00 0.00 C ATOM 86 CG2 VAL A 6 6.269 7.178 11.351 1.00 0.00 C ATOM 0 H VAL A 6 9.185 6.269 10.104 1.00 0.00 H new ATOM 0 HA VAL A 6 7.552 8.526 9.099 1.00 0.00 H new ATOM 0 HB VAL A 6 8.080 8.079 12.012 1.00 0.00 H new ATOM 0 HG11 VAL A 6 6.205 9.754 12.161 1.00 0.00 H new ATOM 0 HG12 VAL A 6 7.556 10.376 11.183 1.00 0.00 H new ATOM 0 HG13 VAL A 6 6.090 9.758 10.385 1.00 0.00 H new ATOM 0 HG21 VAL A 6 5.750 7.341 12.295 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.561 7.269 10.527 1.00 0.00 H new ATOM 0 HG23 VAL A 6 6.707 6.180 11.345 1.00 0.00 H new ATOM 96 N THR A 7 9.714 9.893 9.363 1.00 0.00 N ATOM 97 CA THR A 7 10.986 10.598 9.343 1.00 0.00 C ATOM 98 C THR A 7 10.953 11.728 10.371 1.00 0.00 C ATOM 99 O THR A 7 9.957 12.448 10.461 1.00 0.00 O ATOM 100 CB THR A 7 11.274 11.111 7.925 1.00 0.00 C ATOM 101 OG1 THR A 7 10.914 10.133 6.972 1.00 0.00 O ATOM 102 CG2 THR A 7 12.743 11.483 7.724 1.00 0.00 C ATOM 0 H THR A 7 8.969 10.378 8.862 1.00 0.00 H new ATOM 0 HA THR A 7 11.798 9.923 9.615 1.00 0.00 H new ATOM 0 HB THR A 7 10.677 12.013 7.790 1.00 0.00 H new ATOM 0 HG1 THR A 7 9.947 10.170 6.815 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.892 11.840 6.705 1.00 0.00 H new ATOM 0 HG22 THR A 7 13.019 12.269 8.427 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.367 10.606 7.896 1.00 0.00 H new ATOM 110 N LEU A 8 12.029 11.888 11.139 1.00 0.00 N ATOM 111 CA LEU A 8 12.223 12.995 12.063 1.00 0.00 C ATOM 112 C LEU A 8 13.341 13.851 11.475 1.00 0.00 C ATOM 113 O LEU A 8 14.434 13.332 11.249 1.00 0.00 O ATOM 114 CB LEU A 8 12.582 12.438 13.454 1.00 0.00 C ATOM 115 CG LEU A 8 11.658 12.964 14.561 1.00 0.00 C ATOM 116 CD1 LEU A 8 10.239 12.409 14.405 1.00 0.00 C ATOM 117 CD2 LEU A 8 12.182 12.532 15.935 1.00 0.00 C ATOM 0 H LEU A 8 12.809 11.231 11.133 1.00 0.00 H new ATOM 0 HA LEU A 8 11.325 13.600 12.190 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.529 11.350 13.429 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.613 12.702 13.691 1.00 0.00 H new ATOM 0 HG LEU A 8 11.639 14.051 14.480 1.00 0.00 H new ATOM 0 HD11 LEU A 8 9.606 12.798 15.203 1.00 0.00 H new ATOM 0 HD12 LEU A 8 9.834 12.712 13.440 1.00 0.00 H new ATOM 0 HD13 LEU A 8 10.266 11.321 14.461 1.00 0.00 H new ATOM 0 HD21 LEU A 8 11.519 12.911 16.713 1.00 0.00 H new ATOM 0 HD22 LEU A 8 12.216 11.444 15.986 1.00 0.00 H new ATOM 0 HD23 LEU A 8 13.184 12.934 16.085 1.00 0.00 H new ATOM 129 N VAL A 9 13.067 15.125 11.174 1.00 0.00 N ATOM 130 CA VAL A 9 14.027 16.008 10.518 1.00 0.00 C ATOM 131 C VAL A 9 14.493 17.087 11.488 1.00 0.00 C ATOM 132 O VAL A 9 13.663 17.698 12.163 1.00 0.00 O ATOM 133 CB VAL A 9 13.429 16.626 9.246 1.00 0.00 C ATOM 134 CG1 VAL A 9 14.503 17.383 8.456 1.00 0.00 C ATOM 135 CG2 VAL A 9 12.760 15.568 8.365 1.00 0.00 C ATOM 0 H VAL A 9 12.172 15.569 11.380 1.00 0.00 H new ATOM 0 HA VAL A 9 14.892 15.417 10.217 1.00 0.00 H new ATOM 0 HB VAL A 9 12.659 17.333 9.555 1.00 0.00 H new ATOM 0 HG11 VAL A 9 14.059 17.813 7.558 1.00 0.00 H new ATOM 0 HG12 VAL A 9 14.916 18.180 9.075 1.00 0.00 H new ATOM 0 HG13 VAL A 9 15.299 16.695 8.173 1.00 0.00 H new ATOM 0 HG21 VAL A 9 12.349 16.043 7.474 1.00 0.00 H new ATOM 0 HG22 VAL A 9 13.497 14.821 8.070 1.00 0.00 H new ATOM 0 HG23 VAL A 9 11.957 15.085 8.922 1.00 0.00 H new ATOM 145 N SER A 10 15.808 17.327 11.539 1.00 0.00 N ATOM 146 CA SER A 10 16.426 18.355 12.372 1.00 0.00 C ATOM 147 C SER A 10 17.150 19.402 11.524 1.00 0.00 C ATOM 148 O SER A 10 17.421 19.173 10.345 1.00 0.00 O ATOM 149 CB SER A 10 17.365 17.709 13.397 1.00 0.00 C ATOM 150 OG SER A 10 18.048 16.584 12.870 1.00 0.00 O ATOM 0 H SER A 10 16.484 16.798 10.988 1.00 0.00 H new ATOM 0 HA SER A 10 15.639 18.879 12.914 1.00 0.00 H new ATOM 0 HB2 SER A 10 18.093 18.447 13.735 1.00 0.00 H new ATOM 0 HB3 SER A 10 16.790 17.405 14.272 1.00 0.00 H new ATOM 0 HG SER A 10 17.734 15.771 13.319 1.00 0.00 H new ATOM 156 N LYS A 11 17.446 20.544 12.160 1.00 0.00 N ATOM 157 CA LYS A 11 18.029 21.770 11.629 1.00 0.00 C ATOM 158 C LYS A 11 18.150 21.817 10.099 1.00 0.00 C ATOM 159 O LYS A 11 17.147 22.033 9.418 1.00 0.00 O ATOM 160 CB LYS A 11 19.321 22.082 12.405 1.00 0.00 C ATOM 161 CG LYS A 11 19.845 23.507 12.174 1.00 0.00 C ATOM 162 CD LYS A 11 20.787 23.954 13.301 1.00 0.00 C ATOM 163 CE LYS A 11 22.021 23.052 13.415 1.00 0.00 C ATOM 164 NZ LYS A 11 22.943 23.537 14.458 1.00 0.00 N ATOM 0 H LYS A 11 17.262 20.634 13.159 1.00 0.00 H new ATOM 0 HA LYS A 11 17.331 22.589 11.801 1.00 0.00 H new ATOM 0 HB2 LYS A 11 19.139 21.938 13.470 1.00 0.00 H new ATOM 0 HB3 LYS A 11 20.092 21.368 12.114 1.00 0.00 H new ATOM 0 HG2 LYS A 11 20.371 23.551 11.220 1.00 0.00 H new ATOM 0 HG3 LYS A 11 19.004 24.198 12.107 1.00 0.00 H new ATOM 0 HD2 LYS A 11 21.105 24.981 13.121 1.00 0.00 H new ATOM 0 HD3 LYS A 11 20.247 23.949 14.248 1.00 0.00 H new ATOM 0 HE2 LYS A 11 21.710 22.033 13.647 1.00 0.00 H new ATOM 0 HE3 LYS A 11 22.539 23.017 12.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 23.768 22.907 14.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 23.257 24.500 14.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 22.454 23.547 15.376 1.00 0.00 H new ATOM 178 N ASP A 12 19.356 21.648 9.545 1.00 0.00 N ATOM 179 CA ASP A 12 19.600 21.828 8.115 1.00 0.00 C ATOM 180 C ASP A 12 19.206 20.567 7.346 1.00 0.00 C ATOM 181 O ASP A 12 20.046 19.942 6.704 1.00 0.00 O ATOM 182 CB ASP A 12 21.063 22.204 7.836 1.00 0.00 C ATOM 183 CG ASP A 12 21.506 23.441 8.606 1.00 0.00 C ATOM 184 OD1 ASP A 12 21.041 24.541 8.240 1.00 0.00 O ATOM 185 OD2 ASP A 12 22.291 23.255 9.562 1.00 0.00 O ATOM 0 H ASP A 12 20.186 21.383 10.076 1.00 0.00 H new ATOM 0 HA ASP A 12 18.979 22.655 7.770 1.00 0.00 H new ATOM 0 HB2 ASP A 12 21.707 21.365 8.101 1.00 0.00 H new ATOM 0 HB3 ASP A 12 21.192 22.380 6.768 1.00 0.00 H new ATOM 190 N ASP A 13 17.929 20.192 7.422 1.00 0.00 N ATOM 191 CA ASP A 13 17.372 19.024 6.756 1.00 0.00 C ATOM 192 C ASP A 13 18.178 17.752 7.055 1.00 0.00 C ATOM 193 O ASP A 13 18.495 16.981 6.152 1.00 0.00 O ATOM 194 CB ASP A 13 17.223 19.296 5.248 1.00 0.00 C ATOM 195 CG ASP A 13 16.403 18.221 4.535 1.00 0.00 C ATOM 196 OD1 ASP A 13 15.312 17.900 5.055 1.00 0.00 O ATOM 197 OD2 ASP A 13 16.864 17.755 3.471 1.00 0.00 O ATOM 0 H ASP A 13 17.238 20.710 7.965 1.00 0.00 H new ATOM 0 HA ASP A 13 16.376 18.839 7.158 1.00 0.00 H new ATOM 0 HB2 ASP A 13 16.748 20.266 5.103 1.00 0.00 H new ATOM 0 HB3 ASP A 13 18.212 19.354 4.794 1.00 0.00 H new ATOM 202 N LYS A 14 18.461 17.494 8.336 1.00 0.00 N ATOM 203 CA LYS A 14 19.024 16.223 8.765 1.00 0.00 C ATOM 204 C LYS A 14 17.848 15.295 9.032 1.00 0.00 C ATOM 205 O LYS A 14 17.261 15.324 10.116 1.00 0.00 O ATOM 206 CB LYS A 14 19.882 16.363 10.026 1.00 0.00 C ATOM 207 CG LYS A 14 21.230 17.049 9.787 1.00 0.00 C ATOM 208 CD LYS A 14 21.131 18.555 10.041 1.00 0.00 C ATOM 209 CE LYS A 14 22.532 19.179 9.981 1.00 0.00 C ATOM 210 NZ LYS A 14 22.564 20.517 10.598 1.00 0.00 N ATOM 0 H LYS A 14 18.306 18.158 9.094 1.00 0.00 H new ATOM 0 HA LYS A 14 19.684 15.832 7.990 1.00 0.00 H new ATOM 0 HB2 LYS A 14 19.324 16.930 10.772 1.00 0.00 H new ATOM 0 HB3 LYS A 14 20.059 15.372 10.445 1.00 0.00 H new ATOM 0 HG2 LYS A 14 21.985 16.615 10.443 1.00 0.00 H new ATOM 0 HG3 LYS A 14 21.557 16.870 8.763 1.00 0.00 H new ATOM 0 HD2 LYS A 14 20.483 19.018 9.297 1.00 0.00 H new ATOM 0 HD3 LYS A 14 20.680 18.741 11.016 1.00 0.00 H new ATOM 0 HE2 LYS A 14 23.242 18.527 10.490 1.00 0.00 H new ATOM 0 HE3 LYS A 14 22.854 19.250 8.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 23.534 20.890 10.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 21.931 21.156 10.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 22.249 20.451 11.587 1.00 0.00 H new ATOM 224 N GLU A 15 17.500 14.521 8.005 1.00 0.00 N ATOM 225 CA GLU A 15 16.359 13.619 7.968 1.00 0.00 C ATOM 226 C GLU A 15 16.759 12.240 8.500 1.00 0.00 C ATOM 227 O GLU A 15 17.605 11.582 7.901 1.00 0.00 O ATOM 228 CB GLU A 15 15.859 13.485 6.519 1.00 0.00 C ATOM 229 CG GLU A 15 15.569 14.826 5.830 1.00 0.00 C ATOM 230 CD GLU A 15 14.957 14.635 4.445 1.00 0.00 C ATOM 231 OE1 GLU A 15 15.650 14.036 3.595 1.00 0.00 O ATOM 232 OE2 GLU A 15 13.801 15.082 4.263 1.00 0.00 O ATOM 0 H GLU A 15 18.034 14.508 7.136 1.00 0.00 H new ATOM 0 HA GLU A 15 15.565 14.024 8.595 1.00 0.00 H new ATOM 0 HB2 GLU A 15 16.605 12.944 5.937 1.00 0.00 H new ATOM 0 HB3 GLU A 15 14.951 12.882 6.513 1.00 0.00 H new ATOM 0 HG2 GLU A 15 14.890 15.413 6.449 1.00 0.00 H new ATOM 0 HG3 GLU A 15 16.494 15.396 5.743 1.00 0.00 H new ATOM 239 N TYR A 16 16.151 11.792 9.602 1.00 0.00 N ATOM 240 CA TYR A 16 16.338 10.446 10.136 1.00 0.00 C ATOM 241 C TYR A 16 15.057 9.640 9.914 1.00 0.00 C ATOM 242 O TYR A 16 14.013 10.010 10.445 1.00 0.00 O ATOM 243 CB TYR A 16 16.682 10.529 11.628 1.00 0.00 C ATOM 244 CG TYR A 16 17.791 11.507 11.976 1.00 0.00 C ATOM 245 CD1 TYR A 16 19.019 11.473 11.287 1.00 0.00 C ATOM 246 CD2 TYR A 16 17.579 12.477 12.973 1.00 0.00 C ATOM 247 CE1 TYR A 16 20.024 12.410 11.586 1.00 0.00 C ATOM 248 CE2 TYR A 16 18.593 13.399 13.280 1.00 0.00 C ATOM 249 CZ TYR A 16 19.808 13.375 12.581 1.00 0.00 C ATOM 250 OH TYR A 16 20.790 14.263 12.900 1.00 0.00 O ATOM 0 H TYR A 16 15.509 12.362 10.152 1.00 0.00 H new ATOM 0 HA TYR A 16 17.161 9.948 9.623 1.00 0.00 H new ATOM 0 HB2 TYR A 16 15.784 10.810 12.178 1.00 0.00 H new ATOM 0 HB3 TYR A 16 16.970 9.537 11.975 1.00 0.00 H new ATOM 0 HD1 TYR A 16 19.189 10.725 10.527 1.00 0.00 H new ATOM 0 HD2 TYR A 16 16.638 12.512 13.501 1.00 0.00 H new ATOM 0 HE1 TYR A 16 20.961 12.387 11.050 1.00 0.00 H new ATOM 0 HE2 TYR A 16 18.436 14.131 14.059 1.00 0.00 H new ATOM 0 HH TYR A 16 20.638 14.607 13.805 1.00 0.00 H new ATOM 260 N GLU A 17 15.122 8.568 9.120 1.00 0.00 N ATOM 261 CA GLU A 17 13.987 7.723 8.762 1.00 0.00 C ATOM 262 C GLU A 17 13.847 6.603 9.796 1.00 0.00 C ATOM 263 O GLU A 17 14.693 5.713 9.836 1.00 0.00 O ATOM 264 CB GLU A 17 14.209 7.127 7.360 1.00 0.00 C ATOM 265 CG GLU A 17 14.245 8.173 6.231 1.00 0.00 C ATOM 266 CD GLU A 17 15.471 9.086 6.261 1.00 0.00 C ATOM 267 OE1 GLU A 17 16.537 8.599 6.697 1.00 0.00 O ATOM 268 OE2 GLU A 17 15.314 10.257 5.855 1.00 0.00 O ATOM 0 H GLU A 17 15.996 8.257 8.696 1.00 0.00 H new ATOM 0 HA GLU A 17 13.073 8.317 8.751 1.00 0.00 H new ATOM 0 HB2 GLU A 17 15.147 6.572 7.357 1.00 0.00 H new ATOM 0 HB3 GLU A 17 13.415 6.410 7.152 1.00 0.00 H new ATOM 0 HG2 GLU A 17 14.214 7.657 5.272 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.347 8.788 6.292 1.00 0.00 H new ATOM 275 N ILE A 18 12.794 6.624 10.620 1.00 0.00 N ATOM 276 CA ILE A 18 12.573 5.633 11.666 1.00 0.00 C ATOM 277 C ILE A 18 11.467 4.687 11.212 1.00 0.00 C ATOM 278 O ILE A 18 10.369 5.137 10.887 1.00 0.00 O ATOM 279 CB ILE A 18 12.209 6.331 12.990 1.00 0.00 C ATOM 280 CG1 ILE A 18 13.304 7.326 13.401 1.00 0.00 C ATOM 281 CG2 ILE A 18 12.017 5.309 14.113 1.00 0.00 C ATOM 282 CD1 ILE A 18 12.859 8.751 13.088 1.00 0.00 C ATOM 0 H ILE A 18 12.067 7.338 10.575 1.00 0.00 H new ATOM 0 HA ILE A 18 13.482 5.058 11.841 1.00 0.00 H new ATOM 0 HB ILE A 18 11.274 6.868 12.829 1.00 0.00 H new ATOM 0 HG12 ILE A 18 13.515 7.228 14.466 1.00 0.00 H new ATOM 0 HG13 ILE A 18 14.229 7.101 12.871 1.00 0.00 H new ATOM 0 HG21 ILE A 18 11.761 5.827 15.037 1.00 0.00 H new ATOM 0 HG22 ILE A 18 11.213 4.623 13.847 1.00 0.00 H new ATOM 0 HG23 ILE A 18 12.940 4.748 14.256 1.00 0.00 H new ATOM 0 HD11 ILE A 18 13.642 9.450 13.383 1.00 0.00 H new ATOM 0 HD12 ILE A 18 12.671 8.847 12.019 1.00 0.00 H new ATOM 0 HD13 ILE A 18 11.946 8.976 13.639 1.00 0.00 H new ATOM 294 N SER A 19 11.744 3.382 11.183 1.00 0.00 N ATOM 295 CA SER