USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1058 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 Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -0.949 K(o=-0.95,f=-8.6!) USER MOD Single : A 24 SER OG : rot 44:sc= 0.947 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -137:sc= -2.01 (180deg=-8.38!) USER MOD Single : A 33 LYS NZ :NH3+ 168:sc= -0.238 (180deg=-0.518) USER MOD Single : A 36 TYR OH : rot -69:sc= 0.208 USER MOD Single : A 38 HIS : no HD1:sc= -0.152 X(o=-0.15,f=-0.52) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.0436 USER MOD Single : A 51 HIS : no HD1:sc=-0.00949 X(o=-0.0095,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= -0.405 K(o=-0.4,f=-1.8!) USER MOD Single : A 65 THR OG1 : rot -160:sc= -0.0567 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -45:sc= 0.326 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.32 K(o=-0.32,f=-1.8!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 22:sc= 0.0644 USER MOD Single : A 104 GLN : amide:sc= -1.63! C(o=-1.6!,f=-3.1!) USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 113 LYS NZ :NH3+ 153:sc= -0.281 (180deg=-1.09) USER MOD Single : A 114 MET CE :methyl 158:sc= -0.164 (180deg=-0.544) USER MOD Single : A 119 SER OG : rot 161:sc= 0.567 USER MOD Single : A 120 ASN : amide:sc= -6.81! C(o=-6.8!,f=-13!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 64:sc= 0.249 USER MOD Single : A 126 CYS SG : rot -130:sc= -3.02! USER MOD Single : A 127 ASN : amide:sc= 0.75 K(o=0.75,f=-0.097) USER MOD Single : A 135 LYS NZ :NH3+ 151:sc= -0.483 (180deg=-0.93) USER MOD Single : A 136 ASN : amide:sc= -0.0137 X(o=-0.014,f=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 9:sc= 1.03 USER MOD Single : A 144 MET CE :methyl -141:sc= -0.0497 (180deg=-1.75!) USER MOD Single : A 146 LYS NZ :NH3+ 148:sc= -1.69 (180deg=-2.67!) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 CYS SG : rot -123:sc= 0.729 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -6.862 -10.264 9.902 1.00 0.00 N ATOM 88 CA ASP A 9 -7.764 -9.152 10.181 1.00 0.00 C ATOM 89 C ASP A 9 -8.596 -8.804 8.951 1.00 0.00 C ATOM 90 O ASP A 9 -8.055 -8.480 7.894 1.00 0.00 O ATOM 91 CB ASP A 9 -6.970 -7.927 10.639 1.00 0.00 C ATOM 92 CG ASP A 9 -7.594 -7.252 11.844 1.00 0.00 C ATOM 93 OD1 ASP A 9 -7.812 -7.940 12.863 1.00 0.00 O ATOM 94 OD2 ASP A 9 -7.864 -6.034 11.769 1.00 0.00 O ATOM 0 HA ASP A 9 -8.441 -9.457 10.979 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -5.951 -8.228 10.882 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -6.905 -7.212 9.819 1.00 0.00 H new ATOM 99 N ILE A 10 -9.915 -8.875 9.096 1.00 0.00 N ATOM 100 CA ILE A 10 -10.822 -8.568 7.997 1.00 0.00 C ATOM 101 C ILE A 10 -11.951 -7.649 8.455 1.00 0.00 C ATOM 102 O ILE A 10 -12.657 -7.948 9.417 1.00 0.00 O ATOM 103 CB ILE A 10 -11.427 -9.853 7.392 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.291 -9.516 6.175 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.242 -10.600 8.438 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.290 -10.597 5.117 1.00 0.00 C ATOM 0 H ILE A 10 -10.379 -9.142 9.964 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.234 -8.059 7.233 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.612 -10.499 7.066 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.315 -9.341 6.504 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.935 -8.585 5.733 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.662 -11.503 7.995 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.599 -10.871 9.275 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.050 -9.961 8.794 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.923 -10.291 4.284 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.272 -10.756 4.761 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -12.674 -11.524 5.543 1.00 0.00 H new ATOM 118 N VAL A 11 -12.112 -6.528 7.759 1.00 0.00 N ATOM 119 CA VAL A 11 -13.154 -5.564 8.094 1.00 0.00 C ATOM 120 C VAL A 11 -14.191 -5.466 6.980 1.00 0.00 C ATOM 121 O VAL A 11 -14.007 -4.731 6.011 1.00 0.00 O ATOM 122 CB VAL A 11 -12.564 -4.165 8.354 1.00 0.00 C ATOM 123 CG1 VAL A 11 -13.632 -3.226 8.895 1.00 0.00 C ATOM 124 CG2 VAL A 11 -11.386 -4.252 9.312 1.00 0.00 C ATOM 0 H VAL A 11 -11.535 -6.265 6.960 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.634 -5.922 9.004 1.00 0.00 H new ATOM 0 HB VAL A 11 -12.204 -3.761 7.408 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -13.196 -2.243 9.072 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -14.441 -3.139 8.170 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -14.025 -3.623 9.831 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.982 -3.254 9.484 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.718 -4.677 10.259 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.612 -4.887 8.881 1.00 0.00 H new ATOM 134 N GLY A 12 -15.279 -6.215 7.125 1.00 0.00 N ATOM 135 CA GLY A 12 -16.328 -6.198 6.122 1.00 0.00 C ATOM 136 C GLY A 12 -15.899 -6.848 4.822 1.00 0.00 C ATOM 137 O GLY A 12 -16.379 -7.926 4.471 1.00 0.00 O ATOM 0 H GLY A 12 -15.453 -6.833 7.918 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -17.206 -6.715 6.510 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.624 -5.167 5.928 1.00 0.00 H new ATOM 141 N ILE A 13 -14.992 -6.192 4.106 1.00 0.00 N ATOM 142 CA ILE A 13 -14.497 -6.713 2.837 1.00 0.00 C ATOM 143 C ILE A 13 -13.057 -6.279 2.589 1.00 0.00 C ATOM 144 O ILE A 13 -12.639 -6.102 1.446 1.00 0.00 O ATOM 145 CB ILE A 13 -15.371 -6.246 1.658 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.501 -4.721 1.660 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.743 -6.901 1.723 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.375 -4.102 0.285 1.00 0.00 C ATOM 0 H ILE A 13 -14.585 -5.299 4.383 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.540 -7.800 2.904 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.890 -6.548 0.728 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.466 -4.447 2.086 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.735 -4.300 2.311 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.349 -6.561 0.883 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.632 -7.984 1.675 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -17.233 -6.628 2.658 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.477 -3.020 0.363 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.399 -4.345 -0.135 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -16.158 -4.495 -0.364 1.00 0.00 H new ATOM 160 N TRP A 14 -12.302 -6.109 3.670 1.00 0.00 N ATOM 161 CA TRP A 14 -10.907 -5.696 3.571 1.00 0.00 C ATOM 162 C TRP A 14 -10.027 -6.521 4.504 1.00 0.00 C ATOM 163 O TRP A 14 -10.010 -6.299 5.715 1.00 0.00 O ATOM 164 CB TRP A 14 -10.769 -4.209 3.904 1.00 0.00 C ATOM 165 CG TRP A 14 -11.552 -3.320 2.986 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.842 -2.904 3.152 1.00 0.00 C ATOM 167 CD2 TRP A 14 -11.096 -2.739 1.760 1.00 0.00 C ATOM 168 NE1 TRP A 14 -13.215 -2.100 2.103 1.00 0.00 N ATOM 169 CE2 TRP A 14 -12.161 -1.982 1.236 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.890 -2.783 1.055 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -12.056 -1.277 0.039 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.786 -2.082 -0.132 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.863 -1.338 -0.629 1.00 0.00 C ATOM 0 H TRP A 14 -12.633 -6.251 4.624 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.576 -5.865 2.546 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -11.099 -4.041 4.929 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.716 -3.930 3.858 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.476 -3.168 3.986 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -14.129 -1.662 1.988 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -9.054 -3.354 1.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.885 -0.703 -0.348 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.859 -2.109 -0.685 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.750 -0.801 -1.559 1.00 0.00 H new ATOM 184 N TRP A 15 -9.298 -7.475 3.933 1.00 0.00 N ATOM 185 CA TRP A 15 -8.416 -8.333 4.716 1.00 0.00 C ATOM 186 C TRP A 15 -6.968 -7.866 4.611 1.00 0.00 C ATOM 187 O TRP A 15 -6.455 -7.646 3.513 1.00 0.00 O ATOM 188 CB TRP A 15 -8.533 -9.784 4.245 1.00 0.00 C ATOM 189 CG TRP A 15 -8.319 -9.951 2.772 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.256 -9.819 1.787 1.00 0.00 C ATOM 191 CD2 TRP A 15 -7.090 -10.283 2.114 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.685 -10.048 0.559 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.357 -10.334 0.733 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.790 -10.540 2.560 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.372 -10.633 -0.205 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.813 -10.837 1.628 1.00 0.00 C ATOM 197 CH2 TRP A 15 -5.109 -10.881 0.260 1.00 0.00 C ATOM 0 H TRP A 15 -9.301 -7.673 2.932 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.723 -8.271 5.760 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.805 -10.392 4.782 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.520 -10.164 4.507 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.294 -9.571 1.950 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.171 -10.011 -0.337 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.553 -10.507 3.613 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.597 -10.668 -1.261 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.805 -11.038 1.960 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.324 -11.116 -0.443 1.00 0.00 H new ATOM 208 N THR A 16 -6.316 -7.717 5.759 1.00 0.00 N ATOM 209 CA THR A 16 -4.926 -7.277 5.797 1.00 0.00 C ATOM 210 C THR A 16 -3.999 -8.347 5.229 1.00 0.00 C ATOM 211 O THR A 16 -4.109 -9.524 5.574 1.00 0.00 O ATOM 212 CB THR A 16 -4.516 -6.940 7.231 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.508 -6.149 7.863 1.00 0.00 O ATOM 214 CG2 THR A 16 -3.205 -6.190 7.319 1.00 0.00 C ATOM 0 H THR A 16 -6.728 -7.894 6.675 1.00 0.00 H new ATOM 0 HA THR A 16 -4.838 -6.382 5.181 1.00 0.00 H new ATOM 0 HB THR A 16 -4.399 -7.901 7.731 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.229 -5.945 8.780 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.974 -5.983 8.364 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.410 -6.795 6.885 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.286 -5.251 6.772 1.00 0.00 H new ATOM 222 N VAL A 17 -3.089 -7.930 4.355 1.00 0.00 N ATOM 223 CA VAL A 17 -2.143 -8.853 3.739 1.00 0.00 C ATOM 224 C VAL A 17 -1.087 -9.308 4.741 1.00 0.00 C ATOM 225 O VAL A 17 -0.768 -8.591 5.689 1.00 0.00 O ATOM 226 CB VAL A 17 -1.439 -8.213 2.527 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.400 -8.094 1.354 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.867 -6.853 2.898 1.00 0.00 C ATOM 0 H VAL A 17 -2.987 -6.960 4.058 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.718 -9.715 3.402 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.613 -8.858 2.227 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.886 -7.640 0.507 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.756 -9.085 1.073 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.248 -7.471 1.640 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.374 -6.417 2.030 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.673 -6.196 3.226 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -0.144 -6.970 3.705 1.00 0.00 H new ATOM 238 N SER A 18 -0.550 -10.505 4.525 1.00 0.00 N ATOM 239 CA SER A 18 0.470 -11.056 5.409 1.00 0.00 C ATOM 240 C SER A 18 1.821 -11.128 4.706 1.00 0.00 C ATOM 241 O SER A 18 2.868 -10.972 5.333 1.00 0.00 O ATOM 242 CB SER A 18 0.058 -12.448 5.890 1.00 0.00 C ATOM 243 OG SER A 18 -0.873 -12.366 6.956 1.00 0.00 O ATOM 0 H SER A 18 -0.805 -11.111 3.745 1.00 0.00 H new ATOM 0 HA SER A 18 0.565 -10.394 6.270 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.380 -13.007 5.063 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.940 -12.999 6.215 1.00 0.00 H new ATOM 0 HG SER A 18 -1.121 -13.269 7.244 1.00 0.00 H new ATOM 249 N ASN A 19 1.790 -11.365 3.397 1.00 0.00 N ATOM 250 CA ASN A 19 3.013 -11.458 2.609 1.00 0.00 C ATOM 251 C ASN A 19 3.008 -10.441 1.473 1.00 0.00 C ATOM 252 O ASN A 19 2.068 -9.657 1.331 1.00 0.00 O ATOM 253 CB ASN A 19 3.176 -12.870 2.043 1.00 0.00 C ATOM 254 CG ASN A 19 1.899 -13.390 1.412 1.00 0.00 C ATOM 255 OD1 ASN A 19 0.830 -13.349 2.020 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.006 -13.888 0.185 1.00 0.00 N ATOM 0 H ASN A 19 0.932 -11.496 2.861 1.00 0.00 H new ATOM 0 HA ASN A 19 3.854 -11.238 3.266 1.00 0.00 H new ATOM 0 HB2 ASN A 19 3.972 -12.871 1.299 1.00 0.00 H new ATOM 0 HB3 ASN A 19 3.485 -13.545 2.841 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.182 -14.256 -0.290 1.00 0.00 H new ATOM 0 HD22 ASN A 19 2.913 -13.902 -0.282 1.00 0.00 H new ATOM 263 N PHE A 20 4.064 -10.458 0.666 1.00 0.00 N ATOM 264 CA PHE A 20 4.183 -9.537 -0.459 1.00 0.00 C ATOM 265 C PHE A 20 3.371 -10.029 -1.653 1.00 0.00 C ATOM 266 O PHE A 20 2.822 -9.231 -2.413 1.00 0.00 O ATOM 267 CB PHE A 20 5.652 -9.376 -0.857 1.00 0.00 C ATOM 268 CG PHE A 20 5.866 -8.404 -1.982 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.620 -8.777 -3.294 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.315 -7.117 -1.728 1.00 0.00 C ATOM 271 CE1 PHE A 20 5.818 -7.885 -4.331 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.514 -6.221 -2.761 1.00 0.00 C ATOM 273 CZ PHE A 20 6.266 -6.606 -4.064 1.00 0.00 C ATOM 0 H PHE A 20 4.850 -11.100 0.770 1.00 0.00 H new ATOM 0 HA PHE A 20 3.788 -8.569 -0.149 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.221 -9.045 0.012 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.050 -10.348 -1.147 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.270 -9.776 -3.508 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.511 -6.811 -0.711 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.623 -8.188 -5.349 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.863 -5.221 -2.550 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.422 -5.908 -4.873 1.00 0.00 H new ATOM 283 N GLY A 21 3.299 -11.346 -1.811 1.00 0.00 N ATOM 284 CA GLY A 21 2.552 -11.920 -2.916 1.00 0.00 C ATOM 285 C GLY A 21 1.070 -11.613 -2.837 1.00 0.00 C ATOM 286 O GLY A 21 0.387 -11.550 -3.858 1.00 0.00 O ATOM 0 H GLY A 21 3.744 -12.026 -1.195 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.949 -11.538 -3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.696 -13.000 -2.925 1.00 0.00 H new ATOM 290 N GLU A 22 0.570 -11.423 -1.619 1.00 0.00 N ATOM 291 CA GLU A 22 -0.841 -11.122 -1.410 1.00 0.00 C ATOM 292 C GLU A 22 -1.171 -9.707 -1.875 1.00 0.00 C ATOM 293 O GLU A 22 -2.268 -9.446 -2.370 1.00 0.00 O ATOM 294 CB GLU A 22 -1.205 -11.285 0.067 1.00 0.00 C ATOM 295 CG GLU A 22 -1.535 -12.716 0.457 1.00 0.00 C ATOM 296 CD GLU A 22 -2.842 -13.198 -0.142 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.892 -13.397 -1.375 1.00 0.00 O ATOM 298 OE2 GLU A 22 -3.815 -13.375 0.619 1.00 0.00 O ATOM 0 H GLU A 22 1.122 -11.472 -0.763 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.428 -11.825 -2.001 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.374 -10.933 0.678 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -2.060 -10.649 0.294 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.727 -13.372 0.133 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -1.589 -12.789 1.543 1.00 0.00 H new ATOM 305 N ILE A 23 -0.217 -8.797 -1.710 1.00 0.00 N ATOM 306 CA ILE A 23 -0.406 -7.409 -2.112 1.00 0.00 C ATOM 307 C ILE A 23 -0.418 -7.273 -3.631 1.00 0.00 C ATOM 308 O ILE A 23 0.622 -7.374 -4.282 1.00 0.00 O ATOM 309 CB ILE A 23 0.695 -6.500 -1.535 1.00 0.00 C ATOM 310 CG1 ILE A 23 0.851 -6.743 -0.032 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.376 -5.038 -1.810 1.00 0.00 C ATOM 312 CD1 ILE A 23 1.925 -5.891 0.609 1.00 0.00 C ATOM 0 H ILE A 23 0.696 -8.996 -1.300 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.371 -7.094 -1.714 1.00 0.00 H new ATOM 0 HB ILE A 23 1.638 -6.743 -2.024 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -0.101 -6.545 0.461 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.084 -7.794 0.136 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.164 -4.409 -1.396 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.311 -4.876 -2.886 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.576 -4.780 -1.346 1.00 0.00 H new ATOM 0 HD11 ILE A 23 1.980 -6.116 1.674 1.00 0.00 H new ATOM 0 HD12 ILE A 23 2.886 -6.106 0.143 