USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=28 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 -170:sc= -0.228 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -1.15 K(o=-1.2,f=-6.2!) USER MOD Single : A 24 SER OG : rot -4:sc= 1.06 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.00716 USER MOD Single : A 31 MET CE :methyl -130:sc= -2.04 (180deg=-6.12!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc=-0.00267 X(o=-0.0027,f=-0.3) USER MOD Single : A 42 ASN : amide:sc=-0.00233 K(o=-0.0023,f=-1.4!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.0617 USER MOD Single : A 51 HIS : no HE2:sc= 0 K(o=0,f=-1) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= -0.434 K(o=-0.43,f=-2.4!) USER MOD Single : A 65 THR OG1 : rot -140:sc= 0 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+ -143:sc= -0.135 (180deg=-1.93!) USER MOD Single : A 78 SER OG : rot 150:sc= 0.158 USER MOD Single : A 80 TYR OH : rot -80:sc= 0.781 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= -0.645 K(o=-0.65,f=-1.6!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -0.187 K(o=-0.19,f=-2.5!) USER MOD Single : A 110 GLN : amide:sc=-0.000279 X(o=-0.00028,f=-0.025) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl -115:sc= -2.03 (180deg=-4.54!) USER MOD Single : A 119 SER OG : rot -16:sc= 0.522! USER MOD Single : A 120 ASN : amide:sc= -5.79! C(o=-5.8!,f=-13!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 66:sc= 0.233 USER MOD Single : A 126 CYS SG : rot 110:sc= -1.23 USER MOD Single : A 127 ASN : amide:sc= 0.76 K(o=0.76,f=-0.15) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.57) USER MOD Single : A 137 LYS NZ :NH3+ -169:sc=-0.00127 (180deg=-0.0857) USER MOD Single : A 138 THR OG1 : rot 42:sc= 1.14 USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0374) USER MOD Single : A 149 SER OG : rot -121:sc= 0.00172 USER MOD Single : A 150 CYS SG : rot -107:sc= 0.203 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -5.748 -9.673 10.094 1.00 0.00 N ATOM 88 CA ASP A 9 -6.776 -8.693 10.428 1.00 0.00 C ATOM 89 C ASP A 9 -7.827 -8.611 9.325 1.00 0.00 C ATOM 90 O ASP A 9 -7.572 -8.983 8.180 1.00 0.00 O ATOM 91 CB ASP A 9 -6.146 -7.318 10.651 1.00 0.00 C ATOM 92 CG ASP A 9 -7.000 -6.430 11.534 1.00 0.00 C ATOM 93 OD1 ASP A 9 -7.557 -6.940 12.528 1.00 0.00 O ATOM 94 OD2 ASP A 9 -7.111 -5.223 11.231 1.00 0.00 O ATOM 0 HA ASP A 9 -7.264 -9.014 11.348 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -5.163 -7.441 11.105 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -5.993 -6.830 9.688 1.00 0.00 H new ATOM 99 N ILE A 10 -9.010 -8.121 9.681 1.00 0.00 N ATOM 100 CA ILE A 10 -10.101 -7.989 8.723 1.00 0.00 C ATOM 101 C ILE A 10 -10.977 -6.783 9.054 1.00 0.00 C ATOM 102 O ILE A 10 -11.360 -6.579 10.206 1.00 0.00 O ATOM 103 CB ILE A 10 -10.978 -9.258 8.690 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.055 -9.140 7.607 1.00 0.00 C ATOM 105 CG2 ILE A 10 -11.609 -9.505 10.053 1.00 0.00 C ATOM 106 CD1 ILE A 10 -11.866 -10.108 6.459 1.00 0.00 C ATOM 0 H ILE A 10 -9.237 -7.809 10.625 1.00 0.00 H new ATOM 0 HA ILE A 10 -9.648 -7.847 7.742 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.343 -10.110 8.447 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.033 -9.310 8.058 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -12.057 -8.122 7.217 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.224 -10.404 10.012 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -10.825 -9.636 10.799 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.231 -8.652 10.326 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.664 -9.968 5.730 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -10.903 -9.924 5.982 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -11.894 -11.130 6.837 1.00 0.00 H new ATOM 118 N VAL A 11 -11.289 -5.988 8.036 1.00 0.00 N ATOM 119 CA VAL A 11 -12.119 -4.803 8.219 1.00 0.00 C ATOM 120 C VAL A 11 -13.269 -4.778 7.218 1.00 0.00 C ATOM 121 O VAL A 11 -13.108 -4.331 6.083 1.00 0.00 O ATOM 122 CB VAL A 11 -11.294 -3.511 8.067 1.00 0.00 C ATOM 123 CG1 VAL A 11 -12.125 -2.297 8.456 1.00 0.00 C ATOM 124 CG2 VAL A 11 -10.025 -3.586 8.902 1.00 0.00 C ATOM 0 H VAL A 11 -10.980 -6.143 7.076 1.00 0.00 H new ATOM 0 HA VAL A 11 -12.522 -4.852 9.231 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.008 -3.406 7.021 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.525 -1.394 8.342 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.001 -2.234 7.811 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -12.444 -2.392 9.494 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -9.455 -2.665 8.782 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -10.287 -3.716 9.952 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.421 -4.431 8.572 1.00 0.00 H new ATOM 134 N GLY A 12 -14.431 -5.260 7.648 1.00 0.00 N ATOM 135 CA GLY A 12 -15.591 -5.285 6.777 1.00 0.00 C ATOM 136 C GLY A 12 -15.384 -6.163 5.559 1.00 0.00 C ATOM 137 O GLY A 12 -15.784 -7.327 5.549 1.00 0.00 O ATOM 0 H GLY A 12 -14.590 -5.633 8.584 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.454 -5.644 7.337 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -15.821 -4.270 6.454 1.00 0.00 H new ATOM 141 N ILE A 13 -14.757 -5.603 4.529 1.00 0.00 N ATOM 142 CA ILE A 13 -14.497 -6.343 3.300 1.00 0.00 C ATOM 143 C ILE A 13 -13.050 -6.166 2.849 1.00 0.00 C ATOM 144 O ILE A 13 -12.754 -6.192 1.655 1.00 0.00 O ATOM 145 CB ILE A 13 -15.435 -5.895 2.163 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.477 -4.367 2.074 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.832 -6.459 2.378 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.189 -3.836 0.686 1.00 0.00 C ATOM 0 H ILE A 13 -14.420 -4.640 4.521 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.682 -7.395 3.519 1.00 0.00 H new ATOM 0 HB ILE A 13 -15.049 -6.281 1.220 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.460 -4.019 2.391 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.751 -3.950 2.772 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.484 -6.134 1.567 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.786 -7.548 2.393 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -17.227 -6.099 3.328 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.235 -2.747 0.696 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.194 -4.154 0.374 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.930 -4.224 -0.013 1.00 0.00 H new ATOM 160 N TRP A 14 -12.153 -5.986 3.813 1.00 0.00 N ATOM 161 CA TRP A 14 -10.738 -5.804 3.516 1.00 0.00 C ATOM 162 C TRP A 14 -9.874 -6.651 4.445 1.00 0.00 C ATOM 163 O TRP A 14 -10.103 -6.692 5.655 1.00 0.00 O ATOM 164 CB TRP A 14 -10.352 -4.329 3.646 1.00 0.00 C ATOM 165 CG TRP A 14 -11.138 -3.428 2.742 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.428 -3.017 2.913 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.682 -2.826 1.525 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.803 -2.197 1.877 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.749 -2.064 1.012 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.475 -2.858 0.820 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.643 -1.340 -0.173 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.373 -2.138 -0.356 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.451 -1.389 -0.842 1.00 0.00 C ATOM 0 H TRP A 14 -12.382 -5.962 4.807 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.564 -6.128 2.490 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.497 -4.012 4.679 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.290 -4.218 3.425 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.062 -3.296 3.742 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.718 -1.758 1.769 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.638 -3.434 1.187 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.473 -0.760 -0.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.446 -2.154 -0.909 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.339 -0.838 -1.764 1.00 0.00 H new ATOM 184 N TRP A 15 -8.882 -7.325 3.874 1.00 0.00 N ATOM 185 CA TRP A 15 -7.985 -8.172 4.652 1.00 0.00 C ATOM 186 C TRP A 15 -6.540 -7.702 4.517 1.00 0.00 C ATOM 187 O TRP A 15 -6.043 -7.498 3.409 1.00 0.00 O ATOM 188 CB TRP A 15 -8.104 -9.629 4.201 1.00 0.00 C ATOM 189 CG TRP A 15 -8.004 -9.803 2.717 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.006 -9.638 1.803 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.839 -10.176 1.973 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.534 -9.887 0.537 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.207 -10.219 0.615 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.520 -10.478 2.324 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.303 -10.551 -0.392 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.624 -10.808 1.324 1.00 0.00 C ATOM 197 CH2 TRP A 15 -5.019 -10.841 -0.019 1.00 0.00 C ATOM 0 H TRP A 15 -8.678 -7.301 2.875 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.276 -8.099 5.700 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.321 -10.215 4.682 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.058 -10.031 4.543 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.020 -9.354 2.041 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.082 -9.833 -0.321 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.207 -10.454 3.357 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.605 -10.578 -1.429 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.602 -11.044 1.583 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.295 -11.101 -0.777 1.00 0.00 H new ATOM 208 N THR A 16 -5.870 -7.534 5.653 1.00 0.00 N ATOM 209 CA THR A 16 -4.482 -7.089 5.663 1.00 0.00 C ATOM 210 C THR A 16 -3.568 -8.142 5.045 1.00 0.00 C ATOM 211 O THR A 16 -3.749 -9.341 5.262 1.00 0.00 O ATOM 212 CB THR A 16 -4.032 -6.784 7.092 1.00 0.00 C ATOM 213 OG1 THR A 16 -4.914 -5.861 7.709 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.636 -6.207 7.171 1.00 0.00 C ATOM 0 H THR A 16 -6.266 -7.699 6.578 1.00 0.00 H new ATOM 0 HA THR A 16 -4.415 -6.179 5.066 1.00 0.00 H new ATOM 0 HB THR A 16 -4.040 -7.744 7.608 1.00 0.00 H new ATOM 0 HG1 THR A 16 -4.529 -5.557 8.557 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.380 -6.014 8.213 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.925 -6.916 6.748 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.596 -5.274 6.609 1.00 0.00 H new ATOM 222 N VAL A 17 -2.585 -7.687 4.274 1.00 0.00 N ATOM 223 CA VAL A 17 -1.643 -8.590 3.624 1.00 0.00 C ATOM 224 C VAL A 17 -0.570 -9.061 4.601 1.00 0.00 C ATOM 225 O VAL A 17 -0.204 -8.342 5.530 1.00 0.00 O ATOM 226 CB VAL A 17 -0.962 -7.919 2.418 1.00 0.00 C ATOM 227 CG1 VAL A 17 -1.967 -7.672 1.304 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.290 -6.620 2.837 1.00 0.00 C ATOM 0 H VAL A 17 -2.421 -6.698 4.085 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.217 -9.449 3.276 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.194 -8.593 2.039 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.466 -7.197 0.461 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.396 -8.622 0.984 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.761 -7.020 1.668 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.186 -6.161 1.971 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.037 -5.939 3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.463 -6.829 3.597 1.00 0.00 H new ATOM 238 N SER A 18 -0.070 -10.273 4.384 1.00 0.00 N ATOM 239 CA SER A 18 0.960 -10.840 5.245 1.00 0.00 C ATOM 240 C SER A 18 2.304 -10.889 4.524 1.00 0.00 C ATOM 241 O SER A 18 3.358 -10.744 5.144 1.00 0.00 O ATOM 242 CB SER A 18 0.561 -12.246 5.698 1.00 0.00 C ATOM 243 OG SER A 18 1.233 -12.609 6.890 1.00 0.00 O ATOM 0 H SER A 18 -0.362 -10.881 3.619 1.00 0.00 H new ATOM 0 HA SER A 18 1.059 -10.199 6.121 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.516 -12.288 5.858 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.795 -12.964 4.912 1.00 0.00 H new ATOM 0 HG SER A 18 0.959 -13.511 7.158 1.00 0.00 H new ATOM 249 N ASN A 19 2.259 -11.094 3.212 1.00 0.00 N ATOM 250 CA ASN A 19 3.472 -11.162 2.407 1.00 0.00 C ATOM 251 C ASN A 19 3.349 -10.290 1.162 1.00 0.00 C ATOM 252 O ASN A 19 2.321 -9.650 0.940 1.00 0.00 O ATOM 253 CB ASN A 19 3.762 -12.609 2.003 1.00 0.00 C ATOM 254 CG ASN A 19 2.539 -13.307 1.438 1.00 0.00 C ATOM 255 OD1 ASN A 19 1.519 -13.440 2.113 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.637 -13.757 0.192 1.00 0.00 N ATOM 0 H ASN A 19 1.395 -11.216 2.684 1.00 0.00 H new ATOM 0 HA ASN A 19 4.299 -10.788 3.011 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.560 -12.623 1.261 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.123 -13.160 2.871 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.847 -14.235 -0.241 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.502 -13.625 -0.331 1.00 0.00 H new ATOM 263 N PHE A 20 4.403 -10.268 0.354 1.00 0.00 N ATOM 264 CA PHE A 20 4.412 -9.473 -0.869 1.00 0.00 C ATOM 265 C PHE A 20 3.553 -10.125 -1.948 1.00 0.00 C ATOM 266 O PHE A 20 2.864 -9.440 -2.704 1.00 0.00 O ATOM 267 CB PHE A 20 5.845 -9.300 -1.378 1.00 0.00 C ATOM 268 CG PHE A 20 5.980 -8.248 -2.443 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.653 -8.530 -3.759 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.436 -6.978 -2.125 1.00 0.00 C ATOM 271 CE1 PHE A 20 5.777 -7.564 -4.740 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.562 -6.009 -3.102 1.00 0.00 C ATOM 273 CZ PHE A 20 6.232 -6.302 -4.411 1.00 0.00 C ATOM 0 H PHE A 20 5.262 -10.791 0.523 1.00 0.00 H new ATOM 0 HA PHE A 20 3.993 -8.493 -0.639 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.491 -9.042 -0.539 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.200 -10.252 -1.772 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.297 -9.515 -4.022 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.695 -6.744 -1.103 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.518 -7.796 -5.763 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.918 -5.023 -2.842 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.330 -5.546 -5.176 1.00 0.00 H new ATOM 283 N GLY A 21 3.597 -11.452 -2.012 1.00 0.00 N ATOM 284 CA GLY A 21 2.817 -12.173 -3.000 1.00 0.00 C ATOM 285 C GLY A 21 1.329 -11.907 -2.871 1.00 0.00 C ATOM 286 O GLY A 21 0.592 -11.978 -3.855 1.00 0.00 O ATOM 0 H GLY A 21 4.159 -12.041 -1.397 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.149 -11.888 -3.999 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.002 -13.242 -2.895 1.00 0.00 H new ATOM 290 N GLU A 22 0.888 -11.601 -1.655 1.00 0.00 N ATOM 291 CA GLU A 22 -0.521 -11.325 -1.401 1.00 0.00 C ATOM 292 C GLU A 22 -0.907 -9.941 -1.916 1.00 0.00 C ATOM 293 O GLU A 22 -2.055 -9.707 -2.294 1.00 0.00 O ATOM 294 CB GLU A 22 -0.820 -11.424 0.096 1.00 0.00 C ATOM 295 CG GLU A 22 -0.884 -12.854 0.610 1.00 0.00 C ATOM 296 CD GLU A 22 -2.174 -13.551 0.229 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.586 -13.441 -0.945 1.00 0.00 O ATOM 298 OE2 GLU A 22 -2.775 -14.209 1.105 1.00 0.00 O ATOM 0 H GLU A 22 1.486 -11.538 -0.831 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.112 -12.070 -1.934 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.052 -10.882 0.648 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.769 -10.930 0.302 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.040 -13.417 0.213 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.783 -12.851 1.695 1.00 0.00 H new ATOM 305 N ILE A 23 0.060 -9.029 -1.932 1.00 0.00 N ATOM 306 CA ILE A 23 -0.180 -7.670 -2.402 1.00 0.00 C ATOM 307 C ILE A 23 -0.400 -7.644 -3.912 1.00 0.00 C ATOM 308 O ILE A 23 0.549 -7.735 -4.690 1.00 0.00 O ATOM 309 CB ILE A 23 0.995 -6.736 -2.050 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.334 -6.846 -0.561 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.659 -5.298 -2.416 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.629 -6.162 -0.185 1.00 0.00 C ATOM 0 H ILE A 23 1.016 -9.207 -1.625 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.079 -7.315 -1.898 1.00 0.00 H new ATOM 0 HB ILE A 23 1.867 -7.042 -2.627 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.521 -6.413 0.022 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.396 -7.899 -0.287 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.499 -4.652 -2.161 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.462 -5.231 -3.486 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.225 -4.979 -1.864 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.806 -6.280 0.884 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.452 -6.611 -0.741 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.564 -5.101 -0.427 1.00 0.00 H new ATOM 324 N SER A 24 -1.659 -7.519 -4.318 1.00 0.00 N ATOM 325 CA SER A 24 -2.005 -7.481 -5.734 1.00 0.00 C ATOM 326 C SER A 24 -3.420 -6.948 -5.934 1.00 0.00 C ATOM 327 O SER A 24 -4.347 -7.334 -5.221 1.00 0.00 O ATOM 328 CB SER A 24 -1.881 -8.876 -6.348 1.00 0.00 C ATOM 329 OG SER A 24 -0.529 -9.297 -6.393 1.00 0.00 O ATOM 0 H SER A 24 -2.456 -7.442 -3.687 1.00 0.00 H new ATOM 0 HA SER A 24 -1.309 -6.808 -6.235 1.00 0.00 H new ATOM 0 HB2 SER A 24 -2.467 -9.586 -5.765 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.297 -8.871 -7.355 1.00 0.00 H new ATOM 0 HG SER A 24 0.050 -8.571 -6.081 1.00 0.00 H new ATOM 335 N GLY A 25 -3.580 -6.059 -6.909 1.00 0.00 N ATOM 336 CA GLY A 25 -4.885 -5.487 -7.185 1.00 0.00 C ATOM 337 C GLY A 25 -5.197 -4.300 -6.297 1.00 0.00 C ATOM 338 O GLY A 25 -4.290 -3.629 -5.802 1.00 0.00 O ATOM 0 H GLY A 25 -2.829 -5.724 -7.513 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.929 -5.177 -8.229 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.650 -6.251 -7.047 1.00 0.00 H new ATOM 342 N THR A 26 -6.485 -4.036 -6.094 1.00 0.00 N ATOM 343 CA THR A 26 -6.915 -2.921 -5.260 1.00 0.00 C ATOM 344 C THR A 26 -6.545 -3.160 -3.799 1.00 0.00 C ATOM 345 O THR A 26 -6.815 -4.225 -3.246 1.00 0.00 O ATOM 346 CB THR A 26 -8.424 -2.713 -5.388 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.847 -2.919 -6.724 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.876 -1.330 -4.972 1.00 0.00 C ATOM 0 H THR A 26 -7.248 -4.580 -6.496 1.00 0.00 H new ATOM 0 HA THR A 26 -6.401 -2.023 -5.604 1.00 0.00 H new ATOM 0 HB THR A 26 -8.873 -3.442 -4.714 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.816 -2.783 -6.785 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.957 -1.250 -5.088 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.609 -1.158 -3.929 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.388 -0.584 -5.599 1.00 0.00 H new ATOM 356 N ILE A 27 -5.924 -2.160 -3.180 1.00 0.00 N ATOM 357 CA ILE A 27 -5.518 -2.261 -1.784 1.00 0.00 C ATOM 358 C ILE A 27 -5.641 -0.916 -1.077 1.00 0.00 C ATOM 359 O ILE A 27 -5.486 0.138 -1.695 1.00 0.00 O ATOM 360 CB ILE A 27 -4.067 -2.764 -1.657 1.00 0.00 C ATOM 361 CG1 ILE A 27 -3.113 -1.834 -2.407 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.951 -4.187 -2.182 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.770 -1.669 -1.729 1.00 0.00 C ATOM 0 H ILE A 27 -5.692 -1.271 -3.624 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.187 -2.979 -1.311 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.790 -2.763 -0.603 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.957 -2.222 -3.414 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.581 -0.855 -2.512 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.920 -4.528 -2.085 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.605 -4.842 -1.606 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.245 -4.213 -3.231 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.146 -0.996 -2.317 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.914 -1.252 -0.732 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.281 -2.640 -1.649 1.00 0.00 H new ATOM 375 N ALA A 28 -5.920 -0.959 0.223 1.00 0.00 N ATOM 376 CA ALA A 28 -6.064 0.256 1.014 1.00 0.00 C ATOM 377 C ALA A 28 -4.975 0.350 2.077 1.00 0.00 C ATOM 378 O ALA A 28 -4.515 -0.665 2.602 1.00 0.00 O ATOM 379 CB ALA A 28 -7.443 0.305 1.657 1.00 0.00 C ATOM 0 H ALA A 28 -6.051 -1.823 0.749 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.957 1.112 0.347 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.538 1.218 2.245 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.207 0.293 0.880 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.572 -0.561 2.307 1.00 0.00 H new ATOM 385 N ILE A 29 -4.566 1.575 2.393 1.00 0.00 N ATOM 386 CA ILE A 29 -3.531 1.801 3.394 1.00 0.00 C ATOM 387 C ILE A 29 -4.070 2.619 4.563 1.00 0.00 C ATOM 388 O ILE A 29 -4.968 3.444 4.396 1.00 0.00 O ATOM 389 CB ILE A 29 -2.313 2.529 2.790 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.839 1.816 1.523 1.00 0.00 C ATOM 391 CG2 ILE A 29 -1.186 2.613 3.810 1.00 0.00 C ATOM 392 CD1 ILE A 29 -1.413 2.762 0.421 1.00 0.00 C ATOM 0 H ILE A 29 -4.936 2.426 1.970 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.217 0.821 3.752 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.612 3.542 2.522 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.003 1.163 1.774 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.641 1.178 1.153 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.334 3.129 3.369 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.529 3.162 4.687 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.887 1.607 4.106 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.089 2.187 -0.447 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.253 3.398 0.142 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.589 3.383 0.773 1.00 0.00 H new ATOM 404 N GLU A 30 -3.514 2.385 5.748 1.00 0.00 N ATOM 405 CA GLU A 30 -3.940 3.099 6.946 1.00 0.00 C ATOM 406 C GLU A 30 -2.735 3.574 7.753 1.00 0.00 C ATOM 407 O GLU A 30 -2.116 2.795 8.479 1.00 0.00 O ATOM 408 CB GLU A 30 -4.828 2.204 7.812 1.00 0.00 C ATOM 409 CG GLU A 30 -5.887 2.967 8.590 1.00 0.00 C ATOM 410 CD GLU A 30 -6.827 2.051 9.347 1.00 0.00 C ATOM 411 OE1 GLU A 30 -6.911 0.857 8.987 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.479 2.526 10.301 1.00 0.00 O ATOM 0 H GLU A 30 -2.768 1.707 5.904 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.513 3.972 6.633 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.318 1.467 7.175 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.201 1.653 8.513 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.400 3.643 9.293 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.464 3.585 7.902 1.00 0.00 H new ATOM 419 N MET A 31 -2.407 4.854 7.621 1.00 0.00 N ATOM 420 CA MET A 31 -1.277 5.432 8.337 1.00 0.00 C ATOM 421 C MET A 31 -1.637 5.699 9.795 1.00 0.00 C ATOM 422 O MET A 31 -0.884 5.350 10.705 1.00 0.00 O ATOM 423 CB MET A 31 -0.829 6.731 7.665 1.00 0.00 C ATOM 424 CG MET A 31 -0.189 6.520 6.302 1.00 0.00 C ATOM 425 SD MET A 31 0.116 8.069 5.431 1.00 0.00 S ATOM 426 CE MET A 31 1.740 7.757 4.743 1.00 0.00 C ATOM 0 H MET A 31 -2.908 5.512 7.024 1.00 0.00 H new ATOM 0 HA MET A 31 -0.456 4.715 8.308 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.691 7.390 7.555 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.119 7.241 8.316 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.753 5.986 6.426 1.00 0.00 H new ATOM 0 HG3 MET A 31 -0.837 5.888 5.695 1.00 0.00 H new ATOM 0 HE1 MET A 31 2.400 8.593 4.975 1.00 0.00 H new ATOM 0 HE2 MET A 31 2.148 6.842 5.173 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.662 7.646 3.661 1.00 0.00 H new ATOM 436 N ASP A 32 -2.793 6.320 10.010 1.00 0.00 N ATOM 437 CA ASP A 32 -3.253 6.633 11.358 1.00 0.00 C ATOM 438 C ASP A 32 -4.256 5.592 11.846 1.00 0.00 C ATOM 439 O ASP A 32 -4.603 4.662 11.119 1.00 0.00 O ATOM 440 CB ASP A 32 -3.888 8.024 11.392 1.00 0.00 C ATOM 441 CG ASP A 32 -3.664 8.730 12.716 1.00 0.00 C ATOM 442 OD1 ASP A 32 -2.501 8.791 13.166 1.00 0.00 O ATOM 443 OD2 ASP A 32 -4.652 9.220 13.301 1.00 0.00 O ATOM 0 H ASP A 32 -3.428 6.616 9.268 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.389 6.619 12.022 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.474 8.629 10.586 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -4.959 7.936 11.207 1.00 0.00 H new ATOM 448 N LYS A 33 -4.716 5.756 13.082 1.00 0.00 N ATOM 449 CA LYS A 33 -5.679 4.830 13.666 1.00 0.00 C ATOM 450 C LYS A 33 -7.097 5.159 13.209 1.00 0.00 C ATOM 451 O LYS A 33 -7.822 5.895 13.878 1.00 0.00 O ATOM 452 CB LYS A 33 -5.596 4.874 15.195 1.00 0.00 C ATOM 453 CG LYS A 33 -5.277 3.528 15.825 1.00 0.00 C ATOM 454 CD LYS A 33 -6.535 2.701 16.038 1.00 0.00 C ATOM 455 CE LYS A 33 -7.024 2.085 14.738 1.00 0.00 C ATOM 456 NZ LYS A 33 -8.045 1.028 14.973 1.00 0.00 N ATOM 0 H LYS A 33 -4.438 6.520 13.698 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.433 3.824 13.325 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.832 5.594 15.489 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.544 5.236 15.592 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.584 2.981 15.186 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.775 3.682 16.780 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -6.334 1.912 16.763 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -7.318 3.330 16.461 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.448 2.864 14.104 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.179 1.659 14.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -8.352 0.633 14.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -7.634 0.272 15.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -8.863 1.439 15.466 1.00 0.00 H new ATOM 470 N GLY A 34 -7.486 4.608 12.063 1.00 0.00 N ATOM 471 CA GLY A 34 -8.815 4.854 11.535 1.00 0.00 C ATOM 472 C GLY A 34 -8.802 5.784 10.338 1.00 0.00 C ATOM 473 O GLY A 34 -9.693 5.727 9.491 1.00 0.00 O ATOM 0 H GLY A 34 -6.904 3.996 11.491 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.270 3.906 11.249 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.440 5.284 12.318 1.00 0.00 H new ATOM 477 N ALA A 35 -7.791 6.643 10.268 1.00 0.00 N ATOM 478 CA ALA A 35 -7.667 7.589 9.167 1.00 0.00 C ATOM 479 C ALA A 35 -6.958 6.955 7.975 1.00 0.00 C ATOM 480 O ALA A 35 -6.139 6.050 8.137 1.00 0.00 O ATOM 481 CB ALA A 35 -6.923 8.835 9.623 1.00 0.00 C ATOM 0 H ALA A 35 -7.045 6.703 10.961 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.671 7.873 8.851 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.838 9.533 8.790 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.471 9.308 10.438 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.927 8.558 9.968 1.00 0.00 H new ATOM 487 N TYR A 36 -7.278 7.435 6.778 1.00 0.00 N ATOM 488 CA TYR A 36 -6.672 6.914 5.557 1.00 0.00 C ATOM 489 C TYR A 36 -6.053 8.040 4.735 1.00 0.00 C ATOM 490 O TYR A 36 -6.261 9.219 5.022 1.00 0.00 O ATOM 491 CB TYR A 36 -7.715 6.170 4.723 1.00 0.00 C ATOM 492 CG TYR A 36 -8.247 4.922 5.389 1.00 0.00 C ATOM 493 CD1 TYR A 36 -8.978 4.997 6.569 1.00 0.00 C ATOM 494 CD2 TYR A 36 -8.018 3.666 4.839 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.464 3.858 7.181 1.00 0.00 C ATOM 496 CE2 TYR A 36 -8.501 2.522 5.446 1.00 0.00 C ATOM 497 CZ TYR A 36 -9.223 2.623 6.616 1.00 0.00 C ATOM 498 OH TYR A 36 -9.706 1.487 7.222 1.00 0.00 O ATOM 0 H TYR A 36 -7.954 8.184 6.627 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.882 6.219 5.840 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.547 6.842 4.514 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.275 5.900 3.763 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.169 5.962 7.015 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -7.453 3.583 3.922 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -10.030 3.934 8.098 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -8.314 1.554 5.006 1.00 0.00 H new ATOM 0 HH TYR A 36 -9.449 0.701 6.696 1.00 0.00 H new ATOM 508 N ILE A 37 -5.292 7.668 3.712 1.00 0.00 N ATOM 509 CA ILE A 37 -4.643 8.645 2.847 1.00 0.00 C ATOM 510 C ILE A 37 -5.648 9.305 1.909 1.00 0.00 C ATOM 511 O ILE A 37 -6.206 8.656 1.025 1.00 0.00 O ATOM 512 CB ILE A 37 -3.525 7.997 2.009 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.609 7.157 2.901 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.726 9.063 1.273 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.490 6.472 2.147 1.00 0.00 C ATOM 0 H ILE A 37 -5.109 6.696 3.462 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.207 9.403 3.498 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.982 7.340 1.269 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -2.178 7.798 3.670 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.206 6.402 3.412 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.940 8.588 0.686 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.388 9.621 0.610 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.277 9.745 1.995 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.882 5.895 2.844 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.913 5.805 1.396 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.868 7.222 1.658 1.00 0.00 H new ATOM 527 N HIS A 38 -5.875 10.599 2.110 1.00 0.00 N ATOM 528 CA HIS A 38 -6.813 11.348 1.282 1.00 0.00 C ATOM 529 C HIS A 38 -6.076 12.151 0.215 1.00 0.00 C ATOM 530 O HIS A 38 -5.004 12.701 0.468 1.00 0.00 O ATOM 531 CB HIS A 38 -7.656 12.284 2.150 1.00 0.00 C ATOM 532 CG HIS A 38 -8.929 12.724 1.495 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.878 11.856 1.002 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.404 13.972 1.257 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.877 12.588 0.490 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.638 13.879 0.620 1.00 0.00 N ATOM 0 H HIS A 38 -5.422 11.151 2.839 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.470 10.635 0.784 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.894 11.781 3.087 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -7.064 13.164 2.402 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.904 14.892 1.520 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.763 12.175 0.031 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.234 14.649 0.317 1.00 0.00 H new ATOM 544 N ALA A 39 -6.658 12.216 -0.978 1.00 0.00 N ATOM 545 CA ALA A 39 -6.058 12.953 -2.083 1.00 0.00 C ATOM 546 C ALA A 39 -6.801 14.259 -2.339 1.00 0.00 C ATOM 547 O ALA A 39 -8.031 14.287 -2.383 1.00 0.00 O ATOM 548 CB ALA A 39 -6.042 12.096 -3.340 1.00 0.00 C ATOM 0 H ALA A 39 -7.545 11.767 -1.204 1.00 0.00 H new ATOM 0 HA ALA A 39 -5.031 13.198 -1.810 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.591 12.658 -4.158 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.460 11.192 -3.157 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.063 11.823 -3.607 1.00 0.00 H new ATOM 554 N LEU A 40 -6.047 15.340 -2.508 1.00 0.00 N ATOM 555 CA LEU A 40 -6.635 16.650 -2.760 1.00 0.00 C ATOM 556 C LEU A 40 -6.846 16.874 -4.254 1.00 0.00 C ATOM 557 O LEU A 40 -6.034 16.449 -5.076 1.00 0.00 O ATOM 558 CB LEU A 40 -5.740 17.752 -2.189 1.00 0.00 C ATOM 559 CG LEU A 40 -5.874 17.977 -0.682 1.00 0.00 C ATOM 560 CD1 LEU A 40 -4.898 19.045 -0.214 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.301 18.363 -0.325 1.00 0.00 C ATOM 0 H LEU A 40 -5.028 15.335 -2.475 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.605 16.686 -2.265 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.702 17.509 -2.414 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.967 18.686 -2.702 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.633 17.044 -0.172 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.007 19.192 0.860 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.879 18.728 -0.435 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.107 19.981 -0.731 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.377 18.519 0.751 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.570 19.282 -0.845 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.980 17.565 -0.625 1.00 0.00 H new ATOM 573 N ASP A 41 -7.941 17.544 -4.598 1.00 0.00 N ATOM 574 CA ASP A 41 -8.260 17.825 -5.993 1.00 0.00 C ATOM 575 C ASP A 41 -7.146 18.631 -6.656 1.00 0.00 C ATOM 576 O ASP A 41 -6.911 18.511 -7.857 1.00 0.00 O ATOM 577 CB ASP A 41 -9.583 18.587 -6.092 1.00 0.00 C ATOM 578 CG ASP A 41 -10.783 17.696 -5.835 1.00 0.00 C ATOM 579 OD1 ASP A 41 -10.657 16.749 -5.030 1.00 0.00 O ATOM 580 OD2 ASP A 41 -11.847 17.946 -6.437 1.00 0.00 O ATOM 0 H ASP A 41 -8.623 17.903 -3.929 1.00 0.00 H new ATOM 0 HA ASP A 41 -8.356 16.873 -6.516 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -9.582 19.407 -5.374 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -9.670 19.032 -7.083 1.00 0.00 H new ATOM 585 N ASN A 42 -6.463 19.450 -5.863 1.00 0.00 N ATOM 586 CA ASN A 42 -5.373 20.275 -6.372 1.00 0.00 C ATOM 587 C ASN A 42 -4.215 19.408 -6.853 1.00 0.00 C ATOM 588 O ASN A 42 -3.580 19.708 -7.864 1.00 0.00 O ATOM 589 CB ASN A 42 -4.888 21.240 -5.290 1.00 0.00 C ATOM 590 CG ASN A 42 -4.004 22.338 -5.847 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.992 22.589 -7.052 1.00 0.00 O ATOM 592 ND2 ASN A 42 -3.257 23.000 -4.970 1.00 0.00 N ATOM 0 H ASN A 42 -6.645 19.560 -4.865 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.749 