A 19 10.743 2.371 10.890 1.00 0.00 C ATOM 296 C SER A 19 9.566 2.507 11.858 1.00 0.00 C ATOM 297 O SER A 19 9.771 2.720 13.055 1.00 0.00 O ATOM 298 CB SER A 19 11.393 0.993 11.002 1.00 0.00 C ATOM 299 OG SER A 19 12.632 1.023 10.321 1.00 0.00 O ATOM 0 H SER A 19 12.673 3.002 11.363 1.00 0.00 H new ATOM 0 HA SER A 19 10.358 2.501 9.879 1.00 0.00 H new ATOM 0 HB2 SER A 19 11.543 0.729 12.049 1.00 0.00 H new ATOM 0 HB3 SER A 19 10.743 0.232 10.571 1.00 0.00 H new ATOM 0 HG SER A 19 12.523 1.486 9.464 1.00 0.00 H new ATOM 305 N ARG A 20 8.332 2.398 11.359 1.00 0.00 N ATOM 306 CA ARG A 20 7.160 2.682 12.180 1.00 0.00 C ATOM 307 C ARG A 20 7.084 1.749 13.386 1.00 0.00 C ATOM 308 O ARG A 20 6.576 2.132 14.433 1.00 0.00 O ATOM 309 CB ARG A 20 5.868 2.682 11.360 1.00 0.00 C ATOM 310 CG ARG A 20 4.690 3.282 12.138 1.00 0.00 C ATOM 311 CD ARG A 20 3.783 2.213 12.761 1.00 0.00 C ATOM 312 NE ARG A 20 2.875 1.652 11.758 1.00 0.00 N ATOM 313 CZ ARG A 20 1.816 0.881 12.030 1.00 0.00 C ATOM 314 NH1 ARG A 20 1.602 0.425 13.269 1.00 0.00 N ATOM 315 NH2 ARG A 20 0.960 0.597 11.045 1.00 0.00 N ATOM 0 H ARG A 20 8.123 2.118 10.401 1.00 0.00 H new ATOM 0 HA ARG A 20 7.274 3.694 12.568 1.00 0.00 H new ATOM 0 HB2 ARG A 20 6.022 3.249 10.442 1.00 0.00 H new ATOM 0 HB3 ARG A 20 5.625 1.661 11.067 1.00 0.00 H new ATOM 0 HG2 ARG A 20 5.073 3.931 12.926 1.00 0.00 H new ATOM 0 HG3 ARG A 20 4.100 3.908 11.469 1.00 0.00 H new ATOM 0 HD2 ARG A 20 4.393 1.418 13.191 1.00 0.00 H new ATOM 0 HD3 ARG A 20 3.206 2.649 13.577 1.00 0.00 H new ATOM 0 HE ARG A 20 3.064 1.865 10.779 1.00 0.00 H new ATOM 0 HH11 ARG A 20 2.250 0.664 14.020 1.00 0.00 H new ATOM 0 HH12 ARG A 20 0.791 -0.162 13.463 1.00 0.00 H new ATOM 0 HH21 ARG A 20 1.120 0.966 10.108 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.146 0.011 11.230 1.00 0.00 H new ATOM 329 N SER A 21 7.625 0.539 13.253 1.00 0.00 N ATOM 330 CA SER A 21 7.834 -0.395 14.343 1.00 0.00 C ATOM 331 C SER A 21 8.478 0.287 15.561 1.00 0.00 C ATOM 332 O SER A 21 8.045 0.069 16.689 1.00 0.00 O ATOM 333 CB SER A 21 8.705 -1.525 13.790 1.00 0.00 C ATOM 334 OG SER A 21 9.739 -0.975 12.985 1.00 0.00 O ATOM 0 H SER A 21 7.938 0.176 12.352 1.00 0.00 H new ATOM 0 HA SER A 21 6.884 -0.788 14.704 1.00 0.00 H new ATOM 0 HB2 SER A 21 9.135 -2.102 14.609 1.00 0.00 H new ATOM 0 HB3 SER A 21 8.097 -2.212 13.201 1.00 0.00 H new ATOM 0 HG SER A 21 10.298 -1.698 12.632 1.00 0.00 H new ATOM 340 N ALA A 22 9.495 1.123 15.332 1.00 0.00 N ATOM 341 CA ALA A 22 10.102 1.959 16.360 1.00 0.00 C ATOM 342 C ALA A 22 9.251 3.206 16.578 1.00 0.00 C ATOM 343 O ALA A 22 8.923 3.515 17.719 1.00 0.00 O ATOM 344 CB ALA A 22 11.541 2.306 15.968 1.00 0.00 C ATOM 0 H ALA A 22 9.922 1.236 14.413 1.00 0.00 H new ATOM 0 HA ALA A 22 10.142 1.416 17.304 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.988 2.931 16.741 1.00 0.00 H new ATOM 0 HB2 ALA A 22 12.121 1.389 15.863 1.00 0.00 H new ATOM 0 HB3 ALA A 22 11.540 2.845 15.021 1.00 0.00 H new ATOM 350 N ALA A 23 8.875 3.925 15.515 1.00 0.00 N ATOM 351 CA ALA A 23 8.150 5.188 15.652 1.00 0.00 C ATOM 352 C ALA A 23 6.954 5.068 16.606 1.00 0.00 C ATOM 353 O ALA A 23 6.778 5.893 17.495 1.00 0.00 O ATOM 354 CB ALA A 23 7.698 5.716 14.290 1.00 0.00 C ATOM 0 H ALA A 23 9.062 3.652 14.550 1.00 0.00 H new ATOM 0 HA ALA A 23 8.846 5.905 16.088 1.00 0.00 H new ATOM 0 HB1 ALA A 23 7.162 6.656 14.424 1.00 0.00 H new ATOM 0 HB2 ALA A 23 8.569 5.882 13.657 1.00 0.00 H new ATOM 0 HB3 ALA A 23 7.040 4.987 13.817 1.00 0.00 H new ATOM 360 N MET A 24 6.158 4.010 16.440 1.00 0.00 N ATOM 361 CA MET A 24 4.961 3.718 17.215 1.00 0.00 C ATOM 362 C MET A 24 5.239 3.568 18.710 1.00 0.00 C ATOM 363 O MET A 24 4.330 3.783 19.510 1.00 0.00 O ATOM 364 CB MET A 24 4.307 2.457 16.637 1.00 0.00 C ATOM 365 CG MET A 24 2.913 2.183 17.215 1.00 0.00 C ATOM 366 SD MET A 24 2.001 0.825 16.435 1.00 0.00 S ATOM 367 CE MET A 24 3.073 -0.567 16.856 1.00 0.00 C ATOM 0 H MET A 24 6.343 3.304 15.728 1.00 0.00 H new ATOM 0 HA MET A 24 4.281 4.566 17.134 1.00 0.00 H new ATOM 0 HB2 MET A 24 4.231 2.558 15.554 1.00 0.00 H new ATOM 0 HB3 MET A 24 4.950 1.599 16.833 1.00 0.00 H new ATOM 0 HG2 MET A 24 3.015 1.966 18.278 1.00 0.00 H new ATOM 0 HG3 MET A 24 2.318 3.093 17.131 1.00 0.00 H new ATOM 0 HE1 MET A 24 2.578 -1.501 16.590 1.00 0.00 H new ATOM 0 HE2 MET A 24 4.010 -0.484 16.306 1.00 0.00 H new ATOM 0 HE3 MET A 24 3.278 -0.557 17.926 1.00 0.00 H new ATOM 377 N ILE A 25 6.472 3.227 19.106 1.00 0.00 N ATOM 378 CA ILE A 25 6.843 3.209 20.517 1.00 0.00 C ATOM 379 C ILE A 25 6.601 4.606 21.106 1.00 0.00 C ATOM 380 O ILE A 25 6.238 4.725 22.271 1.00 0.00 O ATOM 381 CB ILE A 25 8.286 2.693 20.691 1.00 0.00 C ATOM 382 CG1 ILE A 25 8.405 1.263 20.130 1.00 0.00 C ATOM 383 CG2 ILE A 25 8.717 2.718 22.162 1.00 0.00 C ATOM 384 CD1 ILE A 25 9.826 0.696 20.213 1.00 0.00 C ATOM 0 H ILE A 25 7.223 2.962 18.469 1.00 0.00 H new ATOM 0 HA ILE A 25 6.221 2.511 21.076 1.00 0.00 H new ATOM 0 HB ILE A 25 8.949 3.357 20.136 1.00 0.00 H new ATOM 0 HG12 ILE A 25 7.727 0.608 20.677 1.00 0.00 H new ATOM 0 HG13 ILE A 25 8.080 1.260 19.090 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.739 2.348 22.248 1.00 0.00 H new ATOM 0 HG22 ILE A 25 8.668 3.740 22.538 1.00 0.00 H new ATOM 0 HG23 ILE A 25 8.051 2.084 22.747 1.00 0.00 H new ATOM 0 HD11 ILE A 25 9.840 -0.313 19.801 1.00 0.00 H new ATOM 0 HD12 ILE A 25 10.505 1.330 19.642 1.00 0.00 H new ATOM 0 HD13 ILE A 25 10.146 0.667 21.255 1.00 0.00 H new ATOM 396 N SER A 26 6.756 5.651 20.285 1.00 0.00 N ATOM 397 CA SER A 26 6.365 7.017 20.586 1.00 0.00 C ATOM 398 C SER A 26 4.984 7.260 19.960 1.00 0.00 C ATOM 399 O SER A 26 4.912 7.702 18.812 1.00 0.00 O ATOM 400 CB SER A 26 7.423 7.958 20.012 1.00 0.00 C ATOM 401 OG SER A 26 8.604 7.807 20.773 1.00 0.00 O ATOM 0 H SER A 26 7.174 5.556 19.359 1.00 0.00 H new ATOM 0 HA SER A 26 6.297 7.197 21.659 1.00 0.00 H new ATOM 0 HB2 SER A 26 7.613 7.724 18.964 1.00 0.00 H new ATOM 0 HB3 SER A 26 7.075 8.990 20.050 1.00 0.00 H new ATOM 0 HG SER A 26 8.404 7.956 21.721 1.00 0.00 H new ATOM 407 N PRO A 27 3.878 6.983 20.678 1.00 0.00 N ATOM 408 CA PRO A 27 2.534 6.962 20.114 1.00 0.00 C ATOM 409 C PRO A 27 2.187 8.187 19.271 1.00 0.00 C ATOM 410 O PRO A 27 1.600 8.032 18.205 1.00 0.00 O ATOM 411 CB PRO A 27 1.569 6.764 21.290 1.00 0.00 C ATOM 412 CG PRO A 27 2.408 7.098 22.523 1.00 0.00 C ATOM 413 CD PRO A 27 3.807 6.669 22.096 1.00 0.00 C ATOM 0 HA PRO A 27 2.456 6.144 19.398 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.702 7.420 21.209 1.00 0.00 H new ATOM 0 HB3 PRO A 27 1.193 5.742 21.329 1.00 0.00 H new ATOM 0 HG2 PRO A 27 2.366 8.159 22.767 1.00 0.00 H new ATOM 0 HG3 PRO A 27 2.068 6.554 23.405 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.573 7.204 22.658 1.00 0.00 H new ATOM 0 HD3 PRO A 27 3.966 5.605 22.274 1.00 0.00 H new ATOM 421 N THR A 28 2.553 9.389 19.720 1.00 0.00 N ATOM 422 CA THR A 28 2.335 10.636 18.999 1.00 0.00 C ATOM 423 C THR A 28 2.814 10.535 17.545 1.00 0.00 C ATOM 424 O THR A 28 2.094 10.896 16.612 1.00 0.00 O ATOM 425 CB THR A 28 3.107 11.742 19.734 1.00 0.00 C ATOM 426 OG1 THR A 28 4.412 11.269 20.003 1.00 0.00 O ATOM 427 CG2 THR A 28 2.438 12.103 21.063 1.00 0.00 C ATOM 0 H THR A 28 3.020 9.521 20.617 1.00 0.00 H new ATOM 0 HA THR A 28 1.268 10.859 18.971 1.00 0.00 H new ATOM 0 HB THR A 28 3.125 12.631 19.104 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.966 12.007 20.334 1.00 0.00 H new ATOM 0 HG21 THR A 28 3.010 12.888 21.557 1.00 0.00 H new ATOM 0 HG22 THR A 28 1.424 12.456 20.876 1.00 0.00 H new ATOM 0 HG23 THR A 28 2.403 11.222 21.704 1.00 0.00 H new ATOM 435 N LEU A 29 4.052 10.058 17.376 1.00 0.00 N ATOM 436 CA LEU A 29 4.755 10.047 16.105 1.00 0.00 C ATOM 437 C LEU A 29 4.010 9.191 15.082 1.00 0.00 C ATOM 438 O LEU A 29 3.938 9.557 13.915 1.00 0.00 O ATOM 439 CB LEU A 29 6.202 9.578 16.324 1.00 0.00 C ATOM 440 CG LEU A 29 7.082 9.623 15.063 1.00 0.00 C ATOM 441 CD1 LEU A 29 7.129 11.023 14.446 1.00 0.00 C ATOM 442 CD2 LEU A 29 8.504 9.192 15.436 1.00 0.00 C ATOM 0 H LEU A 29 4.598 9.662 18.141 1.00 0.00 H new ATOM 0 HA LEU A 29 4.790 11.057 15.696 1.00 0.00 H new ATOM 0 HB2 LEU A 29 6.660 10.199 17.094 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.186 8.557 16.705 1.00 0.00 H new ATOM 0 HG LEU A 29 6.649 8.948 14.325 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.761 11.008 13.558 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.121 11.332 14.169 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.538 11.727 15.171 1.00 0.00 H new ATOM 0 HD21 LEU A 29 9.137 9.220 14.549 1.00 0.00 H new ATOM 0 HD22 LEU A 29 8.904 9.871 16.189 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.484 8.178 15.835 1.00 0.00 H new ATOM 454 N LYS A 30 3.434 8.068 15.518 1.00 0.00 N ATOM 455 CA LYS A 30 2.540 7.291 14.671 1.00 0.00 C ATOM 456 C LYS A 30 1.212 8.031 14.546 1.00 0.00 C ATOM 457 O LYS A 30 0.819 8.384 13.444 1.00 0.00 O ATOM 458 CB LYS A 30 2.394 5.876 15.247 1.00 0.00 C ATOM 459 CG LYS A 30 1.559 4.900 14.402 1.00 0.00 C ATOM 460 CD LYS A 30 0.045 5.153 14.444 1.00 0.00 C ATOM 461 CE LYS A 30 -0.739 3.895 14.045 1.00 0.00 C ATOM 462 NZ LYS A 30 -0.413 3.454 12.677 1.00 0.00 N ATOM 0 H LYS A 30 3.573 7.681 16.451 1.00 0.00 H new ATOM 0 HA LYS A 30 2.944 7.180 13.665 1.00 0.00 H new ATOM 0 HB2 LYS A 30 3.389 5.453 15.381 1.00 0.00 H new ATOM 0 HB3 LYS A 30 1.943 5.950 16.236 1.00 0.00 H new ATOM 0 HG2 LYS A 30 1.895 4.957 13.367 1.00 0.00 H new ATOM 0 HG3 LYS A 30 1.754 3.884 14.745 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -0.247 5.464 15.447 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.208 5.972 13.770 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -0.518 3.092 14.748 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -1.808 4.096 14.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.235 3.607 12.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 0.396 4.001 12.