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.683 -4.837 0.473 1.00 0.00 H new ATOM 324 N SER A 24 -1.601 -7.044 -4.191 1.00 0.00 N ATOM 325 CA SER A 24 -1.750 -6.894 -5.633 1.00 0.00 C ATOM 326 C SER A 24 -3.135 -6.363 -5.985 1.00 0.00 C ATOM 327 O SER A 24 -4.148 -6.879 -5.512 1.00 0.00 O ATOM 328 CB SER A 24 -1.510 -8.232 -6.334 1.00 0.00 C ATOM 329 OG SER A 24 -0.155 -8.368 -6.727 1.00 0.00 O ATOM 0 H SER A 24 -2.472 -6.958 -3.667 1.00 0.00 H new ATOM 0 HA SER A 24 -1.007 -6.174 -5.976 1.00 0.00 H new ATOM 0 HB2 SER A 24 -1.782 -9.049 -5.666 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.155 -8.308 -7.209 1.00 0.00 H new ATOM 0 HG SER A 24 0.428 -8.065 -6.000 1.00 0.00 H new ATOM 335 N GLY A 25 -3.173 -5.328 -6.818 1.00 0.00 N ATOM 336 CA GLY A 25 -4.440 -4.744 -7.218 1.00 0.00 C ATOM 337 C GLY A 25 -4.915 -3.675 -6.255 1.00 0.00 C ATOM 338 O GLY A 25 -4.113 -3.078 -5.536 1.00 0.00 O ATOM 0 H GLY A 25 -2.349 -4.883 -7.223 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.339 -4.313 -8.214 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.193 -5.529 -7.285 1.00 0.00 H new ATOM 342 N THR A 26 -6.222 -3.432 -6.239 1.00 0.00 N ATOM 343 CA THR A 26 -6.802 -2.428 -5.357 1.00 0.00 C ATOM 344 C THR A 26 -6.522 -2.762 -3.895 1.00 0.00 C ATOM 345 O THR A 26 -6.705 -3.900 -3.462 1.00 0.00 O ATOM 346 CB THR A 26 -8.310 -2.325 -5.588 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.588 -2.002 -6.940 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.980 -1.281 -4.720 1.00 0.00 C ATOM 0 H THR A 26 -6.899 -3.918 -6.828 1.00 0.00 H new ATOM 0 HA THR A 26 -6.340 -1.468 -5.587 1.00 0.00 H new ATOM 0 HB THR A 26 -8.710 -3.304 -5.324 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.558 -1.942 -7.069 1.00 0.00 H new ATOM 0 HG21 THR A 26 -10.048 -1.261 -4.935 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.826 -1.528 -3.670 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.549 -0.302 -4.930 1.00 0.00 H new ATOM 356 N ILE A 27 -6.074 -1.764 -3.139 1.00 0.00 N ATOM 357 CA ILE A 27 -5.769 -1.954 -1.727 1.00 0.00 C ATOM 358 C ILE A 27 -6.117 -0.709 -0.917 1.00 0.00 C ATOM 359 O ILE A 27 -6.497 0.321 -1.476 1.00 0.00 O ATOM 360 CB ILE A 27 -4.281 -2.291 -1.514 1.00 0.00 C ATOM 361 CG1 ILE A 27 -3.396 -1.249 -2.198 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.974 -3.685 -2.041 1.00 0.00 C ATOM 363 CD1 ILE A 27 -2.171 -0.874 -1.392 1.00 0.00 C ATOM 0 H ILE A 27 -5.915 -0.817 -3.481 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.377 -2.791 -1.382 1.00 0.00 H new ATOM 0 HB ILE A 27 -4.069 -2.273 -0.445 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -3.079 -1.633 -3.168 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.985 -0.352 -2.387 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.919 -3.909 -1.884 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.584 -4.417 -1.511 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.199 -3.729 -3.107 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.590 -0.131 -1.938 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -2.480 -0.460 -0.432 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.560 -1.761 -1.225 1.00 0.00 H new ATOM 375 N ALA A 28 -5.985 -0.811 0.401 1.00 0.00 N ATOM 376 CA ALA A 28 -6.284 0.306 1.287 1.00 0.00 C ATOM 377 C ALA A 28 -5.285 0.377 2.437 1.00 0.00 C ATOM 378 O ALA A 28 -5.269 -0.487 3.312 1.00 0.00 O ATOM 379 CB ALA A 28 -7.702 0.187 1.826 1.00 0.00 C ATOM 0 H ALA A 28 -5.673 -1.656 0.879 1.00 0.00 H new ATOM 0 HA ALA A 28 -6.201 1.227 0.710 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.912 1.028 2.487 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.408 0.192 0.996 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.803 -0.745 2.382 1.00 0.00 H new ATOM 385 N ILE A 29 -4.451 1.412 2.426 1.00 0.00 N ATOM 386 CA ILE A 29 -3.447 1.595 3.467 1.00 0.00 C ATOM 387 C ILE A 29 -4.011 2.393 4.637 1.00 0.00 C ATOM 388 O ILE A 29 -4.993 3.120 4.491 1.00 0.00 O ATOM 389 CB ILE A 29 -2.196 2.313 2.924 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.705 1.635 1.643 1.00 0.00 C ATOM 391 CG2 ILE A 29 -1.098 2.332 3.977 1.00 0.00 C ATOM 392 CD1 ILE A 29 -1.386 2.609 0.528 1.00 0.00 C ATOM 0 H ILE A 29 -4.451 2.136 1.708 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.163 0.601 3.811 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.461 3.343 2.686 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.814 1.050 1.870 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.466 0.935 1.297 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.221 2.842 3.579 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.453 2.858 4.863 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.832 1.309 4.244 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.044 2.059 -0.349 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.281 3.177 0.274 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.603 3.293 0.855 1.00 0.00 H new ATOM 404 N GLU A 30 -3.382 2.252 5.799 1.00 0.00 N ATOM 405 CA GLU A 30 -3.821 2.961 6.996 1.00 0.00 C ATOM 406 C GLU A 30 -2.628 3.396 7.840 1.00 0.00 C ATOM 407 O GLU A 30 -2.021 2.585 8.539 1.00 0.00 O ATOM 408 CB GLU A 30 -4.752 2.075 7.826 1.00 0.00 C ATOM 409 CG GLU A 30 -5.280 2.753 9.080 1.00 0.00 C ATOM 410 CD GLU A 30 -6.317 1.915 9.802 1.00 0.00 C ATOM 411 OE1 GLU A 30 -5.922 1.025 10.584 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.525 2.151 9.587 1.00 0.00 O ATOM 0 H GLU A 30 -2.567 1.654 5.938 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.364 3.852 6.681 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.595 1.768 7.207 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.218 1.168 8.111 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.449 2.958 9.755 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -5.718 3.715 8.812 1.00 0.00 H new ATOM 419 N MET A 31 -2.297 4.681 7.770 1.00 0.00 N ATOM 420 CA MET A 31 -1.176 5.224 8.528 1.00 0.00 C ATOM 421 C MET A 31 -1.484 5.234 10.023 1.00 0.00 C ATOM 422 O MET A 31 -0.976 4.406 10.777 1.00 0.00 O ATOM 423 CB MET A 31 -0.850 6.641 8.053 1.00 0.00 C ATOM 424 CG MET A 31 -0.227 6.690 6.667 1.00 0.00 C ATOM 425 SD MET A 31 0.806 8.147 6.421 1.00 0.00 S ATOM 426 CE MET A 31 0.723 8.326 4.641 1.00 0.00 C ATOM 0 H MET A 31 -2.789 5.366 7.196 1.00 0.00 H new ATOM 0 HA MET A 31 -0.311 4.584 8.358 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.764 7.234 8.052 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.169 7.106 8.765 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.373 5.793 6.511 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.018 6.679 5.917 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.715 8.555 4.252 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.365 7.396 4.198 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.038 9.135 4.388 1.00 0.00 H new ATOM 436 N ASP A 32 -2.321 6.177 10.443 1.00 0.00 N ATOM 437 CA ASP A 32 -2.697 6.296 11.847 1.00 0.00 C ATOM 438 C ASP A 32 -3.733 5.241 12.224 1.00 0.00 C ATOM 439 O ASP A 32 -4.145 4.434 11.391 1.00 0.00 O ATOM 440 CB ASP A 32 -3.245 7.696 12.133 1.00 0.00 C ATOM 441 CG ASP A 32 -2.544 8.365 13.299 1.00 0.00 C ATOM 442 OD1 ASP A 32 -1.445 8.920 13.092 1.00 0.00 O ATOM 443 OD2 ASP A 32 -3.094 8.332 14.420 1.00 0.00 O ATOM 0 H ASP A 32 -2.752 6.870 9.831 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.805 6.134 12.452 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.135 8.315 11.243 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -4.312 7.629 12.344 1.00 0.00 H new ATOM 448 N LYS A 33 -4.151 5.254 13.486 1.00 0.00 N ATOM 449 CA LYS A 33 -5.140 4.300 13.975 1.00 0.00 C ATOM 450 C LYS A 33 -6.545 4.700 13.537 1.00 0.00 C ATOM 451 O LYS A 33 -7.304 5.286 14.310 1.00 0.00 O ATOM 452 CB LYS A 33 -5.078 4.204 15.501 1.00 0.00 C ATOM 453 CG LYS A 33 -4.152 3.108 16.004 1.00 0.00 C ATOM 454 CD LYS A 33 -4.676 1.727 15.642 1.00 0.00 C ATOM 455 CE LYS A 33 -5.442 1.102 16.797 1.00 0.00 C ATOM 456 NZ LYS A 33 -6.682 1.861 17.118 1.00 0.00 N ATOM 0 H LYS A 33 -3.820 5.915 14.189 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.908 3.325 13.547 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.747 5.161 15.904 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.082 4.026 15.887 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -3.159 3.245 15.577 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.047 3.187 17.086 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.326 1.800 14.770 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -3.843 1.081 15.365 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.701 0.073 16.546 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.802 1.064 17.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.275 1.301 17.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.430 2.761 17.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.209 2.052 16.242 1.00 0.00 H new ATOM 470 N GLY A 34 -6.886 4.380 12.292 1.00 0.00 N ATOM 471 CA GLY A 34 -8.201 4.714 11.774 1.00 0.00 C ATOM 472 C GLY A 34 -8.136 5.691 10.616 1.00 0.00 C ATOM 473 O GLY A 34 -9.013 5.696 9.751 1.00 0.00 O ATOM 0 H GLY A 34 -6.276 3.896 11.633 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -8.703 3.802 11.449 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -8.805 5.142 12.574 1.00 0.00 H new ATOM 477 N ALA A 35 -7.098 6.519 10.599 1.00 0.00 N ATOM 478 CA ALA A 35 -6.924 7.504 9.539 1.00 0.00 C ATOM 479 C ALA A 35 -6.386 6.856 8.268 1.00 0.00 C ATOM 480 O ALA A 35 -5.593 5.915 8.327 1.00 0.00 O ATOM 481 CB ALA A 35 -5.993 8.617 10.000 1.00 0.00 C ATOM 0 H ALA A 35 -6.364 6.528 11.307 1.00 0.00 H new ATOM 0 HA ALA A 35 -7.901 7.931 9.312 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.872 9.346 9.198 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -6.418 9.108 10.875 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.021 8.195 10.257 1.00 0.00 H new ATOM 487 N TYR A 36 -6.821 7.365 7.120 1.00 0.00 N ATOM 488 CA TYR A 36 -6.383 6.838 5.833 1.00 0.00 C ATOM 489 C TYR A 36 -5.752 7.936 4.984 1.00 0.00 C ATOM 490 O TYR A 36 -5.869 9.121 5.297 1.00 0.00 O ATOM 491 CB TYR A 36 -7.562 6.213 5.085 1.00 0.00 C ATOM 492 CG TYR A 36 -8.124 4.980 5.756 1.00 0.00 C ATOM 493 CD1 TYR A 36 -8.818 5.074 6.955 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.960 3.722 5.189 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.334 3.949 7.571 1.00 0.00 C ATOM 496 CE2 TYR A 36 -8.474 2.593 5.799 1.00 0.00 C ATOM 497 CZ TYR A 36 -9.159 2.712 6.989 1.00 0.00 C ATOM 498 OH TYR A 36 -9.671 1.590 7.599 1.00 0.00 O ATOM 0 H TYR A 36 -7.477 8.143 7.055 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.633 6.070 6.019 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.354 6.956 4.988 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.243 5.953 4.076 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -8.957 6.042 7.414 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -7.423 3.625 4.257 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -9.871 4.039 8.503 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -8.339 1.622 5.345 1.00 0.00 H new ATOM 0 HH TYR A 36 -9.175 1.412 8.425 1.00 0.00 H new ATOM 508 N ILE A 37 -5.083 7.536 3.907 1.00 0.00 N ATOM 509 CA ILE A 37 -4.435 8.487 3.013 1.00 0.00 C ATOM 510 C ILE A 37 -5.421 9.038 1.989 1.00 0.00 C ATOM 511 O ILE A 37 -5.891 8.312 1.113 1.00 0.00 O ATOM 512 CB ILE A 37 -3.247 7.844 2.272 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.333 7.118 3.259 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.470 8.901 1.500 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.431 6.093 2.604 1.00 0.00 C ATOM 0 H ILE A 37 -4.976 6.559 3.633 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.066 9.303 3.634 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.634 7.114 1.561 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.718 7.852 3.780 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.945 6.623 4.013 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.634 8.432 0.982 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.127 9.377 0.772 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.092 9.653 2.193 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.810 5.617 3.363 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.040 5.338 2.107 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.793 6.586 1.870 1.00 0.00 H new ATOM 527 N HIS A 38 -5.731 10.325 2.106 1.00 0.00 N ATOM 528 CA HIS A 38 -6.661 10.973 1.190 1.00 0.00 C ATOM 529 C HIS A 38 -5.917 11.632 0.033 1.00 0.00 C ATOM 530 O HIS A 38 -4.771 12.056 0.182 1.00 0.00 O ATOM 531 CB HIS A 38 -7.499 12.015 1.933 1.00 0.00 C ATOM 532 CG HIS A 38 -8.719 12.449 1.180 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.451 11.619 0.360 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.334 13.658 1.136 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.465 12.333 -0.147 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.440 13.577 0.293 1.00 0.00 N ATOM 0 H HIS A 38 -5.351 10.939 2.826 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.322 10.208 0.783 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.803 11.605 2.896 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -6.880 12.888 2.139 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -9.017 14.542 1.669 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.207 11.941 -0.827 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.095 14.324 0.063 1.00 0.00 H new ATOM 544 N ALA A 39 -6.576 11.715 -1.117 1.00 0.00 N ATOM 545 CA ALA A 39 -5.977 12.323 -2.300 1.00 0.00 C ATOM 546 C ALA A 39 -6.605 13.680 -2.597 1.00 0.00 C ATOM 547 O ALA A 39 -7.794 13.891 -2.359 1.00 0.00 O ATOM 548 CB ALA A 39 -6.121 11.398 -3.498 1.00 0.00 C ATOM 0 H ALA A 39 -7.525 11.369 -1.256 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.917 12.479 -2.101 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.670 11.864 -4.374 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.619 10.453 -3.291 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.178 11.213 -3.690 1.00 0.00 H new ATOM 554 N LEU A 40 -5.798 14.597 -3.120 1.00 0.00 N ATOM 555 CA LEU A 40 -6.275 15.936 -3.452 1.00 0.00 C ATOM 556 C LEU A 40 -6.227 16.172 -4.958 1.00 0.00 C ATOM 557 O LEU A 40 -5.399 15.594 -5.661 1.00 0.00 O ATOM 558 CB LEU A 40 -5.434 16.992 -2.731 1.00 0.00 C ATOM 559 CG LEU A 40 -5.586 17.012 -1.209 1.00 0.00 C ATOM 560 CD1 LEU A 40 -4.528 17.904 -0.578 1.00 0.00 C ATOM 561 CD2 LEU A 40 -6.980 17.478 -0.819 1.00 0.00 C ATOM 0 H LEU A 40 -4.811 14.438 -3.323 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.311 16.019 -3.122 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.384 16.827 -2.974 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.700 17.975 -3.120 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.446 15.998 -0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.652 17.906 0.505 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.537 17.526 -0.829 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.636 18.920 -0.957 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.070 17.486 0.267 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.149 18.483 -1.205 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.722 16.799 -1.240 1.00 0.00 H new ATOM 573 N ASP A 41 -7.121 17.025 -5.446 1.00 0.00 N ATOM 574 CA ASP A 41 -7.182 17.338 -6.869 1.00 0.00 C ATOM 575 C ASP A 41 -6.024 18.244 -7.277 1.00 0.00 C ATOM 576 O ASP A 41 -5.505 18.142 -8.388 1.00 0.00 O ATOM 577 CB ASP A 41 -8.514 18.009 -7.209 1.00 0.00 C ATOM 578 CG ASP A 41 -8.745 18.112 -8.703 1.00 0.00 C ATOM 579 OD1 ASP A 41 -8.608 17.083 -9.397 1.00 0.00 O ATOM 580 OD2 ASP A 41 -9.064 19.223 -9.180 1.00 0.00 O ATOM 0 H ASP A 41 -7.813 17.512 -4.877 1.00 0.00 H new ATOM 0 HA ASP A 41 -7.102 16.404 -7.424 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -9.328 17.443 -6.756 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.537 19.007 -6.771 1.00 0.00 H new ATOM 585 N ASN A 42 -5.627 19.132 -6.371 1.00 0.00 N ATOM 586 CA ASN A 42 -4.531 20.056 -6.636 1.00 0.00 C ATOM 587 C ASN A 42 -3.241 19.299 -6.940 1.00 0.00 C ATOM 588 O ASN A 42 -2.393 19.777 -7.692 1.00 0.00 O ATOM 589 CB ASN A 42 -4.319 20.985 -5.439 1.00 0.00 C ATOM 590 CG ASN A 42 -3.532 22.229 -5.805 1.00 0.00 C ATOM 591 OD1 ASN A 42 -4.018 23.091 -6.537 1.00 0.00 O ATOM 592 ND2 ASN A 42 -2.311 22.326 -5.295 1.00 0.00 N ATOM 0 H ASN A 42 -6.048 19.231 -5.447 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.796 20.652 -7.509 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.288 21.277 -5.033 