20.849 -7.218 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.749 21.688 -4.794 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.337 20.684 -4.532 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -2.642 23.750 -5.287 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -3.298 22.759 -3.980 1.00 0.00 H new ATOM 599 N GLY A 43 -3.946 18.331 -6.123 1.00 0.00 N ATOM 600 CA GLY A 43 -2.864 17.437 -6.490 1.00 0.00 C ATOM 601 C GLY A 43 -2.127 16.889 -5.284 1.00 0.00 C ATOM 602 O GLY A 43 -1.540 15.809 -5.345 1.00 0.00 O ATOM 0 H GLY A 43 -4.458 18.061 -5.283 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.264 16.608 -7.074 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.160 17.968 -7.131 1.00 0.00 H new ATOM 606 N LEU A 44 -2.158 17.636 -4.184 1.00 0.00 N ATOM 607 CA LEU A 44 -1.488 17.218 -2.958 1.00 0.00 C ATOM 608 C LEU A 44 -2.286 16.133 -2.243 1.00 0.00 C ATOM 609 O LEU A 44 -3.357 15.734 -2.700 1.00 0.00 O ATOM 610 CB LEU A 44 -1.289 18.417 -2.028 1.00 0.00 C ATOM 611 CG LEU A 44 -0.396 19.528 -2.586 1.00 0.00 C ATOM 612 CD1 LEU A 44 -0.939 20.895 -2.196 1.00 0.00 C ATOM 613 CD2 LEU A 44 1.034 19.359 -2.096 1.00 0.00 C ATOM 0 H LEU A 44 -2.640 18.533 -4.117 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.514 16.809 -3.227 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.265 18.840 -1.792 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.860 18.063 -1.091 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.396 19.457 -3.674 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.292 21.673 -2.601 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.945 21.015 -2.597 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.970 20.978 -1.110 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.655 20.157 -2.503 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.053 19.403 -1.007 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.420 18.395 -2.427 1.00 0.00 H new ATOM 625 N PHE A 45 -1.757 15.661 -1.119 1.00 0.00 N ATOM 626 CA PHE A 45 -2.421 14.622 -0.340 1.00 0.00 C ATOM 627 C PHE A 45 -2.448 14.989 1.140 1.00 0.00 C ATOM 628 O PHE A 45 -1.483 15.539 1.672 1.00 0.00 O ATOM 629 CB PHE A 45 -1.712 13.280 -0.531 1.00 0.00 C ATOM 630 CG PHE A 45 -1.931 12.674 -1.888 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.417 13.279 -3.023 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.649 11.496 -2.027 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.616 12.723 -4.273 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.852 10.936 -3.274 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.334 11.549 -4.399 1.00 0.00 C ATOM 0 H PHE A 45 -0.871 15.981 -0.727 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.448 14.536 -0.695 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.643 13.417 -0.372 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -2.061 12.582 0.230 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.854 14.196 -2.930 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.054 11.011 -1.151 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.211 13.206 -5.150 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.415 10.020 -3.369 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.490 11.112 -5.374 1.00 0.00 H new ATOM 645 N THR A 46 -3.558 14.680 1.801 1.00 0.00 N ATOM 646 CA THR A 46 -3.711 14.979 3.220 1.00 0.00 C ATOM 647 C THR A 46 -4.418 13.836 3.942 1.00 0.00 C ATOM 648 O THR A 46 -5.055 12.991 3.313 1.00 0.00 O ATOM 649 CB THR A 46 -4.494 16.279 3.408 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.579 16.619 4.781 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.903 16.214 2.861 1.00 0.00 C ATOM 0 H THR A 46 -4.365 14.223 1.377 1.00 0.00 H new ATOM 0 HA THR A 46 -2.717 15.098 3.651 1.00 0.00 H new ATOM 0 HB THR A 46 -3.941 17.033 2.849 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.082 17.454 4.881 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.402 17.169 3.027 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.869 16.004 1.792 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.454 15.423 3.369 1.00 0.00 H new ATOM 659 N LEU A 47 -4.302 13.817 5.266 1.00 0.00 N ATOM 660 CA LEU A 47 -4.931 12.778 6.074 1.00 0.00 C ATOM 661 C LEU A 47 -6.451 12.891 6.015 1.00 0.00 C ATOM 662 O LEU A 47 -7.020 13.928 6.354 1.00 0.00 O ATOM 663 CB LEU A 47 -4.456 12.873 7.525 1.00 0.00 C ATOM 664 CG LEU A 47 -4.692 11.619 8.367 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.963 10.428 7.767 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.247 11.851 9.803 1.00 0.00 C ATOM 0 H LEU A 47 -3.778 14.509 5.802 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.640 11.809 5.668 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.390 13.099 7.528 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.961 13.713 8.002 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.760 11.401 8.369 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.143 9.545 8.380 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.329 10.249 6.756 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.893 10.635 7.734 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.422 10.948 10.388 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.185 12.094 9.820 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.815 12.677 10.231 1.00 0.00 H new ATOM 678 N GLY A 48 -7.103 11.816 5.584 1.00 0.00 N ATOM 679 CA GLY A 48 -8.551 11.816 5.489 1.00 0.00 C ATOM 680 C GLY A 48 -9.222 11.792 6.848 1.00 0.00 C ATOM 681 O GLY A 48 -8.550 11.760 7.879 1.00 0.00 O ATOM 0 H GLY A 48 -6.655 10.945 5.299 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.876 12.701 4.943 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.874 10.949 4.913 1.00 0.00 H new ATOM 685 N ALA A 49 -10.551 11.810 6.850 1.00 0.00 N ATOM 686 CA ALA A 49 -11.313 11.790 8.092 1.00 0.00 C ATOM 687 C ALA A 49 -11.595 10.356 8.541 1.00 0.00 C ATOM 688 O ALA A 49 -12.234 9.590 7.819 1.00 0.00 O ATOM 689 CB ALA A 49 -12.617 12.555 7.920 1.00 0.00 C ATOM 0 H ALA A 49 -11.122 11.838 6.005 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.716 12.275 8.865 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.178 12.533 8.854 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.400 13.589 7.651 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -13.209 12.092 7.131 1.00 0.00 H new ATOM 695 N PRO A 50 -11.123 9.970 9.741 1.00 0.00 N ATOM 696 CA PRO A 50 -11.333 8.618 10.271 1.00 0.00 C ATOM 697 C PRO A 50 -12.802 8.208 10.247 1.00 0.00 C ATOM 698 O PRO A 50 -13.692 9.042 10.416 1.00 0.00 O ATOM 699 CB PRO A 50 -10.829 8.719 11.713 1.00 0.00 C ATOM 700 CG PRO A 50 -9.843 9.833 11.692 1.00 0.00 C ATOM 701 CD PRO A 50 -10.349 10.814 10.671 1.00 0.00 C ATOM 0 HA PRO A 50 -10.817 7.863 9.677 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.646 8.926 12.404 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.366 7.787 12.037 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.760 10.299 12.674 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -8.850 9.470 11.426 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -10.971 11.584 11.127 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.530 11.325 10.164 1.00 0.00 H new ATOM 709 N HIS A 51 -13.047 6.919 10.038 1.00 0.00 N ATOM 710 CA HIS A 51 -14.408 6.398 9.995 1.00 0.00 C ATOM 711 C HIS A 51 -14.971 6.229 11.402 1.00 0.00 C ATOM 712 O HIS A 51 -14.266 5.800 12.316 1.00 0.00 O ATOM 713 CB HIS A 51 -14.440 5.059 9.255 1.00 0.00 C ATOM 714 CG HIS A 51 -14.220 5.183 7.780 1.00 0.00 C ATOM 715 ND1 HIS A 51 -15.194 5.680 6.949 1.00 0.00 N ATOM 716 CD2 HIS A 51 -13.128 4.864 7.043 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.679 5.653 5.733 1.00 0.00 C ATOM 718 NE2 HIS A 51 -13.430 5.166 5.739 1.00 0.00 N ATOM 0 H HIS A 51 -12.321 6.216 9.896 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.029 7.116 9.460 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -13.676 4.404 9.674 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.403 4.579 9.431 1.00 0.00 H new ATOM 0 HD1 HIS A 51 -16.124 6.003 7.216 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.200 4.452 7.411 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -15.199 5.982 4.845 1.00 0.00 H new ATOM 726 N ARG A 52 -16.245 6.569 11.569 1.00 0.00 N ATOM 727 CA ARG A 52 -16.903 6.454 12.866 1.00 0.00 C ATOM 728 C ARG A 52 -17.044 4.993 13.279 1.00 0.00 C ATOM 729 O ARG A 52 -16.959 4.661 14.461 1.00 0.00 O ATOM 730 CB ARG A 52 -18.280 7.119 12.823 1.00 0.00 C ATOM 731 CG ARG A 52 -19.104 6.733 11.604 1.00 0.00 C ATOM 732 CD ARG A 52 -20.466 6.184 11.998 1.00 0.00 C ATOM 733 NE ARG A 52 -21.308 5.925 10.833 1.00 0.00 N ATOM 734 CZ ARG A 52 -22.381 5.137 10.855 1.00 0.00 C ATOM 735 NH1 ARG A 52 -22.745 4.530 11.978 1.00 0.00 N ATOM 736 NH2 ARG A 52 -23.091 4.954 9.751 1.00 0.00 N ATOM 0 H ARG A 52 -16.842 6.926 10.823 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.284 6.962 13.605 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -18.832 6.851 13.724 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -18.152 8.201 12.837 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -19.234 7.604 10.962 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.565 5.986 11.022 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.335 5.261 12.564 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.966 6.894 12.657 1.00 0.00 H new ATOM 0 HE ARG A 52 -21.060 6.374 9.951 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -22.202 4.666 12.830 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -23.568 3.928 11.988 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -22.815 5.417 8.885 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -23.913 4.350 9.768 1.00 0.00 H new ATOM 750 N GLU A 53 -17.261 4.124 12.297 1.00 0.00 N ATOM 751 CA GLU A 53 -17.414 2.698 12.559 1.00 0.00 C ATOM 752 C GLU A 53 -16.092 1.963 12.364 1.00 0.00 C ATOM 753 O GLU A 53 -15.208 2.432 11.646 1.00 0.00 O ATOM 754 CB GLU A 53 -18.487 2.104 11.641 1.00 0.00 C ATOM 755 CG GLU A 53 -19.666 1.506 12.393 1.00 0.00 C ATOM 756 CD GLU A 53 -19.777 0.005 12.208 1.00 0.00 C ATOM 757 OE1 GLU A 53 -19.811 -0.449 11.044 1.00 0.00 O ATOM 758 OE2 GLU A 53 -19.829 -0.716 13.226 1.00 0.00 O ATOM 0 H GLU A 53 -17.335 4.383 11.313 1.00 0.00 H new ATOM 0 HA GLU A 53 -17.724 2.574 13.596 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.851 2.882 10.970 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -18.034 1.332 11.018 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -19.566 1.731 13.455 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.587 1.979 12.052 1.00 0.00 H new ATOM 765 N VAL A 54 -15.962 0.808 13.010 1.00 0.00 N ATOM 766 CA VAL A 54 -14.750 0.007 12.908 1.00 0.00 C ATOM 767 C VAL A 54 -14.738 -0.812 11.622 1.00 0.00 C ATOM 768 O VAL A 54 -13.768 -0.785 10.865 1.00 0.00 O ATOM 769 CB VAL A 54 -14.602 -0.945 14.110 1.00 0.00 C ATOM 770 CG1 VAL A 54 -13.241 -1.623 14.092 1.00 0.00 C ATOM 771 CG2 VAL A 54 -14.815 -0.194 15.416 1.00 0.00 C ATOM 0 H VAL A 54 -16.683 0.407 13.610 1.00 0.00 H new ATOM 0 HA VAL A 54 -13.912 0.704 12.900 1.00 0.00 H new ATOM 0 HB VAL A 54 -15.367 -1.718 14.033 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -13.156 -2.291 14.949 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -13.133 -2.197 13.172 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -12.457 -0.867 14.142 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -14.707 -0.883 16.254 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -14.075 0.602 15.503 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -15.816 0.238 15.428 1.00 0.00 H new ATOM 781 N ASP A 55 -15.824 -1.540 11.382 1.00 0.00 N ATOM 782 CA ASP A 55 -15.939 -2.367 10.187 1.00 0.00 C ATOM 783 C ASP A 55 -16.588 -1.590 9.047 1.00 0.00 C ATOM 784 O ASP A 55 -17.781 -1.741 8.779 1.00 0.00 O ATOM 785 CB ASP A 55 -16.754 -3.627 10.490 1.00 0.00 C ATOM 786 CG ASP A 55 -18.135 -3.305 11.025 1.00 0.00 C ATOM 787 OD1 ASP A 55 -18.247 -2.400 11.878 1.00 0.00 O ATOM 788 OD2 ASP A 55 -19.106 -3.961 10.592 1.00 0.00 O ATOM 0 H ASP A 55 -16.636 -1.574 11.999 1.00 0.00 H new ATOM 0 HA ASP A 55 -14.935 -2.657 9.879 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -16.849 -4.223 9.582 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -16.218 -4.237 11.217 1.00 0.00 H new ATOM 793 N GLU A 56 -15.796 -0.759 8.377 1.00 0.00 N ATOM 794 CA GLU A 56 -16.294 0.042 7.266 1.00 0.00 C ATOM 795 C GLU A 56 -15.326 0.000 6.088 1.00 0.00 C ATOM 796 O GLU A 56 -14.249 -0.592 6.178 1.00 0.00 O ATOM 797 CB GLU A 56 -16.513 1.490 7.710 1.00 0.00 C ATOM 798 CG GLU A 56 -17.695 2.162 7.031 1.00 0.00 C ATOM 799 CD GLU A 56 -18.430 3.117 7.952 1.00 0.00 C ATOM 800 OE1 GLU A 56 -17.956 4.260 8.123 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.480 2.722 8.501 1.00 0.00 O ATOM 0 H GLU A 56 -14.807 -0.623 8.585 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.247 -0.380 6.946 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -16.664 1.511 8.789 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.611 2.065 7.503 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.344 2.706 6.154 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -18.388 1.399 6.677 1.00 0.00 H new ATOM 808 N GLY A 57 -15.714 0.631 4.985 1.00 0.00 N ATOM 809 CA GLY A 57 -14.869 0.653 3.805 1.00 0.00 C ATOM 810 C GLY A 57 -14.349 2.043 3.489 1.00 0.00 C ATOM 811 O GLY A 57 -15.002 3.038 3.802 1.00 0.00 O ATOM 0 H GLY A 57 -16.599 1.128 4.887 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -14.026 -0.022 3.953 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.433 0.277 2.951 1.00 0.00 H new ATOM 815 N PRO A 58 -13.163 2.144 2.862 1.00 0.00 N ATOM 816 CA PRO A 58 -12.566 3.436 2.507 1.00 0.00 C ATOM 817 C PRO A 58 -13.325 4.136 1.385 1.00 0.00 C ATOM 818 O PRO A 58 -14.078 3.506 0.644 1.00 0.00 O ATOM 819 CB PRO A 58 -11.156 3.061 2.048 1.00 0.00 C ATOM 820 CG PRO A 58 -11.273 1.652 1.578 1.00 0.00 C ATOM 821 CD PRO A 58 -12.316 1.010 2.450 1.00 0.00 C ATOM 0 HA PRO A 58 -12.584 4.137 3.342 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.812 3.718 1.249 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.438 3.148 2.863 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.564 1.614 0.528 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.319 1.132 1.663 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.888 0.259 1.905 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.869 0.510 3.309 1.00 0.00 H new ATOM 829 N SER A 59 -13.120 5.444 1.267 1.00 0.00 N ATOM 830 CA SER A 59 -13.784 6.232 0.235 1.00 0.00 C ATOM 831 C SER A 59 -13.160 5.972 -1.135 1.00 0.00 C ATOM 832 O SER A 59 -12.048 5.453 -1.231 1.00 0.00 O ATOM 833 CB SER A 59 -13.700 7.722 0.571 1.00 0.00 C ATOM 834 OG SER A 59 -14.025 7.957 1.931 1.00 0.00 O ATOM 0 H SER A 59 -12.499 5.980 1.873 1.00 0.00 H new ATOM 0 HA SER A 59 -14.831 5.932 0.200 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.694 8.088 0.366 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.380 8.282 -0.071 1.00 0.00 H new ATOM 0 HG SER A 59 -13.962 8.916 2.121 1.00 0.00 H new ATOM 840 N PRO A 60 -13.871 6.333 -2.217 1.00 0.00 N ATOM 841 CA PRO A 60 -13.382 6.136 -3.586 1.00 0.00 C ATOM 842 C PRO A 60 -11.982 6.712 -3.799 1.00 0.00 C ATOM 843 O PRO A 60 -11.111 6.041 -4.352 1.00 0.00 O ATOM 844 CB PRO A 60 -14.407 6.879 -4.445 1.00 0.00 C ATOM 845 CG PRO A 60 -15.652 6.891 -3.628 1.00 0.00 C ATOM 846 CD PRO A 60 -15.206 6.960 -2.192 1.00 0.00 C ATOM 0 HA PRO A 60 -13.289 5.078 -3.833 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -14.073 7.892 -4.672 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -14.564 6.374 -5.398 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -16.278 7.746 -3.884 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -16.246 5.995 -3.809 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -15.160 7.989 -1.835 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.889 6.424 -1.533 1.00 0.00 H new ATOM 854 N PRO A 61 -11.739 7.966 -3.367 1.00 0.00 N ATOM 855 CA PRO A 61 -10.430 8.606 -3.528 1.00 0.00 C ATOM 856 C PRO A 61 -9.379 8.023 -2.589 1.00 0.00 C ATOM 857 O PRO A 61 -8.181 8.092 -2.863 1.00 0.00 O ATOM 858 CB PRO A 61 -10.706 10.070 -3.181 1.00 0.00 C ATOM 859 CG PRO A 61 -11.871 10.025 -2.257 1.00 0.00 C ATOM 860 CD PRO A 61 -12.709 8.855 -2.695 1.00 0.00 C ATOM 0 HA PRO A 61 -10.026 8.461 -4.530 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.842 10.534 -2.706 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.931 10.653 -4.074 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.544 