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.170 2.443 12.687 1.00 0.00 H new ATOM 476 N ALA A 31 0.515 8.253 15.662 1.00 0.00 N ATOM 477 CA ALA A 31 -0.857 8.748 15.720 1.00 0.00 C ATOM 478 C ALA A 31 -1.152 9.891 14.746 1.00 0.00 C ATOM 479 O ALA A 31 -2.184 9.878 14.079 1.00 0.00 O ATOM 480 CB ALA A 31 -1.187 9.171 17.154 1.00 0.00 C ATOM 0 H ALA A 31 0.910 8.085 16.587 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.498 7.924 15.406 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.211 9.541 17.198 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.082 8.314 17.819 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -0.503 9.960 17.467 1.00 0.00 H new ATOM 486 N MET A 32 -0.276 10.897 14.684 1.00 0.00 N ATOM 487 CA MET A 32 -0.516 12.071 13.850 1.00 0.00 C ATOM 488 C MET A 32 -0.366 11.785 12.351 1.00 0.00 C ATOM 489 O MET A 32 -0.869 12.555 11.533 1.00 0.00 O ATOM 490 CB MET A 32 0.429 13.202 14.276 1.00 0.00 C ATOM 491 CG MET A 32 0.176 13.650 15.721 1.00 0.00 C ATOM 492 SD MET A 32 1.144 15.078 16.281 1.00 0.00 S ATOM 493 CE MET A 32 2.829 14.450 16.096 1.00 0.00 C ATOM 0 H MET A 32 0.603 10.920 15.201 1.00 0.00 H new ATOM 0 HA MET A 32 -1.553 12.370 14.002 1.00 0.00 H new ATOM 0 HB2 MET A 32 1.462 12.868 14.176 1.00 0.00 H new ATOM 0 HB3 MET A 32 0.302 14.052 13.606 1.00 0.00 H new ATOM 0 HG2 MET A 32 -0.883 13.887 15.829 1.00 0.00 H new ATOM 0 HG3 MET A 32 0.384 12.810 16.384 1.00 0.00 H new ATOM 0 HE1 MET A 32 3.530 15.151 16.549 1.00 0.00 H new ATOM 0 HE2 MET A 32 2.913 13.482 16.590 1.00 0.00 H new ATOM 0 HE3 MET A 32 3.061 14.338 15.037 1.00 0.00 H new ATOM 503 N ILE A 33 0.342 10.717 11.984 1.00 0.00 N ATOM 504 CA ILE A 33 0.639 10.350 10.607 1.00 0.00 C ATOM 505 C ILE A 33 -0.078 9.027 10.315 1.00 0.00 C ATOM 506 O ILE A 33 -0.718 8.469 11.202 1.00 0.00 O ATOM 507 CB ILE A 33 2.176 10.322 10.394 1.00 0.00 C ATOM 508 CG1 ILE A 33 2.841 8.968 10.704 1.00 0.00 C ATOM 509 CG2 ILE A 33 2.872 11.406 11.233 1.00 0.00 C ATOM 510 CD1 ILE A 33 3.312 8.278 9.422 1.00 0.00 C ATOM 0 H ILE A 33 0.736 10.065 12.662 1.00 0.00 H new ATOM 0 HA ILE A 33 0.269 11.081 9.888 1.00 0.00 H new ATOM 0 HB ILE A 33 2.304 10.510 9.328 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.689 9.121 11.371 1.00 0.00 H new ATOM 0 HG13 ILE A 33 2.135 8.324 11.228 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.948 11.362 11.063 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.498 12.388 10.942 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.664 11.238 12.290 1.00 0.00 H new ATOM 0 HD11 ILE A 33 3.777 7.325 9.672 1.00 0.00 H new ATOM 0 HD12 ILE A 33 2.458 8.104 8.767 1.00 0.00 H new ATOM 0 HD13 ILE A 33 4.037 8.913 8.912 1.00 0.00 H new ATOM 522 N GLU A 34 0.006 8.517 9.085 1.00 0.00 N ATOM 523 CA GLU A 34 -0.437 7.172 8.718 1.00 0.00 C ATOM 524 C GLU A 34 -1.963 6.966 8.730 1.00 0.00 C ATOM 525 O GLU A 34 -2.515 6.492 7.745 1.00 0.00 O ATOM 526 CB GLU A 34 0.300 6.127 9.569 1.00 0.00 C ATOM 527 CG GLU A 34 0.365 4.765 8.866 1.00 0.00 C ATOM 528 CD GLU A 34 1.204 3.752 9.639 1.00 0.00 C ATOM 529 OE1 GLU A 34 1.662 4.115 10.743 1.00 0.00 O ATOM 530 OE2 GLU A 34 1.355 2.622 9.124 1.00 0.00 O ATOM 0 H GLU A 34 0.393 9.040 8.299 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.168 7.036 7.670 1.00 0.00 H new ATOM 0 HB2 GLU A 34 1.311 6.476 9.779 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -0.205 6.017 10.529 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -0.645 4.375 8.740 1.00 0.00 H new ATOM 0 HG3 GLU A 34 0.784 4.894 7.868 1.00 0.00 H new ATOM 537 N GLY A 35 -2.665 7.291 9.817 1.00 0.00 N ATOM 538 CA GLY A 35 -4.120 7.315 9.848 1.00 0.00 C ATOM 539 C GLY A 35 -4.648 8.338 8.846 1.00 0.00 C ATOM 540 O GLY A 35 -5.264 7.958 7.846 1.00 0.00 O ATOM 0 H GLY A 35 -2.232 7.546 10.705 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -4.513 6.326 9.612 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -4.466 7.564 10.851 1.00 0.00 H new ATOM 544 N PRO A 36 -4.400 9.639 9.066 1.00 0.00 N ATOM 545 CA PRO A 36 -4.742 10.663 8.094 1.00 0.00 C ATOM 546 C PRO A 36 -3.737 10.650 6.933 1.00 0.00 C ATOM 547 O PRO A 36 -3.090 11.655 6.644 1.00 0.00 O ATOM 548 CB PRO A 36 -4.758 11.967 8.896 1.00 0.00 C ATOM 549 CG PRO A 36 -3.693 11.724 9.966 1.00 0.00 C ATOM 550 CD PRO A 36 -3.849 10.237 10.280 1.00 0.00 C ATOM 0 HA PRO A 36 -5.709 10.511 7.614 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -4.515 12.828 8.273 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -5.737 12.158 9.336 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -2.693 11.956 9.599 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.860 12.342 10.848 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.890 9.788 10.539 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.513 10.083 11.130 1.00 0.00 H new ATOM 558 N PHE A 37 -3.603 9.520 6.229 1.00 0.00 N ATOM 559 CA PHE A 37 -2.608 9.368 5.172 1.00 0.00 C ATOM 560 C PHE A 37 -2.910 10.190 3.930 1.00 0.00 C ATOM 561 O PHE A 37 -2.098 10.191 3.007 1.00 0.00 O ATOM 562 CB PHE A 37 -2.449 7.893 4.763 1.00 0.00 C ATOM 563 CG PHE A 37 -3.719 7.244 4.229 1.00 0.00 C ATOM 564 CD1 PHE A 37 -4.151 7.512 2.915 1.00 0.00 C ATOM 565 CD2 PHE A 37 -4.485 6.391 5.046 1.00 0.00 C ATOM 566 CE1 PHE A 37 -5.389 7.026 2.463 1.00 0.00 C ATOM 567 CE2 PHE A 37 -5.707 5.878 4.582 1.00 0.00 C ATOM 568 CZ PHE A 37 -6.179 6.225 3.306 1.00 0.00 C ATOM 0 H PHE A 37 -4.180 8.692 6.378 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.679 9.743 5.601 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.672 7.822 4.001 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.102 7.325 5.626 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -3.527 8.094 2.252 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -4.132 6.130 6.033 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -5.734 7.268 1.468 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -6.285 5.215 5.208 1.00 0.00 H new ATOM 0 HZ PHE A 37 -7.146 5.878 2.973 1.00 0.00 H new ATOM 578 N ARG A 38 -4.031 10.911 3.892 1.00 0.00 N ATOM 579 CA ARG A 38 -4.343 11.803 2.781 1.00 0.00 C ATOM 580 C ARG A 38 -3.222 12.821 2.502 1.00 0.00 C ATOM 581 O ARG A 38 -3.217 13.411 1.425 1.00 0.00 O ATOM 582 CB ARG A 38 -5.705 12.483 3.003 1.00 0.00 C ATOM 583 CG ARG A 38 -6.876 11.651 2.454 1.00 0.00 C ATOM 584 CD ARG A 38 -7.106 10.324 3.188 1.00 0.00 C ATOM 585 NE ARG A 38 -7.616 10.547 4.547 1.00 0.00 N ATOM 586 CZ ARG A 38 -7.416 9.756 5.611 1.00 0.00 C ATOM 587 NH1 ARG A 38 -6.576 8.717 5.558 1.00 0.00 N ATOM 588 NH2 ARG A 38 -8.069 10.014 6.748 1.00 0.00 N ATOM 0 H ARG A 38 -4.741 10.892 4.624 1.00 0.00 H new ATOM 0 HA ARG A 38 -4.413 11.192 1.881 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -5.853 12.653 4.069 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.702 13.461 2.522 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -7.787 12.246 2.510 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -6.696 11.443 1.399 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -7.814 9.714 2.627 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -6.171 9.765 3.235 1.00 0.00 H new ATOM 0 HE ARG A 38 -8.177 11.386 4.696 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -6.072 8.513 4.695 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -6.440 8.129 6.380 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -8.711 10.805 6.799 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -7.926 9.420 7.565 1.00 0.00 H new ATOM 602 N GLU A 39 -2.269 13.019 3.429 1.00 0.00 N ATOM 603 CA GLU A 39 -1.076 13.830 3.187 1.00 0.00 C ATOM 604 C GLU A 39 0.219 13.071 3.538 1.00 0.00 C ATOM 605 O GLU A 39 1.262 13.695 3.712 1.00 0.00 O ATOM 606 CB GLU A 39 -1.219 15.141 3.975 1.00 0.00 C ATOM 607 CG GLU A 39 -0.410 16.306 3.387 1.00 0.00 C ATOM 608 CD GLU A 39 -0.576 17.568 4.228 1.00 0.00 C ATOM 609 OE1 GLU A 39 -0.306 17.472 5.447 1.00 0.00 O ATOM 610 OE2 GLU A 39 -0.978 18.598 3.646 1.00 0.00 O ATOM 0 H GLU A 39 -2.310 12.618 4.366 1.00 0.00 H new ATOM 0 HA GLU A 39 -0.995 14.057 2.124 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.272 15.422 4.008 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -0.901 14.973 5.004 1.00 0.00 H new ATOM 0 HG2 GLU A 39 0.644 16.033 3.339 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.736 16.500 2.365 1.00 0.00 H new ATOM 617 N SER A 40 0.173 11.735 3.637 1.00 0.00 N ATOM 618 CA SER A 40 1.250 10.822 4.040 1.00 0.00 C ATOM 619 C SER A 40 1.758 11.069 5.468 1.00 0.00 C ATOM 620 O SER A 40 1.590 10.225 6.348 1.00 0.00 O ATOM 621 CB SER A 40 2.382 10.775 2.999 1.00 0.00 C ATOM 622 OG SER A 40 3.139 11.971 2.938 1.00 0.00 O ATOM 0 H SER A 40 -0.684 11.226 3.421 1.00 0.00 H new ATOM 0 HA SER A 40 0.809 9.826 4.068 1.00 0.00 H new ATOM 0 HB2 SER A 40 3.047 9.944 3.234 1.00 0.00 H new ATOM 0 HB3 SER A 40 1.954 10.574 2.017 1.00 0.00 H new ATOM 0 HG SER A 40 2.535 12.742 2.964 1.00 0.00 H new ATOM 628 N LYS A 41 2.372 12.235 5.680 1.00 0.00 N ATOM 629 CA LYS A 41 2.827 12.760 6.960 1.00 0.00 C ATOM 630 C LYS A 41 4.050 12.020 7.502 1.00 0.00 C ATOM 631 O LYS A 41 4.408 12.178 8.664 1.00 0.00 O ATOM 632 CB LYS A 41 1.661 12.885 7.946 1.00 0.00 C ATOM 633 CG LYS A 41 0.552 13.783 7.388 1.00 0.00 C ATOM 634 CD LYS A 41 -0.635 13.772 8.352 1.00 0.00 C ATOM 635 CE LYS A 41 -1.878 14.393 7.710 1.00 0.00 C ATOM 636 NZ LYS A 41 -1.723 15.843 7.489 1.00 0.00 N ATOM 0 H LYS A 41 2.575 12.874 4.912 1.00 0.00 H new ATOM 0 HA LYS A 41 3.191 13.775 6.801 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.257 11.896 8.161 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.022 13.294 8.890 1.00 0.00 H new ATOM 0 HG2 LYS A 41 0.922 14.800 7.259 1.00 0.00 H new ATOM 0 HG3 LYS A 41 0.241 13.429 6.405 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -0.852 12.747 8.653 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -0.377 14.322 9.257 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -2.078 13.901 6.758 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -2.743 14.215 8.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -2.600 16.228 7.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -1.524 16.313 8.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -0.935 16.012 6.831 1.00 0.00 H new ATOM 650 N GLY A 42 4.783 11.307 6.645 1.00 0.00 N ATOM 651 CA GLY A 42 5.984 10.589 7.047 1.00 0.00 C ATOM 652 C GLY A 42 7.194 11.477 7.333 1.00 0.00 C ATOM 653 O GLY A 42 8.317 10.986 7.224 1.00 0.00 O ATOM 0 H GLY A 42 4.557 11.214 5.655 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.760 10.005 7.940 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.248 9.881 6.261 1.00 0.00 H new ATOM 657 N ARG A 43 7.008 12.752 7.697 1.00 0.00 N ATOM 658 CA ARG A 43 8.092 13.684 7.949 1.00 0.00 C ATOM 659 C ARG A 43 7.685 14.737 8.982 1.00 0.00 C ATOM 660 O ARG A 43 6.927 15.646 8.654 1.00 0.00 O ATOM 661 CB ARG A 43 8.527 14.312 6.620 1.00 0.00 C ATOM 662 CG ARG A 43 9.916 14.937 6.756 1.00 0.00 C ATOM 663 CD ARG A 43 10.465 15.363 5.395 1.00 0.00 C ATOM 664 NE ARG A 43 10.118 16.754 5.075 1.00 0.00 N ATOM 665 CZ ARG A 43 10.827 17.571 4.279 1.00 0.00 C ATOM 666 NH1 ARG A 43 11.982 17.183 3.720 1.00 0.00 N ATOM 667 NH2 ARG A 43 10.362 18.802 4.047 1.00 0.00 N ATOM 0 H ARG A 43 6.083 13.162 7.824 1.00 0.00 H new ATOM 0 HA ARG A 43 8.943 13.152 8.375 1.00 0.00 H new ATOM 0 HB2 ARG A 43 8.538 13.553 5.838 1.00 0.00 H new ATOM 0 HB3 ARG A 43 7.807 15.072 6.317 1.00 0.00 H new ATOM 0 HG2 ARG A 43 9.866 15.802 7.418 1.00 0.00 H new ATOM 0 HG3 ARG A 43 10.596 14.221 7.218 1.00 0.00 H new ATOM 0 HD2 ARG A 43 11.549 15.249 5.389 1.00 0.00 H new ATOM 0 HD3 ARG A 43 10.071 14.703 4.622 1.00 0.00 H new ATOM 0 HE ARG A 43 9.267 17.131 5.492 1.00 0.00 H new ATOM 0 HH11 ARG A 43 12.344 16.246 3.895 1.00 0.00 H new ATOM 0 HH12 ARG A 43 12.499 17.825 3.120 1.00 0.00 H new ATOM 0 HH21 ARG A 43 9.485 19.104 4.471 1.00 0.00 H new ATOM 0 HH22 ARG A 43 10.884 19.439 3.446 1.00 0.00 H new ATOM 681 N ILE A 44 8.193 14.635 10.214 1.00 0.00 N ATOM 682 CA ILE A 44 8.039 15.674 11.227 1.00 0.00 C ATOM 683 C ILE A 44 9.279 16.569 11.166 1.00 0.00 C ATOM 684 O ILE A 44 10.404 16.091 11.332 1.00 0.00 O ATOM 685 CB ILE A 44 7.838 15.065 12.624 1.00 0.00 C ATOM 686 CG1 ILE A 44 6.782 13.944 12.651 1.00 0.00 C ATOM 687 CG2 ILE A 44 7.474 16.159 13.639 1.00 0.00 C ATOM 688 CD1 ILE A 44 5.406 14.341 12.104 1.00 0.00 C ATOM 0 H ILE A 44 8.724 13.825 10.534 1.00 0.00 H new ATOM 0 HA ILE A 44 7.147 16.269 11.028 1.00 0.00 H new ATOM 0 HB ILE A 44 8.788 14.608 12.901 1.00 0.00 H new ATOM 0 HG12 ILE A 44 7.156 13.098 12.074 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.663 13.601 13.679 1.00 0.00 H new ATOM 0 HG21 ILE A 44 7.335 15.711 14.623 1.00 0.00 H new ATOM 0 HG22 ILE A 44 8.277 16.894 13.685 1.00 0.00 H new ATOM 0 HG23 ILE A 44 6.551 16.649 13.330 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.731 13.488 12.164 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.004 15.164 12.694 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.504 14.654 11.064 1.00 0.00 H new ATOM 700 N GLU A 45 9.071 17.860 10.894 1.00 0.00 N ATOM 701 CA GLU A 45 10.131 18.818 10.637 1.00 0.00 C ATOM 702 C GLU A 45 10.407 19.666 11.876 1.00 0.00 C ATOM 703 O GLU A 45 9.760 20.691 12.078 1.00 0.00 O ATOM 704 CB GLU