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.794 20.445 -4.652 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -1.734 23.140 -5.505 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -1.950 21.586 -4.693 1.00 0.00 H new ATOM 599 N GLY A 43 -3.100 18.117 -6.350 1.00 0.00 N ATOM 600 CA GLY A 43 -1.912 17.314 -6.569 1.00 0.00 C ATOM 601 C GLY A 43 -1.162 17.025 -5.285 1.00 0.00 C ATOM 602 O GLY A 43 0.069 17.011 -5.266 1.00 0.00 O ATOM 0 H GLY A 43 -3.788 17.700 -5.723 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.195 16.373 -7.040 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.251 17.832 -7.264 1.00 0.00 H new ATOM 606 N LEU A 44 -1.905 16.795 -4.207 1.00 0.00 N ATOM 607 CA LEU A 44 -1.303 16.506 -2.911 1.00 0.00 C ATOM 608 C LEU A 44 -2.091 15.430 -2.173 1.00 0.00 C ATOM 609 O LEU A 44 -3.094 14.924 -2.678 1.00 0.00 O ATOM 610 CB LEU A 44 -1.235 17.777 -2.061 1.00 0.00 C ATOM 611 CG LEU A 44 -0.377 18.902 -2.646 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.011 20.256 -2.370 1.00 0.00 C ATOM 613 CD2 LEU A 44 1.033 18.844 -2.077 1.00 0.00 C ATOM 0 H LEU A 44 -2.925 16.803 -4.206 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.292 16.137 -3.083 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.248 18.152 -1.914 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.845 17.517 -1.077 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.319 18.766 -3.726 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.387 21.043 -2.793 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.001 20.294 -2.825 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.100 20.403 -1.294 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.631 19.650 -2.503 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.993 18.955 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.487 17.885 -2.327 1.00 0.00 H new ATOM 625 N PHE A 45 -1.632 15.084 -0.975 1.00 0.00 N ATOM 626 CA PHE A 45 -2.296 14.067 -0.167 1.00 0.00 C ATOM 627 C PHE A 45 -2.304 14.463 1.306 1.00 0.00 C ATOM 628 O PHE A 45 -1.306 14.958 1.832 1.00 0.00 O ATOM 629 CB PHE A 45 -1.601 12.715 -0.340 1.00 0.00 C ATOM 630 CG PHE A 45 -1.906 12.047 -1.650 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.315 12.491 -2.823 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.784 10.977 -1.710 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.594 11.878 -4.030 1.00 0.00 C ATOM 634 CE2 PHE A 45 -3.066 10.361 -2.914 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.471 10.812 -4.075 1.00 0.00 C ATOM 0 H PHE A 45 -0.804 15.492 -0.542 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.328 13.984 -0.508 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.523 12.856 -0.256 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.901 12.055 0.474 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.629 13.325 -2.793 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.253 10.620 -0.805 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.127 12.232 -4.937 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.752 9.527 -2.947 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.691 10.332 -5.017 1.00 0.00 H new ATOM 645 N THR A 46 -3.436 14.241 1.967 1.00 0.00 N ATOM 646 CA THR A 46 -3.573 14.574 3.380 1.00 0.00 C ATOM 647 C THR A 46 -4.264 13.446 4.140 1.00 0.00 C ATOM 648 O THR A 46 -4.925 12.595 3.544 1.00 0.00 O ATOM 649 CB THR A 46 -4.364 15.873 3.544 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.444 16.243 4.908 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.776 15.786 3.008 1.00 0.00 C ATOM 0 H THR A 46 -4.271 13.832 1.547 1.00 0.00 H new ATOM 0 HA THR A 46 -2.574 14.709 3.795 1.00 0.00 H new ATOM 0 HB THR A 46 -3.818 16.618 2.965 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.952 17.077 4.992 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.281 16.741 3.156 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.747 15.552 1.944 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.319 15.003 3.537 1.00 0.00 H new ATOM 659 N LEU A 47 -4.105 13.446 5.459 1.00 0.00 N ATOM 660 CA LEU A 47 -4.713 12.422 6.301 1.00 0.00 C ATOM 661 C LEU A 47 -6.232 12.567 6.324 1.00 0.00 C ATOM 662 O LEU A 47 -6.758 13.632 6.647 1.00 0.00 O ATOM 663 CB LEU A 47 -4.161 12.508 7.725 1.00 0.00 C ATOM 664 CG LEU A 47 -4.245 11.211 8.532 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.359 10.139 7.915 1.00 0.00 C ATOM 666 CD2 LEU A 47 -3.854 11.459 9.981 1.00 0.00 C ATOM 0 H LEU A 47 -3.561 14.143 5.968 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.465 11.448 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.118 12.820 7.676 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.702 13.287 8.262 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.276 10.858 8.509 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.432 9.224 8.503 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.685 9.941 6.894 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.325 10.483 7.906 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.919 10.526 10.540 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.832 11.836 10.023 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.530 12.193 10.420 1.00 0.00 H new ATOM 678 N GLY A 48 -6.930 11.491 5.978 1.00 0.00 N ATOM 679 CA GLY A 48 -8.380 11.520 5.965 1.00 0.00 C ATOM 680 C GLY A 48 -8.976 11.364 7.351 1.00 0.00 C ATOM 681 O GLY A 48 -8.346 10.801 8.245 1.00 0.00 O ATOM 0 H GLY A 48 -6.517 10.599 5.706 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.718 12.461 5.532 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.751 10.722 5.322 1.00 0.00 H new ATOM 685 N ALA A 49 -10.194 11.866 7.529 1.00 0.00 N ATOM 686 CA ALA A 49 -10.876 11.781 8.814 1.00 0.00 C ATOM 687 C ALA A 49 -11.220 10.332 9.159 1.00 0.00 C ATOM 688 O ALA A 49 -12.034 9.704 8.482 1.00 0.00 O ATOM 689 CB ALA A 49 -12.136 12.633 8.799 1.00 0.00 C ATOM 0 H ALA A 49 -10.729 12.336 6.798 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.201 12.161 9.581 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.636 12.560 9.765 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.870 13.672 8.605 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.806 12.278 8.016 1.00 0.00 H new ATOM 695 N PRO A 50 -10.604 9.776 10.219 1.00 0.00 N ATOM 696 CA PRO A 50 -10.858 8.395 10.641 1.00 0.00 C ATOM 697 C PRO A 50 -12.345 8.101 10.804 1.00 0.00 C ATOM 698 O PRO A 50 -13.184 8.987 10.640 1.00 0.00 O ATOM 699 CB PRO A 50 -10.144 8.297 11.990 1.00 0.00 C ATOM 700 CG PRO A 50 -9.066 9.323 11.924 1.00 0.00 C ATOM 701 CD PRO A 50 -9.617 10.446 11.088 1.00 0.00 C ATOM 0 HA PRO A 50 -10.505 7.674 9.903 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -10.828 8.494 12.815 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -9.733 7.300 12.149 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -8.798 9.673 12.921 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -8.161 8.911 11.477 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -10.082 11.215 11.705 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -8.835 10.934 10.506 1.00 0.00 H new ATOM 709 N HIS A 51 -12.666 6.852 11.126 1.00 0.00 N ATOM 710 CA HIS A 51 -14.052 6.443 11.310 1.00 0.00 C ATOM 711 C HIS A 51 -14.340 6.141 12.778 1.00 0.00 C ATOM 712 O HIS A 51 -13.483 5.626 13.496 1.00 0.00 O ATOM 713 CB HIS A 51 -14.360 5.212 10.456 1.00 0.00 C ATOM 714 CG HIS A 51 -13.926 5.350 9.030 1.00 0.00 C ATOM 715 ND1 HIS A 51 -14.782 5.812 8.061 1.00 0.00 N ATOM 716 CD2 HIS A 51 -12.724 5.075 8.464 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.091 5.811 6.935 1.00 0.00 C ATOM 718 NE2 HIS A 51 -12.838 5.371 7.129 1.00 0.00 N ATOM 0 H HIS A 51 -11.984 6.106 11.265 1.00 0.00 H new ATOM 0 HA HIS A 51 -14.692 7.266 10.994 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -13.869 4.343 10.894 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.432 5.019 10.484 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -11.847 4.696 8.967 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.485 6.125 5.979 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.111 5.275 6.420 1.00 0.00 H new ATOM 726 N ARG A 52 -15.552 6.465 13.217 1.00 0.00 N ATOM 727 CA ARG A 52 -15.953 6.229 14.598 1.00 0.00 C ATOM 728 C ARG A 52 -16.155 4.741 14.861 1.00 0.00 C ATOM 729 O ARG A 52 -15.565 4.176 15.781 1.00 0.00 O ATOM 730 CB ARG A 52 -17.239 6.995 14.916 1.00 0.00 C ATOM 731 CG ARG A 52 -17.657 6.902 16.374 1.00 0.00 C ATOM 732 CD ARG A 52 -18.770 7.886 16.699 1.00 0.00 C ATOM 733 NE ARG A 52 -18.331 9.272 16.564 1.00 0.00 N ATOM 734 CZ ARG A 52 -18.968 10.308 17.108 1.00 0.00 C ATOM 735 NH1 ARG A 52 -20.071 10.117 17.822 1.00 0.00 N ATOM 736 NH2 ARG A 52 -18.501 11.537 16.938 1.00 0.00 N ATOM 0 H ARG A 52 -16.273 6.892 12.636 1.00 0.00 H new ATOM 0 HA ARG A 52 -15.154 6.588 15.247 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -17.102 8.044 14.652 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -18.045 6.611 14.290 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -17.991 5.888 16.594 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -16.797 7.100 17.013 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -19.617 7.708 16.036 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -19.120 7.714 17.717 1.00 0.00 H new ATOM 0 HE ARG A 52 -17.487 9.458 16.022 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -20.435 9.174 17.956 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -20.555 10.914 18.236 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -17.654 11.690 16.391 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -18.989 12.330 17.355 1.00 0.00 H new ATOM 750 N GLU A 53 -16.994 4.111 14.045 1.00 0.00 N ATOM 751 CA GLU A 53 -17.274 2.686 14.188 1.00 0.00 C ATOM 752 C GLU A 53 -16.011 1.859 13.976 1.00 0.00 C ATOM 753 O GLU A 53 -15.138 2.230 13.192 1.00 0.00 O ATOM 754 CB GLU A 53 -18.353 2.255 13.193 1.00 0.00 C ATOM 755 CG GLU A 53 -19.769 2.497 13.688 1.00 0.00 C ATOM 756 CD GLU A 53 -20.729 1.399 13.273 1.00 0.00 C ATOM 757 OE1 GLU A 53 -20.276 0.247 13.110 1.00 0.00 O ATOM 758 OE2 GLU A 53 -21.932 1.692 13.112 1.00 0.00 O ATOM 0 H GLU A 53 -17.492 4.564 13.278 1.00 0.00 H new ATOM 0 HA GLU A 53 -17.634 2.512 15.202 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.208 2.793 12.256 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -18.230 1.194 12.973 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -19.761 2.576 14.775 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.126 3.452 13.302 1.00 0.00 H new ATOM 765 N VAL A 54 -15.919 0.736 14.682 1.00 0.00 N ATOM 766 CA VAL A 54 -14.762 -0.143 14.571 1.00 0.00 C ATOM 767 C VAL A 54 -14.739 -0.855 13.224 1.00 0.00 C ATOM 768 O VAL A 54 -13.675 -1.096 12.655 1.00 0.00 O ATOM 769 CB VAL A 54 -14.747 -1.197 15.695 1.00 0.00 C ATOM 770 CG1 VAL A 54 -13.439 -1.973 15.683 1.00 0.00 C ATOM 771 CG2 VAL A 54 -14.974 -0.539 17.048 1.00 0.00 C ATOM 0 H VAL A 54 -16.632 0.414 15.337 1.00 0.00 H new ATOM 0 HA VAL A 54 -13.877 0.487 14.661 1.00 0.00 H new ATOM 0 HB VAL A 54 -15.561 -1.901 15.519 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -13.447 -2.712 16.484 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -13.324 -2.478 14.724 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -12.607 -1.285 15.833 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -14.960 -1.299 17.829 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -14.185 0.189 17.236 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -15.940 -0.035 17.050 1.00 0.00 H new ATOM 781 N ASP A 55 -15.922 -1.188 12.716 1.00 0.00 N ATOM 782 CA ASP A 55 -16.038 -1.872 11.433 1.00 0.00 C ATOM 783 C ASP A 55 -16.592 -0.934 10.365 1.00 0.00 C ATOM 784 O ASP A 55 -17.806 -0.814 10.200 1.00 0.00 O ATOM 785 CB ASP A 55 -16.939 -3.101 11.567 1.00 0.00 C ATOM 786 CG ASP A 55 -16.229 -4.270 12.220 1.00 0.00 C ATOM 787 OD1 ASP A 55 -15.004 -4.409 12.018 1.00 0.00 O ATOM 788 OD2 ASP A 55 -16.898 -5.047 12.935 1.00 0.00 O ATOM 0 H ASP A 55 -16.813 -0.995 13.173 1.00 0.00 H new ATOM 0 HA ASP A 55 -15.042 -2.192 11.128 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -17.819 -2.840 12.154 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -17.291 -3.399 10.580 1.00 0.00 H new ATOM 793 N GLU A 56 -15.694 -0.274 9.642 1.00 0.00 N ATOM 794 CA GLU A 56 -16.093 0.652 8.589 1.00 0.00 C ATOM 795 C GLU A 56 -15.126 0.586 7.411 1.00 0.00 C ATOM 796 O GLU A 56 -13.909 0.639 7.589 1.00 0.00 O ATOM 797 CB GLU A 56 -16.154 2.081 9.134 1.00 0.00 C ATOM 798 CG GLU A 56 -17.303 2.900 8.567 1.00 0.00 C ATOM 799 CD GLU A 56 -18.187 3.494 9.645 1.00 0.00 C ATOM 800 OE1 GLU A 56 -17.851 4.584 10.156 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.215 2.869 9.982 1.00 0.00 O ATOM 0 H GLU A 56 -14.685 -0.363 9.766 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.084 0.361 8.240 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -16.247 2.043 10.219 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.214 2.586 8.912 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -16.901 3.703 7.949 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.907 2.268 7.915 1.00 0.00 H new ATOM 808 N GLY A 57 -15.676 0.468 6.206 1.00 0.00 N ATOM 809 CA GLY A 57 -14.847 0.395 5.017 1.00 0.00 C ATOM 810 C GLY A 57 -14.405 1.765 4.534 1.00 0.00 C ATOM 811 O GLY A 57 -15.135 2.744 4.686 1.00 0.00 O ATOM 0 H GLY A 57 -16.680 0.422 6.032 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.968 -0.214 5.227 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.400 -0.106 4.222 1.00 0.00 H new ATOM 815 N PRO A 58 -13.202 1.866 3.941 1.00 0.00 N ATOM 816 CA PRO A 58 -12.675 3.139 3.437 1.00 0.00 C ATOM 817 C PRO A 58 -13.420 3.627 2.200 1.00 0.00 C ATOM 818 O PRO A 58 -14.044 2.841 1.487 1.00 0.00 O ATOM 819 CB PRO A 58 -11.223 2.810 3.087 1.00 0.00 C ATOM 820 CG PRO A 58 -11.221 1.347 2.811 1.00 0.00 C ATOM 821 CD PRO A 58 -12.263 0.751 3.717 1.00 0.00 C ATOM 0 HA PRO A 58 -12.781 3.940 4.169 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.887 3.377 2.219 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.552 3.058 3.909 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.454 1.147 1.765 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.240 0.915 3.008 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.757 -0.103 3.254 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.828 0.399 4.652 1.00 0.00 H new ATOM 829 N SER A 59 -13.347 4.930 1.950 1.00 0.00 N ATOM 830 CA SER A 59 -14.010 5.525 0.796 1.00 0.00 C ATOM 831 C SER A 59 -13.182 5.315 -0.469 1.00 0.00 C ATOM 832 O SER A 59 -11.994 4.999 -0.394 1.00 0.00 O ATOM 833 CB SER A 59 -14.242 7.019 1.030 1.00 0.00 C ATOM 834 OG SER A 59 -14.951 7.243 2.236 1.00 0.00 O ATOM 0 H SER A 59 -12.835 5.594 2.531 1.00 0.00 H new ATOM 0 HA SER A 59 -14.974 5.034 0.664 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.284 7.538 1.066 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.800 7.439 0.193 1.00 0.00 H new ATOM 0 HG SER A 59 -15.085 8.206 2.363 1.00 0.00 H new ATOM 840 N PRO A 60 -13.797 5.484 -1.652 1.00 0.00 N ATOM 841 CA PRO A 60 -13.104 5.307 -2.933 1.00 0.00 C ATOM 842 C PRO A 60 -11.853 6.174 -3.049 1.00 0.00 C ATOM 843 O PRO A 60 -10.797 5.698 -3.465 1.00 0.00 O ATOM 844 CB PRO A 60 -14.148 5.722 -3.975 1.00 0.00 C ATOM 845 CG PRO A 60 -15.462 5.566 -3.288 1.00 0.00 C ATOM 846 CD PRO A 60 -15.210 5.860 -1.836 1.00 0.00 C ATOM 0 HA PRO A 60 -12.748 4.284 -3.058 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.993 6.750 -4.301 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -14.090 5.093 -4.864 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -16.202 6.251 -3.702 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.853 4.557 -3.419 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -15.380 6.911 -1.604 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.868 5.280 -1.189 1.00 0.00 H new ATOM 854 N PRO A 61 -11.950 7.462 -2.679 1.00 0.00 N ATOM 855 CA PRO A 61 -10.816 8.388 -2.743 1.00 0.00 C ATOM 856 C PRO A 61 -9.581 7.842 -2.033 1.00 0.00 C ATOM 857 O PRO A 61 -8.451 8.187 -2.379 1.00 0.00 O ATOM 858 CB PRO A 61 -11.332 9.636 -2.025 1.00 0.00 C ATOM 859 CG PRO A 61 -12.814 9.570 -2.161 1.00 0.00 C ATOM 860 CD PRO A 61 -13.169 8.113 -2.167 1.00 0.00 C ATOM 0 HA PRO A 61 -10.499 8.570 -3.770 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -11.031 9.642 -0.977 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.934 10.545 -2.476 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -13.304 10.087 -1.336 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -13.143 10.055 -3.080 