9.905 -1.224 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.442 10.952 -2.305 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.184 8.362 -1.847 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.506 9.163 -3.372 1.00 0.00 H new ATOM 868 N GLU A 62 -9.835 7.448 -1.480 1.00 0.00 N ATOM 869 CA GLU A 62 -8.933 6.852 -0.502 1.00 0.00 C ATOM 870 C GLU A 62 -8.427 5.496 -0.985 1.00 0.00 C ATOM 871 O GLU A 62 -7.308 5.092 -0.669 1.00 0.00 O ATOM 872 CB GLU A 62 -9.638 6.696 0.847 1.00 0.00 C ATOM 873 CG GLU A 62 -9.408 7.865 1.792 1.00 0.00 C ATOM 874 CD GLU A 62 -10.343 7.843 2.985 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.901 6.765 3.283 1.00 0.00 O ATOM 876 OE2 GLU A 62 -10.518 8.903 3.622 1.00 0.00 O ATOM 0 H GLU A 62 -10.823 7.383 -1.237 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.078 7.517 -0.381 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.709 6.582 0.677 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.292 5.780 1.325 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.376 7.846 2.143 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.542 8.800 1.247 1.00 0.00 H new ATOM 883 N GLN A 63 -9.258 4.798 -1.751 1.00 0.00 N ATOM 884 CA GLN A 63 -8.894 3.488 -2.278 1.00 0.00 C ATOM 885 C GLN A 63 -7.726 3.598 -3.252 1.00 0.00 C ATOM 886 O GLN A 63 -7.708 4.472 -4.119 1.00 0.00 O ATOM 887 CB GLN A 63 -10.094 2.842 -2.974 1.00 0.00 C ATOM 888 CG GLN A 63 -11.384 2.934 -2.176 1.00 0.00 C ATOM 889 CD GLN A 63 -12.154 1.627 -2.160 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.858 0.709 -2.924 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.149 1.538 -1.285 1.00 0.00 N ATOM 0 H GLN A 63 -10.188 5.117 -2.021 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.588 2.861 -1.441 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.241 3.319 -3.943 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.870 1.793 -3.166 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -11.153 3.228 -1.152 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -12.013 3.717 -2.599 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.360 2.324 -0.670 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.703 0.683 -1.228 1.00 0.00 H new ATOM 900 N PHE A 64 -6.751 2.707 -3.103 1.00 0.00 N ATOM 901 CA PHE A 64 -5.579 2.704 -3.971 1.00 0.00 C ATOM 902 C PHE A 64 -5.459 1.379 -4.719 1.00 0.00 C ATOM 903 O PHE A 64 -6.162 0.416 -4.411 1.00 0.00 O ATOM 904 CB PHE A 64 -4.311 2.957 -3.151 1.00 0.00 C ATOM 905 CG PHE A 64 -4.286 4.303 -2.486 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.894 5.430 -3.188 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.654 4.440 -1.156 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.871 6.671 -2.578 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.631 5.677 -0.540 1.00 0.00 C ATOM 910 CZ PHE A 64 -4.239 6.794 -1.253 1.00 0.00 C ATOM 0 H PHE A 64 -6.749 1.978 -2.390 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.697 3.504 -4.702 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.220 2.183 -2.389 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.442 2.867 -3.803 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.603 5.339 -4.224 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.962 3.570 -0.595 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.566 7.543 -3.137 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.919 5.771 0.497 1.00 0.00 H new ATOM 0 HZ PHE A 64 -4.221 7.762 -0.774 1.00 0.00 H new ATOM 920 N THR A 65 -4.566 1.339 -5.701 1.00 0.00 N ATOM 921 CA THR A 65 -4.356 0.132 -6.494 1.00 0.00 C ATOM 922 C THR A 65 -2.877 -0.241 -6.535 1.00 0.00 C ATOM 923 O THR A 65 -2.019 0.606 -6.783 1.00 0.00 O ATOM 924 CB THR A 65 -4.884 0.332 -7.916 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.839 1.377 -7.954 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.534 -0.907 -8.492 1.00 0.00 C ATOM 0 H THR A 65 -3.976 2.127 -5.968 1.00 0.00 H new ATOM 0 HA THR A 65 -4.905 -0.683 -6.022 1.00 0.00 H new ATOM 0 HB THR A 65 -4.009 0.576 -8.518 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.572 1.128 -8.555 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.887 -0.697 -9.502 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.807 -1.718 -8.523 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.378 -1.199 -7.867 1.00 0.00 H new ATOM 934 N ALA A 66 -2.587 -1.514 -6.287 1.00 0.00 N ATOM 935 CA ALA A 66 -1.213 -2.001 -6.296 1.00 0.00 C ATOM 936 C ALA A 66 -0.865 -2.641 -7.637 1.00 0.00 C ATOM 937 O ALA A 66 -1.745 -3.120 -8.352 1.00 0.00 O ATOM 938 CB ALA A 66 -0.998 -2.993 -5.164 1.00 0.00 C ATOM 0 H ALA A 66 -3.286 -2.227 -6.077 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.551 -1.148 -6.148 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.032 -3.349 -5.183 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -1.196 -2.505 -4.210 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.676 -3.838 -5.287 1.00 0.00 H new ATOM 944 N VAL A 67 0.420 -2.643 -7.971 1.00 0.00 N ATOM 945 CA VAL A 67 0.883 -3.224 -9.226 1.00 0.00 C ATOM 946 C VAL A 67 2.319 -3.722 -9.106 1.00 0.00 C ATOM 947 O VAL A 67 3.250 -2.932 -8.949 1.00 0.00 O ATOM 948 CB VAL A 67 0.801 -2.208 -10.380 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.095 -2.884 -11.710 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.564 -1.537 -10.405 1.00 0.00 C ATOM 0 H VAL A 67 1.160 -2.249 -7.390 1.00 0.00 H new ATOM 0 HA VAL A 67 0.226 -4.066 -9.444 1.00 0.00 H new ATOM 0 HB VAL A 67 1.556 -1.439 -10.216 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.032 -2.150 -12.513 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.097 -3.312 -11.687 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.367 -3.676 -11.885 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.603 -0.822 -11.227 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.338 -2.292 -10.543 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.730 -1.015 -9.463 1.00 0.00 H new ATOM 960 N LYS A 68 2.492 -5.038 -9.181 1.00 0.00 N ATOM 961 CA LYS A 68 3.817 -5.642 -9.082 1.00 0.00 C ATOM 962 C LYS A 68 4.677 -5.264 -10.283 1.00 0.00 C ATOM 963 O LYS A 68 4.207 -5.266 -11.421 1.00 0.00 O ATOM 964 CB LYS A 68 3.700 -7.164 -8.981 1.00 0.00 C ATOM 965 CG LYS A 68 3.057 -7.642 -7.690 1.00 0.00 C ATOM 966 CD LYS A 68 3.103 -9.156 -7.573 1.00 0.00 C ATOM 967 CE LYS A 68 4.458 -9.637 -7.079 1.00 0.00 C ATOM 968 NZ LYS A 68 4.734 -11.041 -7.491 1.00 0.00 N ATOM 0 H LYS A 68 1.732 -5.706 -9.310 1.00 0.00 H new ATOM 0 HA LYS A 68 4.297 -5.262 -8.180 1.00 0.00 H new ATOM 0 HB2 LYS A 68 3.117 -7.532 -9.825 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.694 -7.603 -9.066 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.570 -7.194 -6.839 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.021 -7.304 -7.651 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.325 -9.493 -6.888 1.00 0.00 H new ATOM 0 HD3 LYS A 68 2.889 -9.603 -8.544 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.239 -8.984 -7.469 1.00 0.00 H new ATOM 0 HE3 LYS A 68 4.495 -9.564 -5.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 5.667 -11.330 -7.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.003 -11.668 -7.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 4.725 -11.106 -8.529 1.00 0.00 H new ATOM 982 N LEU A 69 5.939 -4.939 -10.023 1.00 0.00 N ATOM 983 CA LEU A 69 6.864 -4.560 -11.086 1.00 0.00 C ATOM 984 C LEU A 69 8.086 -5.474 -11.099 1.00 0.00 C ATOM 985 O LEU A 69 8.277 -6.256 -12.030 1.00 0.00 O ATOM 986 CB LEU A 69 7.301 -3.103 -10.915 1.00 0.00 C ATOM 987 CG LEU A 69 6.187 -2.137 -10.508 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.772 -0.810 -10.049 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.221 -1.925 -11.664 1.00 0.00 C ATOM 0 H LEU A 69 6.345 -4.930 -9.087 1.00 0.00 H new ATOM 0 HA LEU A 69 6.346 -4.667 -12.039 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.089 -3.062 -10.163 1.00 0.00 H new ATOM 0 HB3 LEU A 69 7.736 -2.758 -11.853 1.00 0.00 H new ATOM 0 HG LEU A 69 5.637 -2.574 -9.675 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.965 -0.136 -9.764 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.425 -0.977 -9.193 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.346 -0.365 -10.862 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.434 -1.235 -11.359 1.00 0.00 H new ATOM 0 HD22 LEU A 69 5.759 -1.508 -12.516 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.777 -2.879 -11.947 1.00 0.00 H new ATOM 1001 N SER A 70 8.912 -5.370 -10.061 1.00 0.00 N ATOM 1002 CA SER A 70 10.114 -6.189 -9.955 1.00 0.00 C ATOM 1003 C SER A 70 10.880 -5.870 -8.674 1.00 0.00 C ATOM 1004 O SER A 70 10.761 -4.775 -8.125 1.00 0.00 O ATOM 1005 CB SER A 70 11.018 -5.966 -11.172 1.00 0.00 C ATOM 1006 OG SER A 70 11.439 -7.200 -11.727 1.00 0.00 O ATOM 0 H SER A 70 8.770 -4.727 -9.282 1.00 0.00 H new ATOM 0 HA SER A 70 9.808 -7.235 -9.923 1.00 0.00 H new ATOM 0 HB2 SER A 70 10.483 -5.388 -11.926 1.00 0.00 H new ATOM 0 HB3 SER A 70 11.889 -5.379 -10.880 1.00 0.00 H new ATOM 0 HG SER A 70 12.013 -7.031 -12.503 1.00 0.00 H new ATOM 1012 N ASP A 71 11.663 -6.835 -8.204 1.00 0.00 N ATOM 1013 CA ASP A 71 12.450 -6.658 -6.989 1.00 0.00 C ATOM 1014 C ASP A 71 11.554 -6.313 -5.802 1.00 0.00 C ATOM 1015 O ASP A 71 11.943 -5.546 -4.921 1.00 0.00 O ATOM 1016 CB ASP A 71 13.496 -5.560 -7.189 1.00 0.00 C ATOM 1017 CG ASP A 71 14.738 -6.066 -7.893 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.156 -7.210 -7.613 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.296 -5.319 -8.726 1.00 0.00 O ATOM 0 H ASP A 71 11.770 -7.748 -8.646 1.00 0.00 H new ATOM 0 HA ASP A 71 12.957 -7.599 -6.776 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.059 -4.747 -7.769 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.774 -5.146 -6.220 1.00 0.00 H new ATOM 1024 N SER A 72 10.355 -6.885 -5.787 1.00 0.00 N ATOM 1025 CA SER A 72 9.405 -6.636 -4.709 1.00 0.00 C ATOM 1026 C SER A 72 9.048 -5.156 -4.628 1.00 0.00 C ATOM 1027 O SER A 72 9.002 -4.576 -3.542 1.00 0.00 O ATOM 1028 CB SER A 72 9.984 -7.110 -3.373 1.00 0.00 C ATOM 1029 OG SER A 72 9.701 -8.480 -3.151 1.00 0.00 O ATOM 0 H SER A 72 10.018 -7.523 -6.508 1.00 0.00 H new ATOM 0 HA SER A 72 8.495 -7.197 -4.922 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.063 -6.952 -3.364 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.568 -6.514 -2.561 1.00 0.00 H new ATOM 0 HG SER A 72 10.083 -8.758 -2.292 1.00 0.00 H new ATOM 1035 N ARG A 73 8.795 -4.549 -5.783 1.00 0.00 N ATOM 1036 CA ARG A 73 8.442 -3.135 -5.843 1.00 0.00 C ATOM 1037 C ARG A 73 7.048 -2.947 -6.431 1.00 0.00 C ATOM 1038 O ARG A 73 6.800 -3.285 -7.588 1.00 0.00 O ATOM 1039 CB ARG A 73 9.469 -2.366 -6.677 1.00 0.00 C ATOM 1040 CG ARG A 73 10.905 -2.590 -6.233 1.00 0.00 C ATOM 1041 CD ARG A 73 11.152 -2.028 -4.842 1.00 0.00 C ATOM 1042 NE ARG A 73 11.787 -0.713 -4.888 1.00 0.00 N ATOM 1043 CZ ARG A 73 13.073 -0.520 -5.173 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.863 -1.554 -5.438 1.00 0.00 N ATOM 1045 NH2 ARG A 73 13.570 0.708 -5.193 1.00 0.00 N ATOM 0 H ARG A 73 8.828 -5.014 -6.690 1.00 0.00 H new ATOM 0 HA ARG A 73 8.443 -2.742 -4.826 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.370 -2.661 -7.722 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.243 -1.301 -6.624 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.127 -3.657 -6.240 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.584 -2.118 -6.943 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.205 -1.955 -4.307 1.00 0.00 H new ATOM 0 HD3 ARG A 73 11.783 -2.716 -4.280 1.00 0.00 H new ATOM 0 HE ARG A 73 11.211 0.105 -4.690 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.485 -2.501 -5.424 1.00 0.00 H new ATOM 0 HH12 ARG A 73 14.848 -1.401 -5.656 1.00 0.00 H new ATOM 0 HH21 ARG A 73 12.967 1.505 -4.990 1.00 0.00 H new ATOM 0 HH22 ARG A 73 14.555 0.856 -5.411 1.00 0.00 H new ATOM 1059 N ILE A 74 6.140 -2.403 -5.626 1.00 0.00 N ATOM 1060 CA ILE A 74 4.770 -2.168 -6.066 1.00 0.00 C ATOM 1061 C ILE A 74 4.492 -0.677 -6.224 1.00 0.00 C ATOM 1062 O ILE A 74 4.968 0.140 -5.436 1.00 0.00 O ATOM 1063 CB ILE A 74 3.751 -2.766 -5.078 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.100 -2.365 -3.644 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.704 -4.281 -5.216 1.00 0.00 C ATOM 1066 CD1 ILE A 74 2.889 -2.197 -2.751 1.00 0.00 C ATOM 0 H ILE A 74 6.329 -2.117 -4.665 1.00 0.00 H new ATOM 0 HA ILE A 74 4.660 -2.661 -7.032 1.00 0.00 H new ATOM 0 HB ILE A 74 2.764 -2.369 -5.314 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.757 -3.121 -3.214 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.660 -1.430 -3.663 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.979 -4.688 -4.511 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.410 -4.545 -6.232 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.689 -4.696 -5.004 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.212 -1.912 -1.750 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.242 -1.420 -3.158 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.340 -3.137 -2.702 1.00 0.00 H new ATOM 1078 N ALA A 75 3.718 -0.329 -7.248 1.00 0.00 N ATOM 1079 CA ALA A 75 3.377 1.063 -7.508 1.00 0.00 C ATOM 1080 C ALA A 75 1.961 1.378 -7.041 1.00 0.00 C ATOM 1081 O ALA A 75 1.000 0.733 -7.460 1.00 0.00 O ATOM 1082 CB ALA A 75 3.526 1.373 -8.990 1.00 0.00 C ATOM 0 H ALA A 75 3.316 -0.993 -7.910 1.00 0.00 H new ATOM 0 HA ALA A 75 4.066 1.692 -6.944 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.268 2.416 -9.171 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.557 1.195 -9.297 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.860 0.730 -9.565 1.00 0.00 H new ATOM 1088 N LEU A 76 1.839 2.374 -6.168 1.00 0.00 N ATOM 1089 CA LEU A 76 0.538 2.774 -5.643 1.00 0.00 C ATOM 1090 C LEU A 76 -0.210 3.644 -6.646 1.00 0.00 C ATOM 1091 O LEU A 76 0.366 4.549 -7.251 1.00 0.00 O ATOM 1092 CB LEU A 76 0.709 3.530 -4.323 1.00 0.00 C ATOM 1093 CG LEU A 76 1.004 2.650 -3.107 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.091 3.494 -1.845 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.062 1.574 -2.958 1.00 0.00 C ATOM 0 H LEU A 76 2.624 2.918 -5.810 1.00 0.00 H new ATOM 0 HA LEU A 76 -0.047 1.872 -5.465 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.519 4.250 -4.437 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.199 4.100 -4.128 1.00 0.00 H new ATOM 0 HG LEU A 76 1.967 2.163 -3.260 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.301 2.851 -0.991 1.00 0.00 H new ATOM 0 HD12 LEU A 76 1.890 4.228 -1.952 1.00 0.00 H new ATOM 0 HD13 LEU A 76 0.144 4.010 -1.686 1.00 0.00 H new ATOM 0 HD21 LEU A 76 0.163 0.957 -2.088 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.037 2.043 -2.827 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.077 0.950 -3.852 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.499 3.364 -6.819 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.327 4.122 -7.750 1.00 0.00 C ATOM 1109 C LYS A 77 -3.511 4.760 -7.030 1.00 0.00 C ATOM 1110 O LYS A 77 -4.326 4.066 -6.421 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.830 3.213 -8.873 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.459 3.970 -10.033 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.367 3.071 -10.857 1.00 0.00 C ATOM 1114 CE LYS A 77 -5.836 3.338 -10.564 1.00 0.00 C ATOM 1115 NZ LYS A 77 -6.505 4.055 -11.686 1.00 0.00 N ATOM 0 H LYS A 77 -1.991 2.619 -6.327 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.715 4.915 -8.179 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.997 2.617 -9.247 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.562 2.516 -8.465 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.032 4.815 -9.650 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.675 4.379 -10.670 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.172 3.230 -11.918 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.137 2.027 -10.644 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -6.347 2.393 -10.381 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.923 3.929 -9.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -7.191 4.736 -11.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -5.792 4.562 -12.