A 45 9.751 19.681 9.426 1.00 0.00 C ATOM 705 CG GLU A 45 9.594 18.824 8.159 1.00 0.00 C ATOM 706 CD GLU A 45 9.203 19.654 6.939 1.00 0.00 C ATOM 707 OE1 GLU A 45 9.671 20.811 6.856 1.00 0.00 O ATOM 708 OE2 GLU A 45 8.459 19.110 6.094 1.00 0.00 O ATOM 0 H GLU A 45 8.138 18.270 10.847 1.00 0.00 H new ATOM 0 HA GLU A 45 11.055 18.287 10.406 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.819 20.208 9.630 1.00 0.00 H new ATOM 0 HB3 GLU A 45 10.516 20.440 9.262 1.00 0.00 H new ATOM 0 HG2 GLU A 45 10.531 18.305 7.957 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.837 18.059 8.333 1.00 0.00 H new ATOM 715 N LEU A 46 11.413 19.299 12.674 1.00 0.00 N ATOM 716 CA LEU A 46 11.781 20.059 13.861 1.00 0.00 C ATOM 717 C LEU A 46 12.766 21.133 13.412 1.00 0.00 C ATOM 718 O LEU A 46 13.934 21.152 13.802 1.00 0.00 O ATOM 719 CB LEU A 46 12.371 19.150 14.953 1.00 0.00 C ATOM 720 CG LEU A 46 11.429 18.092 15.548 1.00 0.00 C ATOM 721 CD1 LEU A 46 10.098 18.705 15.993 1.00 0.00 C ATOM 722 CD2 LEU A 46 11.194 16.913 14.602 1.00 0.00 C ATOM 0 H LEU A 46 11.989 18.472 12.513 1.00 0.00 H new ATOM 0 HA LEU A 46 10.903 20.521 14.313 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.240 18.639 14.538 1.00 0.00 H new ATOM 0 HB3 LEU A 46 12.731 19.782 15.765 1.00 0.00 H new ATOM 0 HG LEU A 46 11.934 17.699 16.430 1.00 0.00 H new ATOM 0 HD11 LEU A 46 9.459 17.925 16.408 1.00 0.00 H new ATOM 0 HD12 LEU A 46 10.283 19.465 16.752 1.00 0.00 H new ATOM 0 HD13 LEU A 46 9.603 19.161 15.136 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.521 16.197 15.074 1.00 0.00 H new ATOM 0 HD22 LEU A 46 10.748 17.274 13.675 1.00 0.00 H new ATOM 0 HD23 LEU A 46 12.145 16.428 14.382 1.00 0.00 H new ATOM 734 N LYS A 47 12.269 22.024 12.552 1.00 0.00 N ATOM 735 CA LYS A 47 13.031 23.109 11.970 1.00 0.00 C ATOM 736 C LYS A 47 13.807 23.861 13.055 1.00 0.00 C ATOM 737 O LYS A 47 13.228 24.324 14.034 1.00 0.00 O ATOM 738 CB LYS A 47 12.112 24.017 11.138 1.00 0.00 C ATOM 739 CG LYS A 47 10.914 24.582 11.916 1.00 0.00 C ATOM 740 CD LYS A 47 10.025 25.408 10.979 1.00 0.00 C ATOM 741 CE LYS A 47 8.817 25.961 11.743 1.00 0.00 C ATOM 742 NZ LYS A 47 7.946 26.759 10.863 1.00 0.00 N ATOM 0 H LYS A 47 11.299 22.002 12.238 1.00 0.00 H new ATOM 0 HA LYS A 47 13.776 22.708 11.283 1.00 0.00 H new ATOM 0 HB2 LYS A 47 12.699 24.847 10.744 1.00 0.00 H new ATOM 0 HB3 LYS A 47 11.742 23.454 10.281 1.00 0.00 H new ATOM 0 HG2 LYS A 47 10.337 23.768 12.354 1.00 0.00 H new ATOM 0 HG3 LYS A 47 11.265 25.203 12.740 1.00 0.00 H new ATOM 0 HD2 LYS A 47 10.600 26.229 10.551 1.00 0.00 H new ATOM 0 HD3 LYS A 47 9.686 24.789 10.148 1.00 0.00 H new ATOM 0 HE2 LYS A 47 8.247 25.137 12.172 1.00 0.00 H new ATOM 0 HE3 LYS A 47 9.161 26.577 12.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 7.138 27.119 11.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 8.485 27.559 10.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 7.600 26.163 10.084 1.00 0.00 H new ATOM 756 N GLN A 48 15.130 23.909 12.888 1.00 0.00 N ATOM 757 CA GLN A 48 16.109 24.585 13.740 1.00 0.00 C ATOM 758 C GLN A 48 16.577 23.702 14.902 1.00 0.00 C ATOM 759 O GLN A 48 17.646 23.952 15.460 1.00 0.00 O ATOM 760 CB GLN A 48 15.619 25.971 14.204 1.00 0.00 C ATOM 761 CG GLN A 48 16.746 26.883 14.724 1.00 0.00 C ATOM 762 CD GLN A 48 16.673 27.112 16.234 1.00 0.00 C ATOM 763 OE1 GLN A 48 16.198 28.149 16.685 1.00 0.00 O ATOM 764 NE2 GLN A 48 17.148 26.163 17.034 1.00 0.00 N ATOM 0 H GLN A 48 15.576 23.443 12.098 1.00 0.00 H new ATOM 0 HA GLN A 48 16.990 24.765 13.124 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.117 26.466 13.373 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.877 25.840 14.992 1.00 0.00 H new ATOM 0 HG2 GLN A 48 17.710 26.440 14.474 1.00 0.00 H new ATOM 0 HG3 GLN A 48 16.695 27.844 14.212 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.538 25.309 16.636 1.00 0.00 H new ATOM 0 HE22 GLN A 48 17.122 26.289 18.046 1.00 0.00 H new ATOM 773 N PHE A 49 15.807 22.679 15.276 1.00 0.00 N ATOM 774 CA PHE A 49 16.136 21.813 16.398 1.00 0.00 C ATOM 775 C PHE A 49 17.439 21.072 16.098 1.00 0.00 C ATOM 776 O PHE A 49 17.627 20.605 14.973 1.00 0.00 O ATOM 777 CB PHE A 49 14.974 20.850 16.616 1.00 0.00 C ATOM 778 CG PHE A 49 14.914 20.221 17.987 1.00 0.00 C ATOM 779 CD1 PHE A 49 15.561 18.999 18.230 1.00 0.00 C ATOM 780 CD2 PHE A 49 14.103 20.800 18.981 1.00 0.00 C ATOM 781 CE1 PHE A 49 15.330 18.315 19.434 1.00 0.00 C ATOM 782 CE2 PHE A 49 13.891 20.125 20.194 1.00 0.00 C ATOM 783 CZ PHE A 49 14.494 18.877 20.414 1.00 0.00 C ATOM 0 H PHE A 49 14.937 22.431 14.805 1.00 0.00 H new ATOM 0 HA PHE A 49 16.286 22.390 17.311 1.00 0.00 H new ATOM 0 HB2 PHE A 49 14.041 21.384 16.437 1.00 0.00 H new ATOM 0 HB3 PHE A 49 15.035 20.056 15.871 1.00 0.00 H new ATOM 0 HD1 PHE A 49 16.234 18.586 17.493 1.00 0.00 H new ATOM 0 HD2 PHE A 49 13.644 21.763 18.811 1.00 0.00 H new ATOM 0 HE1 PHE A 49 15.795 17.356 19.607 1.00 0.00 H new ATOM 0 HE2 PHE A 49 13.265 20.565 20.956 1.00 0.00 H new ATOM 0 HZ PHE A 49 14.315 18.347 21.338 1.00 0.00 H new ATOM 793 N ASP A 50 18.338 20.969 17.083 1.00 0.00 N ATOM 794 CA ASP A 50 19.696 20.495 16.854 1.00 0.00 C ATOM 795 C ASP A 50 19.763 19.088 16.252 1.00 0.00 C ATOM 796 O ASP A 50 19.126 18.149 16.736 1.00 0.00 O ATOM 797 CB ASP A 50 20.530 20.590 18.134 1.00 0.00 C ATOM 798 CG ASP A 50 21.949 20.085 17.888 1.00 0.00 C ATOM 799 OD1 ASP A 50 22.161 18.865 18.066 1.00 0.00 O ATOM 800 OD2 ASP A 50 22.786 20.915 17.476 1.00 0.00 O ATOM 0 H ASP A 50 18.141 21.212 18.054 1.00 0.00 H new ATOM 0 HA ASP A 50 20.126 21.159 16.104 1.00 0.00 H new ATOM 0 HB2 ASP A 50 20.561 21.624 18.479 1.00 0.00 H new ATOM 0 HB3 ASP A 50 20.061 20.004 18.924 1.00 0.00 H new ATOM 805 N SER A 51 20.606 18.964 15.221 1.00 0.00 N ATOM 806 CA SER A 51 20.938 17.757 14.492 1.00 0.00 C ATOM 807 C SER A 51 21.159 16.565 15.420 1.00 0.00 C ATOM 808 O SER A 51 20.479 15.544 15.322 1.00 0.00 O ATOM 809 CB SER A 51 22.192 18.055 13.655 1.00 0.00 C ATOM 810 OG SER A 51 22.214 19.426 13.282 1.00 0.00 O ATOM 0 H SER A 51 21.107 19.773 14.854 1.00 0.00 H new ATOM 0 HA SER A 51 20.105 17.477 13.847 1.00 0.00 H new ATOM 0 HB2 SER A 51 23.087 17.811 14.227 1.00 0.00 H new ATOM 0 HB3 SER A 51 22.202 17.427 12.764 1.00 0.00 H new ATOM 0 HG SER A 51 22.752 19.932 13.926 1.00 0.00 H new ATOM 816 N HIS A 52 22.148 16.691 16.303 1.00 0.00 N ATOM 817 CA HIS A 52 22.633 15.587 17.107 1.00 0.00 C ATOM 818 C HIS A 52 21.704 15.314 18.281 1.00 0.00 C ATOM 819 O HIS A 52 21.562 14.169 18.695 1.00 0.00 O ATOM 820 CB HIS A 52 24.085 15.841 17.514 1.00 0.00 C ATOM 821 CG HIS A 52 24.963 15.969 16.294 1.00 0.00 C ATOM 822 ND1 HIS A 52 25.121 15.001 15.324 1.00 0.00 N ATOM 823 CD2 HIS A 52 25.499 17.131 15.809 1.00 0.00 C ATOM 824 CE1 HIS A 52 25.756 15.571 14.286 1.00 0.00 C ATOM 825 NE2 HIS A 52 25.995 16.870 14.528 1.00 0.00 N ATOM 0 H HIS A 52 22.634 17.571 16.477 1.00 0.00 H new ATOM 0 HA HIS A 52 22.628 14.671 16.516 1.00 0.00 H new ATOM 0 HB2 HIS A 52 24.147 16.751 18.111 1.00 0.00 H new ATOM 0 HB3 HIS A 52 24.441 15.024 18.141 1.00 0.00 H new ATOM 0 HD1 HIS A 52 24.812 14.031 15.384 1.00 0.00 H new ATOM 0 HD2 HIS A 52 25.533 18.080 16.324 1.00 0.00 H new ATOM 0 HE1 HIS A 52 26.036 15.054 13.380 1.00 0.00 H new ATOM 833 N ILE A 53 21.030 16.337 18.805 1.00 0.00 N ATOM 834 CA ILE A 53 19.995 16.104 19.799 1.00 0.00 C ATOM 835 C ILE A 53 18.888 15.241 19.197 1.00 0.00 C ATOM 836 O ILE A 53 18.546 14.201 19.761 1.00 0.00 O ATOM 837 CB ILE A 53 19.489 17.428 20.385 1.00 0.00 C ATOM 838 CG1 ILE A 53 20.661 18.085 21.139 1.00 0.00 C ATOM 839 CG2 ILE A 53 18.324 17.151 21.339 1.00 0.00 C ATOM 840 CD1 ILE A 53 20.253 19.303 21.957 1.00 0.00 C ATOM 0 H ILE A 53 21.181 17.316 18.561 1.00 0.00 H new ATOM 0 HA ILE A 53 20.410 15.549 20.641 1.00 0.00 H new ATOM 0 HB ILE A 53 19.134 18.093 19.598 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.115 17.348 21.802 1.00 0.00 H new ATOM 0 HG13 ILE A 53 21.425 18.380 20.420 1.00 0.00 H new ATOM 0 HG21 ILE A 53 17.964 18.091 21.756 1.00 0.00 H new ATOM 0 HG22 ILE A 53 17.516 16.662 20.794 1.00 0.00 H new ATOM 0 HG23 ILE A 53 18.662 16.502 22.147 1.00 0.00 H new ATOM 0 HD11 ILE A 53 21.129 19.713 22.460 1.00 0.00 H new ATOM 0 HD12 ILE A 53 19.827 20.058 21.297 1.00 0.00 H new ATOM 0 HD13 ILE A 53 19.511 19.010 22.700 1.00 0.00 H new ATOM 852 N LEU A 54 18.334 15.639 18.046 1.00 0.00 N ATOM 853 CA LEU A 54 17.303 14.816 17.428 1.00 0.00 C ATOM 854 C LEU A 54 17.870 13.427 17.103 1.00 0.00 C ATOM 855 O LEU A 54 17.198 12.423 17.334 1.00 0.00 O ATOM 856 CB LEU A 54 16.690 15.525 16.215 1.00 0.00 C ATOM 857 CG LEU A 54 15.326 14.933 15.808 1.00 0.00 C ATOM 858 CD1 LEU A 54 14.230 15.361 16.798 1.00 0.00 C ATOM 859 CD2 LEU A 54 14.922 15.418 14.414 1.00 0.00 C ATOM 0 H LEU A 54 18.574 16.494 17.543 1.00 0.00 H new ATOM 0 HA LEU A 54 16.482 14.667 18.130 1.00 0.00 H new ATOM 0 HB2 LEU A 54 16.569 16.584 16.441 1.00 0.00 H new ATOM 0 HB3 LEU A 54 17.378 15.455 15.372 1.00 0.00 H new ATOM 0 HG LEU A 54 15.428 13.848 15.811 1.00 0.00 H new ATOM 0 HD11 LEU A 54 13.276 14.932 16.492 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.483 15.006 17.797 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.153 16.448 16.808 1.00 0.00 H new ATOM 0 HD21 LEU A 54 13.957 14.989 14.145 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.848 16.506 14.414 1.00 0.00 H new ATOM 0 HD23 LEU A 54 15.673 15.105 13.688 1.00 0.00 H new ATOM 871 N GLU A 55 19.127 13.361 16.640 1.00 0.00 N ATOM 872 CA GLU A 55 19.833 12.100 16.432 1.00 0.00 C ATOM 873 C GLU A 55 19.774 11.213 17.685 1.00 0.00 C ATOM 874 O GLU A 55 19.364 10.057 17.612 1.00 0.00 O ATOM 875 CB GLU A 55 21.276 12.359 15.982 1.00 0.00 C ATOM 876 CG GLU A 55 21.921 11.162 15.275 1.00 0.00 C ATOM 877 CD GLU A 55 23.290 11.526 14.698 1.00 0.00 C ATOM 878 OE1 GLU A 55 23.938 12.433 15.269 1.00 0.00 O ATOM 879 OE2 GLU A 55 23.665 10.895 13.686 1.00 0.00 O ATOM 0 H GLU A 55 19.679 14.185 16.401 1.00 0.00 H new ATOM 0 HA GLU A 55 19.330 11.554 15.634 1.00 0.00 H new ATOM 0 HB2 GLU A 55 21.290 13.218 15.311 1.00 0.00 H new ATOM 0 HB3 GLU A 55 21.877 12.624 16.852 1.00 0.00 H new ATOM 0 HG2 GLU A 55 22.029 10.337 15.979 1.00 0.00 H new ATOM 0 HG3 GLU A 55 21.268 10.815 14.474 1.00 0.00 H new ATOM 886 N LYS A 56 20.174 11.746 18.844 1.00 0.00 N ATOM 887 CA LYS A 56 20.153 10.993 20.090 1.00 0.00 C ATOM 888 C LYS A 56 18.724 10.583 20.442 1.00 0.00 C ATOM 889 O LYS A 56 18.509 9.458 20.880 1.00 0.00 O ATOM 890 CB LYS A 56 20.814 11.795 21.220 1.00 0.00 C ATOM 891 CG LYS A 56 22.332 11.961 21.041 1.00 0.00 C ATOM 892 CD LYS A 56 23.089 10.630 21.163 1.00 0.00 C ATOM 893 CE LYS A 56 24.603 10.850 21.256 1.00 0.00 C ATOM 894 NZ LYS A 56 25.140 11.511 20.054 1.00 0.00 N ATOM 0 H LYS A 56 20.517 12.702 18.939 1.00 0.00 H new ATOM 0 HA LYS A 56 20.734 10.080 19.959 1.00 0.00 H new ATOM 0 HB2 LYS A 56 20.352 12.781 21.275 1.00 0.00 H new ATOM 0 HB3 LYS A 56 20.619 11.298 22.171 1.00 0.00 H new ATOM 0 HG2 LYS A 56 22.533 12.401 20.064 1.00 0.00 H new ATOM 0 HG3 LYS A 56 22.708 12.659 21.789 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.743 10.094 22.047 1.00 0.00 H new ATOM 0 HD3 LYS A 56 22.864 10.002 20.301 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.828 11.456 22.134 1.00 0.00 H new ATOM 0 HE3 LYS A 56 25.101 9.890 21.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 26.175 11.580 20.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 24.890 10.955 19.