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.424 7.758 -1.168 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -14.029 7.912 -2.806 1.00 0.00 H new ATOM 868 N GLU A 62 -9.804 6.989 -1.037 1.00 0.00 N ATOM 869 CA GLU A 62 -8.709 6.398 -0.277 1.00 0.00 C ATOM 870 C GLU A 62 -8.260 5.076 -0.893 1.00 0.00 C ATOM 871 O GLU A 62 -7.124 4.645 -0.698 1.00 0.00 O ATOM 872 CB GLU A 62 -9.133 6.177 1.176 1.00 0.00 C ATOM 873 CG GLU A 62 -9.466 7.463 1.915 1.00 0.00 C ATOM 874 CD GLU A 62 -10.565 7.277 2.942 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.367 6.485 3.887 1.00 0.00 O ATOM 876 OE2 GLU A 62 -11.624 7.924 2.803 1.00 0.00 O ATOM 0 H GLU A 62 -10.733 6.692 -0.738 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.868 7.091 -0.306 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.003 5.521 1.196 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.332 5.661 1.705 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.570 7.835 2.411 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.771 8.223 1.195 1.00 0.00 H new ATOM 883 N GLN A 63 -9.155 4.435 -1.638 1.00 0.00 N ATOM 884 CA GLN A 63 -8.845 3.162 -2.278 1.00 0.00 C ATOM 885 C GLN A 63 -7.741 3.327 -3.318 1.00 0.00 C ATOM 886 O GLN A 63 -7.915 4.023 -4.319 1.00 0.00 O ATOM 887 CB GLN A 63 -10.098 2.579 -2.936 1.00 0.00 C ATOM 888 CG GLN A 63 -11.234 2.324 -1.958 1.00 0.00 C ATOM 889 CD GLN A 63 -12.244 1.325 -2.485 1.00 0.00 C ATOM 890 OE1 GLN A 63 -12.055 0.733 -3.547 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.328 1.133 -1.741 1.00 0.00 N ATOM 0 H GLN A 63 -10.100 4.776 -1.813 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.493 2.475 -1.508 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.443 3.263 -3.711 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.837 1.643 -3.430 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.823 1.958 -1.017 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -11.739 3.265 -1.740 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.444 1.646 -0.867 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.044 0.473 -2.044 1.00 0.00 H new ATOM 900 N PHE A 64 -6.605 2.681 -3.074 1.00 0.00 N ATOM 901 CA PHE A 64 -5.470 2.754 -3.988 1.00 0.00 C ATOM 902 C PHE A 64 -5.340 1.467 -4.797 1.00 0.00 C ATOM 903 O PHE A 64 -6.132 0.539 -4.636 1.00 0.00 O ATOM 904 CB PHE A 64 -4.177 3.014 -3.213 1.00 0.00 C ATOM 905 CG PHE A 64 -4.116 4.376 -2.584 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.719 5.478 -3.324 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.458 4.555 -1.253 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.663 6.734 -2.747 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.404 5.807 -0.671 1.00 0.00 C ATOM 910 CZ PHE A 64 -4.005 6.897 -1.420 1.00 0.00 C ATOM 0 H PHE A 64 -6.446 2.101 -2.250 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.644 3.581 -4.677 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.072 2.258 -2.434 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.329 2.896 -3.888 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.450 5.355 -4.363 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.770 3.706 -0.664 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.352 7.586 -3.334 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.673 5.933 0.367 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.961 7.876 -0.967 1.00 0.00 H new ATOM 920 N THR A 65 -4.336 1.419 -5.666 1.00 0.00 N ATOM 921 CA THR A 65 -4.102 0.246 -6.500 1.00 0.00 C ATOM 922 C THR A 65 -2.613 -0.080 -6.575 1.00 0.00 C ATOM 923 O THR A 65 -1.810 0.741 -7.017 1.00 0.00 O ATOM 924 CB THR A 65 -4.657 0.474 -7.906 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.701 1.431 -7.885 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.201 -0.785 -8.547 1.00 0.00 C ATOM 0 H THR A 65 -3.671 2.179 -5.811 1.00 0.00 H new ATOM 0 HA THR A 65 -4.619 -0.600 -6.046 1.00 0.00 H new ATOM 0 HB THR A 65 -3.811 0.826 -8.496 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.246 1.338 -8.694 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.579 -0.552 -9.543 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.406 -1.527 -8.625 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.011 -1.184 -7.936 1.00 0.00 H new ATOM 934 N ALA A 66 -2.253 -1.283 -6.142 1.00 0.00 N ATOM 935 CA ALA A 66 -0.861 -1.718 -6.161 1.00 0.00 C ATOM 936 C ALA A 66 -0.563 -2.551 -7.402 1.00 0.00 C ATOM 937 O ALA A 66 -1.452 -3.193 -7.960 1.00 0.00 O ATOM 938 CB ALA A 66 -0.539 -2.509 -4.902 1.00 0.00 C ATOM 0 H ALA A 66 -2.906 -1.975 -5.773 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.229 -0.831 -6.191 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.503 -2.828 -4.929 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.704 -1.882 -4.026 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.185 -3.385 -4.848 1.00 0.00 H new ATOM 944 N VAL A 67 0.696 -2.537 -7.828 1.00 0.00 N ATOM 945 CA VAL A 67 1.114 -3.293 -9.004 1.00 0.00 C ATOM 946 C VAL A 67 2.536 -3.816 -8.844 1.00 0.00 C ATOM 947 O VAL A 67 3.449 -3.067 -8.497 1.00 0.00 O ATOM 948 CB VAL A 67 1.037 -2.434 -10.281 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.286 -3.287 -11.517 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.310 -1.731 -10.370 1.00 0.00 C ATOM 0 H VAL A 67 1.444 -2.011 -7.377 1.00 0.00 H new ATOM 0 HA VAL A 67 0.428 -4.135 -9.099 1.00 0.00 H new ATOM 0 HB VAL A 67 1.816 -1.673 -10.233 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.227 -2.662 -12.408 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.276 -3.738 -11.454 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.533 -4.073 -11.575 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.347 -1.129 -11.278 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.107 -2.474 -10.395 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.442 -1.086 -9.501 1.00 0.00 H new ATOM 960 N LYS A 68 2.719 -5.107 -9.101 1.00 0.00 N ATOM 961 CA LYS A 68 4.031 -5.731 -8.987 1.00 0.00 C ATOM 962 C LYS A 68 4.957 -5.259 -10.104 1.00 0.00 C ATOM 963 O LYS A 68 4.512 -4.990 -11.219 1.00 0.00 O ATOM 964 CB LYS A 68 3.900 -7.255 -9.026 1.00 0.00 C ATOM 965 CG LYS A 68 3.743 -7.888 -7.653 1.00 0.00 C ATOM 966 CD LYS A 68 4.140 -9.356 -7.668 1.00 0.00 C ATOM 967 CE LYS A 68 5.636 -9.530 -7.460 1.00 0.00 C ATOM 968 NZ LYS A 68 6.214 -10.539 -8.392 1.00 0.00 N ATOM 0 H LYS A 68 1.974 -5.741 -9.390 1.00 0.00 H new ATOM 0 HA LYS A 68 4.464 -5.436 -8.031 1.00 0.00 H new ATOM 0 HB2 LYS A 68 3.040 -7.522 -9.640 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.781 -7.675 -9.512 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.358 -7.351 -6.931 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.708 -7.793 -7.323 1.00 0.00 H new ATOM 0 HD2 LYS A 68 3.598 -9.889 -6.886 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.849 -9.803 -8.619 1.00 0.00 H new ATOM 0 HE2 LYS A 68 6.136 -8.573 -7.606 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.826 -9.836 -6.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 7.235 -10.628 -8.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.755 -11.459 -8.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 6.056 -10.235 -9.374 1.00 0.00 H new ATOM 982 N LEU A 69 6.246 -5.162 -9.796 1.00 0.00 N ATOM 983 CA LEU A 69 7.233 -4.722 -10.776 1.00 0.00 C ATOM 984 C LEU A 69 8.467 -5.619 -10.749 1.00 0.00 C ATOM 985 O LEU A 69 8.688 -6.413 -11.664 1.00 0.00 O ATOM 986 CB LEU A 69 7.633 -3.269 -10.511 1.00 0.00 C ATOM 987 CG LEU A 69 6.475 -2.271 -10.497 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.933 -0.930 -9.947 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.895 -2.108 -11.894 1.00 0.00 C ATOM 0 H LEU A 69 6.631 -5.382 -8.877 1.00 0.00 H new ATOM 0 HA LEU A 69 6.781 -4.791 -11.766 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.147 -3.219 -9.551 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.349 -2.961 -11.273 1.00 0.00 H new ATOM 0 HG LEU A 69 5.693 -2.659 -9.844 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.095 -0.232 -9.945 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.299 -1.060 -8.929 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.733 -0.534 -10.573 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.072 -1.394 -11.865 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.669 -1.742 -12.569 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.528 -3.071 -12.250 1.00 0.00 H new ATOM 1001 N SER A 70 9.268 -5.489 -9.695 1.00 0.00 N ATOM 1002 CA SER A 70 10.480 -6.290 -9.551 1.00 0.00 C ATOM 1003 C SER A 70 11.211 -5.942 -8.259 1.00 0.00 C ATOM 1004 O SER A 70 11.093 -4.830 -7.747 1.00 0.00 O ATOM 1005 CB SER A 70 11.408 -6.074 -10.748 1.00 0.00 C ATOM 1006 OG SER A 70 11.684 -4.697 -10.938 1.00 0.00 O ATOM 0 H SER A 70 9.100 -4.837 -8.929 1.00 0.00 H new ATOM 0 HA SER A 70 10.188 -7.339 -9.513 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.340 -6.617 -10.592 1.00 0.00 H new ATOM 0 HB3 SER A 70 10.948 -6.483 -11.647 1.00 0.00 H new ATOM 0 HG SER A 70 12.280 -4.586 -11.708 1.00 0.00 H new ATOM 1012 N ASP A 71 11.970 -6.901 -7.738 1.00 0.00 N ATOM 1013 CA ASP A 71 12.724 -6.696 -6.505 1.00 0.00 C ATOM 1014 C ASP A 71 11.798 -6.313 -5.356 1.00 0.00 C ATOM 1015 O ASP A 71 12.148 -5.490 -4.509 1.00 0.00 O ATOM 1016 CB ASP A 71 13.784 -5.611 -6.708 1.00 0.00 C ATOM 1017 CG ASP A 71 15.127 -6.186 -7.117 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.188 -6.868 -8.161 1.00 0.00 O ATOM 1019 OD2 ASP A 71 16.118 -5.951 -6.395 1.00 0.00 O ATOM 0 H ASP A 71 12.080 -7.828 -8.150 1.00 0.00 H new ATOM 0 HA ASP A 71 13.217 -7.634 -6.249 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.443 -4.912 -7.472 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.901 -5.043 -5.785 1.00 0.00 H new ATOM 1024 N SER A 72 10.614 -6.916 -5.330 1.00 0.00 N ATOM 1025 CA SER A 72 9.638 -6.640 -4.283 1.00 0.00 C ATOM 1026 C SER A 72 9.224 -5.171 -4.296 1.00 0.00 C ATOM 1027 O SER A 72 8.904 -4.597 -3.256 1.00 0.00 O ATOM 1028 CB SER A 72 10.209 -7.008 -2.912 1.00 0.00 C ATOM 1029 OG SER A 72 10.017 -8.383 -2.632 1.00 0.00 O ATOM 0 H SER A 72 10.307 -7.599 -6.023 1.00 0.00 H new ATOM 0 HA SER A 72 8.755 -7.249 -4.477 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.273 -6.773 -2.883 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.728 -6.406 -2.141 1.00 0.00 H new ATOM 0 HG SER A 72 10.392 -8.593 -1.751 1.00 0.00 H new ATOM 1035 N ARG A 73 9.234 -4.570 -5.482 1.00 0.00 N ATOM 1036 CA ARG A 73 8.860 -3.168 -5.631 1.00 0.00 C ATOM 1037 C ARG A 73 7.493 -3.039 -6.293 1.00 0.00 C ATOM 1038 O ARG A 73 7.326 -3.375 -7.466 1.00 0.00 O ATOM 1039 CB ARG A 73 9.912 -2.422 -6.453 1.00 0.00 C ATOM 1040 CG ARG A 73 11.315 -2.516 -5.876 1.00 0.00 C ATOM 1041 CD ARG A 73 11.389 -1.898 -4.490 1.00 0.00 C ATOM 1042 NE ARG A 73 11.198 -0.450 -4.526 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.154 0.417 -4.856 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.368 -0.013 -5.177 1.00 0.00 N ATOM 1045 NH2 ARG A 73 11.894 1.717 -4.863 1.00 0.00 N ATOM 0 H ARG A 73 9.497 -5.032 -6.353 1.00 0.00 H new ATOM 0 HA ARG A 73 8.806 -2.724 -4.637 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.918 -2.821 -7.467 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.627 -1.372 -6.525 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.620 -3.561 -5.826 1.00 0.00 H new ATOM 0 HG3 ARG A 73 12.017 -2.010 -6.539 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.629 -2.348 -3.851 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.357 -2.125 -4.043 1.00 0.00 H new ATOM 0 HE ARG A 73 10.278 -0.081 -4.284 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.573 -1.012 -5.172 1.00 0.00 H new ATOM 0 HH12 ARG A 73 14.096 0.656 -5.429 1.00 0.00 H new ATOM 0 HH21 ARG A 73 10.963 2.052 -4.616 1.00 0.00 H new ATOM 0 HH22 ARG A 73 12.625 2.382 -5.115 1.00 0.00 H new ATOM 1059 N ILE A 74 6.516 -2.552 -5.535 1.00 0.00 N ATOM 1060 CA ILE A 74 5.162 -2.380 -6.049 1.00 0.00 C ATOM 1061 C ILE A 74 4.881 -0.919 -6.384 1.00 0.00 C ATOM 1062 O ILE A 74 5.538 -0.015 -5.870 1.00 0.00 O ATOM 1063 CB ILE A 74 4.110 -2.873 -5.038 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.395 -2.296 -3.650 1.00 0.00 C ATOM 1065 CG2 ILE A 74 4.089 -4.395 -4.992 1.00 0.00 C ATOM 1066 CD1 ILE A 74 3.153 -2.116 -2.804 1.00 0.00 C ATOM 0 H ILE A 74 6.637 -2.269 -4.562 1.00 0.00 H new ATOM 0 HA ILE A 74 5.092 -2.978 -6.957 1.00 0.00 H new ATOM 0 HB ILE A 74 3.128 -2.526 -5.360 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.089 -2.954 -3.127 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.892 -1.332 -3.761 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.340 -4.727 -4.273 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.842 -4.785 -5.979 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.070 -4.763 -4.691 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.430 -1.703 -1.834 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.467 -1.434 -3.306 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.666 -3.081 -2.662 1.00 0.00 H new ATOM 1078 N ALA A 75 3.897 -0.697 -7.251 1.00 0.00 N ATOM 1079 CA ALA A 75 3.525 0.653 -7.656 1.00 0.00 C ATOM 1080 C ALA A 75 2.116 0.998 -7.186 1.00 0.00 C ATOM 1081 O ALA A 75 1.155 0.301 -7.512 1.00 0.00 O ATOM 1082 CB ALA A 75 3.629 0.797 -9.168 1.00 0.00 C ATOM 0 H ALA A 75 3.344 -1.435 -7.686 1.00 0.00 H new ATOM 0 HA ALA A 75 4.218 1.351 -7.186 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.348 1.810 -9.457 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.654 0.601 -9.483 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.959 0.084 -9.648 1.00 0.00 H new ATOM 1088 N LEU A 76 2.001 2.075 -6.417 1.00 0.00 N ATOM 1089 CA LEU A 76 0.709 2.510 -5.900 1.00 0.00 C ATOM 1090 C LEU A 76 0.014 3.445 -6.885 1.00 0.00 C ATOM 1091 O LEU A 76 0.666 4.112 -7.688 1.00 0.00 O ATOM 1092 CB LEU A 76 0.885 3.211 -4.552 1.00 0.00 C ATOM 1093 CG LEU A 76 1.030 2.275 -3.350 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.716 2.991 -2.196 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.331 1.750 -2.919 1.00 0.00 C ATOM 0 H LEU A 76 2.787 2.663 -6.138 1.00 0.00 H new ATOM 0 HA LEU A 76 0.085 1.627 -5.764 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.767 3.850 -4.604 1.00 0.00 H new ATOM 0 HB3 LEU A 76 0.028 3.863 -4.384 1.00 0.00 H new ATOM 0 HG LEU A 76 1.649 1.428 -3.645 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.811 2.310 -1.350 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.707 3.320 -2.509 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.123 3.856 -1.901 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.210 1.086 -2.063 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -0.972 2.586 -2.642 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.787 1.201 -3.743 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.312 3.489 -6.814 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.097 4.343 -7.699 1.00 0.00 C ATOM 1109 C LYS A 77 -3.252 4.992 -6.942 1.00 0.00 C ATOM 1110 O LYS A 77 -4.018 4.313 -6.259 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.637 3.532 -8.879 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.435 4.360 -9.872 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.546 3.544 -10.512 1.00 0.00 C ATOM 1114 CE LYS A 77 -4.094 2.916 -11.821 1.00 0.00 C ATOM 1115 NZ LYS A 77 -4.590 1.520 -11.968 1.00 0.00 N ATOM 0 H LYS A 77 -1.866 2.944 -6.153 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.445 5.130 -8.077 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.802 3.062 -9.399 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.268 2.729 -8.499 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.863 5.225 -9.365 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.770 4.742 -10.647 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.867 2.762 -9.824 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -5.410 4.183 -10.693 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.453 3.518 -12.656 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.005 2.921 -11.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -4.260 1.128 -12.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -4.227 0.938 -11.