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.999 3.369 -12.291 1.00 0.00 H new ATOM 1129 N SER A 78 -3.598 6.084 -7.102 1.00 0.00 N ATOM 1130 CA SER A 78 -4.682 6.815 -6.457 1.00 0.00 C ATOM 1131 C SER A 78 -6.013 6.539 -7.150 1.00 0.00 C ATOM 1132 O SER A 78 -6.048 6.187 -8.329 1.00 0.00 O ATOM 1133 CB SER A 78 -4.390 8.316 -6.467 1.00 0.00 C ATOM 1134 OG SER A 78 -4.219 8.794 -7.790 1.00 0.00 O ATOM 0 H SER A 78 -2.931 6.673 -7.601 1.00 0.00 H new ATOM 0 HA SER A 78 -4.753 6.473 -5.425 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.208 8.852 -5.986 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.491 8.519 -5.885 1.00 0.00 H new ATOM 0 HG SER A 78 -4.507 9.729 -7.840 1.00 0.00 H new ATOM 1140 N GLY A 79 -7.104 6.700 -6.409 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.422 6.464 -6.969 1.00 0.00 C ATOM 1142 C GLY A 79 -8.716 7.355 -8.159 1.00 0.00 C ATOM 1143 O GLY A 79 -9.477 6.981 -9.051 1.00 0.00 O ATOM 0 H GLY A 79 -7.099 6.990 -5.431 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.503 5.420 -7.272 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.175 6.631 -6.199 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.112 8.540 -8.172 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.313 9.488 -9.262 1.00 0.00 C ATOM 1149 C TYR A 80 -7.738 8.948 -10.567 1.00 0.00 C ATOM 1150 O TYR A 80 -8.307 9.153 -11.639 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.663 10.831 -8.923 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.456 11.656 -7.934 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.635 12.286 -8.314 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -8.027 11.804 -6.621 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.363 13.040 -7.414 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -8.750 12.556 -5.715 1.00 0.00 C ATOM 1157 CZ TYR A 80 -9.917 13.173 -6.116 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.638 13.923 -5.217 1.00 0.00 O ATOM 0 H TYR A 80 -7.480 8.866 -7.441 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.386 9.632 -9.391 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.667 10.651 -8.517 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.534 11.405 -9.841 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.988 12.184 -9.330 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -7.113 11.323 -6.303 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.277 13.523 -7.726 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -8.403 12.660 -4.698 1.00 0.00 H new ATOM 0 HH TYR A 80 -10.449 14.874 -5.359 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.607 8.256 -10.468 1.00 0.00 N ATOM 1169 CA GLY A 81 -5.975 7.696 -11.648 1.00 0.00 C ATOM 1170 C GLY A 81 -4.536 8.149 -11.805 1.00 0.00 C ATOM 1171 O GLY A 81 -4.088 8.445 -12.913 1.00 0.00 O ATOM 0 H GLY A 81 -6.117 8.073 -9.592 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.006 6.608 -11.591 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.542 7.986 -12.532 1.00 0.00 H new ATOM 1175 N LYS A 82 -3.811 8.205 -10.693 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.415 8.626 -10.712 1.00 0.00 C ATOM 1177 C LYS A 82 -1.559 7.711 -9.843 1.00 0.00 C ATOM 1178 O LYS A 82 -2.077 6.953 -9.023 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.289 10.071 -10.228 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.505 11.102 -11.325 1.00 0.00 C ATOM 1181 CD LYS A 82 -3.036 12.411 -10.764 1.00 0.00 C ATOM 1182 CE LYS A 82 -4.530 12.555 -11.005 1.00 0.00 C ATOM 1183 NZ LYS A 82 -5.139 13.583 -10.116 1.00 0.00 N ATOM 0 H LYS A 82 -4.167 7.964 -9.768 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.057 8.562 -11.739 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.013 10.243 -9.432 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.299 10.215 -9.795 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.565 11.283 -11.845 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.206 10.710 -12.061 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -2.833 12.459 -9.694 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.510 13.246 -11.226 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.705 12.825 -12.046 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.019 11.595 -10.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -6.158 13.651 -10.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.994 13.312 -9.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -4.690 14.505 -10.293 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.244 7.787 -10.028 1.00 0.00 N ATOM 1198 CA TYR A 83 0.684 6.965 -9.261 1.00 0.00 C ATOM 1199 C TYR A 83 1.350 7.782 -8.159 1.00 0.00 C ATOM 1200 O TYR A 83 1.949 8.825 -8.419 1.00 0.00 O ATOM 1201 CB TYR A 83 1.751 6.368 -10.182 1.00 0.00 C ATOM 1202 CG TYR A 83 1.237 5.245 -11.055 1.00 0.00 C ATOM 1203 CD1 TYR A 83 0.686 4.100 -10.494 1.00 0.00 C ATOM 1204 CD2 TYR A 83 1.302 5.330 -12.440 1.00 0.00 C ATOM 1205 CE1 TYR A 83 0.215 3.071 -11.288 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.833 4.306 -13.241 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.292 3.179 -12.660 1.00 0.00 C ATOM 1208 OH TYR A 83 -0.176 2.158 -13.454 1.00 0.00 O ATOM 0 H TYR A 83 0.202 8.409 -10.702 1.00 0.00 H new ATOM 0 HA TYR A 83 0.117 6.156 -8.799 1.00 0.00 H new ATOM 0 HB2 TYR A 83 2.153 7.157 -10.818 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.577 5.996 -9.575 1.00 0.00 H new ATOM 0 HD1 TYR A 83 0.625 4.012 -9.419 1.00 0.00 H new ATOM 0 HD2 TYR A 83 1.726 6.211 -12.899 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -0.211 2.187 -10.836 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.890 4.388 -14.316 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.049 2.392 -14.397 1.00 0.00 H new ATOM 1218 N LEU A 84 1.240 7.300 -6.925 1.00 0.00 N ATOM 1219 CA LEU A 84 1.831 7.987 -5.782 1.00 0.00 C ATOM 1220 C LEU A 84 3.351 8.017 -5.892 1.00 0.00 C ATOM 1221 O LEU A 84 3.991 6.982 -6.083 1.00 0.00 O ATOM 1222 CB LEU A 84 1.416 7.301 -4.478 1.00 0.00 C ATOM 1223 CG LEU A 84 0.028 7.683 -3.959 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.292 6.922 -2.682 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.056 9.183 -3.722 1.00 0.00 C ATOM 0 H LEU A 84 0.748 6.438 -6.691 1.00 0.00 H new ATOM 0 HA LEU A 84 1.465 9.014 -5.778 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.447 6.222 -4.627 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.152 7.538 -3.710 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.710 7.411 -4.714 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.283 7.206 -2.328 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.272 5.851 -2.882 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.449 7.163 -1.920 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.049 9.438 -3.353 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.691 9.477 -2.985 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.130 9.710 -4.658 1.00 0.00 H new ATOM 1237 N GLY A 85 3.925 9.210 -5.770 1.00 0.00 N ATOM 1238 CA GLY A 85 5.366 9.353 -5.859 1.00 0.00 C ATOM 1239 C GLY A 85 5.903 10.422 -4.929 1.00 0.00 C ATOM 1240 O GLY A 85 5.194 11.369 -4.586 1.00 0.00 O ATOM 0 H GLY A 85 3.417 10.080 -5.611 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.838 8.399 -5.621 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.641 9.598 -6.885 1.00 0.00 H new ATOM 1244 N ILE A 86 7.159 10.272 -4.521 1.00 0.00 N ATOM 1245 CA ILE A 86 7.790 11.234 -3.625 1.00 0.00 C ATOM 1246 C ILE A 86 8.428 12.377 -4.406 1.00 0.00 C ATOM 1247 O ILE A 86 8.956 12.175 -5.499 1.00 0.00 O ATOM 1248 CB ILE A 86 8.866 10.563 -2.749 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.913 9.874 -3.626 1.00 0.00 C ATOM 1250 CG2 ILE A 86 8.227 9.566 -1.794 1.00 0.00 C ATOM 1251 CD1 ILE A 86 11.326 10.007 -3.099 1.00 0.00 C ATOM 0 H ILE A 86 7.759 9.495 -4.796 1.00 0.00 H new ATOM 0 HA ILE A 86 7.004 11.631 -2.983 1.00 0.00 H new ATOM 0 HB ILE A 86 9.364 11.333 -2.159 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.664 8.816 -3.712 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.867 10.295 -4.630 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.000 9.101 -1.183 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.517 10.084 -1.149 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.705 8.798 -2.365 1.00 0.00 H new ATOM 0 HD11 ILE A 86 12.015 9.495 -3.771 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.594 11.062 -3.039 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.388 9.560 -2.107 1.00 0.00 H new ATOM 1263 N ASN A 87 8.375 13.577 -3.838 1.00 0.00 N ATOM 1264 CA ASN A 87 8.948 14.754 -4.481 1.00 0.00 C ATOM 1265 C ASN A 87 10.443 14.853 -4.199 1.00 0.00 C ATOM 1266 O ASN A 87 10.998 14.051 -3.448 1.00 0.00 O ATOM 1267 CB ASN A 87 8.238 16.021 -3.998 1.00 0.00 C ATOM 1268 CG ASN A 87 7.125 16.451 -4.933 1.00 0.00 C ATOM 1269 OD1 ASN A 87 7.178 16.202 -6.137 1.00 0.00 O ATOM 1270 ND2 ASN A 87 6.108 17.104 -4.382 1.00 0.00 N ATOM 0 H ASN A 87 7.941 13.760 -2.933 1.00 0.00 H new ATOM 0 HA ASN A 87 8.806 14.656 -5.557 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.827 15.847 -3.004 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.964 16.829 -3.906 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.331 17.420 -4.962 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.104 17.289 -3.379 1.00 0.00 H new ATOM 1277 N SER A 88 11.090 15.843 -4.806 1.00 0.00 N ATOM 1278 CA SER A 88 12.522 16.047 -4.619 1.00 0.00 C ATOM 1279 C SER A 88 12.810 16.670 -3.257 1.00 0.00 C ATOM 1280 O SER A 88 13.855 16.418 -2.657 1.00 0.00 O ATOM 1281 CB SER A 88 13.079 16.939 -5.731 1.00 0.00 C ATOM 1282 OG SER A 88 14.330 16.459 -6.192 1.00 0.00 O ATOM 0 H SER A 88 10.646 16.516 -5.431 1.00 0.00 H new ATOM 0 HA SER A 88 13.012 15.074 -4.663 1.00 0.00 H new ATOM 0 HB2 SER A 88 12.372 16.976 -6.560 1.00 0.00 H new ATOM 0 HB3 SER A 88 13.191 17.958 -5.362 1.00 0.00 H new ATOM 0 HG SER A 88 14.663 17.045 -6.903 1.00 0.00 H new ATOM 1288 N ASP A 89 11.877 17.484 -2.775 1.00 0.00 N ATOM 1289 CA ASP A 89 12.031 18.142 -1.483 1.00 0.00 C ATOM 1290 C ASP A 89 11.816 17.155 -0.339 1.00 0.00 C ATOM 1291 O ASP A 89 12.592 17.116 0.615 1.00 0.00 O ATOM 1292 CB ASP A 89 11.048 19.309 -1.361 1.00 0.00 C ATOM 1293 CG ASP A 89 11.747 20.633 -1.126 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.747 20.908 -1.823 1.00 0.00 O ATOM 1295 OD2 ASP A 89 11.296 21.396 -0.246 1.00 0.00 O ATOM 0 H ASP A 89 11.007 17.704 -3.259 1.00 0.00 H new ATOM 0 HA ASP A 89 13.049 18.526 -1.418 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.451 19.373 -2.270 1.00 0.00 H new ATOM 0 HB3 ASP A 89 10.358 19.115 -0.540 1.00 0.00 H new ATOM 1300 N GLY A 90 10.758 16.357 -0.445 1.00 0.00 N ATOM 1301 CA GLY A 90 10.461 15.380 0.586 1.00 0.00 C ATOM 1302 C GLY A 90 8.989 15.346 0.948 1.00 0.00 C ATOM 1303 O GLY A 90 8.620 15.580 2.099 1.00 0.00 O ATOM 0 H GLY A 90 10.102 16.370 -1.226 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.771 14.392 0.246 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.046 15.608 1.477 1.00 0.00 H new ATOM 1307 N LEU A 91 8.147 15.053 -0.037 1.00 0.00 N ATOM 1308 CA LEU A 91 6.706 14.989 0.182 1.00 0.00 C ATOM 1309 C LEU A 91 6.075 13.891 -0.667 1.00 0.00 C ATOM 1310 O LEU A 91 6.552 13.585 -1.760 1.00 0.00 O ATOM 1311 CB LEU A 91 6.059 16.336 -0.143 1.00 0.00 C ATOM 1312 CG LEU A 91 4.754 16.623 0.602 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.031 17.376 1.894 1.00 0.00 C ATOM 1314 CD2 LEU A 91 3.798 17.411 -0.282 1.00 0.00 C ATOM 0 H LEU A 91 8.437 14.856 -0.995 1.00 0.00 H new ATOM 0 HA LEU A 91 6.534 14.755 1.233 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.772 17.129 0.085 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.865 16.380 -1.215 1.00 0.00 H new ATOM 0 HG LEU A 91 4.285 15.672 0.854 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.091 17.571 2.410 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.678 16.776 2.533 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.523 18.322 1.666 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.875 17.606 0.264 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.260 18.357 -0.564 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.574 16.835 -1.180 1.00 0.00 H new ATOM 1326 N VAL A 92 4.999 13.300 -0.157 1.00 0.00 N ATOM 1327 CA VAL A 92 4.302 12.236 -0.868 1.00 0.00 C ATOM 1328 C VAL A 92 3.166 12.796 -1.717 1.00 0.00 C ATOM 1329 O VAL A 92 2.065 13.034 -1.220 1.00 0.00 O ATOM 1330 CB VAL A 92 3.730 11.189 0.107 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.180 9.993 -0.655 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.792 10.754 1.106 1.00 0.00 C ATOM 0 H VAL A 92 4.591 13.541 0.746 1.00 0.00 H new ATOM 0 HA VAL A 92 5.035 11.756 -1.516 1.00 0.00 H new ATOM 0 HB VAL A 92 2.909 11.645 0.661 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.781 9.264 0.051 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.386 10.322 -1.325 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.979 9.534 -1.237 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.370 10.014 1.787 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.636 10.317 0.573 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.132 11.619 1.676 1.00 0.00 H new ATOM 1342 N VAL A 93 3.441 13.004 -3.000 1.00 0.00 N ATOM 1343 CA VAL A 93 2.442 13.537 -3.919 1.00 0.00 C ATOM 1344 C VAL A 93 1.997 12.478 -4.922 1.00 0.00 C ATOM 1345 O VAL A 93 2.495 11.353 -4.915 1.00 0.00 O ATOM 1346 CB VAL A 93 2.980 14.758 -4.687 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.198 15.931 -3.742 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.267 14.406 -5.416 1.00 0.00 C ATOM 0 H VAL A 93 4.347 12.812 -3.427 1.00 0.00 H new ATOM 0 HA VAL A 93 1.589 13.844 -3.314 1.00 0.00 H new ATOM 0 HB VAL A 93 2.238 15.052 -5.429 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.578 16.784 -4.303 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.252 16.199 -3.271 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.919 15.651 -2.975 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.632 15.281 -5.953 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.018 14.084 -4.694 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.075 13.600 -6.124 1.00 0.00 H new ATOM 1358 N GLY A 94 1.054 12.847 -5.784 1.00 0.00 N ATOM 1359 CA GLY A 94 0.556 11.918 -6.782 1.00 0.00 C ATOM 1360 C GLY A 94 -0.037 12.622 -7.985 1.00 0.00 C ATOM 1361 O GLY A 94 -1.215 12.977 -7.987 1.00 0.00 O ATOM 0 H GLY A 94 0.626 13.773 -5.809 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.369 11.270 -7.109 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.201 11.276 -6.331 1.00 0.00 H new ATOM 1365 N ARG A 95 0.782 12.826 -9.012 1.00 0.00 N ATOM 1366 CA ARG A 95 0.333 13.493 -10.228 1.00 0.00 C ATOM 1367 C ARG A 95 1.214 13.115 -11.415 1.00 0.00 C ATOM 1368 O ARG A 95 1.525 13.951 -12.262 1.00 0.00 O ATOM 1369 CB ARG A 95 0.342 15.011 -10.035 1.00 0.00 C ATOM 1370 CG ARG A 95 1.685 15.558 -9.574 1.00 0.00 C ATOM 1371 CD ARG A 95 2.079 16.808 -10.347 1.00 0.00 C ATOM 1372 NE ARG A 95 2.126 17.990 -9.488 1.00 0.00 N ATOM 1373 CZ ARG A 95 2.651 19.155 -9.860 1.00 0.00 C ATOM 1374 NH1 ARG A 95 3.172 19.300 -11.072 1.00 0.00 N ATOM 1375 NH2 ARG A 95 2.654 20.179 -9.018 1.00 0.00 N ATOM 0 H ARG A 95 1.761 12.539 -9.026 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.686 13.165 -10.436 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.067 15.490 -10.975 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -0.421 15.281 -9.305 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.638 15.788 -8.510 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.452 14.794 -9.702 1.00 0.00 H new ATOM 0 HD2 ARG A 95 3.055 16.656 -10.809 1.00 0.00 H new ATOM 0 HD3 ARG A 95 1.366 16.975 -11.155 1.00 0.00 H new ATOM 0 HE ARG A 95 1.734 17.918 -8.549 1.00 0.00 H new ATOM 0 HH11 ARG A 95 3.172 18.516 -11.724 1.00 0.00 H new ATOM 0 HH12 ARG A 95 3.573 20.195 -11.351 1.00 0.00 H new ATOM 0 HH21 ARG A 95 2.254 20.074 -8.086 1.00 0.00 H new ATOM 0 HH22 ARG A 95 3.056 21.072 -9.303 1.00 0.00 H new ATOM 1389 N SER A 96 1.613 11.848 -11.468 1.00 0.00 N ATOM 1390 CA SER A 96 2.459 11.359 -12.551 1.00 0.00 C ATOM 1391 C SER A 96 1.904 10.061 -13.130 1.00 0.00 C ATOM 1392 O SER A 96 1.732 9.073 -12.415 1.00 0.00 O ATOM 1393 CB SER A 96 3.888 11.141 -12.050 1.00 0.00 C ATOM 1394 OG SER A 96 4.833 11.706 -12.942 1.00 0.00 O ATOM 0 H SER A 96 1.364 11.142 -10.775 1.00 0.00 H new ATOM 0 HA SER A 96 2.470 12.111 -13.340 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.003 11.588 -11.063 1.00 0.00 H new ATOM 0 HB3 SER A 96 4.079 10.074 -11.941 1.00 0.00 H new ATOM 0 HG SER A 96 5.738 11.555 -12.598 1.00 0.00 H new ATOM 1400 N ASP A 97 1.627 10.070 -14.430 1.00 0.00 N ATOM 1401 CA ASP A 97 1.092 8.894 -15.105 1.00 0.00 C ATOM 1402 C ASP A 97 2.137 7.785 -15.177 1.00 0.00 C ATOM 1403 O ASP A 97 1.806 6.601 -15.114 1.00 0.00 O ATOM 1404 CB ASP A 97 0.622 9.259 -16.515 