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.735 12.465 19.972 1.00 0.00 H new ATOM 908 N ALA A 57 17.742 11.464 20.235 1.00 0.00 N ATOM 909 CA ALA A 57 16.345 11.125 20.477 1.00 0.00 C ATOM 910 C ALA A 57 15.906 9.913 19.641 1.00 0.00 C ATOM 911 O ALA A 57 15.352 8.951 20.175 1.00 0.00 O ATOM 912 CB ALA A 57 15.459 12.348 20.230 1.00 0.00 C ATOM 0 H ALA A 57 17.892 12.416 19.901 1.00 0.00 H new ATOM 0 HA ALA A 57 16.233 10.834 21.521 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.417 12.085 20.413 1.00 0.00 H new ATOM 0 HB2 ALA A 57 15.754 13.153 20.903 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.574 12.678 19.198 1.00 0.00 H new ATOM 918 N VAL A 58 16.155 9.927 18.327 1.00 0.00 N ATOM 919 CA VAL A 58 15.777 8.784 17.495 1.00 0.00 C ATOM 920 C VAL A 58 16.584 7.539 17.883 1.00 0.00 C ATOM 921 O VAL A 58 16.036 6.435 17.938 1.00 0.00 O ATOM 922 CB VAL A 58 15.830 9.104 15.989 1.00 0.00 C ATOM 923 CG1 VAL A 58 14.881 10.263 15.663 1.00 0.00 C ATOM 924 CG2 VAL A 58 17.224 9.440 15.461 1.00 0.00 C ATOM 0 H VAL A 58 16.604 10.695 17.829 1.00 0.00 H new ATOM 0 HA VAL A 58 14.730 8.558 17.695 1.00 0.00 H new ATOM 0 HB VAL A 58 15.521 8.187 15.488 1.00 0.00 H new ATOM 0 HG11 VAL A 58 14.926 10.481 14.596 1.00 0.00 H new ATOM 0 HG12 VAL A 58 13.862 9.986 15.934 1.00 0.00 H new ATOM 0 HG13 VAL A 58 15.179 11.147 16.227 1.00 0.00 H new ATOM 0 HG21 VAL A 58 17.167 9.652 14.393 1.00 0.00 H new ATOM 0 HG22 VAL A 58 17.610 10.315 15.984 1.00 0.00 H new ATOM 0 HG23 VAL A 58 17.890 8.594 15.628 1.00 0.00 H new ATOM 934 N GLU A 59 17.875 7.708 18.193 1.00 0.00 N ATOM 935 CA GLU A 59 18.708 6.600 18.638 1.00 0.00 C ATOM 936 C GLU A 59 18.139 6.007 19.935 1.00 0.00 C ATOM 937 O GLU A 59 18.087 4.789 20.070 1.00 0.00 O ATOM 938 CB GLU A 59 20.180 7.028 18.756 1.00 0.00 C ATOM 939 CG GLU A 59 21.165 5.896 18.419 1.00 0.00 C ATOM 940 CD GLU A 59 21.047 4.680 19.334 1.00 0.00 C ATOM 941 OE1 GLU A 59 21.527 4.784 20.482 1.00 0.00 O ATOM 942 OE2 GLU A 59 20.488 3.663 18.865 1.00 0.00 O ATOM 0 H GLU A 59 18.359 8.604 18.142 1.00 0.00 H new ATOM 0 HA GLU A 59 18.690 5.807 17.890 1.00 0.00 H new ATOM 0 HB2 GLU A 59 20.362 7.871 18.089 1.00 0.00 H new ATOM 0 HB3 GLU A 59 20.371 7.378 19.771 1.00 0.00 H new ATOM 0 HG2 GLU A 59 21.001 5.580 17.389 1.00 0.00 H new ATOM 0 HG3 GLU A 59 22.182 6.284 18.476 1.00 0.00 H new ATOM 949 N TYR A 60 17.657 6.837 20.866 1.00 0.00 N ATOM 950 CA TYR A 60 16.937 6.328 22.026 1.00 0.00 C ATOM 951 C TYR A 60 15.766 5.470 21.574 1.00 0.00 C ATOM 952 O TYR A 60 15.584 4.387 22.114 1.00 0.00 O ATOM 953 CB TYR A 60 16.433 7.425 22.973 1.00 0.00 C ATOM 954 CG TYR A 60 15.495 6.869 24.034 1.00 0.00 C ATOM 955 CD1 TYR A 60 16.023 6.172 25.136 1.00 0.00 C ATOM 956 CD2 TYR A 60 14.106 6.827 23.791 1.00 0.00 C ATOM 957 CE1 TYR A 60 15.169 5.490 26.020 1.00 0.00 C ATOM 958 CE2 TYR A 60 13.258 6.098 24.643 1.00 0.00 C ATOM 959 CZ TYR A 60 13.790 5.432 25.760 1.00 0.00 C ATOM 960 OH TYR A 60 12.964 4.747 26.603 1.00 0.00 O ATOM 0 H TYR A 60 17.753 7.852 20.836 1.00 0.00 H new ATOM 0 HA TYR A 60 17.655 5.734 22.592 1.00 0.00 H new ATOM 0 HB2 TYR A 60 17.283 7.907 23.456 1.00 0.00 H new ATOM 0 HB3 TYR A 60 15.916 8.193 22.397 1.00 0.00 H new ATOM 0 HD1 TYR A 60 17.090 6.161 25.304 1.00 0.00 H new ATOM 0 HD2 TYR A 60 13.692 7.358 22.946 1.00 0.00 H new ATOM 0 HE1 TYR A 60 15.573 5.011 26.899 1.00 0.00 H new ATOM 0 HE2 TYR A 60 12.199 6.050 24.439 1.00 0.00 H new ATOM 0 HH TYR A 60 12.201 4.394 26.099 1.00 0.00 H new ATOM 970 N LEU A 61 14.945 5.932 20.628 1.00 0.00 N ATOM 971 CA LEU A 61 13.777 5.147 20.241 1.00 0.00 C ATOM 972 C LEU A 61 14.205 3.775 19.707 1.00 0.00 C ATOM 973 O LEU A 61 13.643 2.749 20.094 1.00 0.00 O ATOM 974 CB LEU A 61 12.877 5.924 19.270 1.00 0.00 C ATOM 975 CG LEU A 61 11.427 5.408 19.239 1.00 0.00 C ATOM 976 CD1 LEU A 61 10.762 5.491 20.621 1.00 0.00 C ATOM 977 CD2 LEU A 61 10.629 6.292 18.275 1.00 0.00 C ATOM 0 H LEU A 61 15.062 6.815 20.132 1.00 0.00 H new ATOM 0 HA LEU A 61 13.167 4.963 21.126 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.875 6.977 19.551 1.00 0.00 H new ATOM 0 HB3 LEU A 61 13.299 5.863 18.267 1.00 0.00 H new ATOM 0 HG LEU A 61 11.440 4.364 18.925 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.740 5.117 20.556 1.00 0.00 H new ATOM 0 HD12 LEU A 61 11.325 4.887 21.332 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.749 6.528 20.957 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.596 5.946 18.235 1.00 0.00 H new ATOM 0 HD22 LEU A 61 10.653 7.324 18.624 1.00 0.00 H new ATOM 0 HD23 LEU A 61 11.070 6.235 17.280 1.00 0.00 H new ATOM 989 N ASN A 62 15.252 3.738 18.875 1.00 0.00 N ATOM 990 CA ASN A 62 15.874 2.471 18.487 1.00 0.00 C ATOM 991 C ASN A 62 16.296 1.667 19.727 1.00 0.00 C ATOM 992 O ASN A 62 16.006 0.475 19.843 1.00 0.00 O ATOM 993 CB ASN A 62 17.066 2.726 17.558 1.00 0.00 C ATOM 994 CG ASN A 62 17.896 1.458 17.383 1.00 0.00 C ATOM 995 OD1 ASN A 62 17.441 0.494 16.777 1.00 0.00 O ATOM 996 ND2 ASN A 62 19.111 1.437 17.924 1.00 0.00 N ATOM 0 H ASN A 62 15.682 4.565 18.461 1.00 0.00 H new ATOM 0 HA ASN A 62 15.141 1.876 17.943 1.00 0.00 H new ATOM 0 HB2 ASN A 62 16.709 3.070 16.587 1.00 0.00 H new ATOM 0 HB3 ASN A 62 17.689 3.521 17.968 1.00 0.00 H new ATOM 0 HD21 ASN A 62 19.692 0.603 17.841 1.00 0.00 H new ATOM 0 HD22 ASN A 62 19.462 2.255 18.422 1.00 0.00 H new ATOM 1003 N TYR A 63 16.957 2.318 20.682 1.00 0.00 N ATOM 1004 CA TYR A 63 17.324 1.700 21.947 1.00 0.00 C ATOM 1005 C TYR A 63 16.088 1.159 22.678 1.00 0.00 C ATOM 1006 O TYR A 63 16.154 0.112 23.312 1.00 0.00 O ATOM 1007 CB TYR A 63 18.138 2.673 22.815 1.00 0.00 C ATOM 1008 CG TYR A 63 19.164 1.977 23.684 1.00 0.00 C ATOM 1009 CD1 TYR A 63 18.743 1.143 24.735 1.00 0.00 C ATOM 1010 CD2 TYR A 63 20.528 2.025 23.337 1.00 0.00 C ATOM 1011 CE1 TYR A 63 19.654 0.268 25.347 1.00 0.00 C ATOM 1012 CE2 TYR A 63 21.453 1.207 24.009 1.00 0.00 C ATOM 1013 CZ TYR A 63 21.012 0.309 24.994 1.00 0.00 C ATOM 1014 OH TYR A 63 21.905 -0.514 25.610 1.00 0.00 O ATOM 0 H TYR A 63 17.252 3.291 20.597 1.00 0.00 H new ATOM 0 HA TYR A 63 17.965 0.844 21.739 1.00 0.00 H new ATOM 0 HB2 TYR A 63 18.644 3.390 22.169 1.00 0.00 H new ATOM 0 HB3 TYR A 63 17.458 3.240 23.450 1.00 0.00 H new ATOM 0 HD1 TYR A 63 17.717 1.176 25.072 1.00 0.00 H new ATOM 0 HD2 TYR A 63 20.863 2.690 22.555 1.00 0.00 H new ATOM 0 HE1 TYR A 63 19.310 -0.437 26.090 1.00 0.00 H new ATOM 0 HE2 TYR A 63 22.504 1.269 23.767 1.00 0.00 H new ATOM 0 HH TYR A 63 22.801 -0.356 25.245 1.00 0.00 H new ATOM 1024 N ASN A 64 14.946 1.840 22.587 1.00 0.00 N ATOM 1025 CA ASN A 64 13.705 1.406 23.206 1.00 0.00 C ATOM 1026 C ASN A 64 13.169 0.167 22.486 1.00 0.00 C ATOM 1027 O ASN A 64 12.637 -0.734 23.135 1.00 0.00 O ATOM 1028 CB ASN A 64 12.673 2.539 23.218 1.00 0.00 C ATOM 1029 CG ASN A 64 11.632 2.384 24.329 1.00 0.00 C ATOM 1030 OD1 ASN A 64 11.268 3.367 24.969 1.00 0.00 O ATOM 1031 ND2 ASN A 64 11.155 1.172 24.608 1.00 0.00 N ATOM 0 H ASN A 64 14.861 2.718 22.074 1.00 0.00 H new ATOM 0 HA ASN A 64 13.903 1.140 24.244 1.00 0.00 H new ATOM 0 HB2 ASN A 64 13.188 3.492 23.340 1.00 0.00 H new ATOM 0 HB3 ASN A 64 12.166 2.572 22.254 1.00 0.00 H new ATOM 0 HD21 ASN A 64 10.478 1.051 25.362 1.00 0.00 H new ATOM 0 HD22 ASN A 64 11.466 0.365 24.068 1.00 0.00 H new ATOM 1038 N LEU A 65 13.295 0.113 21.157 1.00 0.00 N ATOM 1039 CA LEU A 65 12.977 -1.099 20.409 1.00 0.00 C ATOM 1040 C LEU A 65 13.853 -2.250 20.913 1.00 0.00 C ATOM 1041 O LEU A 65 13.335 -3.317 21.238 1.00 0.00 O ATOM 1042 CB LEU A 65 13.107 -0.860 18.895 1.00 0.00 C ATOM 1043 CG LEU A 65 12.826 -2.108 18.038 1.00 0.00 C ATOM 1044 CD1 LEU A 65 11.401 -2.645 18.228 1.00 0.00 C ATOM 1045 CD2 LEU A 65 13.032 -1.760 16.560 1.00 0.00 C ATOM 0 H LEU A 65 13.614 0.893 20.582 1.00 0.00 H new ATOM 0 HA LEU A 65 11.937 -1.378 20.579 1.00 0.00 H new ATOM 0 HB2 LEU A 65 12.418 -0.068 18.602 1.00 0.00 H new ATOM 0 HB3 LEU A 65 14.114 -0.503 18.679 1.00 0.00 H new ATOM 0 HG LEU A 65 13.518 -2.886 18.360 1.00 0.00 H new ATOM 0 HD11 LEU A 65 11.257 -3.525 17.601 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.251 -2.916 19.273 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.682 -1.876 17.945 1.00 0.00 H new ATOM 0 HD21 LEU A 65 12.834 -2.640 15.948 1.00 0.00 H new ATOM 0 HD22 LEU A 65 12.349 -0.960 16.276 1.00 0.00 H new ATOM 0 HD23 LEU A 65 14.060 -1.432 16.403 1.00 0.00 H new ATOM 1057 N LYS A 66 15.168 -2.028 21.034 1.00 0.00 N ATOM 1058 CA LYS A 66 16.083 -3.003 21.627 1.00 0.00 C ATOM 1059 C LYS A 66 15.597 -3.426 23.016 1.00 0.00 C ATOM 1060 O LYS A 66 15.449 -4.617 23.268 1.00 0.00 O ATOM 1061 CB LYS A 66 17.514 -2.439 21.643 1.00 0.00 C ATOM 1062 CG LYS A 66 18.561 -3.492 22.031 1.00 0.00 C ATOM 1063 CD LYS A 66 19.916 -2.880 22.423 1.00 0.00 C ATOM 1064 CE LYS A 66 20.627 -2.123 21.292 1.00 0.00 C ATOM 1065 NZ LYS A 66 20.139 -0.741 21.138 1.00 0.00 N ATOM 0 H LYS A 66 15.623 -1.170 20.724 1.00 0.00 H new ATOM 0 HA LYS A 66 16.098 -3.906 21.016 1.00 0.00 H new ATOM 0 HB2 LYS A 66 17.754 -2.040 20.657 1.00 0.00 H new ATOM 0 HB3 LYS A 66 17.564 -1.607 22.345 1.00 0.00 H new ATOM 0 HG2 LYS A 66 18.181 -4.083 22.864 1.00 0.00 H new ATOM 0 HG3 LYS A 66 18.706 -4.176 21.195 1.00 0.00 H new ATOM 0 HD2 LYS A 66 19.763 -2.198 23.259 1.00 0.00 H new ATOM 0 HD3 LYS A 66 20.571 -3.676 22.777 1.00 0.00 H new ATOM 0 HE2 LYS A 66 21.699 -2.106 21.490 1.00 0.00 H new ATOM 0 HE3 LYS A 66 20.485 -2.661 20.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 20.934 -0.117 20.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 19.426 -0.707 20.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 19.712 -0.422 22.031 1.00 0.00 H new ATOM 1079 N TYR A 67 15.329 -2.466 23.904 1.00 0.00 N ATOM 1080 CA TYR A 67 14.820 -2.693 25.253 1.00 0.00 C ATOM 1081 C TYR A 67 13.566 -3.574 25.222 1.00 0.00 C ATOM 1082 O TYR A 67 13.420 -4.483 26.033 1.00 0.00 O ATOM 1083 CB TYR A 67 14.550 -1.333 25.914 1.00 0.00 C ATOM 1084 CG TYR A 67 14.103 -1.360 27.363 1.00 0.00 C ATOM 1085 CD1 TYR A 67 12.745 -1.572 27.673 1.00 0.00 C ATOM 1086 CD2 TYR A 67 14.990 -0.947 28.373 1.00 0.00 C ATOM 1087 CE1 TYR A 67 12.282 -1.381 28.986 1.00 0.00 C ATOM 1088 CE2 TYR A 67 14.517 -0.715 29.676 1.00 0.00 C ATOM 1089 CZ TYR A 67 13.167 -0.942 29.985 1.00 0.00 C ATOM 1090 OH TYR A 67 12.717 -0.720 31.253 1.00 0.00 O ATOM 0 H TYR A 67 15.466 -1.477 23.694 1.00 0.00 H new ATOM 0 HA TYR A 67 15.562 -3.229 25.844 1.00 0.00 H new ATOM 0 HB2 TYR A 67 15.460 -0.736 25.849 1.00 0.00 H new ATOM 0 HB3 TYR A 67 13.787 -0.816 25.332 1.00 0.00 H new ATOM 0 HD1 TYR A 67 12.058 -1.882 26.899 1.00 0.00 H new ATOM 0 HD2 TYR A 67 16.037 -0.808 28.147 1.00 0.00 H new ATOM 0 HE1 TYR A 67 11.247 -1.572 29.227 1.00 0.00 H new ATOM 0 HE2 TYR A 67 15.193 -0.362 30.440 1.00 0.00 H new ATOM 0 HH TYR A 67 13.461 -0.421 31.817 1.00 0.00 H new ATOM 1100 N SER A 68 12.656 -3.309 24.283 1.00 0.00 N ATOM 1101 CA SER A 68 11.456 -4.116 24.103 1.00 0.00 C ATOM 1102 C SER A 68 11.841 -5.544 23.693 1.00 0.00 C ATOM 1103 O SER A 68 11.520 -6.503 24.393 1.00 0.00 O ATOM 1104 CB SER A 68 10.523 -3.436 23.090 1.00 0.00 C ATOM 1105 OG SER A 68 9.264 -4.077 23.053 1.00 0.00 O ATOM 0 H SER A 68 12.733 -2.530 23.629 1.00 0.00 H new ATOM 0 HA SER A 68 10.910 -4.193 25.043 1.00 0.00 H new ATOM 0 HB2 SER A 68 10.394 -2.387 23.356 1.00 0.00 H new ATOM 0 HB3 SER A 68 10.977 -3.460 22.099 1.00 0.00 H new ATOM 0 HG SER A 68 8.686 -3.626 22.403 1.00 0.00 H new ATOM 1111 N GLY A 69 12.567 -5.681 22.578 1.00 0.00 N ATOM 1112 CA GLY A 69 13.031 -6.960 22.051 1.00 0.00 C ATOM 1113 C GLY A 69 13.765 -7.786 23.108 1.00 0.00 C ATOM 1114 O GLY A 69 13.642 -9.008 23.144 1.00 0.00 O ATOM 0 H GLY A 69 12.852 -4.885 22.007 1.00 0.00 H new