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.630 1.517 -11.948 1.00 0.00 H new ATOM 1129 N SER A 78 -3.372 6.309 -7.071 1.00 0.00 N ATOM 1130 CA SER A 78 -4.434 7.049 -6.398 1.00 0.00 C ATOM 1131 C SER A 78 -5.802 6.644 -6.935 1.00 0.00 C ATOM 1132 O SER A 78 -5.936 6.258 -8.096 1.00 0.00 O ATOM 1133 CB SER A 78 -4.226 8.554 -6.576 1.00 0.00 C ATOM 1134 OG SER A 78 -4.335 8.926 -7.939 1.00 0.00 O ATOM 0 H SER A 78 -2.748 6.886 -7.635 1.00 0.00 H new ATOM 0 HA SER A 78 -4.396 6.808 -5.336 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.964 9.098 -5.987 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.244 8.836 -6.196 1.00 0.00 H new ATOM 0 HG SER A 78 -3.833 8.292 -8.492 1.00 0.00 H new ATOM 1140 N GLY A 79 -6.818 6.734 -6.082 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.163 6.375 -6.487 1.00 0.00 C ATOM 1142 C GLY A 79 -8.642 7.169 -7.687 1.00 0.00 C ATOM 1143 O GLY A 79 -9.489 6.705 -8.449 1.00 0.00 O ATOM 0 H GLY A 79 -6.732 7.050 -5.116 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.196 5.311 -6.723 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.845 6.537 -5.653 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.096 8.369 -7.855 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.472 9.230 -8.971 1.00 0.00 C ATOM 1149 C TYR A 80 -7.978 8.653 -10.294 1.00 0.00 C ATOM 1150 O TYR A 80 -8.666 8.731 -11.312 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.904 10.636 -8.771 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.717 11.489 -7.822 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -10.059 11.751 -8.070 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -8.142 12.030 -6.679 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.805 12.529 -7.205 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -8.882 12.809 -5.808 1.00 0.00 C ATOM 1157 CZ TYR A 80 -10.212 13.056 -6.077 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.951 13.831 -5.213 1.00 0.00 O ATOM 0 H TYR A 80 -7.392 8.767 -7.233 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.560 9.286 -9.004 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.885 10.557 -8.392 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.847 11.136 -9.738 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -10.526 11.340 -8.953 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -7.100 11.839 -6.467 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.847 12.723 -7.411 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -8.421 13.221 -4.923 1.00 0.00 H new ATOM 0 HH TYR A 80 -10.384 14.123 -4.469 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.781 8.075 -10.272 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.218 7.494 -11.476 1.00 0.00 C ATOM 1170 C GLY A 81 -4.729 7.754 -11.611 1.00 0.00 C ATOM 1171 O GLY A 81 -4.049 7.100 -12.403 1.00 0.00 O ATOM 0 H GLY A 81 -6.192 7.999 -9.443 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.396 6.419 -11.473 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.734 7.900 -12.346 1.00 0.00 H new ATOM 1175 N LYS A 82 -4.219 8.711 -10.841 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.801 9.051 -10.884 1.00 0.00 C ATOM 1177 C LYS A 82 -1.982 8.078 -10.044 1.00 0.00 C ATOM 1178 O LYS A 82 -2.535 7.226 -9.347 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.583 10.482 -10.387 1.00 0.00 C ATOM 1180 CG LYS A 82 -3.182 11.540 -11.298 1.00 0.00 C ATOM 1181 CD LYS A 82 -3.722 12.720 -10.504 1.00 0.00 C ATOM 1182 CE LYS A 82 -5.074 13.175 -11.030 1.00 0.00 C ATOM 1183 NZ LYS A 82 -4.944 13.977 -12.278 1.00 0.00 N ATOM 0 H LYS A 82 -4.766 9.264 -10.181 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.467 8.978 -11.919 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.018 10.582 -9.392 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.513 10.664 -10.287 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.424 11.889 -12.000 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.985 11.100 -11.889 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.814 12.442 -9.454 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -3.014 13.547 -10.554 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -5.700 12.304 -11.222 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.579 13.769 -10.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.888 14.268 -12.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.368 14.822 -12.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -4.486 13.402 -13.014 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.661 8.208 -10.115 1.00 0.00 N ATOM 1198 CA TYR A 83 0.235 7.340 -9.361 1.00 0.00 C ATOM 1199 C TYR A 83 0.921 8.109 -8.237 1.00 0.00 C ATOM 1200 O TYR A 83 1.271 9.279 -8.396 1.00 0.00 O ATOM 1201 CB TYR A 83 1.285 6.727 -10.288 1.00 0.00 C ATOM 1202 CG TYR A 83 0.732 5.667 -11.214 1.00 0.00 C ATOM 1203 CD1 TYR A 83 0.186 6.008 -12.445 1.00 0.00 C ATOM 1204 CD2 TYR A 83 0.756 4.324 -10.856 1.00 0.00 C ATOM 1205 CE1 TYR A 83 -0.321 5.042 -13.293 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.251 3.353 -11.700 1.00 0.00 C ATOM 1207 CZ TYR A 83 -0.285 3.717 -12.916 1.00 0.00 C ATOM 1208 OH TYR A 83 -0.788 2.751 -13.759 1.00 0.00 O ATOM 0 H TYR A 83 -0.188 8.907 -10.688 1.00 0.00 H new ATOM 0 HA TYR A 83 -0.361 6.542 -8.919 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.737 7.519 -10.885 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.080 6.290 -9.684 1.00 0.00 H new ATOM 0 HD1 TYR A 83 0.157 7.045 -12.744 1.00 0.00 H new ATOM 0 HD2 TYR A 83 1.176 4.035 -9.904 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -0.743 5.324 -14.246 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.276 2.314 -11.408 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.685 1.869 -13.344 1.00 0.00 H new ATOM 1218 N LEU A 84 1.111 7.445 -7.101 1.00 0.00 N ATOM 1219 CA LEU A 84 1.757 8.067 -5.951 1.00 0.00 C ATOM 1220 C LEU A 84 3.267 8.144 -6.153 1.00 0.00 C ATOM 1221 O LEU A 84 3.945 7.120 -6.230 1.00 0.00 O ATOM 1222 CB LEU A 84 1.440 7.284 -4.676 1.00 0.00 C ATOM 1223 CG LEU A 84 -0.034 7.284 -4.265 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.322 6.142 -3.301 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.410 8.622 -3.643 1.00 0.00 C ATOM 0 H LEU A 84 0.827 6.477 -6.953 1.00 0.00 H new ATOM 0 HA LEU A 84 1.369 9.081 -5.851 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.763 6.252 -4.812 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.029 7.698 -3.858 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.642 7.136 -5.157 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.375 6.159 -3.021 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.090 5.192 -3.783 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.293 6.256 -2.408 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.461 8.607 -3.356 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.205 8.799 -2.761 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.243 9.420 -4.367 1.00 0.00 H new ATOM 1237 N GLY A 85 3.787 9.365 -6.236 1.00 0.00 N ATOM 1238 CA GLY A 85 5.213 9.551 -6.428 1.00 0.00 C ATOM 1239 C GLY A 85 5.798 10.579 -5.480 1.00 0.00 C ATOM 1240 O GLY A 85 5.373 11.734 -5.466 1.00 0.00 O ATOM 0 H GLY A 85 3.246 10.228 -6.174 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.723 8.598 -6.285 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.400 9.862 -7.456 1.00 0.00 H new ATOM 1244 N ILE A 86 6.777 10.159 -4.686 1.00 0.00 N ATOM 1245 CA ILE A 86 7.424 11.050 -3.731 1.00 0.00 C ATOM 1246 C ILE A 86 8.285 12.088 -4.443 1.00 0.00 C ATOM 1247 O ILE A 86 9.205 11.743 -5.183 1.00 0.00 O ATOM 1248 CB ILE A 86 8.301 10.268 -2.735 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.370 9.468 -3.482 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.441 9.347 -1.882 1.00 0.00 C ATOM 1251 CD1 ILE A 86 10.717 10.157 -3.530 1.00 0.00 C ATOM 0 H ILE A 86 7.140 9.206 -4.685 1.00 0.00 H new ATOM 0 HA ILE A 86 6.629 11.555 -3.183 1.00 0.00 H new ATOM 0 HB ILE A 86 8.800 10.979 -2.077 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.485 8.495 -3.003 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.029 9.284 -4.501 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.075 8.801 -1.183 1.00 0.00 H new ATOM 0 HG22 ILE A 86 6.714 9.939 -1.326 1.00 0.00 H new ATOM 0 HG23 ILE A 86 6.917 8.640 -2.525 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.426 9.533 -4.074 1.00 0.00 H new ATOM 0 HD12 ILE A 86 10.617 11.118 -4.035 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.080 10.317 -2.515 1.00 0.00 H new ATOM 1263 N ASN A 87 7.980 13.361 -4.213 1.00 0.00 N ATOM 1264 CA ASN A 87 8.725 14.449 -4.832 1.00 0.00 C ATOM 1265 C ASN A 87 10.195 14.405 -4.424 1.00 0.00 C ATOM 1266 O ASN A 87 10.594 13.590 -3.592 1.00 0.00 O ATOM 1267 CB ASN A 87 8.115 15.798 -4.447 1.00 0.00 C ATOM 1268 CG ASN A 87 7.863 16.685 -5.651 1.00 0.00 C ATOM 1269 OD1 ASN A 87 8.380 16.434 -6.740 1.00 0.00 O ATOM 1270 ND2 ASN A 87 7.067 17.730 -5.461 1.00 0.00 N ATOM 0 H ASN A 87 7.221 13.664 -3.602 1.00 0.00 H new ATOM 0 HA ASN A 87 8.664 14.327 -5.913 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.176 15.631 -3.919 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.783 16.311 -3.755 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.863 18.363 -6.235 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.660 17.900 -4.541 1.00 0.00 H new ATOM 1277 N SER A 88 10.996 15.286 -5.014 1.00 0.00 N ATOM 1278 CA SER A 88 12.421 15.347 -4.710 1.00 0.00 C ATOM 1279 C SER A 88 12.658 15.969 -3.339 1.00 0.00 C ATOM 1280 O SER A 88 13.523 15.523 -2.584 1.00 0.00 O ATOM 1281 CB SER A 88 13.159 16.151 -5.784 1.00 0.00 C ATOM 1282 OG SER A 88 14.399 15.548 -6.110 1.00 0.00 O ATOM 0 H SER A 88 10.683 15.967 -5.705 1.00 0.00 H new ATOM 0 HA SER A 88 12.809 14.328 -4.698 1.00 0.00 H new ATOM 0 HB2 SER A 88 12.540 16.223 -6.678 1.00 0.00 H new ATOM 0 HB3 SER A 88 13.328 17.168 -5.430 1.00 0.00 H new ATOM 0 HG SER A 88 14.850 16.079 -6.799 1.00 0.00 H new ATOM 1288 N ASP A 89 11.885 17.003 -3.021 1.00 0.00 N ATOM 1289 CA ASP A 89 12.011 17.686 -1.740 1.00 0.00 C ATOM 1290 C ASP A 89 11.766 16.722 -0.582 1.00 0.00 C ATOM 1291 O ASP A 89 12.314 16.893 0.508 1.00 0.00 O ATOM 1292 CB ASP A 89 11.027 18.856 -1.663 1.00 0.00 C ATOM 1293 CG ASP A 89 11.662 20.171 -2.069 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.596 20.620 -1.373 1.00 0.00 O ATOM 1295 OD2 ASP A 89 11.224 20.753 -3.083 1.00 0.00 O ATOM 0 H ASP A 89 11.165 17.386 -3.634 1.00 0.00 H new ATOM 0 HA ASP A 89 13.028 18.070 -1.660 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.173 18.653 -2.310 1.00 0.00 H new ATOM 0 HB3 ASP A 89 10.644 18.939 -0.646 1.00 0.00 H new ATOM 1300 N GLY A 90 10.940 15.710 -0.825 1.00 0.00 N ATOM 1301 CA GLY A 90 10.637 14.735 0.205 1.00 0.00 C ATOM 1302 C GLY A 90 9.176 14.752 0.610 1.00 0.00 C ATOM 1303 O GLY A 90 8.839 14.462 1.758 1.00 0.00 O ATOM 0 H GLY A 90 10.475 15.548 -1.718 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.900 13.740 -0.153 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.256 14.932 1.081 1.00 0.00 H new ATOM 1307 N LEU A 91 8.306 15.093 -0.336 1.00 0.00 N ATOM 1308 CA LEU A 91 6.872 15.146 -0.073 1.00 0.00 C ATOM 1309 C LEU A 91 6.124 14.124 -0.923 1.00 0.00 C ATOM 1310 O LEU A 91 6.311 14.057 -2.138 1.00 0.00 O ATOM 1311 CB LEU A 91 6.334 16.551 -0.352 1.00 0.00 C ATOM 1312 CG LEU A 91 5.228 17.022 0.593 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.781 17.249 1.991 1.00 0.00 C ATOM 1314 CD2 LEU A 91 4.579 18.291 0.062 1.00 0.00 C ATOM 0 H LEU A 91 8.569 15.337 -1.291 1.00 0.00 H new ATOM 0 HA LEU A 91 6.711 14.904 0.978 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.162 17.258 -0.298 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.955 16.582 -1.374 1.00 0.00 H new ATOM 0 HG LEU A 91 4.467 16.243 0.648 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.979 17.584 2.649 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.199 16.317 2.373 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.562 18.009 1.955 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.794 18.612 0.747 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.330 19.076 -0.023 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.147 18.095 -0.919 1.00 0.00 H new ATOM 1326 N VAL A 92 5.277 13.330 -0.276 1.00 0.00 N ATOM 1327 CA VAL A 92 4.501 12.312 -0.973 1.00 0.00 C ATOM 1328 C VAL A 92 3.343 12.936 -1.745 1.00 0.00 C ATOM 1329 O VAL A 92 2.432 13.518 -1.155 1.00 0.00 O ATOM 1330 CB VAL A 92 3.943 11.262 0.005 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.295 10.113 -0.752 1.00 0.00 C ATOM 1332 CG2 VAL A 92 5.044 10.751 0.923 1.00 0.00 C ATOM 0 H VAL A 92 5.111 13.372 0.730 1.00 0.00 H new ATOM 0 HA VAL A 92 5.179 11.822 -1.672 1.00 0.00 H new ATOM 0 HB VAL A 92 3.178 11.737 0.619 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.907 9.382 -0.042 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.477 10.495 -1.363 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.036 9.637 -1.395 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.632 10.010 1.608 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.833 10.294 0.326 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.457 11.583 1.494 1.00 0.00 H new ATOM 1342 N VAL A 93 3.385 12.812 -3.068 1.00 0.00 N ATOM 1343 CA VAL A 93 2.338 13.365 -3.920 1.00 0.00 C ATOM 1344 C VAL A 93 1.925 12.370 -4.999 1.00 0.00 C ATOM 1345 O VAL A 93 2.457 11.262 -5.072 1.00 0.00 O ATOM 1346 CB VAL A 93 2.795 14.674 -4.592 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.012 15.761 -3.552 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.059 14.443 -5.406 1.00 0.00 C ATOM 0 H VAL A 93 4.132 12.334 -3.573 1.00 0.00 H new ATOM 0 HA VAL A 93 1.483 13.574 -3.277 1.00 0.00 H new ATOM 0 HB VAL A 93 2.010 15.006 -5.271 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.334 16.678 -4.046 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.080 15.945 -3.018 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.778 15.441 -2.845 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.367 15.378 -5.873 1.00 0.00 H new ATOM 0 HG22 VAL A 93 4.854 14.086 -4.751 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.864 13.699 -6.178 1.00 0.00 H new ATOM 1358 N GLY A 94 0.974 12.773 -5.836 1.00 0.00 N ATOM 1359 CA GLY A 94 0.506 11.906 -6.900 1.00 0.00 C ATOM 1360 C GLY A 94 -0.180 12.671 -8.014 1.00 0.00 C ATOM 1361 O GLY A 94 -1.355 13.022 -7.903 1.00 0.00 O ATOM 0 H GLY A 94 0.519 13.685 -5.796 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.350 11.352 -7.311 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.187 11.172 -6.488 1.00 0.00 H new ATOM 1365 N ARG A 95 0.555 12.930 -9.092 1.00 0.00 N ATOM 1366 CA ARG A 95 0.010 13.659 -10.231 1.00 0.00 C ATOM 1367 C ARG A 95 0.675 13.213 -11.530 1.00 0.00 C ATOM 1368 O ARG A 95 1.119 14.038 -12.329 1.00 0.00 O ATOM 1369 CB ARG A 95 0.198 15.165 -10.036 1.00 0.00 C ATOM 1370 CG ARG A 95 1.643 15.572 -9.791 1.00 0.00 C ATOM 1371 CD ARG A 95 1.746 17.023 -9.352 1.00 0.00 C ATOM 1372 NE ARG A 95 2.078 17.910 -10.464 1.00 0.00 N ATOM 1373 CZ ARG A 95 3.303 18.036 -10.972 1.00 0.00 C ATOM 1374 NH1 ARG A 95 4.313 17.337 -10.469 1.00 0.00 N ATOM 1375 NH2 ARG A 95 3.518 18.865 -11.984 1.00 0.00 N ATOM 0 H ARG A 95 1.529 12.646 -9.200 1.00 0.00 H new ATOM 0 HA ARG A 95 -1.056 13.440 -10.297 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -0.173 15.686 -10.919 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -0.411 15.493 -9.193 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.079 14.928 -9.027 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.223 15.424 -10.702 1.00 0.00 H new ATOM 0 HD2 ARG A 95 0.800 17.336 -8.909 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.507 17.114 -8.577 1.00 0.00 H new ATOM 0 HE ARG A 95 1.328 18.465 -10.876 1.00 0.00 H new ATOM 0 HH11 ARG A 95 4.153 16.699 -9.689 1.00 0.00 H new ATOM 0 HH12 ARG A 95 5.249 17.438 -10.862 1.00 0.00 H new ATOM 0 HH21 ARG A 95 2.746 19.406 -12.373 1.00 0.00 H new ATOM 0 HH22 ARG A 95 4.456 18.962 -12.373 1.00 0.00 H new ATOM 1389 N SER A 96 0.741 11.902 -11.734 1.00 0.00 N ATOM 1390 CA SER A 96 1.351 11.344 -12.937 1.00 0.00 C ATOM 1391 C SER A 96 0.630 10.075 -13.376 1.00 0.00 C ATOM 1392 O SER A 96 0.181 9.285 -12.545 1.00 0.00 O ATOM 1393 CB SER A 96 2.831 11.046 -12.691 1.00 0.00 C ATOM 1394 OG SER A 96 3.627 12.200 -12.903 1.00 0.00 O ATOM 0 H SER A 96 0.380 11.205 -11.082 1.00 0.00 H new ATOM 0 HA SER A 96 1.263 12.082 -13.734 1.00 0.00 H new ATOM 0 HB2 SER A 96 2.968 10.688 -11.671 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.159 10.247 -13.356 1.00 0.00 H new ATOM 0 HG SER A 96 3.070 13.002 -12.817 1.00 0.00 H new ATOM 1400 N ASP A 97 0.523 9.885 -14.687 1.00 0.00 N ATOM 1401 CA ASP A 97 -0.144 8.711 -15.237 1.00 0.00 C ATOM 1402 C ASP A 97 0.874 7.666 -15.684 1.00 0.00 C ATOM 1403 O ASP A 97 0.636 6.920 -16.634 1.00 0.00 O ATOM 1404 CB ASP A 97 -1.036 9.109 -16.416 1.00 0.00 C ATOM 1405 CG ASP A 97 -2.455 9.423 -15.987 