1.00 0.00 C ATOM 1405 CG ASP A 97 -0.381 10.396 -16.513 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -0.078 11.453 -15.922 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -1.468 10.228 -17.103 1.00 0.00 O ATOM 0 H ASP A 97 1.764 10.879 -15.036 1.00 0.00 H new ATOM 0 HA ASP A 97 0.242 8.531 -14.528 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.484 9.539 -17.121 1.00 0.00 H new ATOM 0 HB3 ASP A 97 0.173 8.383 -16.984 1.00 0.00 H new ATOM 1412 N ALA A 98 3.400 8.177 -15.308 1.00 0.00 N ATOM 1413 CA ALA A 98 4.494 7.216 -15.388 1.00 0.00 C ATOM 1414 C ALA A 98 4.785 6.602 -14.023 1.00 0.00 C ATOM 1415 O ALA A 98 4.152 6.951 -13.026 1.00 0.00 O ATOM 1416 CB ALA A 98 5.742 7.884 -15.946 1.00 0.00 C ATOM 0 H ALA A 98 3.691 9.153 -15.361 1.00 0.00 H new ATOM 0 HA ALA A 98 4.193 6.413 -16.061 1.00 0.00 H new ATOM 0 HB1 ALA A 98 6.551 7.156 -16.000 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.533 8.270 -16.944 1.00 0.00 H new ATOM 0 HB3 ALA A 98 6.037 8.706 -15.294 1.00 0.00 H new ATOM 1422 N ILE A 99 5.747 5.686 -13.984 1.00 0.00 N ATOM 1423 CA ILE A 99 6.121 5.023 -12.741 1.00 0.00 C ATOM 1424 C ILE A 99 7.636 4.954 -12.588 1.00 0.00 C ATOM 1425 O ILE A 99 8.261 3.956 -12.947 1.00 0.00 O ATOM 1426 CB ILE A 99 5.543 3.596 -12.668 1.00 0.00 C ATOM 1427 CG1 ILE A 99 4.054 3.607 -13.016 1.00 0.00 C ATOM 1428 CG2 ILE A 99 5.766 3.005 -11.284 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.491 2.232 -13.302 1.00 0.00 C ATOM 0 H ILE A 99 6.282 5.386 -14.799 1.00 0.00 H new ATOM 0 HA ILE A 99 5.704 5.618 -11.929 1.00 0.00 H new ATOM 0 HB ILE A 99 6.061 2.972 -13.396 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.499 4.054 -12.191 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.897 4.244 -13.887 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.352 1.997 -11.248 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.835 2.967 -11.073 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.271 3.627 -10.539 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.431 2.315 -13.541 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.020 1.791 -14.147 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.616 1.598 -12.424 1.00 0.00 H new ATOM 1441 N GLY A 100 8.221 6.020 -12.054 1.00 0.00 N ATOM 1442 CA GLY A 100 9.660 6.059 -11.863 1.00 0.00 C ATOM 1443 C GLY A 100 10.076 5.558 -10.493 1.00 0.00 C ATOM 1444 O GLY A 100 9.233 5.137 -9.702 1.00 0.00 O ATOM 0 H GLY A 100 7.725 6.858 -11.750 1.00 0.00 H new ATOM 0 HA2 GLY A 100 10.142 5.453 -12.630 1.00 0.00 H new ATOM 0 HA3 GLY A 100 10.014 7.081 -11.996 1.00 0.00 H new ATOM 1448 N PRO A 101 11.383 5.589 -10.182 1.00 0.00 N ATOM 1449 CA PRO A 101 11.898 5.128 -8.888 1.00 0.00 C ATOM 1450 C PRO A 101 11.176 5.778 -7.713 1.00 0.00 C ATOM 1451 O PRO A 101 10.832 5.111 -6.737 1.00 0.00 O ATOM 1452 CB PRO A 101 13.367 5.557 -8.916 1.00 0.00 C ATOM 1453 CG PRO A 101 13.714 5.631 -10.362 1.00 0.00 C ATOM 1454 CD PRO A 101 12.460 6.073 -11.066 1.00 0.00 C ATOM 0 HA PRO A 101 11.756 4.056 -8.752 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.507 6.520 -8.426 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.999 4.839 -8.394 1.00 0.00 H new ATOM 0 HG2 PRO A 101 14.527 6.337 -10.533 1.00 0.00 H new ATOM 0 HG3 PRO A 101 14.049 4.663 -10.733 1.00 0.00 H new ATOM 0 HD2 PRO A 101 12.426 7.156 -11.185 1.00 0.00 H new ATOM 0 HD3 PRO A 101 12.386 5.641 -12.064 1.00 0.00 H new ATOM 1462 N ARG A 102 10.948 7.083 -7.813 1.00 0.00 N ATOM 1463 CA ARG A 102 10.267 7.824 -6.756 1.00 0.00 C ATOM 1464 C ARG A 102 8.864 7.272 -6.521 1.00 0.00 C ATOM 1465 O ARG A 102 8.348 7.316 -5.405 1.00 0.00 O ATOM 1466 CB ARG A 102 10.187 9.309 -7.117 1.00 0.00 C ATOM 1467 CG ARG A 102 11.503 10.052 -6.931 1.00 0.00 C ATOM 1468 CD ARG A 102 12.101 10.482 -8.263 1.00 0.00 C ATOM 1469 NE ARG A 102 13.383 9.830 -8.523 1.00 0.00 N ATOM 1470 CZ ARG A 102 14.272 10.272 -9.408 1.00 0.00 C ATOM 1471 NH1 ARG A 102 14.025 11.366 -10.120 1.00 0.00 N ATOM 1472 NH2 ARG A 102 15.414 9.620 -9.583 1.00 0.00 N ATOM 0 H ARG A 102 11.224 7.650 -8.615 1.00 0.00 H new ATOM 0 HA ARG A 102 10.843 7.709 -5.838 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.868 9.406 -8.155 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.421 9.783 -6.503 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.340 10.930 -6.305 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.211 9.412 -6.404 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.404 10.245 -9.067 1.00 0.00 H new ATOM 0 HD3 ARG A 102 12.237 11.564 -8.267 1.00 0.00 H new ATOM 0 HE ARG A 102 13.609 8.987 -7.995 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.149 11.872 -9.990 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.711 11.700 -10.797 1.00 0.00 H new ATOM 0 HH21 ARG A 102 15.610 8.780 -9.039 1.00 0.00 H new ATOM 0 HH22 ARG A 102 16.096 9.959 -10.262 1.00 0.00 H new ATOM 1486 N GLU A 103 8.252 6.751 -7.580 1.00 0.00 N ATOM 1487 CA GLU A 103 6.909 6.192 -7.490 1.00 0.00 C ATOM 1488 C GLU A 103 6.944 4.761 -6.958 1.00 0.00 C ATOM 1489 O GLU A 103 5.954 4.268 -6.416 1.00 0.00 O ATOM 1490 CB GLU A 103 6.229 6.220 -8.860 1.00 0.00 C ATOM 1491 CG GLU A 103 5.646 7.576 -9.222 1.00 0.00 C ATOM 1492 CD GLU A 103 6.606 8.425 -10.033 1.00 0.00 C ATOM 1493 OE1 GLU A 103 6.792 8.129 -11.232 1.00 0.00 O ATOM 1494 OE2 GLU A 103 7.172 9.385 -9.469 1.00 0.00 O ATOM 0 H GLU A 103 8.666 6.705 -8.511 1.00 0.00 H new ATOM 0 HA GLU A 103 6.337 6.805 -6.793 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.953 5.930 -9.622 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.433 5.475 -8.877 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.726 7.432 -9.789 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.378 8.108 -8.309 1.00 0.00 H new ATOM 1501 N GLN A 104 8.085 4.097 -7.118 1.00 0.00 N ATOM 1502 CA GLN A 104 8.239 2.723 -6.655 1.00 0.00 C ATOM 1503 C GLN A 104 8.144 2.643 -5.134 1.00 0.00 C ATOM 1504 O GLN A 104 8.433 3.611 -4.431 1.00 0.00 O ATOM 1505 CB GLN A 104 9.581 2.155 -7.122 1.00 0.00 C ATOM 1506 CG GLN A 104 9.557 1.630 -8.547 1.00 0.00 C ATOM 1507 CD GLN A 104 10.710 0.692 -8.843 1.00 0.00 C ATOM 1508 OE1 GLN A 104 11.307 0.117 -7.933 1.00 0.00 O ATOM 1509 NE2 GLN A 104 11.030 0.533 -10.122 1.00 0.00 N ATOM 0 H GLN A 104 8.915 4.488 -7.564 1.00 0.00 H new ATOM 0 HA GLN A 104 7.430 2.131 -7.082 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.342 2.931 -7.043 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.878 1.348 -6.452 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.616 1.109 -8.722 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.590 2.470 -9.240 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.508 1.030 -10.844 1.00 0.00 H new ATOM 0 HE22 GLN A 104 11.798 -0.086 -10.382 1.00 0.00 H new ATOM 1518 N TRP A 105 7.737 1.480 -4.634 1.00 0.00 N ATOM 1519 CA TRP A 105 7.604 1.268 -3.196 1.00 0.00 C ATOM 1520 C TRP A 105 8.040 -0.143 -2.816 1.00 0.00 C ATOM 1521 O TRP A 105 7.712 -1.111 -3.504 1.00 0.00 O ATOM 1522 CB TRP A 105 6.158 1.504 -2.755 1.00 0.00 C ATOM 1523 CG TRP A 105 5.623 2.844 -3.158 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.804 3.115 -4.216 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.869 4.097 -2.509 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.527 4.460 -4.266 1.00 0.00 N ATOM 1527 CE2 TRP A 105 5.169 5.084 -3.228 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.614 4.480 -1.390 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 5.191 6.428 -2.864 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.635 5.815 -1.029 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.928 6.774 -1.764 1.00 0.00 C ATOM 0 H TRP A 105 7.493 0.670 -5.203 1.00 0.00 H new ATOM 0 HA TRP A 105 8.251 1.981 -2.686 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.525 0.726 -3.181 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.096 1.408 -1.671 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.429 2.380 -4.912 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.939 4.919 -4.962 1.00 0.00 H new ATOM 0 HE3 TRP A 105 7.163 3.747 -0.818 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.646 7.170 -3.429 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 7.206 6.123 -0.166 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.965 7.809 -1.456 1.00 0.00 H new ATOM 1542 N GLU A 106 8.780 -0.256 -1.718 1.00 0.00 N ATOM 1543 CA GLU A 106 9.261 -1.551 -1.249 1.00 0.00 C ATOM 1544 C GLU A 106 8.782 -1.831 0.175 1.00 0.00 C ATOM 1545 O GLU A 106 9.341 -1.307 1.137 1.00 0.00 O ATOM 1546 CB GLU A 106 10.789 -1.598 -1.301 1.00 0.00 C ATOM 1547 CG GLU A 106 11.352 -3.009 -1.370 1.00 0.00 C ATOM 1548 CD GLU A 106 12.436 -3.255 -0.338 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.584 -2.820 -0.568 1.00 0.00 O ATOM 1550 OE2 GLU A 106 12.137 -3.885 0.698 1.00 0.00 O ATOM 0 H GLU A 106 9.060 0.534 -1.136 1.00 0.00 H new ATOM 0 HA GLU A 106 8.855 -2.320 -1.907 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.132 -1.036 -2.169 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.190 -1.098 -0.419 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.545 -3.726 -1.222 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.757 -3.186 -2.366 1.00 0.00 H new ATOM 1557 N PRO A 107 7.737 -2.665 0.330 1.00 0.00 N ATOM 1558 CA PRO A 107 7.194 -3.009 1.650 1.00 0.00 C ATOM 1559 C PRO A 107 8.272 -3.512 2.604 1.00 0.00 C ATOM 1560 O PRO A 107 9.411 -3.744 2.201 1.00 0.00 O ATOM 1561 CB PRO A 107 6.189 -4.121 1.343 1.00 0.00 C ATOM 1562 CG PRO A 107 5.792 -3.896 -0.074 1.00 0.00 C ATOM 1563 CD PRO A 107 7.008 -3.340 -0.760 1.00 0.00 C ATOM 0 HA PRO A 107 6.753 -2.145 2.148 1.00 0.00 H new ATOM 0 HB2 PRO A 107 6.636 -5.106 1.477 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.327 -4.069 2.008 1.00 0.00 H new ATOM 0 HG2 PRO A 107 5.471 -4.827 -0.542 1.00 0.00 H new ATOM 0 HG3 PRO A 107 4.955 -3.201 -0.139 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.607 -4.128 -1.216 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.738 -2.644 -1.554 1.00 0.00 H new ATOM 1571 N VAL A 108 7.904 -3.678 3.871 1.00 0.00 N ATOM 1572 CA VAL A 108 8.842 -4.154 4.881 1.00 0.00 C ATOM 1573 C VAL A 108 8.117 -4.883 6.007 1.00 0.00 C ATOM 1574 O VAL A 108 7.619 -4.259 6.945 1.00 0.00 O ATOM 1575 CB VAL A 108 9.660 -2.994 5.480 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.760 -3.527 6.386 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.244 -2.125 4.376 1.00 0.00 C ATOM 0 H VAL A 108 6.965 -3.490 4.222 1.00 0.00 H new ATOM 0 HA VAL A 108 9.519 -4.846 4.380 1.00 0.00 H new ATOM 0 HB VAL A 108 8.992 -2.377 6.082 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.327 -2.693 6.800 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.316 -4.102 7.198 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.427 -4.169 5.810 1.00 0.00 H new ATOM 0 HG21 VAL A 108 10.818 -1.311 4.819 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.897 -2.728 3.745 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.436 -1.712 3.772 1.00 0.00 H new ATOM 1587 N PHE A 109 8.063 -6.208 5.909 1.00 0.00 N ATOM 1588 CA PHE A 109 7.402 -7.023 6.922 1.00 0.00 C ATOM 1589 C PHE A 109 8.423 -7.631 7.879 1.00 0.00 C ATOM 1590 O PHE A 109 9.316 -8.367 7.461 1.00 0.00 O ATOM 1591 CB PHE A 109 6.584 -8.133 6.259 1.00 0.00 C ATOM 1592 CG PHE A 109 5.630 -7.636 5.211 1.00 0.00 C ATOM 1593 CD1 PHE A 109 4.340 -7.263 5.549 1.00 0.00 C ATOM 1594 CD2 PHE A 109 6.026 -7.542 3.885 1.00 0.00 C ATOM 1595 CE1 PHE A 109 3.460 -6.805 4.587 1.00 0.00 C ATOM 1596 CE2 PHE A 109 5.150 -7.085 2.918 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.866 -6.716 3.269 1.00 0.00 C ATOM 0 H PHE A 109 8.469 -6.740 5.139 1.00 0.00 H new ATOM 0 HA PHE A 109 6.732 -6.379 7.492 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.265 -8.853 5.805 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.022 -8.666 7.026 1.00 0.00 H new ATOM 0 HD1 PHE A 109 4.018 -7.331 6.578 1.00 0.00 H new ATOM 0 HD2 PHE A 109 7.029 -7.829 3.605 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.457 -6.517 4.865 1.00 0.00 H new ATOM 0 HE2 PHE A 109 5.469 -7.017 1.889 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.181 -6.359 2.515 1.00 0.00 H new ATOM 1607 N GLN A 110 8.285 -7.317 9.162 1.00 0.00 N ATOM 1608 CA GLN A 110 9.198 -7.833 10.175 1.00 0.00 C ATOM 1609 C GLN A 110 8.457 -8.146 11.471 1.00 0.00 C ATOM 1610 O GLN A 110 7.829 -7.268 12.065 1.00 0.00 O ATOM 1611 CB GLN A 110 10.318 -6.826 10.444 1.00 0.00 C ATOM 1612 CG GLN A 110 11.576 -7.454 11.020 1.00 0.00 C ATOM 1613 CD GLN A 110 12.519 -6.429 11.617 1.00 0.00 C ATOM 1614 OE1 GLN A 110 12.168 -5.718 12.558 1.00 0.00 O ATOM 1615 NE2 GLN A 110 13.727 -6.348 11.069 1.00 0.00 N ATOM 0 H GLN A 110 7.551 -6.709 9.525 1.00 0.00 H new ATOM 0 HA GLN A 110 9.633 -8.758 9.796 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.569 -6.318 9.513 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.953 -6.065 11.134 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.298 -8.177 11.787 1.00 0.00 H new ATOM 0 HG3 GLN A 110 12.094 -8.005 10.235 1.00 0.00 H new ATOM 0 HE21 GLN A 110 13.975 -6.958 10.290 1.00 0.00 H new ATOM 0 HE22 GLN A 110 14.406 -5.676 11.428 1.00 0.00 H new ATOM 1624 N ASP A 111 8.536 -9.399 11.905 1.00 0.00 N ATOM 1625 CA ASP A 111 7.874 -9.829 13.131 1.00 0.00 C ATOM 1626 C ASP A 111 6.372 -9.571 13.061 1.00 0.00 C ATOM 1627 O ASP A 111 5.730 -9.303 14.076 1.00 0.00 O ATOM 1628 CB ASP A 111 8.472 -9.102 14.338 1.00 0.00 C ATOM 1629 CG ASP A 111 9.772 -9.728 14.803 1.00 0.00 C ATOM 1630 OD1 ASP A 111 9.717 -10.696 15.590 1.00 0.00 O ATOM 1631 OD2 ASP A 111 10.845 -9.249 14.381 1.00 0.00 O ATOM 0 H ASP A 111 9.053 -10.136 11.425 1.00 0.00 H new ATOM 0 HA ASP A 111 8.034 -10.901 13.243 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.647 -8.058 14.080 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.753 -9.112 15.158 1.00 0.00 H new ATOM 1636 N GLY A 112 5.819 -9.654 11.855 1.00 0.00 N ATOM 1637 CA GLY A 112 4.397 -9.427 11.675 1.00 0.00 C ATOM 1638 C GLY A 112 4.088 -8.007 11.243 1.00 0.00 C ATOM 1639 O GLY A 112 3.099 -7.764 10.551 1.00 0.00 O ATOM 0 H GLY A 112 6.330 -9.874 11.000 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.012 -10.123 10.929 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.877 -9.641 12.609 1.00 0.00 H new ATOM 1643 N LYS A 113 4.935 -7.068 11.653 1.00 0.00 N ATOM 1644 CA LYS A 113 4.747 -5.664 11.304 1.00 0.00 C ATOM 1645 C LYS A 113 4.754 -5.474 9.791 1.00 0.00 C ATOM 1646 O LYS A 113 4.904 -6.435 9.036 1.00 0.00 O ATOM 1647 CB LYS A 113 5.843 -4.808 11.942 1.00 0.00 C ATOM 1648 CG LYS A 113 5.659 -4.601 13.437 1.00 0.00 C ATOM 1649 CD LYS A 113 6.694 -5.372 14.240 1.00 0.00 C ATOM 1650 CE LYS A 113 6.412 -5.297 15.732 1.00 0.00 C ATOM 1651 NZ LYS A 113 6.826 -6.541 16.440 1.00 0.00 N ATOM 0 H LYS A 113 5.758 -7.254 12.227 1.00 0.00 H new ATOM 0 HA LYS A 113 3.777 -5.346 11.687 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.810 -5.279 11.765 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.867 -3.836 11.449 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.734 -3.539 13.670 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.659 -4.921 13.729 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.700 -6.415 13.922 1.00 0.00 H new ATOM 0 HD3 LYS A 113 7.687 -4.971 14.036 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.940 -4.444 16.159 1.00 0.00 H new ATOM 0 HE3 LYS A 113 5.347 -5.126 15.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 6.617 -6.449 17.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 6.304 -7.352 16.