ATOM 0 HA2 GLY A 69 12.179 -7.527 21.676 1.00 0.00 H new ATOM 0 HA3 GLY A 69 13.695 -6.783 21.204 1.00 0.00 H new ATOM 1118 N VAL A 70 14.506 -7.108 23.988 1.00 0.00 N ATOM 1119 CA VAL A 70 15.204 -7.691 25.125 1.00 0.00 C ATOM 1120 C VAL A 70 14.300 -8.615 25.951 1.00 0.00 C ATOM 1121 O VAL A 70 14.801 -9.561 26.556 1.00 0.00 O ATOM 1122 CB VAL A 70 15.876 -6.568 25.954 1.00 0.00 C ATOM 1123 CG1 VAL A 70 15.409 -6.499 27.417 1.00 0.00 C ATOM 1124 CG2 VAL A 70 17.400 -6.734 25.926 1.00 0.00 C ATOM 0 H VAL A 70 14.638 -6.099 23.921 1.00 0.00 H new ATOM 0 HA VAL A 70 15.997 -8.344 24.760 1.00 0.00 H new ATOM 0 HB VAL A 70 15.572 -5.634 25.482 1.00 0.00 H new ATOM 0 HG11 VAL A 70 15.927 -5.687 27.927 1.00 0.00 H new ATOM 0 HG12 VAL A 70 14.334 -6.319 27.448 1.00 0.00 H new ATOM 0 HG13 VAL A 70 15.634 -7.442 27.915 1.00 0.00 H new ATOM 0 HG21 VAL A 70 17.863 -5.940 26.511 1.00 0.00 H new ATOM 0 HG22 VAL A 70 17.668 -7.701 26.350 1.00 0.00 H new ATOM 0 HG23 VAL A 70 17.753 -6.679 24.896 1.00 0.00 H new ATOM 1244 N GLU A 79 21.848 3.277 30.711 1.00 0.00 N ATOM 1245 CA GLU A 79 22.292 4.646 30.927 1.00 0.00 C ATOM 1246 C GLU A 79 22.519 5.306 29.562 1.00 0.00 C ATOM 1247 O GLU A 79 23.655 5.515 29.142 1.00 0.00 O ATOM 1248 CB GLU A 79 23.557 4.644 31.798 1.00 0.00 C ATOM 1249 CG GLU A 79 23.284 4.028 33.177 1.00 0.00 C ATOM 1250 CD GLU A 79 24.524 4.088 34.061 1.00 0.00 C ATOM 1251 OE1 GLU A 79 25.364 3.173 33.925 1.00 0.00 O ATOM 1252 OE2 GLU A 79 24.615 5.055 34.848 1.00 0.00 O ATOM 0 HA GLU A 79 21.538 5.225 31.461 1.00 0.00 H new ATOM 0 HB2 GLU A 79 24.345 4.083 31.296 1.00 0.00 H new ATOM 0 HB3 GLU A 79 23.920 5.665 31.919 1.00 0.00 H new ATOM 0 HG2 GLU A 79 22.464 4.559 33.660 1.00 0.00 H new ATOM 0 HG3 GLU A 79 22.967 2.992 33.059 1.00 0.00 H new ATOM 1259 N PHE A 80 21.418 5.572 28.853 1.00 0.00 N ATOM 1260 CA PHE A 80 21.388 6.035 27.477 1.00 0.00 C ATOM 1261 C PHE A 80 22.284 7.257 27.227 1.00 0.00 C ATOM 1262 O PHE A 80 22.568 8.043 28.134 1.00 0.00 O ATOM 1263 CB PHE A 80 19.932 6.312 27.077 1.00 0.00 C ATOM 1264 CG PHE A 80 19.782 6.717 25.630 1.00 0.00 C ATOM 1265 CD1 PHE A 80 20.030 5.767 24.625 1.00 0.00 C ATOM 1266 CD2 PHE A 80 19.670 8.079 25.297 1.00 0.00 C ATOM 1267 CE1 PHE A 80 20.230 6.186 23.301 1.00 0.00 C ATOM 1268 CE2 PHE A 80 19.886 8.498 23.975 1.00 0.00 C ATOM 1269 CZ PHE A 80 20.184 7.553 22.981 1.00 0.00 C ATOM 0 H PHE A 80 20.484 5.463 29.248 1.00 0.00 H new ATOM 0 HA PHE A 80 21.801 5.246 26.848 1.00 0.00 H new ATOM 0 HB2 PHE A 80 19.335 5.419 27.262 1.00 0.00 H new ATOM 0 HB3 PHE A 80 19.531 7.101 27.713 1.00 0.00 H new ATOM 0 HD1 PHE A 80 20.067 4.716 24.871 1.00 0.00 H new ATOM 0 HD2 PHE A 80 19.418 8.802 26.058 1.00 0.00 H new ATOM 0 HE1 PHE A 80 20.419 5.457 22.527 1.00 0.00 H new ATOM 0 HE2 PHE A 80 19.823 9.546 23.723 1.00 0.00 H new ATOM 0 HZ PHE A 80 20.378 7.877 21.969 1.00 0.00 H new ATOM 1279 N GLU A 81 22.722 7.404 25.974 1.00 0.00 N ATOM 1280 CA GLU A 81 23.645 8.428 25.526 1.00 0.00 C ATOM 1281 C GLU A 81 23.021 9.821 25.591 1.00 0.00 C ATOM 1282 O GLU A 81 22.383 10.254 24.632 1.00 0.00 O ATOM 1283 CB GLU A 81 24.057 8.145 24.078 1.00 0.00 C ATOM 1284 CG GLU A 81 24.806 6.817 23.909 1.00 0.00 C ATOM 1285 CD GLU A 81 25.231 6.614 22.458 1.00 0.00 C ATOM 1286 OE1 GLU A 81 26.138 7.360 22.026 1.00 0.00 O ATOM 1287 OE2 GLU A 81 24.633 5.735 21.801 1.00 0.00 O ATOM 0 H GLU A 81 22.426 6.784 25.220 1.00 0.00 H new ATOM 0 HA GLU A 81 24.511 8.405 26.188 1.00 0.00 H new ATOM 0 HB2 GLU A 81 23.166 8.134 23.450 1.00 0.00 H new ATOM 0 HB3 GLU A 81 24.689 8.959 23.722 1.00 0.00 H new ATOM 0 HG2 GLU A 81 25.684 6.805 24.555 1.00 0.00 H new ATOM 0 HG3 GLU A 81 24.167 5.992 24.224 1.00 0.00 H new ATOM 1294 N ILE A 82 23.264 10.551 26.680 1.00 0.00 N ATOM 1295 CA ILE A 82 22.918 11.963 26.772 1.00 0.00 C ATOM 1296 C ILE A 82 24.164 12.750 27.200 1.00 0.00 C ATOM 1297 O ILE A 82 24.378 12.949 28.395 1.00 0.00 O ATOM 1298 CB ILE A 82 21.736 12.175 27.738 1.00 0.00 C ATOM 1299 CG1 ILE A 82 20.544 11.282 27.349 1.00 0.00 C ATOM 1300 CG2 ILE A 82 21.320 13.655 27.757 1.00 0.00 C ATOM 1301 CD1 ILE A 82 19.339 11.480 28.268 1.00 0.00 C ATOM 0 H ILE A 82 23.706 10.177 27.520 1.00 0.00 H new ATOM 0 HA ILE A 82 22.592 12.331 25.799 1.00 0.00 H new ATOM 0 HB ILE A 82 22.057 11.892 28.740 1.00 0.00 H new ATOM 0 HG12 ILE A 82 20.252 11.498 26.321 1.00 0.00 H new ATOM 0 HG13 ILE A 82 20.852 10.237 27.379 1.00 0.00 H new ATOM 0 HG21 ILE A 82 20.484 13.789 28.444 1.00 0.00 H new ATOM 0 HG22 ILE A 82 22.161 14.265 28.086 1.00 0.00 H new ATOM 0 HG23 ILE A 82 21.019 13.961 26.755 1.00 0.00 H new ATOM 0 HD11 ILE A 82 18.527 10.827 27.949 1.00 0.00 H new ATOM 0 HD12 ILE A 82 19.619 11.237 29.293 1.00 0.00 H new ATOM 0 HD13 ILE A 82 19.010 12.518 28.218 1.00 0.00 H new ATOM 1313 N PRO A 83 25.001 13.195 26.248 1.00 0.00 N ATOM 1314 CA PRO A 83 26.106 14.096 26.530 1.00 0.00 C ATOM 1315 C PRO A 83 25.677 15.400 27.205 1.00 0.00 C ATOM 1316 O PRO A 83 24.494 15.742 27.257 1.00 0.00 O ATOM 1317 CB PRO A 83 26.858 14.298 25.211 1.00 0.00 C ATOM 1318 CG PRO A 83 26.453 13.076 24.382 1.00 0.00 C ATOM 1319 CD PRO A 83 25.040 12.748 24.869 1.00 0.00 C ATOM 0 HA PRO A 83 26.771 13.655 27.273 1.00 0.00 H new ATOM 0 HB2 PRO A 83 26.570 15.229 24.722 1.00 0.00 H new ATOM 0 HB3 PRO A 83 27.936 14.340 25.365 1.00 0.00 H new ATOM 0 HG2 PRO A 83 26.466 13.296 23.315 1.00 0.00 H new ATOM 0 HG3 PRO A 83 27.134 12.241 24.544 1.00 0.00 H new ATOM 0 HD2 PRO A 83 24.288 13.259 24.268 1.00 0.00 H new ATOM 0 HD3 PRO A 83 24.836 11.680 24.795 1.00 0.00 H new ATOM 1327 N THR A 84 26.664 16.126 27.735 1.00 0.00 N ATOM 1328 CA THR A 84 26.473 17.368 28.460 1.00 0.00 C ATOM 1329 C THR A 84 25.625 18.342 27.642 1.00 0.00 C ATOM 1330 O THR A 84 25.833 18.480 26.436 1.00 0.00 O ATOM 1331 CB THR A 84 27.857 17.963 28.748 1.00 0.00 C ATOM 1332 OG1 THR A 84 28.656 17.842 27.585 1.00 0.00 O ATOM 1333 CG2 THR A 84 28.554 17.214 29.887 1.00 0.00 C ATOM 0 H THR A 84 27.644 15.851 27.665 1.00 0.00 H new ATOM 0 HA THR A 84 25.944 17.182 29.395 1.00 0.00 H new ATOM 0 HB THR A 84 27.730 19.007 29.035 1.00 0.00 H new ATOM 0 HG1 THR A 84 29.543 18.221 27.757 1.00 0.00 H new ATOM 0 HG21 THR A 84 29.533 17.658 30.069 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.950 17.284 30.792 1.00 0.00 H new ATOM 0 HG23 THR A 84 28.676 16.166 29.612 1.00 0.00 H new ATOM 1341 N GLU A 85 24.673 19.008 28.295 1.00 0.00 N ATOM 1342 CA GLU A 85 23.819 20.053 27.740 1.00 0.00 C ATOM 1343 C GLU A 85 22.734 19.513 26.801 1.00 0.00 C ATOM 1344 O GLU A 85 21.618 20.033 26.822 1.00 0.00 O ATOM 1345 CB GLU A 85 24.631 21.191 27.097 1.00 0.00 C ATOM 1346 CG GLU A 85 25.826 21.658 27.948 1.00 0.00 C ATOM 1347 CD GLU A 85 25.463 21.853 29.417 1.00 0.00 C ATOM 1348 OE1 GLU A 85 24.702 22.805 29.692 1.00 0.00 O ATOM 1349 OE2 GLU A 85 25.935 21.030 30.233 1.00 0.00 O ATOM 0 H GLU A 85 24.468 18.822 29.277 1.00 0.00 H new ATOM 0 HA GLU A 85 23.289 20.483 28.590 1.00 0.00 H new ATOM 0 HB2 GLU A 85 24.996 20.860 26.125 1.00 0.00 H new ATOM 0 HB3 GLU A 85 23.971 22.040 26.917 1.00 0.00 H new ATOM 0 HG2 GLU A 85 26.630 20.926 27.871 1.00 0.00 H new ATOM 0 HG3 GLU A 85 26.209 22.596 27.545 1.00 0.00 H new ATOM 1356 N MET A 86 23.043 18.486 25.996 1.00 0.00 N ATOM 1357 CA MET A 86 22.103 17.859 25.069 1.00 0.00 C ATOM 1358 C MET A 86 20.745 17.655 25.744 1.00 0.00 C ATOM 1359 O MET A 86 19.714 18.062 25.213 1.00 0.00 O ATOM 1360 CB MET A 86 22.655 16.527 24.528 1.00 0.00 C ATOM 1361 CG MET A 86 24.081 16.659 23.968 1.00 0.00 C ATOM 1362 SD MET A 86 24.601 15.494 22.671 1.00 0.00 S ATOM 1363 CE MET A 86 23.420 15.772 21.337 1.00 0.00 C ATOM 0 H MET A 86 23.971 18.064 25.974 1.00 0.00 H new ATOM 0 HA MET A 86 21.969 18.528 24.219 1.00 0.00 H new ATOM 0 HB2 MET A 86 22.650 15.785 25.327 1.00 0.00 H new ATOM 0 HB3 MET A 86 21.994 16.156 23.744 1.00 0.00 H new ATOM 0 HG2 MET A 86 24.193 17.669 23.574 1.00 0.00 H new ATOM 0 HG3 MET A 86 24.777 16.563 24.801 1.00 0.00 H new ATOM 0 HE1 MET A 86 23.787 15.306 20.423 1.00 0.00 H new ATOM 0 HE2 MET A 86 22.458 15.335 21.606 1.00 0.00 H new ATOM 0 HE3 MET A 86 23.300 16.843 21.175 1.00 0.00 H new ATOM 1373 N SER A 87 20.786 17.082 26.949 1.00 0.00 N ATOM 1374 CA SER A 87 19.691 16.950 27.899 1.00 0.00 C ATOM 1375 C SER A 87 18.622 18.043 27.781 1.00 0.00 C ATOM 1376 O SER A 87 17.441 17.730 27.634 1.00 0.00 O ATOM 1377 CB SER A 87 20.299 16.950 29.307 1.00 0.00 C ATOM 1378 OG SER A 87 21.354 17.895 29.379 1.00 0.00 O ATOM 0 H SER A 87 21.648 16.671 27.307 1.00 0.00 H new ATOM 0 HA SER A 87 19.168 16.019 27.681 1.00 0.00 H new ATOM 0 HB2 SER A 87 19.532 17.192 30.043 1.00 0.00 H new ATOM 0 HB3 SER A 87 20.673 15.956 29.551 1.00 0.00 H new ATOM 0 HG SER A 87 21.736 17.891 30.281 1.00 0.00 H new ATOM 1384 N LEU A 88 19.025 19.313 27.881 1.00 0.00 N ATOM 1385 CA LEU A 88 18.099 20.436 28.001 1.00 0.00 C ATOM 1386 C LEU A 88 17.084 20.427 26.859 1.00 0.00 C ATOM 1387 O LEU A 88 15.880 20.349 27.092 1.00 0.00 O ATOM 1388 CB LEU A 88 18.865 21.771 28.028 1.00 0.00 C ATOM 1389 CG LEU A 88 19.438 22.173 29.402 1.00 0.00 C ATOM 1390 CD1 LEU A 88 18.332 22.593 30.380 1.00 0.00 C ATOM 1391 CD2 LEU A 88 20.309 21.087 30.042 1.00 0.00 C ATOM 0 H LEU A 88 20.007 19.589 27.881 1.00 0.00 H new ATOM 0 HA LEU A 88 17.558 20.329 28.941 1.00 0.00 H new ATOM 0 HB2 LEU A 88 19.686 21.715 27.313 1.00 0.00 H new ATOM 0 HB3 LEU A 88 18.197 22.561 27.686 1.00 0.00 H new ATOM 0 HG LEU A 88 20.082 23.029 29.201 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.777 22.869 31.336 1.00 0.00 H new ATOM 0 HD12 LEU A 88 17.791 23.447 29.972 1.00 0.00 H new ATOM 0 HD13 LEU A 88 17.642 21.762 30.527 1.00 0.00 H new ATOM 0 HD21 LEU A 88 20.678 21.438 31.006 1.00 0.00 H new ATOM 0 HD22 LEU A 88 19.716 20.184 30.187 1.00 0.00 H new ATOM 0 HD23 LEU A 88 21.153 20.866 29.389 1.00 0.00 H new ATOM 1403 N GLU A 89 17.569 20.509 25.621 1.00 0.00 N ATOM 1404 CA GLU A 89 16.697 20.506 24.457 1.00 0.00 C ATOM 1405 C GLU A 89 16.193 19.082 24.187 1.00 0.00 C ATOM 1406 O GLU A 89 15.038 18.900 23.804 1.00 0.00 O ATOM 1407 CB GLU A 89 17.421 21.168 23.277 1.00 0.00 C ATOM 1408 CG GLU A 89 16.626 21.033 21.971 1.00 0.00 C ATOM 1409 CD GLU A 89 17.249 21.808 20.812 1.00 0.00 C ATOM 1410 OE1 GLU A 89 17.203 23.055 20.875 1.00 0.00 O ATOM 1411 OE2 GLU A 89 17.759 21.149 19.877 1.00 0.00 O ATOM 0 H GLU A 89 18.563 20.578 25.402 1.00 0.00 H new ATOM 0 HA GLU A 89 15.801 21.102 24.631 1.00 0.00 H new ATOM 0 HB2 GLU A 89 17.583 22.223 23.496 1.00 0.00 H new ATOM 0 HB3 GLU A 89 18.404 20.714 23.153 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.557 19.979 21.701 1.00 0.00 H new ATOM 0 HG3 GLU A 89 15.608 21.388 22.133 1.00 0.00 H new ATOM 1418 N LEU A 90 17.027 18.063 24.420 1.00 0.00 N ATOM 1419 CA LEU A 90 16.646 16.663 24.260 1.00 0.00 C ATOM 1420 C LEU A 90 15.347 16.360 25.004 1.00 0.00 C ATOM 1421 O LEU A 90 14.500 15.630 24.494 1.00 0.00 O ATOM 1422 CB LEU A 90 17.793 15.753 24.724 1.00 0.00 C ATOM 1423 CG LEU A 90 17.559 14.272 24.398 1.00 0.00 C ATOM 1424 CD1 LEU A 90 18.882 13.600 24.016 1.00 0.00 C ATOM 1425 CD2 LEU A 90 16.968 13.548 25.612 1.00 0.00 C ATOM 0 H LEU A 90 17.991 18.192 24.727 1.00 0.00 H new ATOM 0 HA LEU A 90 16.461 16.465 23.204 1.00 0.00 H new ATOM 0 HB2 LEU A 90 18.720 16.080 24.254 1.00 0.00 H new ATOM 0 HB3 LEU A 90 17.925 15.865 25.800 1.00 0.00 H new ATOM 0 HG LEU A 90 16.862 14.212 23.562 1.00 0.00 H new ATOM 0 HD11 LEU A 90 18.704 12.549 23.787 1.00 0.00 H new ATOM 0 HD12 LEU A 90 19.303 14.096 23.141 1.00 0.00 H new ATOM 0 HD13 LEU A 90 19.582 13.676 24.848 1.00 0.00 H new ATOM 0 