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -2.989 8.694 -15.123 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -3.034 10.396 -16.513 1.00 0.00 O ATOM 0 H ASP A 97 0.890 10.529 -15.388 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.764 8.276 -14.453 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.609 9.980 -16.914 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.051 8.300 -17.146 1.00 0.00 H new ATOM 1412 N ALA A 98 2.008 7.619 -14.993 1.00 0.00 N ATOM 1413 CA ALA A 98 3.061 6.665 -15.319 1.00 0.00 C ATOM 1414 C ALA A 98 3.765 6.174 -14.059 1.00 0.00 C ATOM 1415 O ALA A 98 3.682 6.802 -13.004 1.00 0.00 O ATOM 1416 CB ALA A 98 4.064 7.294 -16.276 1.00 0.00 C ATOM 0 H ALA A 98 2.221 8.230 -14.204 1.00 0.00 H new ATOM 0 HA ALA A 98 2.601 5.805 -15.805 1.00 0.00 H new ATOM 0 HB1 ALA A 98 4.845 6.571 -16.511 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.555 7.590 -17.193 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.511 8.172 -15.809 1.00 0.00 H new ATOM 1422 N ILE A 99 4.460 5.047 -14.177 1.00 0.00 N ATOM 1423 CA ILE A 99 5.179 4.471 -13.047 1.00 0.00 C ATOM 1424 C ILE A 99 6.639 4.907 -13.044 1.00 0.00 C ATOM 1425 O ILE A 99 7.474 4.321 -13.732 1.00 0.00 O ATOM 1426 CB ILE A 99 5.116 2.931 -13.066 1.00 0.00 C ATOM 1427 CG1 ILE A 99 3.676 2.459 -13.272 1.00 0.00 C ATOM 1428 CG2 ILE A 99 5.686 2.362 -11.776 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.569 1.009 -13.688 1.00 0.00 C ATOM 0 H ILE A 99 4.540 4.515 -15.044 1.00 0.00 H new ATOM 0 HA ILE A 99 4.691 4.837 -12.143 1.00 0.00 H new ATOM 0 HB ILE A 99 5.719 2.568 -13.898 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.118 2.605 -12.347 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.203 3.082 -14.031 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.635 1.274 -11.804 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.725 2.674 -11.669 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.107 2.731 -10.929 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.520 0.744 -13.816 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.098 0.861 -14.629 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.012 0.376 -12.919 1.00 0.00 H new ATOM 1441 N GLY A 100 6.941 5.940 -12.264 1.00 0.00 N ATOM 1442 CA GLY A 100 8.302 6.437 -12.187 1.00 0.00 C ATOM 1443 C GLY A 100 9.080 5.821 -11.038 1.00 0.00 C ATOM 1444 O GLY A 100 8.488 5.246 -10.124 1.00 0.00 O ATOM 0 H GLY A 100 6.268 6.441 -11.684 1.00 0.00 H new ATOM 0 HA2 GLY A 100 8.816 6.226 -13.125 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.284 7.521 -12.070 1.00 0.00 H new ATOM 1448 N PRO A 101 10.419 5.928 -11.055 1.00 0.00 N ATOM 1449 CA PRO A 101 11.270 5.371 -9.997 1.00 0.00 C ATOM 1450 C PRO A 101 10.837 5.827 -8.607 1.00 0.00 C ATOM 1451 O PRO A 101 10.828 5.041 -7.660 1.00 0.00 O ATOM 1452 CB PRO A 101 12.659 5.918 -10.331 1.00 0.00 C ATOM 1453 CG PRO A 101 12.621 6.183 -11.795 1.00 0.00 C ATOM 1454 CD PRO A 101 11.209 6.599 -12.105 1.00 0.00 C ATOM 0 HA PRO A 101 11.223 4.282 -9.967 1.00 0.00 H new ATOM 0 HB2 PRO A 101 12.871 6.828 -9.770 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.438 5.199 -10.079 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.327 6.967 -12.068 1.00 0.00 H new ATOM 0 HG3 PRO A 101 12.898 5.293 -12.360 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.091 7.682 -12.067 1.00 0.00 H new ATOM 0 HD3 PRO A 101 10.906 6.280 -13.102 1.00 0.00 H new ATOM 1462 N ARG A 102 10.479 7.102 -8.494 1.00 0.00 N ATOM 1463 CA ARG A 102 10.044 7.662 -7.221 1.00 0.00 C ATOM 1464 C ARG A 102 8.710 7.062 -6.787 1.00 0.00 C ATOM 1465 O ARG A 102 8.426 6.949 -5.594 1.00 0.00 O ATOM 1466 CB ARG A 102 9.920 9.184 -7.325 1.00 0.00 C ATOM 1467 CG ARG A 102 11.258 9.896 -7.451 1.00 0.00 C ATOM 1468 CD ARG A 102 11.081 11.346 -7.870 1.00 0.00 C ATOM 1469 NE ARG A 102 12.215 11.834 -8.651 1.00 0.00 N ATOM 1470 CZ ARG A 102 13.429 12.041 -8.145 1.00 0.00 C ATOM 1471 NH1 ARG A 102 13.671 11.805 -6.861 1.00 0.00 N ATOM 1472 NH2 ARG A 102 14.405 12.485 -8.924 1.00 0.00 N ATOM 0 H ARG A 102 10.482 7.766 -9.268 1.00 0.00 H new ATOM 0 HA ARG A 102 10.794 7.414 -6.470 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.303 9.432 -8.189 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.400 9.559 -6.444 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.785 9.854 -6.498 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.879 9.378 -8.182 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.168 11.445 -8.457 1.00 0.00 H new ATOM 0 HD3 ARG A 102 10.958 11.967 -6.983 1.00 0.00 H new ATOM 0 HE ARG A 102 12.068 12.027 -9.642 1.00 0.00 H new ATOM 0 HH11 ARG A 102 12.925 11.463 -6.256 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.603 11.966 -6.480 1.00 0.00 H new ATOM 0 HH21 ARG A 102 14.226 12.668 -9.911 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.335 12.644 -8.536 1.00 0.00 H new ATOM 1486 N GLU A 103 7.894 6.678 -7.764 1.00 0.00 N ATOM 1487 CA GLU A 103 6.590 6.090 -7.483 1.00 0.00 C ATOM 1488 C GLU A 103 6.734 4.690 -6.893 1.00 0.00 C ATOM 1489 O GLU A 103 5.875 4.230 -6.143 1.00 0.00 O ATOM 1490 CB GLU A 103 5.747 6.033 -8.759 1.00 0.00 C ATOM 1491 CG GLU A 103 5.212 7.388 -9.195 1.00 0.00 C ATOM 1492 CD GLU A 103 6.276 8.256 -9.836 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.141 8.776 -9.100 1.00 0.00 O ATOM 1494 OE2 GLU A 103 6.245 8.416 -11.075 1.00 0.00 O ATOM 0 H GLU A 103 8.113 6.764 -8.756 1.00 0.00 H new ATOM 0 HA GLU A 103 6.088 6.722 -6.750 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.350 5.613 -9.564 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.909 5.354 -8.601 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.394 7.242 -9.901 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.798 7.906 -8.330 1.00 0.00 H new ATOM 1501 N GLN A 104 7.828 4.017 -7.238 1.00 0.00 N ATOM 1502 CA GLN A 104 8.084 2.669 -6.741 1.00 0.00 C ATOM 1503 C GLN A 104 8.133 2.649 -5.216 1.00 0.00 C ATOM 1504 O GLN A 104 8.750 3.513 -4.594 1.00 0.00 O ATOM 1505 CB GLN A 104 9.398 2.133 -7.312 1.00 0.00 C ATOM 1506 CG GLN A 104 9.447 2.133 -8.832 1.00 0.00 C ATOM 1507 CD GLN A 104 10.850 1.928 -9.369 1.00 0.00 C ATOM 1508 OE1 GLN A 104 11.834 2.272 -8.716 1.00 0.00 O ATOM 1509 NE2 GLN A 104 10.947 1.365 -10.568 1.00 0.00 N ATOM 0 H GLN A 104 8.550 4.382 -7.859 1.00 0.00 H new ATOM 0 HA GLN A 104 7.265 2.028 -7.068 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.223 2.735 -6.930 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.553 1.116 -6.952 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.797 1.345 -9.213 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.054 3.079 -9.205 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.104 1.095 -11.074 1.00 0.00 H new ATOM 0 HE22 GLN A 104 11.865 1.202 -10.982 1.00 0.00 H new ATOM 1518 N TRP A 105 7.481 1.655 -4.622 1.00 0.00 N ATOM 1519 CA TRP A 105 7.452 1.519 -3.170 1.00 0.00 C ATOM 1520 C TRP A 105 8.041 0.180 -2.738 1.00 0.00 C ATOM 1521 O TRP A 105 7.762 -0.856 -3.341 1.00 0.00 O ATOM 1522 CB TRP A 105 6.017 1.648 -2.652 1.00 0.00 C ATOM 1523 CG TRP A 105 5.369 2.948 -3.016 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.486 3.168 -4.034 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.552 4.211 -2.364 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.109 4.489 -4.056 1.00 0.00 N ATOM 1527 CE2 TRP A 105 4.750 5.150 -3.040 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.316 4.638 -1.274 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.691 6.488 -2.662 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.256 5.968 -0.899 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.449 6.878 -1.592 1.00 0.00 C ATOM 0 H TRP A 105 6.966 0.932 -5.124 1.00 0.00 H new ATOM 0 HA TRP A 105 8.058 2.318 -2.743 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.419 0.828 -3.051 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.019 1.543 -1.567 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.135 2.413 -4.722 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.459 4.909 -4.720 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.942 3.942 -0.735 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.069 7.193 -3.194 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.841 6.310 -0.058 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.424 7.910 -1.275 1.00 0.00 H new ATOM 1542 N GLU A 106 8.860 0.209 -1.691 1.00 0.00 N ATOM 1543 CA GLU A 106 9.490 -1.002 -1.180 1.00 0.00 C ATOM 1544 C GLU A 106 8.912 -1.389 0.180 1.00 0.00 C ATOM 1545 O GLU A 106 9.377 -0.916 1.216 1.00 0.00 O ATOM 1546 CB GLU A 106 11.002 -0.803 -1.064 1.00 0.00 C ATOM 1547 CG GLU A 106 11.789 -2.104 -1.068 1.00 0.00 C ATOM 1548 CD GLU A 106 13.077 -2.006 -0.274 1.00 0.00 C ATOM 1549 OE1 GLU A 106 14.054 -1.429 -0.796 1.00 0.00 O ATOM 1550 OE2 GLU A 106 13.109 -2.508 0.869 1.00 0.00 O ATOM 0 H GLU A 106 9.102 1.058 -1.180 1.00 0.00 H new ATOM 0 HA GLU A 106 9.287 -1.810 -1.883 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.343 -0.180 -1.891 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.219 -0.260 -0.144 1.00 0.00 H new ATOM 0 HG2 GLU A 106 11.170 -2.900 -0.654 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.020 -2.382 -2.096 1.00 0.00 H new ATOM 1557 N PRO A 107 7.887 -2.260 0.194 1.00 0.00 N ATOM 1558 CA PRO A 107 7.251 -2.707 1.438 1.00 0.00 C ATOM 1559 C PRO A 107 8.162 -3.614 2.257 1.00 0.00 C ATOM 1560 O PRO A 107 9.166 -4.120 1.755 1.00 0.00 O ATOM 1561 CB PRO A 107 6.023 -3.480 0.953 1.00 0.00 C ATOM 1562 CG PRO A 107 6.384 -3.945 -0.415 1.00 0.00 C ATOM 1563 CD PRO A 107 7.269 -2.876 -0.995 1.00 0.00 C ATOM 0 HA PRO A 107 7.011 -1.872 2.097 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.799 -4.320 1.610 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.137 -2.845 0.934 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.902 -4.903 -0.377 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.493 -4.088 -1.026 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.019 -3.296 -1.666 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.696 -2.150 -1.572 1.00 0.00 H new ATOM 1571 N VAL A 108 7.806 -3.818 3.521 1.00 0.00 N ATOM 1572 CA VAL A 108 8.593 -4.666 4.408 1.00 0.00 C ATOM 1573 C VAL A 108 7.713 -5.331 5.460 1.00 0.00 C ATOM 1574 O VAL A 108 6.675 -4.795 5.846 1.00 0.00 O ATOM 1575 CB VAL A 108 9.700 -3.862 5.117 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.633 -4.792 5.877 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.475 -3.021 4.114 1.00 0.00 C ATOM 0 H VAL A 108 6.978 -3.408 3.954 1.00 0.00 H new ATOM 0 HA VAL A 108 9.052 -5.434 3.785 1.00 0.00 H new ATOM 0 HB VAL A 108 9.231 -3.189 5.835 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.408 -4.206 6.371 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.065 -5.346 6.625 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.096 -5.492 5.181 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.252 -2.460 4.633 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.933 -3.673 3.370 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.796 -2.327 3.619 1.00 0.00 H new ATOM 1587 N PHE A 109 8.137 -6.504 5.922 1.00 0.00 N ATOM 1588 CA PHE A 109 7.389 -7.243 6.932 1.00 0.00 C ATOM 1589 C PHE A 109 8.299 -7.668 8.077 1.00 0.00 C ATOM 1590 O PHE A 109 9.263 -8.407 7.876 1.00 0.00 O ATOM 1591 CB PHE A 109 6.728 -8.473 6.306 1.00 0.00 C ATOM 1592 CG PHE A 109 5.568 -8.142 5.410 1.00 0.00 C ATOM 1593 CD1 PHE A 109 4.353 -7.748 5.947 1.00 0.00 C ATOM 1594 CD2 PHE A 109 5.694 -8.224 4.033 1.00 0.00 C ATOM 1595 CE1 PHE A 109 3.284 -7.442 5.125 1.00 0.00 C ATOM 1596 CE2 PHE A 109 4.629 -7.919 3.207 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.423 -7.527 3.753 1.00 0.00 C ATOM 0 H PHE A 109 8.994 -6.962 5.613 1.00 0.00 H new ATOM 0 HA PHE A 109 6.616 -6.587 7.331 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.474 -9.024 5.733 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.385 -9.135 7.101 1.00 0.00 H new ATOM 0 HD1 PHE A 109 4.240 -7.679 7.019 1.00 0.00 H new ATOM 0 HD2 PHE A 109 6.635 -8.530 3.600 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.341 -7.137 5.555 1.00 0.00 H new ATOM 0 HE2 PHE A 109 4.740 -7.987 2.135 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.590 -7.287 3.109 1.00 0.00 H new ATOM 1607 N GLN A 110 7.990 -7.195 9.280 1.00 0.00 N ATOM 1608 CA GLN A 110 8.783 -7.525 10.459 1.00 0.00 C ATOM 1609 C GLN A 110 7.884 -7.814 11.656 1.00 0.00 C ATOM 1610 O GLN A 110 7.166 -6.936 12.133 1.00 0.00 O ATOM 1611 CB GLN A 110 9.740 -6.379 10.792 1.00 0.00 C ATOM 1612 CG GLN A 110 10.949 -6.813 11.603 1.00 0.00 C ATOM 1613 CD GLN A 110 11.954 -5.693 11.797 1.00 0.00 C ATOM 1614 OE1 GLN A 110 11.679 -4.536 11.478 1.00 0.00 O ATOM 1615 NE2 GLN A 110 13.125 -6.033 12.321 1.00 0.00 N ATOM 0 H GLN A 110 7.196 -6.582 9.464 1.00 0.00 H new ATOM 0 HA GLN A 110 9.362 -8.421 10.237 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.081 -5.920 9.864 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.197 -5.613 11.346 1.00 0.00 H new ATOM 0 HG2 GLN A 110 10.618 -7.172 12.578 1.00 0.00 H new ATOM 0 HG3 GLN A 110 11.436 -7.650 11.103 1.00 0.00 H new ATOM 0 HE21 GLN A 110 13.309 -7.005 12.570 1.00 0.00 H new ATOM 0 HE22 GLN A 110 13.841 -5.323 12.474 1.00 0.00 H new ATOM 1624 N ASP A 111 7.929 -9.052 12.139 1.00 0.00 N ATOM 1625 CA ASP A 111 7.120 -9.459 13.281 1.00 0.00 C ATOM 1626 C ASP A 111 5.634 -9.270 12.992 1.00 0.00 C ATOM 1627 O ASP A 111 4.841 -9.021 13.900 1.00 0.00 O ATOM 1628 CB ASP A 111 7.514 -8.657 14.523 1.00 0.00 C ATOM 1629 CG ASP A 111 8.827 -9.126 15.120 1.00 0.00 C ATOM 1630 OD1 ASP A 111 8.808 -10.083 15.922 1.00 0.00 O ATOM 1631 OD2 ASP A 111 9.876 -8.535 14.786 1.00 0.00 O ATOM 0 H ASP A 111 8.518 -9.791 11.756 1.00 0.00 H new ATOM 0 HA ASP A 111 7.304 -10.517 13.465 1.00 0.00 H new ATOM 0 HB2 ASP A 111 7.593 -7.602 14.261 1.00 0.00 H new ATOM 0 HB3 ASP A 111 6.726 -8.741 15.272 1.00 0.00 H new ATOM 1636 N GLY A 112 5.263 -9.390 11.721 1.00 0.00 N ATOM 1637 CA GLY A 112 3.874 -9.230 11.336 1.00 0.00 C ATOM 1638 C GLY A 112 3.563 -7.827 10.850 1.00 0.00 C ATOM 1639 O GLY A 112 2.758 -7.643 9.937 1.00 0.00 O ATOM 0 H GLY A 112 5.900 -9.595 10.951 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.634 -9.945 10.549 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.235 -9.466 12.187 1.00 0.00 H new ATOM 1643 N LYS A 113 4.204 -6.835 11.460 1.00 0.00 N ATOM 1644 CA LYS A 113 3.993 -5.442 11.084 1.00 0.00 C ATOM 1645 C LYS A 113 4.576 -5.156 9.704 1.00 0.00 C ATOM 1646 O LYS A 113 5.136 -6.044 9.061 1.00 0.00 O ATOM 1647 CB LYS A 113 4.625 -4.510 12.121 1.00 0.00 C ATOM 1648 CG LYS A 113 3.798 -4.358 13.386 1.00 0.00 C ATOM 1649 CD LYS A 113 4.654 -3.920 14.563 1.00 0.00 C ATOM 1650 CE LYS A 113 4.008 -4.285 15.889 1.00 0.00 C ATOM 1651 NZ LYS A 113 3.685 -5.735 15.971 1.00 0.00 N ATOM 0 H LYS A 113 4.874 -6.970 12.217 1.00 0.00 H new ATOM 0 HA LYS A 113 2.919 -5.260 11.049 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.612 -4.890 12.385 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.772 -3.527 11.673 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.007 -3.627 13.219 1.00 0.00 H new ATOM 0 HG3 LYS A 113 3.313 -5.305 13.621 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.636 -4.389 14.494 1.00 0.00 H new ATOM 0 HD3 LYS A 113 4.811 -2.842 14.518 1.00 0.00 H new ATOM 0 HE2 LYS A 113 4.679 -4.016 16.705 1.00 0.00 H new ATOM 0 HE3 LYS A 113 3.096 -3.702 16.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 3.688 -6.035 16.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 2.745 -5.905 15.