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 7.847 -6.691 16.309 1.00 0.00 H new ATOM 1665 N MET A 114 4.592 -4.230 9.355 1.00 0.00 N ATOM 1666 CA MET A 114 4.579 -3.915 7.931 1.00 0.00 C ATOM 1667 C MET A 114 4.661 -2.409 7.707 1.00 0.00 C ATOM 1668 O MET A 114 3.895 -1.641 8.290 1.00 0.00 O ATOM 1669 CB MET A 114 3.314 -4.472 7.276 1.00 0.00 C ATOM 1670 CG MET A 114 2.038 -4.126 8.027 1.00 0.00 C ATOM 1671 SD MET A 114 0.755 -5.378 7.828 1.00 0.00 S ATOM 1672 CE MET A 114 0.360 -5.185 6.091 1.00 0.00 C ATOM 0 H MET A 114 4.468 -3.423 9.967 1.00 0.00 H new ATOM 0 HA MET A 114 5.452 -4.380 7.473 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.242 -4.088 6.258 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.400 -5.556 7.202 1.00 0.00 H new ATOM 0 HG2 MET A 114 2.265 -4.009 9.087 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.662 -3.166 7.674 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.666 -4.831 5.988 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.040 -4.462 5.641 1.00 0.00 H new ATOM 0 HE3 MET A 114 0.465 -6.145 5.585 1.00 0.00 H new ATOM 1682 N ALA A 115 5.593 -1.992 6.858 1.00 0.00 N ATOM 1683 CA ALA A 115 5.776 -0.577 6.556 1.00 0.00 C ATOM 1684 C ALA A 115 6.157 -0.374 5.094 1.00 0.00 C ATOM 1685 O ALA A 115 6.739 -1.258 4.465 1.00 0.00 O ATOM 1686 CB ALA A 115 6.833 0.025 7.468 1.00 0.00 C ATOM 0 H ALA A 115 6.234 -2.614 6.366 1.00 0.00 H new ATOM 0 HA ALA A 115 4.829 -0.067 6.732 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.959 1.081 7.231 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.519 -0.079 8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.780 -0.495 7.321 1.00 0.00 H new ATOM 1692 N LEU A 116 5.827 0.796 4.558 1.00 0.00 N ATOM 1693 CA LEU A 116 6.136 1.117 3.169 1.00 0.00 C ATOM 1694 C LEU A 116 7.363 2.017 3.079 1.00 0.00 C ATOM 1695 O LEU A 116 7.331 3.172 3.504 1.00 0.00 O ATOM 1696 CB LEU A 116 4.938 1.796 2.503 1.00 0.00 C ATOM 1697 CG LEU A 116 4.830 1.579 0.993 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.212 0.222 0.692 1.00 0.00 C ATOM 1699 CD2 LEU A 116 4.013 2.692 0.354 1.00 0.00 C ATOM 0 H LEU A 116 5.345 1.539 5.065 1.00 0.00 H new ATOM 0 HA LEU A 116 6.353 0.186 2.646 1.00 0.00 H new ATOM 0 HB2 LEU A 116 4.025 1.432 2.974 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.992 2.867 2.698 1.00 0.00 H new ATOM 0 HG LEU A 116 5.834 1.600 0.568 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.143 0.085 -0.387 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.835 -0.564 1.119 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.215 0.172 1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.946 2.523 -0.721 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.011 2.701 0.784 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.496 3.651 0.541 1.00 0.00 H new ATOM 1711 N LEU A 117 8.445 1.481 2.523 1.00 0.00 N ATOM 1712 CA LEU A 117 9.683 2.236 2.376 1.00 0.00 C ATOM 1713 C LEU A 117 9.766 2.883 0.997 1.00 0.00 C ATOM 1714 O LEU A 117 9.685 2.203 -0.024 1.00 0.00 O ATOM 1715 CB LEU A 117 10.891 1.323 2.597 1.00 0.00 C ATOM 1716 CG LEU A 117 12.233 2.046 2.728 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.546 2.329 4.189 1.00 0.00 C ATOM 1718 CD2 LEU A 117 13.345 1.225 2.092 1.00 0.00 C ATOM 0 H LEU A 117 8.489 0.526 2.167 1.00 0.00 H new ATOM 0 HA LEU A 117 9.689 3.025 3.128 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.723 0.735 3.499 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.953 0.621 1.766 1.00 0.00 H new ATOM 0 HG LEU A 117 12.164 2.998 2.201 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.504 2.844 4.263 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.763 2.957 4.614 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.596 1.389 4.739 1.00 0.00 H new ATOM 0 HD21 LEU A 117 14.292 1.754 2.194 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.414 0.258 2.590 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.126 1.074 1.035 1.00 0.00 H new ATOM 1730 N ALA A 118 9.927 4.203 0.978 1.00 0.00 N ATOM 1731 CA ALA A 118 10.021 4.942 -0.275 1.00 0.00 C ATOM 1732 C ALA A 118 11.359 4.692 -0.962 1.00 0.00 C ATOM 1733 O ALA A 118 12.273 4.117 -0.373 1.00 0.00 O ATOM 1734 CB ALA A 118 9.823 6.429 -0.027 1.00 0.00 C ATOM 0 H ALA A 118 9.995 4.781 1.815 1.00 0.00 H new ATOM 0 HA ALA A 118 9.231 4.587 -0.937 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.896 6.968 -0.971 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.839 6.597 0.412 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.592 6.789 0.657 1.00 0.00 H new ATOM 1740 N SER A 119 11.465 5.129 -2.212 1.00 0.00 N ATOM 1741 CA SER A 119 12.692 4.955 -2.982 1.00 0.00 C ATOM 1742 C SER A 119 13.802 5.876 -2.477 1.00 0.00 C ATOM 1743 O SER A 119 14.956 5.747 -2.883 1.00 0.00 O ATOM 1744 CB SER A 119 12.428 5.224 -4.465 1.00 0.00 C ATOM 1745 OG SER A 119 13.642 5.387 -5.178 1.00 0.00 O ATOM 0 H SER A 119 10.716 5.606 -2.714 1.00 0.00 H new ATOM 0 HA SER A 119 13.022 3.924 -2.855 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.860 4.398 -4.892 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.817 6.120 -4.572 1.00 0.00 H new ATOM 0 HG SER A 119 14.373 5.550 -4.546 1.00 0.00 H new ATOM 1751 N ASN A 120 13.449 6.806 -1.590 1.00 0.00 N ATOM 1752 CA ASN A 120 14.424 7.741 -1.039 1.00 0.00 C ATOM 1753 C ASN A 120 14.960 7.252 0.304 1.00 0.00 C ATOM 1754 O ASN A 120 15.429 8.044 1.120 1.00 0.00 O ATOM 1755 CB ASN A 120 13.795 9.126 -0.876 1.00 0.00 C ATOM 1756 CG ASN A 120 12.584 9.107 0.035 1.00 0.00 C ATOM 1757 OD1 ASN A 120 12.416 8.196 0.844 1.00 0.00 O ATOM 1758 ND2 ASN A 120 11.730 10.116 -0.096 1.00 0.00 N ATOM 0 H ASN A 120 12.499 6.930 -1.240 1.00 0.00 H new ATOM 0 HA ASN A 120 15.259 7.805 -1.737 1.00 0.00 H new ATOM 0 HB2 ASN A 120 14.538 9.814 -0.474 1.00 0.00 H new ATOM 0 HB3 ASN A 120 13.504 9.507 -1.855 1.00 0.00 H new ATOM 0 HD21 ASN A 120 10.895 10.156 0.488 1.00 0.00 H new ATOM 0 HD22 ASN A 120 11.910 10.850 -0.781 1.00 0.00 H new ATOM 1765 N SER A 121 14.891 5.942 0.528 1.00 0.00 N ATOM 1766 CA SER A 121 15.374 5.352 1.772 1.00 0.00 C ATOM 1767 C SER A 121 14.664 5.958 2.979 1.00 0.00 C ATOM 1768 O SER A 121 15.273 6.171 4.027 1.00 0.00 O ATOM 1769 CB SER A 121 16.885 5.550 1.902 1.00 0.00 C ATOM 1770 OG SER A 121 17.504 4.407 2.465 1.00 0.00 O ATOM 0 H SER A 121 14.506 5.270 -0.136 1.00 0.00 H new ATOM 0 HA SER A 121 15.154 4.285 1.745 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.314 5.753 0.921 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.088 6.421 2.525 1.00 0.00 H new ATOM 0 HG SER A 121 18.470 4.559 2.536 1.00 0.00 H new ATOM 1776 N CYS A 122 13.372 6.231 2.827 1.00 0.00 N ATOM 1777 CA CYS A 122 12.582 6.810 3.908 1.00 0.00 C ATOM 1778 C CYS A 122 11.144 6.304 3.861 1.00 0.00 C ATOM 1779 O CYS A 122 10.493 6.348 2.816 1.00 0.00 O ATOM 1780 CB CYS A 122 12.600 8.338 3.823 1.00 0.00 C ATOM 1781 SG CYS A 122 14.249 9.045 3.603 1.00 0.00 S ATOM 0 H CYS A 122 12.850 6.061 1.967 1.00 0.00 H new ATOM 0 HA CYS A 122 13.027 6.502 4.854 1.00 0.00 H new ATOM 0 HB2 CYS A 122 11.968 8.653 2.993 1.00 0.00 H new ATOM 0 HB3 CYS A 122 12.159 8.747 4.732 1.00 0.00 H new ATOM 0 HG CYS A 122 14.719 8.698 2.441 1.00 0.00 H new ATOM 1787 N PHE A 123 10.652 5.825 4.998 1.00 0.00 N ATOM 1788 CA PHE A 123 9.291 5.310 5.086 1.00 0.00 C ATOM 1789 C PHE A 123 8.273 6.426 4.872 1.00 0.00 C ATOM 1790 O PHE A 123 8.639 7.584 4.666 1.00 0.00 O ATOM 1791 CB PHE A 123 9.060 4.647 6.445 1.00 0.00 C ATOM 1792 CG PHE A 123 9.794 3.347 6.611 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.253 2.165 6.133 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.026 3.309 7.244 1.00 0.00 C ATOM 1795 CE1 PHE A 123 9.926 0.968 6.284 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.704 2.115 7.398 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.154 0.942 6.917 1.00 0.00 C ATOM 0 H PHE A 123 11.176 5.783 5.872 1.00 0.00 H new ATOM 0 HA PHE A 123 9.159 4.566 4.300 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.371 5.333 7.233 1.00 0.00 H new ATOM 0 HB3 PHE A 123 7.992 4.472 6.578 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.294 2.179 5.637 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.461 4.223 7.621 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.493 0.053 5.908 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.663 2.098 7.894 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.682 0.008 7.036 1.00 0.00 H new ATOM 1807 N ILE A 124 6.993 6.071 4.922 1.00 0.00 N ATOM 1808 CA ILE A 124 5.923 7.042 4.733 1.00 0.00 C ATOM 1809 C ILE A 124 5.248 7.384 6.057 1.00 0.00 C ATOM 1810 O ILE A 124 5.024 6.510 6.895 1.00 0.00 O ATOM 1811 CB ILE A 124 4.859 6.520 3.749 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.410 5.113 4.148 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.404 6.526 2.328 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.172 4.643 3.414 1.00 0.00 C ATOM 0 H ILE A 124 6.672 5.118 5.092 1.00 0.00 H new ATOM 0 HA ILE A 124 6.382 7.940 4.320 1.00 0.00 H new ATOM 0 HB ILE A 124 3.993 7.181 3.788 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.223 4.413 3.957 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.217 5.092 5.221 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.641 6.155 1.644 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.678 7.543 2.048 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.284 5.885 2.273 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.911 3.638 3.747 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.345 5.321 3.624 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.367 4.631 2.342 1.00 0.00 H new ATOM 1826 N ARG A 125 4.926 8.660 6.239 1.00 0.00 N ATOM 1827 CA ARG A 125 4.277 9.118 7.461 1.00 0.00 C ATOM 1828 C ARG A 125 3.445 10.370 7.200 1.00 0.00 C ATOM 1829 O ARG A 125 3.898 11.299 6.531 1.00 0.00 O ATOM 1830 CB ARG A 125 5.321 9.403 8.543 1.00 0.00 C ATOM 1831 CG ARG A 125 4.724 9.584 9.931 1.00 0.00 C ATOM 1832 CD ARG A 125 5.258 10.834 10.611 1.00 0.00 C ATOM 1833 NE ARG A 125 4.348 11.326 11.643 1.00 0.00 N ATOM 1834 CZ ARG A 125 4.666 12.274 12.522 1.00 0.00 C ATOM 1835 NH1 ARG A 125 5.870 12.834 12.498 1.00 0.00 N ATOM 1836 NH2 ARG A 125 3.780 12.663 13.428 1.00 0.00 N ATOM 0 H ARG A 125 5.104 9.396 5.555 1.00 0.00 H new ATOM 0 HA ARG A 125 3.612 8.327 7.807 1.00 0.00 H new ATOM 0 HB2 ARG A 125 6.039 8.583 8.569 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.875 10.303 8.274 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.638 9.646 9.856 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.952 8.711 10.542 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.229 10.618 11.057 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.416 11.613 9.865 1.00 0.00 H new ATOM 0 HE ARG A 125 3.414 10.919 11.693 1.00 0.00 H new ATOM 0 HH11 ARG A 125 6.556 12.538 11.804 1.00 0.00 H new ATOM 0 HH12 ARG A 125 6.108 13.560 13.174 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.854 12.236 13.452 1.00 0.00 H new ATOM 0 HH22 ARG A 125 4.024 13.389 14.101 1.00 0.00 H new ATOM 1850 N CYS A 126 2.228 10.387 7.733 1.00 0.00 N ATOM 1851 CA CYS A 126 1.333 11.526 7.558 1.00 0.00 C ATOM 1852 C CYS A 126 1.502 12.528 8.695 1.00 0.00 C ATOM 1853 O CYS A 126 1.943 12.173 9.788 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.120 11.053 7.491 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.642 10.066 8.913 1.00 0.00 S ATOM 0 H CYS A 126 1.839 9.626 8.289 1.00 0.00 H new ATOM 0 HA CYS A 126 1.590 12.020 6.621 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.771 11.924 7.408 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.258 10.465 6.584 1.00 0.00 H new ATOM 0 HG CYS A 126 -1.485 10.749 9.629 1.00 0.00 H new ATOM 1861 N ASN A 127 1.150 13.782 8.429 1.00 0.00 N ATOM 1862 CA ASN A 127 1.264 14.836 9.430 1.00 0.00 C ATOM 1863 C ASN A 127 -0.107 15.207 9.986 1.00 0.00 C ATOM 1864 O ASN A 127 -1.138 14.822 9.435 1.00 0.00 O ATOM 1865 CB ASN A 127 1.936 16.071 8.826 1.00 0.00 C ATOM 1866 CG ASN A 127 3.403 16.170 9.201 1.00 0.00 C ATOM 1867 OD1 ASN A 127 3.759 16.129 10.379 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.262 16.302 8.197 1.00 0.00 N ATOM 0 H ASN A 127 0.784 14.093 7.529 1.00 0.00 H new ATOM 0 HA ASN A 127 1.879 14.462 10.249 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.842 16.039 7.741 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.416 16.967 9.164 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.262 16.374 8.387 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.922 16.331 7.236 1.00 0.00 H new ATOM 1875 N GLU A 128 -0.110 15.960 11.082 1.00 0.00 N ATOM 1876 CA GLU A 128 -1.354 16.385 11.714 1.00 0.00 C ATOM 1877 C GLU A 128 -1.997 17.527 10.935 1.00 0.00 C ATOM 1878 O GLU A 128 -3.221 17.655 10.898 1.00 0.00 O ATOM 1879 CB GLU A 128 -1.095 16.820 13.158 1.00 0.00 C ATOM 1880 CG GLU A 128 -1.048 15.663 14.143 1.00 0.00 C ATOM 1881 CD GLU A 128 -2.420 15.291 14.670 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -3.423 15.642 14.014 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -2.491 14.649 15.739 1.00 0.00 O ATOM 0 H GLU A 128 0.735 16.288 11.550 1.00 0.00 H new ATOM 0 HA GLU A 128 -2.040 15.538 11.715 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.150 17.362 13.201 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.876 17.516 13.465 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.602 14.795 13.658 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -0.401 15.928 14.979 1.00 0.00 H new ATOM 1890 N ALA A 129 -1.164 18.355 10.313 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.652 19.486 9.534 1.00 0.00 C ATOM 1892 C ALA A 129 -2.240 19.025 8.204 1.00 0.00 C ATOM 1893 O ALA A 129 -3.311 19.475 7.800 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.529 20.486 9.298 1.00 0.00 C ATOM 0 H ALA A 129 -0.148 18.264 10.334 1.00 0.00 H new ATOM 0 HA ALA A 129 -2.445 19.972 10.102 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.906 21.326 8.715 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -0.156 20.848 10.256 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.281 20.001 8.753 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.531 18.125 7.530 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.000 17.618 6.254 1.00 0.00 C ATOM 1902 C GLY A 130 -0.900 17.562 5.213 1.00 0.00 C ATOM 1903 O GLY A 130 -1.103 17.953 4.063 1.00 0.00 O ATOM 0 H GLY A 130 -0.641 17.738 7.844 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.415 16.620 6.394 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.809 18.252 5.890 1.00 0.00 H new ATOM 1907 N ASP A 131 0.269 17.075 5.616 1.00 0.00 N ATOM 1908 CA ASP A 131 1.407 16.969 4.709 1.00 0.00 C ATOM 1909 C ASP A 131 2.119 15.633 4.883 1.00 0.00 C ATOM 1910 O ASP A 131 2.923 15.460 5.799 1.00 0.00 O ATOM 1911 CB ASP A 131 2.387 18.119 4.951 1.00 0.00 C ATOM 1912 CG ASP A 131 1.807 19.465 4.562 1.00 0.00 C ATOM 1913 OD1 ASP A 131 1.614 19.700 3.350 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.547 20.284 5.469 1.00 0.00 O ATOM 0 H ASP A 131 0.453 16.748 6.564 1.00 0.00 H new ATOM 0 HA ASP A 131 1.032 17.029 3.687 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.667 18.138 6.004 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.299 17.941 4.381 1.00 0.00 H new ATOM 1919 N ILE A 132 1.819 14.688 3.997 1.00 0.00 N ATOM 1920 CA ILE A 132 2.430 13.366 4.053 1.00 0.00 C ATOM 1921 C ILE A 132 3.862 13.400 3.528 1.00 0.00 C ATOM 1922 O ILE A 132 4.089 13.520 2.324 1.00 0.00 O ATOM 1923 CB ILE A 132 1.623 12.337 3.240 1.00 0.00 C ATOM 1924 CG1 ILE A 132 0.139 12.419 3.603 1.00 0.00 C ATOM 1925 CG2 ILE A 132 2.156 10.933 3.482 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.744 11.546 2.738 1.00 0.00 C ATOM 0 H ILE A 132 1.156 14.814 3.232 1.00 0.00 H new ATOM 0 HA ILE A 132 2.435 13.066 5.101 1.00 0.00 H new ATOM 0 HB ILE A 132 1.732 12.568 2.180 1.00 0.00 H new ATOM 0 HG12 ILE A 132 0.012 12.130 4.646 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.191 13.454 3.517 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.575 10.218 2.900 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.202 10.883 3.178 1.00 0.00 H new ATOM 0 HG23 ILE A 132 2.074 10.690 4.541 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.782 11.654 3.052 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -0.646 11.849 1.696 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.440 10.504 2.843 1.00 0.00 H new ATOM 1938 N GLU A 133 4.824 13.291 4.438 1.00 0.00 N ATOM 1939 CA GLU A 133 6.234 13.307 4.066 1.00 0.00 C ATOM 1940 C GLU A 133 6.905 11.982 4.418 1.00 0.00 C ATOM 1941 O GLU A 133 6.299 11.118 5.050 1.00 0.00 O ATOM 1942 CB GLU A 133 6.956 14.459 4.768 1.00 0.00 C ATOM 1943 CG GLU A 133 6.621 14.577 6.246 1.00 0.00 C ATOM 1944 CD GLU A 133 7.450 15.633 6.949 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.576 15.312 7.384 1.00 0.00 O ATOM 1946 OE2 GLU A 133 6.973 16.782 7.064 1.00 0.00 O ATOM 0 H GLU A 133 4.653 13.191 5.439 1.00 0.00 H new ATOM 0 HA GLU A 133 6.297 13.451 2.987 1.00 0.00 H new ATOM 0 HB2 GLU A 133 8.032 14.323 4.658 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.700 15.394 4.270 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.564 14.817 6.357 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.781 13.613 6.729 1.00 0.00 H new ATOM 1953 N ALA A 134 8.158 11.832 4.002 1.00 0.00 N ATOM 1954 CA ALA A 134 8.910 10.613 4.272 1.00 0.00 C ATOM 1955 C ALA A 134 9.746 10.753 5.541 1.00 0.00 C ATOM 1956 O ALA A 134 10.803 11.382 5.533 1.00 0.00 O ATOM 1957 CB ALA A 134 9.800 10.269 3.087 1.00 0.00 C ATOM 0 H ALA A 134 8.673 12.539 3.477 1.00 0.00 H new ATOM 0 HA ALA A 134 8.198 9.802 4.425 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.356 9.356 3.302 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.184 10.118 2.201 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.499 11.086 2.908 1.00 0.00 H new ATOM 1963 N LYS A 135 9.263 10.162 6.629 1.00 0.00 N ATOM 1964 CA LYS A 135 9.966 10.220 7.905 1.00 0.00 C ATOM 1965 C LYS A 135 11.314 9.512 7.815 1.00 0.00 C ATOM 1966 O LYS A 135 11.559 8.740 6.888 1.00 0.00 O ATOM 1967 CB LYS A 135 9.116 9.588 9.009 1.00 0.00 C ATOM 1968 CG LYS A 135 9.369 10.175 10.389 1.00 0.00 C ATOM 1969 CD LYS A 135 9.096 11.673 10.421 1.00 0.00 C ATOM 1970 CE LYS A 135 10.316 12.454 10.885 1.00 0.00 C ATOM 1971 NZ LYS A 135 10.300 13.857 10.388 1.00 0.00 N ATOM 0 H LYS A 135 8.388 9.638 6.652 1.00 0.00 H new ATOM 0 HA LYS A 135 10.142 11.268 8.148 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.062 9.712 8.759 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.313 8.516 9.038 1.00 0.00 H new ATOM 0 HG2 LYS A 135 8.735 9.674 11.120 1.00 0.00 H new ATOM 0 HG3 LYS A 135 10.402 9.987 10.681 1.00 0.00 H new ATOM 0 HD2 LYS A 135 8.803 12.011 9.427 1.00 0.00 H new ATOM 0 HD3 LYS A 135 8.258 11.877 11.087 1.00 0.00 H new ATOM 0 HE2 LYS A 135 10.353 12.455 11.974 1.00 0.00 H new ATOM 0 HE3 LYS A 135 11.220 11.956 10.