HD21 LEU A 90 16.807 12.498 25.367 1.00 0.00 H new ATOM 0 HD22 LEU A 90 17.659 13.623 26.452 1.00 0.00 H new ATOM 0 HD23 LEU A 90 16.017 14.007 25.882 1.00 0.00 H new ATOM 1437 N LEU A 91 15.170 16.941 26.193 1.00 0.00 N ATOM 1438 CA LEU A 91 13.956 16.794 26.982 1.00 0.00 C ATOM 1439 C LEU A 91 12.719 17.134 26.138 1.00 0.00 C ATOM 1440 O LEU A 91 11.717 16.424 26.177 1.00 0.00 O ATOM 1441 CB LEU A 91 14.083 17.661 28.249 1.00 0.00 C ATOM 1442 CG LEU A 91 13.052 17.435 29.369 1.00 0.00 C ATOM 1443 CD1 LEU A 91 11.733 18.173 29.117 1.00 0.00 C ATOM 1444 CD2 LEU A 91 12.789 15.954 29.663 1.00 0.00 C ATOM 0 H LEU A 91 15.875 17.531 26.635 1.00 0.00 H new ATOM 0 HA LEU A 91 13.826 15.759 27.297 1.00 0.00 H new ATOM 0 HB2 LEU A 91 15.076 17.501 28.668 1.00 0.00 H new ATOM 0 HB3 LEU A 91 14.029 18.707 27.948 1.00 0.00 H new ATOM 0 HG LEU A 91 13.513 17.864 30.259 1.00 0.00 H new ATOM 0 HD11 LEU A 91 11.044 17.977 29.939 1.00 0.00 H new ATOM 0 HD12 LEU A 91 11.923 19.244 29.050 1.00 0.00 H new ATOM 0 HD13 LEU A 91 11.293 17.823 28.183 1.00 0.00 H new ATOM 0 HD21 LEU A 91 12.053 15.867 30.462 1.00 0.00 H new ATOM 0 HD22 LEU A 91 12.409 15.467 28.765 1.00 0.00 H new ATOM 0 HD23 LEU A 91 13.718 15.474 29.971 1.00 0.00 H new ATOM 1456 N LEU A 92 12.794 18.190 25.324 1.00 0.00 N ATOM 1457 CA LEU A 92 11.688 18.576 24.459 1.00 0.00 C ATOM 1458 C LEU A 92 11.402 17.472 23.437 1.00 0.00 C ATOM 1459 O LEU A 92 10.246 17.112 23.228 1.00 0.00 O ATOM 1460 CB LEU A 92 11.976 19.914 23.768 1.00 0.00 C ATOM 1461 CG LEU A 92 12.362 21.049 24.732 1.00 0.00 C ATOM 1462 CD1 LEU A 92 12.647 22.315 23.918 1.00 0.00 C ATOM 1463 CD2 LEU A 92 11.254 21.336 25.751 1.00 0.00 C ATOM 0 H LEU A 92 13.614 18.792 25.249 1.00 0.00 H new ATOM 0 HA LEU A 92 10.797 18.709 25.073 1.00 0.00 H new ATOM 0 HB2 LEU A 92 12.783 19.773 23.049 1.00 0.00 H new ATOM 0 HB3 LEU A 92 11.094 20.216 23.203 1.00 0.00 H new ATOM 0 HG LEU A 92 13.248 20.739 25.286 1.00 0.00 H new ATOM 0 HD11 LEU A 92 12.922 23.127 24.592 1.00 0.00 H new ATOM 0 HD12 LEU A 92 13.467 22.125 23.225 1.00 0.00 H new ATOM 0 HD13 LEU A 92 11.755 22.595 23.357 1.00 0.00 H new ATOM 0 HD21 LEU A 92 11.568 22.144 26.412 1.00 0.00 H new ATOM 0 HD22 LEU A 92 10.344 21.629 25.227 1.00 0.00 H new ATOM 0 HD23 LEU A 92 11.060 20.440 26.340 1.00 0.00 H new ATOM 1475 N ALA A 93 12.443 16.898 22.824 1.00 0.00 N ATOM 1476 CA ALA A 93 12.262 15.759 21.927 1.00 0.00 C ATOM 1477 C ALA A 93 11.600 14.603 22.674 1.00 0.00 C ATOM 1478 O ALA A 93 10.644 14.009 22.181 1.00 0.00 O ATOM 1479 CB ALA A 93 13.587 15.316 21.302 1.00 0.00 C ATOM 0 H ALA A 93 13.410 17.202 22.933 1.00 0.00 H new ATOM 0 HA ALA A 93 11.609 16.072 21.112 1.00 0.00 H new ATOM 0 HB1 ALA A 93 13.412 14.467 20.641 1.00 0.00 H new ATOM 0 HB2 ALA A 93 14.012 16.140 20.729 1.00 0.00 H new ATOM 0 HB3 ALA A 93 14.282 15.025 22.090 1.00 0.00 H new ATOM 1485 N ALA A 94 12.094 14.302 23.879 1.00 0.00 N ATOM 1486 CA ALA A 94 11.529 13.271 24.737 1.00 0.00 C ATOM 1487 C ALA A 94 10.048 13.534 25.013 1.00 0.00 C ATOM 1488 O ALA A 94 9.265 12.590 25.062 1.00 0.00 O ATOM 1489 CB ALA A 94 12.332 13.155 26.036 1.00 0.00 C ATOM 0 H ALA A 94 12.903 14.774 24.284 1.00 0.00 H new ATOM 0 HA ALA A 94 11.595 12.316 24.216 1.00 0.00 H new ATOM 0 HB1 ALA A 94 11.896 12.380 26.666 1.00 0.00 H new ATOM 0 HB2 ALA A 94 13.365 12.895 25.803 1.00 0.00 H new ATOM 0 HB3 ALA A 94 12.308 14.108 26.565 1.00 0.00 H new ATOM 1495 N ASP A 95 9.655 14.799 25.181 1.00 0.00 N ATOM 1496 CA ASP A 95 8.252 15.177 25.320 1.00 0.00 C ATOM 1497 C ASP A 95 7.484 14.922 24.023 1.00 0.00 C ATOM 1498 O ASP A 95 6.446 14.267 24.056 1.00 0.00 O ATOM 1499 CB ASP A 95 8.098 16.635 25.776 1.00 0.00 C ATOM 1500 CG ASP A 95 8.630 16.903 27.182 1.00 0.00 C ATOM 1501 OD1 ASP A 95 8.869 15.922 27.921 1.00 0.00 O ATOM 1502 OD2 ASP A 95 8.763 18.104 27.501 1.00 0.00 O ATOM 0 H ASP A 95 10.301 15.587 25.224 1.00 0.00 H new ATOM 0 HA ASP A 95 7.821 14.547 26.098 1.00 0.00 H new ATOM 0 HB2 ASP A 95 8.619 17.283 25.071 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.043 16.907 25.739 1.00 0.00 H new ATOM 1507 N TYR A 96 7.972 15.446 22.892 1.00 0.00 N ATOM 1508 CA TYR A 96 7.306 15.293 21.599 1.00 0.00 C ATOM 1509 C TYR A 96 7.043 13.812 21.307 1.00 0.00 C ATOM 1510 O TYR A 96 5.935 13.413 20.946 1.00 0.00 O ATOM 1511 CB TYR A 96 8.166 15.884 20.464 1.00 0.00 C ATOM 1512 CG TYR A 96 8.646 17.320 20.585 1.00 0.00 C ATOM 1513 CD1 TYR A 96 7.974 18.267 21.384 1.00 0.00 C ATOM 1514 CD2 TYR A 96 9.770 17.720 19.835 1.00 0.00 C ATOM 1515 CE1 TYR A 96 8.449 19.589 21.458 1.00 0.00 C ATOM 1516 CE2 TYR A 96 10.245 19.039 19.909 1.00 0.00 C ATOM 1517 CZ TYR A 96 9.580 19.974 20.720 1.00 0.00 C ATOM 1518 OH TYR A 96 10.022 21.262 20.778 1.00 0.00 O ATOM 0 H TYR A 96 8.837 15.986 22.850 1.00 0.00 H new ATOM 0 HA TYR A 96 6.359 15.831 21.647 1.00 0.00 H new ATOM 0 HB2 TYR A 96 9.045 15.250 20.351 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.594 15.803 19.540 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.094 17.978 21.940 1.00 0.00 H new ATOM 0 HD2 TYR A 96 10.270 17.006 19.198 1.00 0.00 H new ATOM 0 HE1 TYR A 96 7.943 20.309 22.084 1.00 0.00 H new ATOM 0 HE2 TYR A 96 11.118 19.334 19.345 1.00 0.00 H new ATOM 0 HH TYR A 96 10.815 21.362 20.210 1.00 0.00 H new ATOM 1528 N LEU A 97 8.094 13.007 21.444 1.00 0.00 N ATOM 1529 CA LEU A 97 8.067 11.580 21.192 1.00 0.00 C ATOM 1530 C LEU A 97 7.237 10.875 22.266 1.00 0.00 C ATOM 1531 O LEU A 97 6.237 10.224 21.971 1.00 0.00 O ATOM 1532 CB LEU A 97 9.514 11.061 21.178 1.00 0.00 C ATOM 1533 CG LEU A 97 10.313 11.513 19.946 1.00 0.00 C ATOM 1534 CD1 LEU A 97 11.786 11.149 20.149 1.00 0.00 C ATOM 1535 CD2 LEU A 97 9.804 10.839 18.665 1.00 0.00 C ATOM 0 H LEU A 97 9.009 13.344 21.742 1.00 0.00 H new ATOM 0 HA LEU A 97 7.603 11.373 20.228 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.024 11.404 22.078 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.502 9.972 21.214 1.00 0.00 H new ATOM 0 HG LEU A 97 10.190 12.590 19.835 1.00 0.00 H new ATOM 0 HD11 LEU A 97 12.362 11.466 19.280 1.00 0.00 H new ATOM 0 HD12 LEU A 97 12.166 11.651 21.039 1.00 0.00 H new ATOM 0 HD13 LEU A 97 11.880 10.070 20.273 1.00 0.00 H new ATOM 0 HD21 LEU A 97 10.393 11.183 17.814 1.00 0.00 H new ATOM 0 HD22 LEU A 97 9.901 9.757 18.760 1.00 0.00 H new ATOM 0 HD23 LEU A 97 8.757 11.097 18.509 1.00 0.00 H new ATOM 1547 N SER A 98 7.667 10.994 23.521 1.00 0.00 N ATOM 1548 CA SER A 98 7.117 10.246 24.636 1.00 0.00 C ATOM 1549 C SER A 98 7.182 8.734 24.385 1.00 0.00 C ATOM 1550 O SER A 98 7.849 8.263 23.459 1.00 0.00 O ATOM 1551 CB SER A 98 5.704 10.754 24.961 1.00 0.00 C ATOM 1552 OG SER A 98 5.302 10.290 26.239 1.00 0.00 O ATOM 0 H SER A 98 8.421 11.626 23.790 1.00 0.00 H new ATOM 0 HA SER A 98 7.729 10.417 25.521 1.00 0.00 H new ATOM 0 HB2 SER A 98 5.687 11.844 24.939 1.00 0.00 H new ATOM 0 HB3 SER A 98 5.001 10.409 24.202 1.00 0.00 H new ATOM 0 HG SER A 98 4.401 10.620 26.438 1.00 0.00 H new ATOM 1558 N ILE A 99 6.492 7.988 25.245 1.00 0.00 N ATOM 1559 CA ILE A 99 6.317 6.546 25.179 1.00 0.00 C ATOM 1560 C ILE A 99 4.878 6.194 25.565 1.00 0.00 C ATOM 1561 O ILE A 99 4.267 7.010 26.293 1.00 0.00 O ATOM 1562 CB ILE A 99 7.357 5.789 26.032 1.00 0.00 C ATOM 1563 CG1 ILE A 99 7.218 5.945 27.560 1.00 0.00 C ATOM 1564 CG2 ILE A 99 8.794 6.069 25.566 1.00 0.00 C ATOM 1565 CD1 ILE A 99 7.428 7.357 28.119 1.00 0.00 C ATOM 1566 OXT ILE A 99 4.410 5.123 25.125 1.00 0.00 O ATOM 0 H ILE A 99 6.016 8.399 26.048 1.00 0.00 H new ATOM 0 HA ILE A 99 6.493 6.219 24.154 1.00 0.00 H new ATOM 0 HB ILE A 99 7.125 4.740 25.849 1.00 0.00 H new ATOM 0 HG12 ILE A 99 6.223 5.607 27.850 1.00 0.00 H new ATOM 0 HG13 ILE A 99 7.934 5.277 28.039 1.00 0.00 H new ATOM 0 HG21 ILE A 99 9.494 5.517 26.193 1.00 0.00 H new ATOM 0 HG22 ILE A 99 8.908 5.753 24.529 1.00 0.00 H new ATOM 0 HG23 ILE A 99 9.001 7.136 25.645 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.305 7.342 29.202 1.00 0.00 H new ATOM 0 HD12 ILE A 99 8.433 7.700 27.873 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.695 8.035 27.680 1.00 0.00 H new ATOM 1579 N THR B 157 11.477 5.761 28.828 1.00 0.00 N ATOM 1580 CA THR B 157 12.407 6.077 29.933 1.00 0.00 C ATOM 1581 C THR B 157 13.188 7.379 29.699 1.00 0.00 C ATOM 1582 O THR B 157 13.769 7.925 30.636 1.00 0.00 O ATOM 1583 CB THR B 157 13.370 4.911 30.204 1.00 0.00 C ATOM 1584 OG1 THR B 157 14.189 4.668 29.080 1.00 0.00 O ATOM 1585 CG2 THR B 157 12.630 3.619 30.564 1.00 0.00 C ATOM 0 HA THR B 157 11.788 6.230 30.817 1.00 0.00 H new ATOM 0 HB THR B 157 13.982 5.207 31.056 1.00 0.00 H new ATOM 0 HG1 THR B 157 13.652 4.736 28.263 1.00 0.00 H new ATOM 0 HG21 THR B 157 13.353 2.824 30.746 1.00 0.00 H new ATOM 0 HG22 THR B 157 12.033 3.780 31.462 1.00 0.00 H new ATOM 0 HG23 THR B 157 11.976 3.333 29.740 1.00 0.00 H new ATOM 1595 N LEU B 158 13.215 7.877 28.455 1.00 0.00 N ATOM 1596 CA LEU B 158 14.081 8.983 28.058 1.00 0.00 C ATOM 1597 C LEU B 158 13.896 10.216 28.943 1.00 0.00 C ATOM 1598 O LEU B 158 14.876 10.859 29.306 1.00 0.00 O ATOM 1599 CB LEU B 158 13.855 9.327 26.579 1.00 0.00 C ATOM 1600 CG LEU B 158 14.887 10.313 26.000 1.00 0.00 C ATOM 1601 CD1 LEU B 158 16.319 9.776 26.146 1.00 0.00 C ATOM 1602 CD2 LEU B 158 14.570 10.556 24.520 1.00 0.00 C ATOM 0 H LEU B 158 12.633 7.519 27.698 1.00 0.00 H new ATOM 0 HA LEU B 158 15.112 8.656 28.193 1.00 0.00 H new ATOM 0 HB2 LEU B 158 13.879 8.407 25.995 1.00 0.00 H new ATOM 0 HB3 LEU B 158 12.858 9.752 26.464 1.00 0.00 H new ATOM 0 HG LEU B 158 14.825 11.248 26.556 1.00 0.00 H new ATOM 0 HD11 LEU B 158 17.022 10.496 25.727 1.00 0.00 H new ATOM 0 HD12 LEU B 158 16.544 9.621 27.201 1.00 0.00 H new ATOM 0 HD13 LEU B 158 16.409 8.829 25.613 1.00 0.00 H new ATOM 0 HD21 LEU B 158 15.296 11.253 24.102 1.00 0.00 H new ATOM 0 HD22 LEU B 158 14.620 9.612 23.977 1.00 0.00 H new ATOM 0 HD23 LEU B 158 13.568 10.976 24.427 1.00 0.00 H new ATOM 1614 N LYS B 159 12.648 10.543 29.292 1.00 0.00 N ATOM 1615 CA LYS B 159 12.337 11.671 30.165 1.00 0.00 C ATOM 1616 C LYS B 159 13.084 11.512 31.497 1.00 0.00 C ATOM 1617 O LYS B 159 13.858 12.374 31.912 1.00 0.00 O ATOM 1618 CB LYS B 159 10.822 11.737 30.425 1.00 0.00 C ATOM 1619 CG LYS B 159 9.934 11.747 29.171 1.00 0.00 C ATOM 1620 CD LYS B 159 8.468 11.668 29.623 1.00 0.00 C ATOM 1621 CE LYS B 159 7.512 11.346 28.472 1.00 0.00 C ATOM 1622 NZ LYS B 159 7.518 12.392 27.440 1.00 0.00 N ATOM 0 H LYS B 159 11.826 10.030 28.975 1.00 0.00 H new ATOM 0 HA LYS B 159 12.653 12.594 29.679 1.00 0.00 H new ATOM 0 HB2 LYS B 159 10.540 10.884 31.042 1.00 0.00 H new ATOM 0 HB3 LYS B 159 10.610 12.634 31.006 1.00 0.00 H new ATOM 0 HG2 LYS B 159 10.105 12.654 28.591 1.00 0.00 H new ATOM 0 HG3 LYS B 159 10.179 10.904 28.525 1.00 0.00 H new ATOM 0 HD2 LYS B 159 8.371 10.905 30.395 1.00 0.00 H new ATOM 0 HD3 LYS B 159 8.180 12.617 30.075 1.00 0.00 H new ATOM 0 HE2 LYS B 159 7.793 10.393 28.024 1.00 0.00 H new ATOM 0 HE3 LYS B 159 6.501 11.229 28.