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 4.397 -6.280 15.443 1.00 0.00 H new ATOM 1665 N MET A 114 4.442 -3.913 9.256 1.00 0.00 N ATOM 1666 CA MET A 114 4.956 -3.510 7.952 1.00 0.00 C ATOM 1667 C MET A 114 5.036 -1.991 7.844 1.00 0.00 C ATOM 1668 O MET A 114 4.332 -1.270 8.551 1.00 0.00 O ATOM 1669 CB MET A 114 4.070 -4.067 6.837 1.00 0.00 C ATOM 1670 CG MET A 114 2.622 -3.611 6.925 1.00 0.00 C ATOM 1671 SD MET A 114 1.516 -4.612 5.912 1.00 0.00 S ATOM 1672 CE MET A 114 0.505 -5.382 7.175 1.00 0.00 C ATOM 0 H MET A 114 3.982 -3.166 9.777 1.00 0.00 H new ATOM 0 HA MET A 114 5.962 -3.917 7.844 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.480 -3.764 5.873 1.00 0.00 H new ATOM 0 HB3 MET A 114 4.102 -5.156 6.869 1.00 0.00 H new ATOM 0 HG2 MET A 114 2.294 -3.653 7.964 1.00 0.00 H new ATOM 0 HG3 MET A 114 2.553 -2.570 6.611 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.440 -5.705 6.738 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.029 -6.246 7.584 1.00 0.00 H new ATOM 0 HE3 MET A 114 0.310 -4.665 7.972 1.00 0.00 H new ATOM 1682 N ALA A 115 5.897 -1.511 6.952 1.00 0.00 N ATOM 1683 CA ALA A 115 6.068 -0.077 6.751 1.00 0.00 C ATOM 1684 C ALA A 115 6.505 0.228 5.322 1.00 0.00 C ATOM 1685 O ALA A 115 7.549 -0.240 4.869 1.00 0.00 O ATOM 1686 CB ALA A 115 7.079 0.478 7.743 1.00 0.00 C ATOM 0 H ALA A 115 6.486 -2.094 6.358 1.00 0.00 H new ATOM 0 HA ALA A 115 5.106 0.406 6.921 1.00 0.00 H new ATOM 0 HB1 ALA A 115 7.197 1.550 7.581 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.727 0.301 8.759 1.00 0.00 H new ATOM 0 HB3 ALA A 115 8.039 -0.018 7.600 1.00 0.00 H new ATOM 1692 N LEU A 116 5.698 1.014 4.617 1.00 0.00 N ATOM 1693 CA LEU A 116 6.001 1.382 3.239 1.00 0.00 C ATOM 1694 C LEU A 116 7.210 2.310 3.176 1.00 0.00 C ATOM 1695 O LEU A 116 7.219 3.377 3.790 1.00 0.00 O ATOM 1696 CB LEU A 116 4.791 2.057 2.590 1.00 0.00 C ATOM 1697 CG LEU A 116 4.593 1.742 1.107 1.00 0.00 C ATOM 1698 CD1 LEU A 116 3.689 0.531 0.935 1.00 0.00 C ATOM 1699 CD2 LEU A 116 4.015 2.947 0.378 1.00 0.00 C ATOM 0 H LEU A 116 4.829 1.408 4.977 1.00 0.00 H new ATOM 0 HA LEU A 116 6.237 0.470 2.690 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.894 1.759 3.132 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.890 3.136 2.707 1.00 0.00 H new ATOM 0 HG LEU A 116 5.565 1.510 0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.559 0.322 -0.127 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.141 -0.333 1.423 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.718 0.735 1.386 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.881 2.705 -0.676 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.052 3.209 0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.698 3.791 0.472 1.00 0.00 H new ATOM 1711 N LEU A 117 8.229 1.896 2.429 1.00 0.00 N ATOM 1712 CA LEU A 117 9.443 2.691 2.286 1.00 0.00 C ATOM 1713 C LEU A 117 9.505 3.345 0.910 1.00 0.00 C ATOM 1714 O LEU A 117 9.449 2.666 -0.114 1.00 0.00 O ATOM 1715 CB LEU A 117 10.679 1.815 2.503 1.00 0.00 C ATOM 1716 CG LEU A 117 12.016 2.557 2.447 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.504 2.883 3.850 1.00 0.00 C ATOM 1718 CD2 LEU A 117 13.053 1.733 1.698 1.00 0.00 C ATOM 0 H LEU A 117 8.238 1.016 1.914 1.00 0.00 H new ATOM 0 HA LEU A 117 9.425 3.476 3.042 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.593 1.325 3.473 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.685 1.029 1.748 1.00 0.00 H new ATOM 0 HG LEU A 117 11.868 3.493 1.909 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.456 3.411 3.791 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.771 3.513 4.353 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.636 1.959 4.413 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.997 2.277 1.668 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.198 0.781 2.208 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.707 1.551 0.681 1.00 0.00 H new ATOM 1730 N ALA A 118 9.621 4.670 0.895 1.00 0.00 N ATOM 1731 CA ALA A 118 9.690 5.416 -0.355 1.00 0.00 C ATOM 1732 C ALA A 118 10.925 5.024 -1.159 1.00 0.00 C ATOM 1733 O ALA A 118 11.843 4.392 -0.638 1.00 0.00 O ATOM 1734 CB ALA A 118 9.691 6.911 -0.078 1.00 0.00 C ATOM 0 H ALA A 118 9.669 5.248 1.734 1.00 0.00 H new ATOM 0 HA ALA A 118 8.809 5.169 -0.947 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.743 7.456 -1.021 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.777 7.184 0.449 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.554 7.167 0.537 1.00 0.00 H new ATOM 1740 N SER A 119 10.939 5.402 -2.433 1.00 0.00 N ATOM 1741 CA SER A 119 12.062 5.092 -3.312 1.00 0.00 C ATOM 1742 C SER A 119 13.306 5.890 -2.928 1.00 0.00 C ATOM 1743 O SER A 119 14.407 5.595 -3.392 1.00 0.00 O ATOM 1744 CB SER A 119 11.689 5.378 -4.767 1.00 0.00 C ATOM 1745 OG SER A 119 12.793 5.165 -5.629 1.00 0.00 O ATOM 0 H SER A 119 10.185 5.924 -2.880 1.00 0.00 H new ATOM 0 HA SER A 119 12.290 4.032 -3.200 1.00 0.00 H new ATOM 0 HB2 SER A 119 10.861 4.735 -5.066 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.344 6.408 -4.861 1.00 0.00 H new ATOM 0 HG SER A 119 12.474 5.060 -6.550 1.00 0.00 H new ATOM 1751 N ASN A 120 13.129 6.901 -2.080 1.00 0.00 N ATOM 1752 CA ASN A 120 14.243 7.734 -1.644 1.00 0.00 C ATOM 1753 C ASN A 120 14.795 7.259 -0.302 1.00 0.00 C ATOM 1754 O ASN A 120 15.367 8.042 0.456 1.00 0.00 O ATOM 1755 CB ASN A 120 13.804 9.195 -1.537 1.00 0.00 C ATOM 1756 CG ASN A 120 12.595 9.370 -0.638 1.00 0.00 C ATOM 1757 OD1 ASN A 120 12.243 8.474 0.129 1.00 0.00 O ATOM 1758 ND2 ASN A 120 11.953 10.528 -0.728 1.00 0.00 N ATOM 0 H ASN A 120 12.226 7.161 -1.683 1.00 0.00 H new ATOM 0 HA ASN A 120 15.034 7.650 -2.389 1.00 0.00 H new ATOM 0 HB2 ASN A 120 14.630 9.793 -1.151 1.00 0.00 H new ATOM 0 HB3 ASN A 120 13.572 9.576 -2.532 1.00 0.00 H new ATOM 0 HD21 ASN A 120 11.133 10.703 -0.147 1.00 0.00 H new ATOM 0 HD22 ASN A 120 12.280 11.243 -1.378 1.00 0.00 H new ATOM 1765 N SER A 121 14.622 5.971 -0.014 1.00 0.00 N ATOM 1766 CA SER A 121 15.106 5.394 1.236 1.00 0.00 C ATOM 1767 C SER A 121 14.541 6.144 2.441 1.00 0.00 C ATOM 1768 O SER A 121 15.274 6.493 3.367 1.00 0.00 O ATOM 1769 CB SER A 121 16.635 5.419 1.274 1.00 0.00 C ATOM 1770 OG SER A 121 17.183 5.065 0.016 1.00 0.00 O ATOM 0 H SER A 121 14.150 5.308 -0.629 1.00 0.00 H new ATOM 0 HA SER A 121 14.765 4.360 1.285 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.978 6.414 1.557 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.994 4.729 2.038 1.00 0.00 H new ATOM 0 HG SER A 121 18.161 5.090 0.067 1.00 0.00 H new ATOM 1776 N CYS A 122 13.235 6.386 2.422 1.00 0.00 N ATOM 1777 CA CYS A 122 12.574 7.092 3.513 1.00 0.00 C ATOM 1778 C CYS A 122 11.145 6.591 3.700 1.00 0.00 C ATOM 1779 O CYS A 122 10.340 6.616 2.770 1.00 0.00 O ATOM 1780 CB CYS A 122 12.565 8.598 3.242 1.00 0.00 C ATOM 1781 SG CYS A 122 14.211 9.319 3.040 1.00 0.00 S ATOM 0 H CYS A 122 12.614 6.104 1.664 1.00 0.00 H new ATOM 0 HA CYS A 122 13.132 6.896 4.429 1.00 0.00 H new ATOM 0 HB2 CYS A 122 11.982 8.791 2.342 1.00 0.00 H new ATOM 0 HB3 CYS A 122 12.057 9.102 4.065 1.00 0.00 H new ATOM 0 HG CYS A 122 14.779 8.816 1.984 1.00 0.00 H new ATOM 1787 N PHE A 123 10.838 6.134 4.911 1.00 0.00 N ATOM 1788 CA PHE A 123 9.507 5.626 5.220 1.00 0.00 C ATOM 1789 C PHE A 123 8.470 6.741 5.152 1.00 0.00 C ATOM 1790 O PHE A 123 8.786 7.912 5.366 1.00 0.00 O ATOM 1791 CB PHE A 123 9.493 4.985 6.609 1.00 0.00 C ATOM 1792 CG PHE A 123 10.153 3.636 6.654 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.541 2.532 6.080 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.382 3.471 7.269 1.00 0.00 C ATOM 1795 CE1 PHE A 123 10.145 1.290 6.121 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.991 2.231 7.312 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.371 1.139 6.737 1.00 0.00 C ATOM 0 H PHE A 123 11.493 6.106 5.693 1.00 0.00 H new ATOM 0 HA PHE A 123 9.252 4.871 4.476 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.995 5.650 7.312 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.461 4.887 6.945 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.582 2.644 5.596 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.871 4.321 7.721 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.658 0.437 5.671 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.950 2.116 7.795 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.844 0.169 6.769 1.00 0.00 H new ATOM 1807 N ILE A 124 7.229 6.371 4.853 1.00 0.00 N ATOM 1808 CA ILE A 124 6.144 7.339 4.757 1.00 0.00 C ATOM 1809 C ILE A 124 5.614 7.708 6.139 1.00 0.00 C ATOM 1810 O ILE A 124 5.789 6.961 7.101 1.00 0.00 O ATOM 1811 CB ILE A 124 4.983 6.800 3.901 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.471 5.477 4.471 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.427 6.625 2.456 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.173 5.013 3.849 1.00 0.00 C ATOM 0 H ILE A 124 6.950 5.407 4.673 1.00 0.00 H new ATOM 0 HA ILE A 124 6.555 8.228 4.278 1.00 0.00 H new ATOM 0 HB ILE A 124 4.168 7.523 3.925 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.230 4.709 4.323 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.331 5.584 5.547 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.595 6.243 1.864 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.747 7.587 2.055 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.257 5.920 2.413 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.870 4.069 4.301 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.400 5.762 4.019 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.313 4.873 2.777 1.00 0.00 H new ATOM 1826 N ARG A 125 4.964 8.864 6.229 1.00 0.00 N ATOM 1827 CA ARG A 125 4.408 9.331 7.493 1.00 0.00 C ATOM 1828 C ARG A 125 3.584 10.599 7.288 1.00 0.00 C ATOM 1829 O ARG A 125 3.928 11.449 6.467 1.00 0.00 O ATOM 1830 CB ARG A 125 5.528 9.594 8.501 1.00 0.00 C ATOM 1831 CG ARG A 125 5.025 9.939 9.893 1.00 0.00 C ATOM 1832 CD ARG A 125 5.006 8.718 10.799 1.00 0.00 C ATOM 1833 NE ARG A 125 4.139 8.910 11.960 1.00 0.00 N ATOM 1834 CZ ARG A 125 2.811 8.821 11.916 1.00 0.00 C ATOM 1835 NH1 ARG A 125 2.195 8.544 10.773 1.00 0.00 N ATOM 1836 NH2 ARG A 125 2.099 9.010 13.018 1.00 0.00 N ATOM 0 H ARG A 125 4.810 9.494 5.442 1.00 0.00 H new ATOM 0 HA ARG A 125 3.753 8.552 7.884 1.00 0.00 H new ATOM 0 HB2 ARG A 125 6.165 8.712 8.562 1.00 0.00 H new ATOM 0 HB3 ARG A 125 6.150 10.411 8.136 1.00 0.00 H new ATOM 0 HG2 ARG A 125 5.662 10.708 10.331 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.021 10.358 9.824 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.666 7.851 10.232 1.00 0.00 H new ATOM 0 HD3 ARG A 125 6.020 8.501 11.136 1.00 0.00 H new ATOM 0 HE ARG A 125 4.577 9.125 12.856 1.00 0.00 H new ATOM 0 HH11 ARG A 125 2.739 8.398 9.923 1.00 0.00 H new ATOM 0 HH12 ARG A 125 1.178 8.477 10.745 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.568 9.223 13.898 1.00 0.00 H new ATOM 0 HH22 ARG A 125 1.082 8.942 12.986 1.00 0.00 H new ATOM 1850 N CYS A 126 2.495 10.718 8.039 1.00 0.00 N ATOM 1851 CA CYS A 126 1.622 11.882 7.941 1.00 0.00 C ATOM 1852 C CYS A 126 1.839 12.827 9.118 1.00 0.00 C ATOM 1853 O CYS A 126 2.246 12.404 10.199 1.00 0.00 O ATOM 1854 CB CYS A 126 0.157 11.444 7.888 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.413 10.594 9.377 1.00 0.00 S ATOM 0 H CYS A 126 2.195 10.023 8.723 1.00 0.00 H new ATOM 0 HA CYS A 126 1.869 12.413 7.022 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.468 12.322 7.722 1.00 0.00 H new ATOM 0 HB3 CYS A 126 0.016 10.786 7.031 1.00 0.00 H new ATOM 0 HG CYS A 126 -1.008 9.487 9.044 1.00 0.00 H new ATOM 1861 N ASN A 127 1.562 14.109 8.898 1.00 0.00 N ATOM 1862 CA ASN A 127 1.726 15.114 9.942 1.00 0.00 C ATOM 1863 C ASN A 127 0.407 15.370 10.662 1.00 0.00 C ATOM 1864 O ASN A 127 -0.664 15.034 10.155 1.00 0.00 O ATOM 1865 CB ASN A 127 2.257 16.419 9.343 1.00 0.00 C ATOM 1866 CG ASN A 127 3.767 16.525 9.437 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.337 16.488 10.527 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.423 16.657 8.289 1.00 0.00 N ATOM 0 H ASN A 127 1.224 14.475 8.008 1.00 0.00 H new ATOM 0 HA ASN A 127 2.447 14.736 10.667 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.955 16.485 8.298 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.803 17.264 9.860 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.440 16.732 8.289 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.909 16.683 7.408 1.00 0.00 H new ATOM 1875 N GLU A 128 0.489 15.967 11.847 1.00 0.00 N ATOM 1876 CA GLU A 128 -0.700 16.266 12.636 1.00 0.00 C ATOM 1877 C GLU A 128 -1.496 17.408 12.011 1.00 0.00 C ATOM 1878 O GLU A 128 -2.721 17.457 12.122 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.307 16.625 14.071 1.00 0.00 C ATOM 1880 CG GLU A 128 -1.153 15.930 15.125 1.00 0.00 C ATOM 1881 CD GLU A 128 -0.798 14.463 15.281 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -0.512 13.809 14.257 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -0.808 13.970 16.428 1.00 0.00 O ATOM 0 H GLU A 128 1.366 16.253 12.281 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.330 15.376 12.651 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.740 16.365 14.228 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -0.391 17.704 14.203 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.023 16.436 16.082 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -2.206 16.019 14.858 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.791 18.324 11.354 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.432 19.465 10.711 1.00 0.00 C ATOM 1892 C ALA A 129 -2.083 19.059 9.394 1.00 0.00 C ATOM 1893 O ALA A 129 -3.250 19.364 9.147 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.421 20.577 10.481 1.00 0.00 C ATOM 0 H ALA A 129 0.224 18.298 11.253 1.00 0.00 H new ATOM 0 HA ALA A 129 -2.215 19.832 11.375 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.913 21.422 10.000 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -0.006 20.895 11.437 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.382 20.212 9.840 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.322 18.368 8.552 1.00 0.00 N ATOM 1901 CA GLY A 130 -1.842 17.932 7.270 1.00 0.00 C ATOM 1902 C GLY A 130 -0.795 17.975 6.174 1.00 0.00 C ATOM 1903 O GLY A 130 -0.942 18.709 5.196 1.00 0.00 O ATOM 0 H GLY A 130 -0.354 18.102 8.735 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.224 16.915 7.363 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.684 18.565 6.989 1.00 0.00 H new ATOM 1907 N ASP A 131 0.264 17.189 6.338 1.00 0.00 N ATOM 1908 CA ASP A 131 1.339 17.140 5.354 1.00 0.00 C ATOM 1909 C ASP A 131 2.072 15.804 5.414 1.00 0.00 C ATOM 1910 O ASP A 131 2.827 15.541 6.350 1.00 0.00 O ATOM 1911 CB ASP A 131 2.325 18.287 5.589 1.00 0.00 C ATOM 1912 CG ASP A 131 1.684 19.649 5.402 1.00 0.00 C ATOM 1913 OD1 ASP A 131 1.525 20.074 4.238 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.343 20.289 6.418 1.00 0.00 O ATOM 0 H ASP A 131 0.401 16.577 7.143 1.00 0.00 H new ATOM 0 HA ASP A 131 0.897 17.246 4.364 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.729 18.214 6.599 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.165 18.187 4.902 1.00 0.00 H new ATOM 1919 N ILE A 132 1.844 14.964 4.409 1.00 0.00 N ATOM 1920 CA ILE A 132 2.483 13.655 4.348 1.00 0.00 C ATOM 1921 C ILE A 132 3.845 13.741 3.668 1.00 0.00 C ATOM 1922 O ILE A 132 3.937 14.025 2.474 1.00 0.00 O ATOM 1923 CB ILE A 132 1.609 12.637 3.592 1.00 0.00 C ATOM 1924 CG1 ILE A 132 0.173 12.673 4.119 1.00 0.00 C ATOM 1925 CG2 ILE A 132 2.191 11.238 3.721 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.785 11.812 3.324 1.00 0.00 C ATOM 0 H ILE A 132 1.222 15.167 3.627 1.00 0.00 H new ATOM 0 HA ILE A 132 2.612 13.318 5.377 1.00 0.00 H new ATOM 0 HB ILE A 132 1.596 12.907 2.536 1.00 0.00 H new ATOM 0 HG12 ILE A 132 0.168 12.344 5.158 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.183 13.703 4.109 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.561 10.531 3.181 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.197 11.222 3.301 1.00 0.00 H new ATOM 0 HG23 ILE A 132 2.233 10.957 4.773 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.784 11.886 3.754 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -0.809 12.155 2.289 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.453 10.774 3.355 1.00 0.00 H new ATOM 1938 N GLU A 133 4.900 13.494 4.436 1.00 0.00 N ATOM 1939 CA GLU A 133 6.259 13.544 3.908 1.00 0.00 C ATOM 1940 C GLU A 133 7.021 12.265 4.242 1.00 0.00 C ATOM 1941 O GLU A 133 6.576 11.463 5.063 1.00 0.00 O ATOM 1942 CB GLU A 133 7.004 14.756 4.470 1.00 0.00 C ATOM 1943 CG GLU A 133 6.949 14.853 5.986 1.00 0.00 C ATOM 1944 CD GLU A 133 8.324 14.984 6.613 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.934 16.066 6.483 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.789 14.006 7.233 1.00 0.00 O ATOM 0 H GLU A 133 4.841 13.257 5.426 1.00 0.00 H new ATOM 0 HA GLU A 133 6.196 13.636 2.824 1.00 0.00 H new ATOM 0 HB2 GLU A 133 8.046 14.710 4.155 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.581 15.664 4.040 1.00 0.00 H new ATOM 0 HG2 GLU A 133 6.341 15.712 6.269 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.455 13.967 6.385 1.00 0.00 H new ATOM 1953 N ALA A 134 8.169 12.082 3.600 1.00 0.00 N ATOM 1954 CA ALA A 134 8.993 10.901 3.828 1.00 0.00 C ATOM 1955 C ALA A 134 9.781 11.024 5.128 1.00 0.00 C ATOM 1956 O ALA A 134 10.803 11.707 5.183 1.00 0.00 O ATOM 1957 CB ALA A 134 9.935 10.682 2.655 1.00 0.00 C ATOM 0 H ALA A 134 8.550 12.737 2.917 1.00 0.00 H new ATOM 0 HA ALA A 134 8.333 10.038 3.915 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.544 9.797 2.838 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.354 10.540 1.744 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.583 11.551 2.541 1.00 0.00 H new ATOM 1963 N LYS A 135 9.299 10.356 6.171 1.00 0.00 N ATOM 1964 CA LYS A 135 9.960 10.390 7.471 1.00 0.00 C ATOM 1965 C LYS A 135 11.356 9.781 7.387 1.00 0.00 C ATOM 1966 O LYS A 135 11.742 9.231 6.356 1.00 0.00 O ATOM 1967 CB LYS A 135 9.125 9.639 8.510 1.00 0.00 C ATOM 1968 CG LYS A 135 9.175 10.263 9.896 1.00 0.00 C ATOM 1969 CD LYS A 135 9.827 9.333 10.907 1.00 0.00 C ATOM 1970 CE LYS A 135 9.368 9.638 12.323 1.00 0.00 C ATOM 1971 NZ LYS A 135 8.011 9.090 12.596 1.00 0.00 N ATOM 0 H LYS A 135 8.454 9.785 6.142 1.00 0.00 H new ATOM 0 HA LYS A 135 10.055 11.432 7.776 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.089 9.603 8.174 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.477 8.609 8.571 1.00 0.00 H new ATOM 0 HG2 LYS A 135 9.729 11.201 9.853 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.164 10.505 10.223 1.00 0.00 H new ATOM 0 HD2 LYS A 135 9.586 8.299 10.660 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.911 9.430 10.846 1.00 0.00 H new ATOM 0 HE2 LYS A 135 10.079 9.217 13.034 1.00 0.00 H new ATOM 0 HE3 LYS A 135 9.362 10.717 12.