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 11.148 14.355 10.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 10.290 13.857 9.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 9.450 14.341 10.742 1.00 0.00 H new ATOM 1985 N ASN A 136 12.186 9.781 8.783 1.00 0.00 N ATOM 1986 CA ASN A 136 13.511 9.171 8.814 1.00 0.00 C ATOM 1987 C ASN A 136 13.420 7.651 8.719 1.00 0.00 C ATOM 1988 O ASN A 136 12.330 7.080 8.760 1.00 0.00 O ATOM 1989 CB ASN A 136 14.245 9.570 10.095 1.00 0.00 C ATOM 1990 CG ASN A 136 15.709 9.880 9.850 1.00 0.00 C ATOM 1991 OD1 ASN A 136 16.059 10.547 8.877 1.00 0.00 O ATOM 1992 ND2 ASN A 136 16.572 9.397 10.736 1.00 0.00 N ATOM 0 H ASN A 136 11.998 10.418 9.557 1.00 0.00 H new ATOM 0 HA ASN A 136 14.069 9.534 7.951 1.00 0.00 H new ATOM 0 HB2 ASN A 136 13.760 10.443 10.532 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.164 8.763 10.823 1.00 0.00 H new ATOM 0 HD21 ASN A 136 17.570 9.574 10.625 1.00 0.00 H new ATOM 0 HD22 ASN A 136 16.237 8.849 11.528 1.00 0.00 H new ATOM 1999 N LYS A 137 14.572 7.002 8.590 1.00 0.00 N ATOM 2000 CA LYS A 137 14.625 5.548 8.487 1.00 0.00 C ATOM 2001 C LYS A 137 14.010 4.892 9.720 1.00 0.00 C ATOM 2002 O LYS A 137 13.419 3.816 9.634 1.00 0.00 O ATOM 2003 CB LYS A 137 16.070 5.080 8.314 1.00 0.00 C ATOM 2004 CG LYS A 137 16.715 5.562 7.025 1.00 0.00 C ATOM 2005 CD LYS A 137 18.211 5.292 7.016 1.00 0.00 C ATOM 2006 CE LYS A 137 18.967 6.312 7.851 1.00 0.00 C ATOM 2007 NZ LYS A 137 19.040 7.638 7.177 1.00 0.00 N ATOM 0 H LYS A 137 15.483 7.460 8.554 1.00 0.00 H new ATOM 0 HA LYS A 137 14.047 5.250 7.612 1.00 0.00 H new ATOM 0 HB2 LYS A 137 16.661 5.432 9.160 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.096 3.991 8.338 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.249 5.063 6.175 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.536 6.631 6.905 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.403 4.291 7.401 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.580 5.315 5.990 1.00 0.00 H new ATOM 0 HE2 LYS A 137 18.478 6.423 8.819 1.00 0.00 H new ATOM 0 HE3 LYS A 137 19.976 5.947 8.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 19.714 8.248 7.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 19.357 7.511 6.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 18.100 8.082 7.183 1.00 0.00 H new ATOM 2021 N THR A 138 14.153 5.548 10.866 1.00 0.00 N ATOM 2022 CA THR A 138 13.611 5.030 12.117 1.00 0.00 C ATOM 2023 C THR A 138 12.097 4.875 12.031 1.00 0.00 C ATOM 2024 O THR A 138 11.353 5.835 12.223 1.00 0.00 O ATOM 2025 CB THR A 138 13.975 5.956 13.278 1.00 0.00 C ATOM 2026 OG1 THR A 138 13.364 7.224 13.118 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.466 6.180 13.420 1.00 0.00 C ATOM 0 H THR A 138 14.640 6.440 10.955 1.00 0.00 H new ATOM 0 HA THR A 138 14.049 4.048 12.294 1.00 0.00 H new ATOM 0 HB THR A 138 13.612 5.453 14.174 1.00 0.00 H new ATOM 0 HG1 THR A 138 12.441 7.106 12.809 1.00 0.00 H new ATOM 0 HG21 THR A 138 15.655 6.846 14.262 1.00 0.00 H new ATOM 0 HG22 THR A 138 15.962 5.225 13.594 1.00 0.00 H new ATOM 0 HG23 THR A 138 15.855 6.630 12.507 1.00 0.00 H new ATOM 2035 N ALA A 139 11.648 3.658 11.742 1.00 0.00 N ATOM 2036 CA ALA A 139 10.221 3.377 11.630 1.00 0.00 C ATOM 2037 C ALA A 139 9.585 3.211 13.005 1.00 0.00 C ATOM 2038 O ALA A 139 9.666 2.144 13.612 1.00 0.00 O ATOM 2039 CB ALA A 139 9.994 2.131 10.787 1.00 0.00 C ATOM 0 H ALA A 139 12.251 2.851 11.581 1.00 0.00 H new ATOM 0 HA ALA A 139 9.745 4.226 11.139 1.00 0.00 H new ATOM 0 HB1 ALA A 139 8.925 1.933 10.711 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.406 2.286 9.790 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.489 1.280 11.255 1.00 0.00 H new ATOM 2045 N GLY A 140 8.953 4.274 13.491 1.00 0.00 N ATOM 2046 CA GLY A 140 8.311 4.226 14.791 1.00 0.00 C ATOM 2047 C GLY A 140 7.007 3.453 14.766 1.00 0.00 C ATOM 2048 O GLY A 140 6.577 2.983 13.713 1.00 0.00 O ATOM 0 H GLY A 140 8.874 5.168 13.007 1.00 0.00 H new ATOM 0 HA2 GLY A 140 8.989 3.766 15.511 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.121 5.242 15.137 1.00 0.00 H new ATOM 2052 N GLU A 141 6.377 3.319 15.928 1.00 0.00 N ATOM 2053 CA GLU A 141 5.116 2.598 16.036 1.00 0.00 C ATOM 2054 C GLU A 141 4.022 3.291 15.228 1.00 0.00 C ATOM 2055 O GLU A 141 3.116 2.643 14.706 1.00 0.00 O ATOM 2056 CB GLU A 141 4.693 2.484 17.503 1.00 0.00 C ATOM 2057 CG GLU A 141 4.361 1.064 17.930 1.00 0.00 C ATOM 2058 CD GLU A 141 4.847 0.748 19.331 1.00 0.00 C ATOM 2059 OE1 GLU A 141 6.074 0.601 19.515 1.00 0.00 O ATOM 2060 OE2 GLU A 141 4.001 0.647 20.245 1.00 0.00 O ATOM 0 H GLU A 141 6.720 3.701 16.809 1.00 0.00 H new ATOM 0 HA GLU A 141 5.262 1.597 15.630 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.495 2.867 18.135 1.00 0.00 H new ATOM 0 HB3 GLU A 141 3.823 3.119 17.672 1.00 0.00 H new ATOM 0 HG2 GLU A 141 3.282 0.917 17.882 1.00 0.00 H new ATOM 0 HG3 GLU A 141 4.810 0.363 17.227 1.00 0.00 H new ATOM 2067 N GLU A 142 4.114 4.614 15.131 1.00 0.00 N ATOM 2068 CA GLU A 142 3.132 5.396 14.388 1.00 0.00 C ATOM 2069 C GLU A 142 3.465 5.414 12.900 1.00 0.00 C ATOM 2070 O GLU A 142 2.573 5.470 12.054 1.00 0.00 O ATOM 2071 CB GLU A 142 3.075 6.827 14.927 1.00 0.00 C ATOM 2072 CG GLU A 142 4.439 7.484 15.057 1.00 0.00 C ATOM 2073 CD GLU A 142 4.926 7.539 16.493 1.00 0.00 C ATOM 2074 OE1 GLU A 142 4.509 8.462 17.225 1.00 0.00 O ATOM 2075 OE2 GLU A 142 5.722 6.660 16.885 1.00 0.00 O ATOM 0 H GLU A 142 4.858 5.166 15.557 1.00 0.00 H new ATOM 0 HA GLU A 142 2.157 4.927 14.518 1.00 0.00 H new ATOM 0 HB2 GLU A 142 2.452 7.430 14.267 1.00 0.00 H new ATOM 0 HB3 GLU A 142 2.590 6.819 15.903 1.00 0.00 H new ATOM 0 HG2 GLU A 142 5.162 6.935 14.453 1.00 0.00 H new ATOM 0 HG3 GLU A 142 4.391 8.496 14.655 1.00 0.00 H new ATOM 2082 N GLU A 143 4.757 5.365 12.586 1.00 0.00 N ATOM 2083 CA GLU A 143 5.207 5.376 11.200 1.00 0.00 C ATOM 2084 C GLU A 143 4.701 4.146 10.452 1.00 0.00 C ATOM 2085 O GLU A 143 4.485 4.188 9.241 1.00 0.00 O ATOM 2086 CB GLU A 143 6.736 5.433 11.139 1.00 0.00 C ATOM 2087 CG GLU A 143 7.284 6.834 10.926 1.00 0.00 C ATOM 2088 CD GLU A 143 8.765 6.934 11.230 1.00 0.00 C ATOM 2089 OE1 GLU A 143 9.578 6.642 10.327 1.00 0.00 O ATOM 2090 OE2 GLU A 143 9.115 7.304 12.371 1.00 0.00 O ATOM 0 H GLU A 143 5.509 5.317 13.273 1.00 0.00 H new ATOM 0 HA GLU A 143 4.797 6.264 10.718 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.144 5.029 12.066 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.083 4.789 10.331 1.00 0.00 H new ATOM 0 HG2 GLU A 143 7.108 7.136 9.894 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.739 7.533 11.560 1.00 0.00 H new ATOM 2097 N MET A 144 4.515 3.049 11.182 1.00 0.00 N ATOM 2098 CA MET A 144 4.035 1.808 10.587 1.00 0.00 C ATOM 2099 C MET A 144 2.681 2.012 9.916 1.00 0.00 C ATOM 2100 O MET A 144 1.960 2.960 10.226 1.00 0.00 O ATOM 2101 CB MET A 144 3.928 0.715 11.654 1.00 0.00 C ATOM 2102 CG MET A 144 5.276 0.205 12.137 1.00 0.00 C ATOM 2103 SD MET A 144 5.889 -1.177 11.154 1.00 0.00 S ATOM 2104 CE MET A 144 7.547 -1.348 11.807 1.00 0.00 C ATOM 0 H MET A 144 4.690 2.996 12.186 1.00 0.00 H new ATOM 0 HA MET A 144 4.753 1.498 9.828 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.369 1.103 12.505 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.356 -0.120 11.251 1.00 0.00 H new ATOM 0 HG2 MET A 144 6.001 1.019 12.104 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.191 -0.105 13.179 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.056 -2.166 11.297 1.00 0.00 H new ATOM 0 HE2 MET A 144 8.098 -0.421 11.647 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.497 -1.561 12.875 1.00 0.00 H new ATOM 2114 N ILE A 145 2.341 1.117 8.995 1.00 0.00 N ATOM 2115 CA ILE A 145 1.074 1.198 8.280 1.00 0.00 C ATOM 2116 C ILE A 145 0.408 -0.170 8.181 1.00 0.00 C ATOM 2117 O ILE A 145 0.987 -1.183 8.577 1.00 0.00 O ATOM 2118 CB ILE A 145 1.264 1.767 6.861 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.324 0.964 6.104 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.652 3.236 6.927 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.003 0.769 4.639 1.00 0.00 C ATOM 0 H ILE A 145 2.926 0.326 8.726 1.00 0.00 H new ATOM 0 HA ILE A 145 0.433 1.870 8.851 1.00 0.00 H new ATOM 0 HB ILE A 145 0.320 1.685 6.323 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.284 1.472 6.193 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.435 -0.012 6.576 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.783 3.624 5.917 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.866 3.798 7.432 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.586 3.341 7.479 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.797 0.192 4.166 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.058 0.234 4.542 1.00 0.00 H new ATOM 0 HD13 ILE A 145 1.922 1.741 4.152 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.811 -0.193 7.652 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.555 -1.438 7.502 1.00 0.00 C ATOM 2135 C LYS A 146 -2.164 -1.543 6.108 1.00 0.00 C ATOM 2136 O LYS A 146 -3.207 -0.951 5.828 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.656 -1.529 8.560 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.128 -1.570 9.985 1.00 0.00 C ATOM 2139 CD LYS A 146 -2.674 -2.764 10.751 1.00 0.00 C ATOM 2140 CE LYS A 146 -2.965 -2.411 12.200 1.00 0.00 C ATOM 2141 NZ LYS A 146 -4.336 -1.854 12.372 1.00 0.00 N ATOM 0 H LYS A 146 -1.304 0.636 7.320 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.860 -2.266 7.639 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.323 -0.674 8.453 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.252 -2.423 8.376 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.039 -1.615 9.969 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -2.402 -0.650 10.501 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -3.586 -3.119 10.272 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -1.955 -3.582 10.712 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -2.854 -3.301 12.820 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -2.232 -1.685 12.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -4.465 -1.548 13.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -4.462 -1.040 11.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -5.039 -2.585 12.142 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.505 -2.300 5.236 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.982 -2.482 3.870 1.00 0.00 C ATOM 2157 C ILE A 147 -3.050 -3.570 3.802 1.00 0.00 C ATOM 2158 O ILE A 147 -2.849 -4.682 4.292 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.828 -2.850 2.915 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.328 -1.861 3.071 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.320 -2.876 1.476 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.692 -2.518 3.041 1.00 0.00 C ATOM 0 H ILE A 147 -0.640 -2.797 5.451 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.414 -1.532 3.556 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.466 -3.845 3.173 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.272 -1.120 2.273 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.212 -1.324 4.013 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.494 -3.137 0.814 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.114 -3.617 1.376 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.705 -1.893 1.205 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.465 -1.758 3.157 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.767 -3.239 3.855 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.828 -3.031 2.089 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.184 -3.241 3.193 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.284 -4.189 3.061 1.00 0.00 C ATOM 2176 C ARG A 148 -5.668 -4.376 1.597 1.00 0.00 C ATOM 2177 O ARG A 148 -5.422 -3.504 0.764 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.496 -3.711 3.862 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.258 -3.673 5.362 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.276 -2.789 6.066 1.00 0.00 C ATOM 2181 NE ARG A 148 -6.715 -2.146 7.252 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.559 -2.757 8.423 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -6.921 -4.025 8.571 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.040 -2.098 9.450 1.00 0.00 N ATOM 0 H ARG A 148 -4.365 -2.325 2.783 1.00 0.00 H new ATOM 0 HA ARG A 148 -4.953 -5.149 3.456 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.775 -2.714 3.522 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.341 -4.367 3.653 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.312 -4.684 5.766 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.253 -3.303 5.563 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.633 -2.026 5.375 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.140 -3.389 6.353 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.426 -1.171 7.177 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.321 -4.536 7.784 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -6.799 -4.488 9.471 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -5.761 -1.123 9.342 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -5.920 -2.566 10.348 1.00 0.00 H new ATOM 2198 N SER A 149 -6.273 -5.520 1.291 1.00 0.00 N ATOM 2199 CA SER A 149 -6.691 -5.821 -0.074 1.00 0.00 C ATOM 2200 C SER A 149 -8.135 -6.311 -0.104 1.00 0.00 C ATOM 2201 O SER A 149 -8.530 -7.159 0.695 1.00 0.00 O ATOM 2202 CB SER A 149 -5.770 -6.874 -0.692 1.00 0.00 C ATOM 2203 OG SER A 149 -6.268 -7.318 -1.942 1.00 0.00 O ATOM 0 H SER A 149 -6.484 -6.252 1.969 1.00 0.00 H new ATOM 0 HA SER A 149 -6.625 -4.903 -0.659 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.772 -6.457 -0.823 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.675 -7.722 -0.013 1.00 0.00 H new ATOM 0 HG SER A 149 -6.422 -8.285 -1.908 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.919 -5.771 -1.032 1.00 0.00 N ATOM 2210 CA CYS A 150 -10.320 -6.154 -1.168 1.00 0.00 C ATOM 2211 C CYS A 150 -10.514 -7.098 -2.350 1.00 0.00 C ATOM 2212 O CYS A 150 -11.562 -7.095 -2.994 1.00 0.00 O ATOM 2213 CB CYS A 150 -11.194 -4.912 -1.344 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.762 -3.902 -2.780 1.00 0.00 S ATOM 0 H CYS A 150 -8.608 -5.067 -1.701 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.619 -6.675 -0.258 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -12.235 -5.223 -1.432 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -11.120 -4.298 -0.446 1.00 0.00 H new ATOM 0 HG CYS A 150 -10.175 -2.812 -2.383 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.497 -7.908 -2.627 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.555 -8.858 -3.731 1.00 0.00 C ATOM 2222 C ALA A 151 -10.145 -10.189 -3.278 1.00 0.00 C ATOM 2223 O ALA A 151 -10.366 -10.408 -2.087 1.00 0.00 O ATOM 2224 CB ALA A 151 -8.169 -9.067 -4.322 1.00 0.00 C ATOM 0 H ALA A 151 -8.623 -7.925 -2.102 1.00 0.00 H new ATOM 0 HA ALA A 151 -10.207 -8.444 -4.500 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -8.228 -9.779 -5.145 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.784 -8.116 -4.691 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.501 -9.456 -3.554 1.00 0.00 H new