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 159 6.595 12.412 26.961 1.00 0.00 H new ATOM 0 HZ2 LYS B 159 7.698 13.316 27.883 1.00 0.00 H new ATOM 0 HZ3 LYS B 159 8.265 12.190 26.745 1.00 0.00 H new ATOM 1636 N GLU B 160 12.840 10.378 32.158 1.00 0.00 N ATOM 1637 CA GLU B 160 13.376 10.055 33.468 1.00 0.00 C ATOM 1638 C GLU B 160 14.902 10.044 33.403 1.00 0.00 C ATOM 1639 O GLU B 160 15.568 10.647 34.239 1.00 0.00 O ATOM 1640 CB GLU B 160 12.831 8.698 33.944 1.00 0.00 C ATOM 1641 CG GLU B 160 11.312 8.692 34.207 1.00 0.00 C ATOM 1642 CD GLU B 160 10.438 8.785 32.954 1.00 0.00 C ATOM 1643 OE1 GLU B 160 10.929 8.389 31.873 1.00 0.00 O ATOM 1644 OE2 GLU B 160 9.295 9.268 33.096 1.00 0.00 O ATOM 0 H GLU B 160 12.245 9.642 31.779 1.00 0.00 H new ATOM 0 HA GLU B 160 13.064 10.811 34.188 1.00 0.00 H new ATOM 0 HB2 GLU B 160 13.063 7.941 33.194 1.00 0.00 H new ATOM 0 HB3 GLU B 160 13.349 8.410 34.859 1.00 0.00 H new ATOM 0 HG2 GLU B 160 11.055 7.779 34.744 1.00 0.00 H new ATOM 0 HG3 GLU B 160 11.069 9.527 34.864 1.00 0.00 H new ATOM 1651 N ARG B 161 15.452 9.366 32.395 1.00 0.00 N ATOM 1652 CA ARG B 161 16.885 9.313 32.160 1.00 0.00 C ATOM 1653 C ARG B 161 17.454 10.727 31.989 1.00 0.00 C ATOM 1654 O ARG B 161 18.438 11.080 32.634 1.00 0.00 O ATOM 1655 CB ARG B 161 17.150 8.401 30.956 1.00 0.00 C ATOM 1656 CG ARG B 161 18.600 8.391 30.464 1.00 0.00 C ATOM 1657 CD ARG B 161 19.648 8.048 31.527 1.00 0.00 C ATOM 1658 NE ARG B 161 20.980 8.042 30.910 1.00 0.00 N ATOM 1659 CZ ARG B 161 22.150 8.203 31.542 1.00 0.00 C ATOM 1660 NH1 ARG B 161 22.212 8.370 32.870 1.00 0.00 N ATOM 1661 NH2 ARG B 161 23.266 8.200 30.808 1.00 0.00 N ATOM 0 H ARG B 161 14.906 8.836 31.716 1.00 0.00 H new ATOM 0 HA ARG B 161 17.403 8.888 33.020 1.00 0.00 H new ATOM 0 HB2 ARG B 161 16.864 7.383 31.219 1.00 0.00 H new ATOM 0 HB3 ARG B 161 16.505 8.711 30.134 1.00 0.00 H new ATOM 0 HG2 ARG B 161 18.685 7.673 29.648 1.00 0.00 H new ATOM 0 HG3 ARG B 161 18.833 9.372 30.050 1.00 0.00 H new ATOM 0 HD2 ARG B 161 19.613 8.776 32.337 1.00 0.00 H new ATOM 0 HD3 ARG B 161 19.433 7.073 31.965 1.00 0.00 H new ATOM 0 HE ARG B 161 21.018 7.901 29.900 1.00 0.00 H new ATOM 0 HH11 ARG B 161 21.355 8.377 33.424 1.00 0.00 H new ATOM 0 HH12 ARG B 161 23.116 8.491 33.327 1.00 0.00 H new ATOM 0 HH21 ARG B 161 23.211 8.078 29.797 1.00 0.00 H new ATOM 0 HH22 ARG B 161 24.173 8.320 31.259 1.00 0.00 H new ATOM 1675 N CYS B 162 16.838 11.557 31.144 1.00 0.00 N ATOM 1676 CA CYS B 162 17.284 12.933 30.956 1.00 0.00 C ATOM 1677 C CYS B 162 17.275 13.688 32.284 1.00 0.00 C ATOM 1678 O CYS B 162 18.283 14.284 32.657 1.00 0.00 O ATOM 1679 CB CYS B 162 16.447 13.652 29.897 1.00 0.00 C ATOM 1680 SG CYS B 162 17.057 15.353 29.793 1.00 0.00 S ATOM 0 H CYS B 162 16.029 11.297 30.580 1.00 0.00 H new ATOM 0 HA CYS B 162 18.311 12.908 30.591 1.00 0.00 H new ATOM 0 HB2 CYS B 162 16.536 13.152 28.932 1.00 0.00 H new ATOM 0 HB3 CYS B 162 15.391 13.638 30.167 1.00 0.00 H new ATOM 0 HG CYS B 162 16.936 15.784 28.572 1.00 0.00 H new ATOM 1686 N LEU B 163 16.167 13.632 33.028 1.00 0.00 N ATOM 1687 CA LEU B 163 16.099 14.256 34.346 1.00 0.00 C ATOM 1688 C LEU B 163 17.231 13.749 35.253 1.00 0.00 C ATOM 1689 O LEU B 163 17.926 14.547 35.880 1.00 0.00 O ATOM 1690 CB LEU B 163 14.720 14.023 34.979 1.00 0.00 C ATOM 1691 CG LEU B 163 13.585 14.763 34.248 1.00 0.00 C ATOM 1692 CD1 LEU B 163 12.234 14.209 34.713 1.00 0.00 C ATOM 1693 CD2 LEU B 163 13.622 16.274 34.511 1.00 0.00 C ATOM 0 H LEU B 163 15.309 13.162 32.739 1.00 0.00 H new ATOM 0 HA LEU B 163 16.235 15.331 34.228 1.00 0.00 H new ATOM 0 HB2 LEU B 163 14.505 12.954 34.983 1.00 0.00 H new ATOM 0 HB3 LEU B 163 14.745 14.347 36.019 1.00 0.00 H new ATOM 0 HG LEU B 163 13.720 14.602 33.178 1.00 0.00 H new ATOM 0 HD11 LEU B 163 11.429 14.732 34.196 1.00 0.00 H new ATOM 0 HD12 LEU B 163 12.180 13.144 34.486 1.00 0.00 H new ATOM 0 HD13 LEU B 163 12.131 14.356 35.788 1.00 0.00 H new ATOM 0 HD21 LEU B 163 12.804 16.757 33.976 1.00 0.00 H new ATOM 0 HD22 LEU B 163 13.516 16.460 35.580 1.00 0.00 H new ATOM 0 HD23 LEU B 163 14.572 16.681 34.164 1.00 0.00 H new ATOM 1705 N GLN B 164 17.438 12.432 35.307 1.00 0.00 N ATOM 1706 CA GLN B 164 18.514 11.801 36.062 1.00 0.00 C ATOM 1707 C GLN B 164 19.868 12.410 35.666 1.00 0.00 C ATOM 1708 O GLN B 164 20.652 12.809 36.530 1.00 0.00 O ATOM 1709 CB GLN B 164 18.428 10.275 35.859 1.00 0.00 C ATOM 1710 CG GLN B 164 19.252 9.439 36.846 1.00 0.00 C ATOM 1711 CD GLN B 164 20.751 9.614 36.640 1.00 0.00 C ATOM 1712 OE1 GLN B 164 21.244 9.528 35.519 1.00 0.00 O ATOM 1713 NE2 GLN B 164 21.472 9.906 37.714 1.00 0.00 N ATOM 0 H GLN B 164 16.847 11.762 34.815 1.00 0.00 H new ATOM 0 HA GLN B 164 18.411 11.990 37.131 1.00 0.00 H new ATOM 0 HB2 GLN B 164 17.384 9.973 35.935 1.00 0.00 H new ATOM 0 HB3 GLN B 164 18.755 10.040 34.846 1.00 0.00 H new ATOM 0 HG2 GLN B 164 18.992 9.724 37.866 1.00 0.00 H new ATOM 0 HG3 GLN B 164 18.992 8.386 36.733 1.00 0.00 H new ATOM 0 HE21 GLN B 164 21.023 9.968 38.628 1.00 0.00 H new ATOM 0 HE22 GLN B 164 22.475 10.069 37.626 1.00 0.00 H new ATOM 1722 N VAL B 165 20.145 12.509 34.364 1.00 0.00 N ATOM 1723 CA VAL B 165 21.371 13.116 33.860 1.00 0.00 C ATOM 1724 C VAL B 165 21.475 14.573 34.317 1.00 0.00 C ATOM 1725 O VAL B 165 22.507 14.971 34.854 1.00 0.00 O ATOM 1726 CB VAL B 165 21.462 12.957 32.330 1.00 0.00 C ATOM 1727 CG1 VAL B 165 22.598 13.791 31.721 1.00 0.00 C ATOM 1728 CG2 VAL B 165 21.713 11.484 31.992 1.00 0.00 C ATOM 0 H VAL B 165 19.522 12.169 33.631 1.00 0.00 H new ATOM 0 HA VAL B 165 22.231 12.595 34.280 1.00 0.00 H new ATOM 0 HB VAL B 165 20.519 13.309 31.911 1.00 0.00 H new ATOM 0 HG11 VAL B 165 22.619 13.644 30.641 1.00 0.00 H new ATOM 0 HG12 VAL B 165 22.433 14.846 31.940 1.00 0.00 H new ATOM 0 HG13 VAL B 165 23.550 13.476 32.149 1.00 0.00 H new ATOM 0 HG21 VAL B 165 21.778 11.365 30.911 1.00 0.00 H new ATOM 0 HG22 VAL B 165 22.647 11.160 32.450 1.00 0.00 H new ATOM 0 HG23 VAL B 165 20.892 10.878 32.375 1.00 0.00 H new ATOM 1738 N VAL B 166 20.422 15.376 34.126 1.00 0.00 N ATOM 1739 CA VAL B 166 20.411 16.771 34.561 1.00 0.00 C ATOM 1740 C VAL B 166 20.765 16.855 36.047 1.00 0.00 C ATOM 1741 O VAL B 166 21.664 17.605 36.421 1.00 0.00 O ATOM 1742 CB VAL B 166 19.060 17.438 34.240 1.00 0.00 C ATOM 1743 CG1 VAL B 166 18.950 18.833 34.873 1.00 0.00 C ATOM 1744 CG2 VAL B 166 18.889 17.593 32.725 1.00 0.00 C ATOM 0 H VAL B 166 19.561 15.077 33.669 1.00 0.00 H new ATOM 0 HA VAL B 166 21.169 17.326 34.008 1.00 0.00 H new ATOM 0 HB VAL B 166 18.284 16.793 34.652 1.00 0.00 H new ATOM 0 HG11 VAL B 166 17.983 19.270 34.624 1.00 0.00 H new ATOM 0 HG12 VAL B 166 19.042 18.749 35.956 1.00 0.00 H new ATOM 0 HG13 VAL B 166 19.747 19.471 34.489 1.00 0.00 H new ATOM 0 HG21 VAL B 166 17.930 18.066 32.514 1.00 0.00 H new ATOM 0 HG22 VAL B 166 19.694 18.213 32.329 1.00 0.00 H new ATOM 0 HG23 VAL B 166 18.921 16.611 32.253 1.00 0.00 H new ATOM 1754 N ARG B 167 20.082 16.070 36.886 1.00 0.00 N ATOM 1755 CA ARG B 167 20.359 15.985 38.314 1.00 0.00 C ATOM 1756 C ARG B 167 21.837 15.659 38.552 1.00 0.00 C ATOM 1757 O ARG B 167 22.511 16.361 39.306 1.00 0.00 O ATOM 1758 CB ARG B 167 19.428 14.956 38.969 1.00 0.00 C ATOM 1759 CG ARG B 167 17.980 15.471 39.007 1.00 0.00 C ATOM 1760 CD ARG B 167 16.981 14.331 39.229 1.00 0.00 C ATOM 1761 NE ARG B 167 17.216 13.629 40.497 1.00 0.00 N ATOM 1762 CZ ARG B 167 16.568 12.519 40.878 1.00 0.00 C ATOM 1763 NH1 ARG B 167 15.648 11.965 40.080 1.00 0.00 N ATOM 1764 NH2 ARG B 167 16.843 11.969 42.064 1.00 0.00 N ATOM 0 H ARG B 167 19.314 15.471 36.584 1.00 0.00 H new ATOM 0 HA ARG B 167 20.163 16.951 38.780 1.00 0.00 H new ATOM 0 HB2 ARG B 167 19.470 14.018 38.416 1.00 0.00 H new ATOM 0 HB3 ARG B 167 19.769 14.744 39.982 1.00 0.00 H new ATOM 0 HG2 ARG B 167 17.876 16.207 39.804 1.00 0.00 H new ATOM 0 HG3 ARG B 167 17.750 15.980 38.071 1.00 0.00 H new ATOM 0 HD2 ARG B 167 15.967 14.731 39.219 1.00 0.00 H new ATOM 0 HD3 ARG B 167 17.052 13.622 38.404 1.00 0.00 H new ATOM 0 HE ARG B 167 17.919 14.011 41.130 1.00 0.00 H new ATOM 0 HH11 ARG B 167 15.436 12.387 39.176 1.00 0.00 H new ATOM 0 HH12 ARG B 167 15.158 11.120 40.376 1.00 0.00 H new ATOM 0 HH21 ARG B 167 17.542 12.394 42.673 1.00 0.00 H new ATOM 0 HH22 ARG B 167 16.354 11.124 42.360 1.00 0.00 H new ATOM 1778 N SER B 168 22.351 14.618 37.888 1.00 0.00 N ATOM 1779 CA SER B 168 23.755 14.231 37.992 1.00 0.00 C ATOM 1780 C SER B 168 24.689 15.391 37.638 1.00 0.00 C ATOM 1781 O SER B 168 25.709 15.585 38.293 1.00 0.00 O ATOM 1782 CB SER B 168 24.057 13.029 37.090 1.00 0.00 C ATOM 1783 OG SER B 168 23.170 11.964 37.359 1.00 0.00 O ATOM 0 H SER B 168 21.804 14.024 37.266 1.00 0.00 H new ATOM 0 HA SER B 168 23.935 13.953 39.030 1.00 0.00 H new ATOM 0 HB2 SER B 168 23.972 13.323 36.044 1.00 0.00 H new ATOM 0 HB3 SER B 168 25.085 12.701 37.246 1.00 0.00 H new ATOM 0 HG SER B 168 22.276 12.190 37.026 1.00 0.00 H new ATOM 1789 N LEU B 169 24.362 16.136 36.580 1.00 0.00 N ATOM 1790 CA LEU B 169 25.171 17.245 36.102 1.00 0.00 C ATOM 1791 C LEU B 169 25.152 18.379 37.127 1.00 0.00 C ATOM 1792 O LEU B 169 26.205 18.816 37.586 1.00 0.00 O ATOM 1793 CB LEU B 169 24.663 17.667 34.711 1.00 0.00 C ATOM 1794 CG LEU B 169 25.490 18.721 33.948 1.00 0.00 C ATOM 1795 CD1 LEU B 169 25.308 20.148 34.481 1.00 0.00 C ATOM 1796 CD2 LEU B 169 26.978 18.364 33.874 1.00 0.00 C ATOM 0 H LEU B 169 23.518 15.980 36.029 1.00 0.00 H new ATOM 0 HA LEU B 169 26.215 16.951 35.991 1.00 0.00 H new ATOM 0 HB2 LEU B 169 24.599 16.774 34.090 1.00 0.00 H new ATOM 0 HB3 LEU B 169 23.649 18.050 34.824 1.00 0.00 H new ATOM 0 HG LEU B 169 25.087 18.704 32.935 1.00 0.00 H new ATOM 0 HD11 LEU B 169 25.920 20.835 33.897 1.00 0.00 H new ATOM 0 HD12 LEU B 169 24.260 20.436 34.400 1.00 0.00 H new ATOM 0 HD13 LEU B 169 25.615 20.188 35.526 1.00 0.00 H new ATOM 0 HD21 LEU B 169 27.512 19.141 33.326 1.00 0.00 H new ATOM 0 HD22 LEU B 169 27.384 18.287 34.883 1.00 0.00 H new ATOM 0 HD23 LEU B 169 27.098 17.410 33.361 1.00 0.00 H new ATOM 1808 N VAL B 170 23.959 18.873 37.474 1.00 0.00 N ATOM 1809 CA VAL B 170 23.814 20.071 38.295 1.00 0.00 C ATOM 1810 C VAL B 170 24.187 19.810 39.760 1.00 0.00 C ATOM 1811 O VAL B 170 24.712 20.702 40.422 1.00 0.00 O ATOM 1812 CB VAL B 170 22.406 20.672 38.120 1.00 0.00 C ATOM 1813 CG1 VAL B 170 21.322 19.883 38.861 1.00 0.00 C ATOM 1814 CG2 VAL B 170 22.366 22.135 38.581 1.00 0.00 C ATOM 0 H VAL B 170 23.073 18.453 37.193 1.00 0.00 H new ATOM 0 HA VAL B 170 24.526 20.820 37.948 1.00 0.00 H new ATOM 0 HB VAL B 170 22.192 20.615 37.053 1.00 0.00 H new ATOM 0 HG11 VAL B 170 20.353 20.356 38.699 1.00 0.00 H new ATOM 0 HG12 VAL B 170 21.294 18.861 38.484 1.00 0.00 H new ATOM 0 HG13 VAL B 170 21.546 19.871 39.928 1.00 0.00 H new ATOM 0 HG21 VAL B 170 21.360 22.532 38.445 1.00 0.00 H new ATOM 0 HG22 VAL B 170 22.640 22.192 39.635 1.00 0.00 H new ATOM 0 HG23 VAL B 170 23.070 22.722 37.991 1.00 0.00 H new ATOM 1824 N LYS B 171 23.918 18.601 40.268 1.00 0.00 N ATOM 1825 CA LYS B 171 24.193 18.215 41.648 1.00 0.00 C ATOM 1826 C LYS B 171 23.481 19.156 42.632 1.00 0.00 C ATOM 1827 O LYS B 171 24.126 19.567 43.621 1.00 0.00 O ATOM 1828 CB LYS B 171 25.709 18.120 41.900 1.00 0.00 C ATOM 1829 CG LYS B 171 26.399 17.211 40.877 1.00 0.00 C ATOM 1830 CD LYS B 171 27.914 17.173 41.118 1.00 0.00 C ATOM 1831 CE LYS B 171 28.617 16.231 40.132 1.00 0.00 C ATOM 1832 NZ LYS B 171 28.343 16.589 38.729 1.00 0.00 N ATOM 1833 OXT LYS B 171 22.283 19.426 42.389 1.00 0.00 O ATOM 0 H LYS B 171 23.495 17.854 39.717 1.00 0.00 H new ATOM 0 HA LYS B 171 23.786 17.219 41.821 1.00 0.00 H new ATOM 0 HB2 LYS B 171 26.148 19.117 41.856 1.00 0.00 H new ATOM 0 HB3 LYS B 171 25.887 17.738 42.905 1.00 0.00 H new ATOM 0 HG2 LYS B 171 25.990 16.203 40.945 1.00 0.00 H new ATOM 0 HG3 LYS B 171 26.195 17.570 39.868 1.00 0.00 H new ATOM 0 HD2 LYS B 171 28.325 18.178 41.018 1.00 0.00 H new ATOM 0 HD3 LYS B 171 28.113 16.847 42.139 1.00 0.00 H new ATOM 0 HE2 LYS B 171 29.692 16.259 40.309 1.00 0.00 H new ATOM 0 HE3 LYS B 171 28.290 15.207 40.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 171 29.043 16.131 38.111 1.00 0.00 H new ATOM 0 HZ2 LYS B 171 27.389 16.268 38.469 1.00 0.00 H new ATOM 0 HZ3 LYS B 171 28.404 17.621 38.616 1.00 0.00 H new