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 7.924 8.868 13.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 7.293 9.795 12.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 7.867 8.224 12.038 1.00 0.00 H new ATOM 1985 N ASN A 136 12.109 9.885 8.478 1.00 0.00 N ATOM 1986 CA ASN A 136 13.462 9.344 8.526 1.00 0.00 C ATOM 1987 C ASN A 136 13.456 7.838 8.281 1.00 0.00 C ATOM 1988 O ASN A 136 12.400 7.204 8.280 1.00 0.00 O ATOM 1989 CB ASN A 136 14.107 9.651 9.881 1.00 0.00 C ATOM 1990 CG ASN A 136 15.123 10.773 9.795 1.00 0.00 C ATOM 1991 OD1 ASN A 136 16.251 10.643 10.269 1.00 0.00 O ATOM 1992 ND2 ASN A 136 14.726 11.886 9.188 1.00 0.00 N ATOM 0 H ASN A 136 11.805 10.339 9.340 1.00 0.00 H new ATOM 0 HA ASN A 136 14.045 9.818 7.737 1.00 0.00 H new ATOM 0 HB2 ASN A 136 13.331 9.921 10.597 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.593 8.752 10.261 1.00 0.00 H new ATOM 0 HD21 ASN A 136 15.366 12.675 9.101 1.00 0.00 H new ATOM 0 HD22 ASN A 136 13.781 11.951 8.809 1.00 0.00 H new ATOM 1999 N LYS A 137 14.640 7.272 8.072 1.00 0.00 N ATOM 2000 CA LYS A 137 14.770 5.841 7.825 1.00 0.00 C ATOM 2001 C LYS A 137 14.271 5.035 9.021 1.00 0.00 C ATOM 2002 O LYS A 137 13.757 3.927 8.864 1.00 0.00 O ATOM 2003 CB LYS A 137 16.228 5.484 7.529 1.00 0.00 C ATOM 2004 CG LYS A 137 16.823 6.269 6.372 1.00 0.00 C ATOM 2005 CD LYS A 137 18.310 5.992 6.217 1.00 0.00 C ATOM 2006 CE LYS A 137 19.140 6.875 7.134 1.00 0.00 C ATOM 2007 NZ LYS A 137 20.463 7.207 6.537 1.00 0.00 N ATOM 0 H LYS A 137 15.523 7.783 8.069 1.00 0.00 H new ATOM 0 HA LYS A 137 14.158 5.590 6.959 1.00 0.00 H new ATOM 0 HB2 LYS A 137 16.826 5.661 8.423 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.295 4.419 7.307 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.305 6.008 5.449 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.665 7.335 6.535 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.511 4.944 6.440 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.607 6.161 5.182 1.00 0.00 H new ATOM 0 HE2 LYS A 137 18.595 7.795 7.343 1.00 0.00 H new ATOM 0 HE3 LYS A 137 19.289 6.369 8.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 20.998 7.810 7.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 20.994 6.330 6.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 20.322 7.712 5.639 1.00 0.00 H new ATOM 2021 N THR A 138 14.424 5.599 10.214 1.00 0.00 N ATOM 2022 CA THR A 138 13.988 4.934 11.436 1.00 0.00 C ATOM 2023 C THR A 138 12.468 4.828 11.485 1.00 0.00 C ATOM 2024 O THR A 138 11.767 5.839 11.537 1.00 0.00 O ATOM 2025 CB THR A 138 14.499 5.691 12.663 1.00 0.00 C ATOM 2026 OG1 THR A 138 13.780 6.899 12.841 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.968 6.038 12.583 1.00 0.00 C ATOM 0 H THR A 138 14.847 6.516 10.361 1.00 0.00 H new ATOM 0 HA THR A 138 14.404 3.927 11.440 1.00 0.00 H new ATOM 0 HB THR A 138 14.349 5.014 13.504 1.00 0.00 H new ATOM 0 HG1 THR A 138 13.020 6.922 12.222 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.265 6.574 13.485 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.554 5.123 12.495 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.146 6.668 11.712 1.00 0.00 H new ATOM 2035 N ALA A 139 11.964 3.598 11.468 1.00 0.00 N ATOM 2036 CA ALA A 139 10.527 3.361 11.510 1.00 0.00 C ATOM 2037 C ALA A 139 10.057 3.089 12.936 1.00 0.00 C ATOM 2038 O ALA A 139 10.343 2.035 13.503 1.00 0.00 O ATOM 2039 CB ALA A 139 10.156 2.199 10.601 1.00 0.00 C ATOM 0 H ALA A 139 12.530 2.751 11.425 1.00 0.00 H new ATOM 0 HA ALA A 139 10.025 4.261 11.154 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.079 2.034 10.643 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.448 2.431 9.577 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.674 1.299 10.931 1.00 0.00 H new ATOM 2045 N GLY A 140 9.336 4.047 13.508 1.00 0.00 N ATOM 2046 CA GLY A 140 8.839 3.892 14.863 1.00 0.00 C ATOM 2047 C GLY A 140 7.686 2.911 14.949 1.00 0.00 C ATOM 2048 O GLY A 140 7.232 2.386 13.933 1.00 0.00 O ATOM 0 H GLY A 140 9.087 4.928 13.058 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.650 3.552 15.507 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.516 4.862 15.241 1.00 0.00 H new ATOM 2052 N GLU A 141 7.212 2.664 16.166 1.00 0.00 N ATOM 2053 CA GLU A 141 6.105 1.739 16.382 1.00 0.00 C ATOM 2054 C GLU A 141 4.854 2.208 15.646 1.00 0.00 C ATOM 2055 O GLU A 141 4.227 1.440 14.916 1.00 0.00 O ATOM 2056 CB GLU A 141 5.810 1.603 17.876 1.00 0.00 C ATOM 2057 CG GLU A 141 6.921 0.917 18.655 1.00 0.00 C ATOM 2058 CD GLU A 141 6.941 -0.584 18.444 1.00 0.00 C ATOM 2059 OE1 GLU A 141 7.412 -1.027 17.375 1.00 0.00 O ATOM 2060 OE2 GLU A 141 6.486 -1.317 19.348 1.00 0.00 O ATOM 0 H GLU A 141 7.577 3.091 17.017 1.00 0.00 H new ATOM 0 HA GLU A 141 6.395 0.766 15.986 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.641 2.594 18.296 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.886 1.040 18.006 1.00 0.00 H new ATOM 0 HG2 GLU A 141 7.882 1.335 18.355 1.00 0.00 H new ATOM 0 HG3 GLU A 141 6.799 1.129 19.717 1.00 0.00 H new ATOM 2067 N GLU A 142 4.497 3.472 15.842 1.00 0.00 N ATOM 2068 CA GLU A 142 3.321 4.044 15.195 1.00 0.00 C ATOM 2069 C GLU A 142 3.522 4.148 13.687 1.00 0.00 C ATOM 2070 O GLU A 142 2.564 4.080 12.918 1.00 0.00 O ATOM 2071 CB GLU A 142 3.014 5.426 15.778 1.00 0.00 C ATOM 2072 CG GLU A 142 4.143 6.426 15.594 1.00 0.00 C ATOM 2073 CD GLU A 142 4.247 7.407 16.746 1.00 0.00 C ATOM 2074 OE1 GLU A 142 3.437 8.357 16.791 1.00 0.00 O ATOM 2075 OE2 GLU A 142 5.137 7.225 17.603 1.00 0.00 O ATOM 0 H GLU A 142 5.005 4.121 16.444 1.00 0.00 H new ATOM 0 HA GLU A 142 2.477 3.381 15.384 1.00 0.00 H new ATOM 0 HB2 GLU A 142 2.112 5.818 15.308 1.00 0.00 H new ATOM 0 HB3 GLU A 142 2.800 5.323 16.842 1.00 0.00 H new ATOM 0 HG2 GLU A 142 5.086 5.889 15.493 1.00 0.00 H new ATOM 0 HG3 GLU A 142 3.988 6.976 14.666 1.00 0.00 H new ATOM 2082 N GLU A 143 4.774 4.313 13.272 1.00 0.00 N ATOM 2083 CA GLU A 143 5.100 4.426 11.854 1.00 0.00 C ATOM 2084 C GLU A 143 4.628 3.196 11.085 1.00 0.00 C ATOM 2085 O GLU A 143 4.290 3.281 9.905 1.00 0.00 O ATOM 2086 CB GLU A 143 6.608 4.614 11.671 1.00 0.00 C ATOM 2087 CG GLU A 143 6.972 5.810 10.806 1.00 0.00 C ATOM 2088 CD GLU A 143 7.350 5.415 9.392 1.00 0.00 C ATOM 2089 OE1 GLU A 143 6.780 4.430 8.878 1.00 0.00 O ATOM 2090 OE2 GLU A 143 8.215 6.091 8.797 1.00 0.00 O ATOM 0 H GLU A 143 5.579 4.371 13.896 1.00 0.00 H new ATOM 0 HA GLU A 143 4.582 5.298 11.455 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.073 4.730 12.650 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.026 3.712 11.224 1.00 0.00 H new ATOM 0 HG2 GLU A 143 6.129 6.500 10.773 1.00 0.00 H new ATOM 0 HG3 GLU A 143 7.804 6.345 11.264 1.00 0.00 H new ATOM 2097 N MET A 144 4.606 2.052 11.762 1.00 0.00 N ATOM 2098 CA MET A 144 4.174 0.804 11.143 1.00 0.00 C ATOM 2099 C MET A 144 2.735 0.912 10.648 1.00 0.00 C ATOM 2100 O MET A 144 1.808 1.087 11.440 1.00 0.00 O ATOM 2101 CB MET A 144 4.298 -0.353 12.136 1.00 0.00 C ATOM 2102 CG MET A 144 5.655 -0.426 12.819 1.00 0.00 C ATOM 2103 SD MET A 144 6.690 -1.754 12.171 1.00 0.00 S ATOM 2104 CE MET A 144 7.871 -0.819 11.201 1.00 0.00 C ATOM 0 H MET A 144 4.882 1.964 12.740 1.00 0.00 H new ATOM 0 HA MET A 144 4.821 0.610 10.287 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.523 -0.253 12.896 1.00 0.00 H new ATOM 0 HB3 MET A 144 4.113 -1.291 11.613 1.00 0.00 H new ATOM 0 HG2 MET A 144 6.172 0.526 12.694 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.511 -0.573 13.889 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.090 -1.356 10.278 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.452 0.158 10.961 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.790 -0.690 11.773 1.00 0.00 H new ATOM 2114 N ILE A 145 2.556 0.807 9.336 1.00 0.00 N ATOM 2115 CA ILE A 145 1.230 0.892 8.737 1.00 0.00 C ATOM 2116 C ILE A 145 0.669 -0.494 8.442 1.00 0.00 C ATOM 2117 O ILE A 145 1.367 -1.499 8.577 1.00 0.00 O ATOM 2118 CB ILE A 145 1.254 1.711 7.433 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.233 1.091 6.434 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.628 3.157 7.722 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.170 1.717 5.058 1.00 0.00 C ATOM 0 H ILE A 145 3.313 0.663 8.667 1.00 0.00 H new ATOM 0 HA ILE A 145 0.589 1.394 9.461 1.00 0.00 H new ATOM 0 HB ILE A 145 0.257 1.696 6.993 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.247 1.189 6.823 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.026 0.024 6.349 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.641 3.723 6.790 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.896 3.593 8.402 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.616 3.192 8.181 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.891 1.228 4.403 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.167 1.596 4.649 1.00 0.00 H new ATOM 0 HD13 ILE A 145 2.407 2.779 5.130 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.597 -0.543 8.040 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.252 -1.807 7.724 1.00 0.00 C ATOM 2135 C LYS A 146 -1.939 -1.740 6.365 1.00 0.00 C ATOM 2136 O LYS A 146 -2.962 -1.073 6.206 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.274 -2.158 8.808 1.00 0.00 C ATOM 2138 CG LYS A 146 -1.699 -2.148 10.214 1.00 0.00 C ATOM 2139 CD LYS A 146 -2.645 -2.806 11.207 1.00 0.00 C ATOM 2140 CE LYS A 146 -2.351 -4.289 11.356 1.00 0.00 C ATOM 2141 NZ LYS A 146 -3.263 -5.123 10.524 1.00 0.00 N ATOM 0 H LYS A 146 -1.190 0.279 7.925 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.489 -2.584 7.686 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.101 -1.450 8.758 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -2.686 -3.145 8.600 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -0.742 -2.670 10.221 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -1.504 -1.121 10.521 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -2.554 -2.317 12.177 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -3.674 -2.669 10.876 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -1.318 -4.485 11.069 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -2.451 -4.575 12.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -2.761 -5.978 10.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -4.094 -5.396 11.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -3.572 -4.578 9.694 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.371 -2.437 5.386 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.929 -2.457 4.039 1.00 0.00 C ATOM 2157 C ILE A 147 -3.027 -3.509 3.914 1.00 0.00 C ATOM 2158 O ILE A 147 -2.794 -4.695 4.152 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.843 -2.739 2.984 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.367 -1.832 3.212 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.402 -2.544 1.583 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.604 -2.273 2.460 1.00 0.00 C ATOM 0 H ILE A 147 -0.525 -2.995 5.500 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.353 -1.469 3.859 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.520 -3.775 3.084 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.111 -0.816 2.910 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.592 -1.801 4.278 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.622 -2.747 0.849 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.236 -3.228 1.426 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.749 -1.517 1.469 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.422 -1.584 2.669 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.885 -3.277 2.779 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.397 -2.277 1.390 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.223 -3.068 3.541 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.357 -3.973 3.385 1.00 0.00 C ATOM 2176 C ARG A 148 -5.608 -4.280 1.912 1.00 0.00 C ATOM 2177 O ARG A 148 -4.952 -3.724 1.031 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.613 -3.364 4.011 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.578 -3.328 5.530 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.466 -2.224 6.082 1.00 0.00 C ATOM 2181 NE ARG A 148 -6.851 -1.544 7.219 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.824 -2.041 8.454 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -7.377 -3.220 8.715 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.243 -1.359 9.431 1.00 0.00 N ATOM 0 H ARG A 148 -4.433 -2.090 3.341 1.00 0.00 H new ATOM 0 HA ARG A 148 -5.119 -4.905 3.898 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.741 -2.349 3.634 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.483 -3.936 3.689 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.904 -4.290 5.925 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.553 -3.175 5.868 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.674 -1.499 5.295 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.423 -2.647 6.387 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.417 -0.635 7.058 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.825 -3.750 7.967 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -7.353 -3.596 9.663 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -5.816 -0.453 9.237 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -6.223 -1.740 10.377 1.00 0.00 H new ATOM 2198 N SER A 149 -6.561 -5.169 1.652 1.00 0.00 N ATOM 2199 CA SER A 149 -6.898 -5.550 0.285 1.00 0.00 C ATOM 2200 C SER A 149 -8.352 -6.000 0.188 1.00 0.00 C ATOM 2201 O SER A 149 -8.916 -6.526 1.149 1.00 0.00 O ATOM 2202 CB SER A 149 -5.973 -6.668 -0.197 1.00 0.00 C ATOM 2203 OG SER A 149 -6.274 -7.040 -1.531 1.00 0.00 O ATOM 0 H SER A 149 -7.113 -5.639 2.369 1.00 0.00 H new ATOM 0 HA SER A 149 -6.764 -4.676 -0.353 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.936 -6.339 -0.133 1.00 0.00 H new ATOM 0 HB3 SER A 149 -6.073 -7.534 0.457 1.00 0.00 H new ATOM 0 HG SER A 149 -5.668 -7.755 -1.816 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.955 -5.790 -0.978 1.00 0.00 N ATOM 2210 CA CYS A 150 -10.344 -6.174 -1.201 1.00 0.00 C ATOM 2211 C CYS A 150 -10.473 -7.056 -2.437 1.00 0.00 C ATOM 2212 O CYS A 150 -11.462 -6.980 -3.166 1.00 0.00 O ATOM 2213 CB CYS A 150 -11.220 -4.930 -1.354 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.774 -3.880 -2.756 1.00 0.00 S ATOM 0 H CYS A 150 -8.503 -5.356 -1.783 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.681 -6.743 -0.335 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -12.259 -5.242 -1.463 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -11.159 -4.341 -0.439 1.00 0.00 H new ATOM 0 HG CYS A 150 -10.526 -2.676 -2.334 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.467 -7.892 -2.670 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.468 -8.789 -3.819 1.00 0.00 C ATOM 2222 C ALA A 151 -10.424 -9.957 -3.603 1.00 0.00 C ATOM 2223 O ALA A 151 -11.144 -10.006 -2.605 1.00 0.00 O ATOM 2224 CB ALA A 151 -8.061 -9.300 -4.091 1.00 0.00 C ATOM 0 H ALA A 151 -8.640 -7.967 -2.078 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.813 -8.227 -4.687 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -8.077 -9.969 -4.952 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.402 -8.457 -4.298 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.695 -9.841 -3.218 1.00 0.00 H new