USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -2.14 K(o=-2.1,f=-5.1!) USER MOD Single : A 24 SER OG : rot 48:sc= 0.899 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -138:sc= -0.728 (180deg=-6.89!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 95:sc= 0.727 USER MOD Single : A 38 HIS : no HD1:sc= -0.261 K(o=-0.26,f=-0.9) USER MOD Single : A 42 ASN : amide:sc= -0.0287 K(o=-0.029,f=-1.4!) USER MOD Single : A 46 THR OG1 : rot -100:sc= -0.158 USER MOD Single : A 51 HIS : no HD1:sc= -1.5 K(o=-1.5,f=-4.7!) USER MOD Single : A 59 SER OG : rot 92:sc= 0.496 USER MOD Single : A 63 GLN : amide:sc= 0.468 K(o=0.47,f=-0.7) USER MOD Single : A 65 THR OG1 : rot -170:sc= -0.0815 USER MOD Single : A 68 LYS NZ :NH3+ -134:sc= -1.15 (180deg=-3.08!) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc=-0.00997 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -53:sc= 0.0971 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -1.79 X(o=-1.8,f=-2.2!) USER MOD Single : A 88 SER OG : rot 180:sc= 0.0518 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -0.117 K(o=-0.12,f=-2.3!) USER MOD Single : A 110 GLN : amide:sc= -0.267 K(o=-0.27,f=-1.6!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl -176:sc= -1.84 (180deg=-1.94) USER MOD Single : A 119 SER OG : rot 177:sc= 1.2 USER MOD Single : A 120 ASN : amide:sc= -5.07! C(o=-5.1!,f=-12!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 26:sc= 0.116 USER MOD Single : A 126 CYS SG : rot 24:sc= -1.54 USER MOD Single : A 127 ASN : amide:sc= -0.387 K(o=-0.39,f=-2.9!) USER MOD Single : A 135 LYS NZ :NH3+ -178:sc= 0.455 (180deg=0.452) USER MOD Single : A 136 ASN : amide:sc=-0.00406 X(o=-0.0041,f=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 44:sc= 0.0116 USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ -155:sc=-0.00337 (180deg=-0.389) USER MOD Single : A 149 SER OG : rot 180:sc= -0.352 USER MOD Single : A 150 CYS SG : rot -106:sc= 0.712 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -7.436 -10.489 10.308 1.00 0.00 N ATOM 88 CA ASP A 9 -8.198 -9.256 10.461 1.00 0.00 C ATOM 89 C ASP A 9 -8.891 -8.879 9.156 1.00 0.00 C ATOM 90 O ASP A 9 -8.242 -8.464 8.195 1.00 0.00 O ATOM 91 CB ASP A 9 -7.280 -8.117 10.912 1.00 0.00 C ATOM 92 CG ASP A 9 -6.817 -8.282 12.346 1.00 0.00 C ATOM 93 OD1 ASP A 9 -6.013 -9.200 12.609 1.00 0.00 O ATOM 94 OD2 ASP A 9 -7.260 -7.491 13.206 1.00 0.00 O ATOM 0 HA ASP A 9 -8.961 -9.422 11.222 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -6.411 -8.072 10.255 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -7.806 -7.168 10.810 1.00 0.00 H new ATOM 99 N ILE A 10 -10.211 -9.027 9.128 1.00 0.00 N ATOM 100 CA ILE A 10 -10.993 -8.703 7.941 1.00 0.00 C ATOM 101 C ILE A 10 -12.010 -7.604 8.236 1.00 0.00 C ATOM 102 O ILE A 10 -12.952 -7.805 9.003 1.00 0.00 O ATOM 103 CB ILE A 10 -11.729 -9.944 7.397 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.451 -9.608 6.091 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.712 -10.477 8.431 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.727 -10.819 5.225 1.00 0.00 C ATOM 0 H ILE A 10 -10.762 -9.370 9.915 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.292 -8.349 7.185 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.992 -10.721 7.192 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.395 -9.115 6.323 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.850 -8.896 5.525 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -13.222 -11.353 8.030 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.173 -10.754 9.337 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.445 -9.706 8.667 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -13.241 -10.507 4.316 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.785 -11.301 4.962 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -13.354 -11.523 5.773 1.00 0.00 H new ATOM 118 N VAL A 11 -11.812 -6.442 7.622 1.00 0.00 N ATOM 119 CA VAL A 11 -12.712 -5.312 7.817 1.00 0.00 C ATOM 120 C VAL A 11 -13.702 -5.193 6.663 1.00 0.00 C ATOM 121 O VAL A 11 -13.436 -4.514 5.672 1.00 0.00 O ATOM 122 CB VAL A 11 -11.933 -3.990 7.947 1.00 0.00 C ATOM 123 CG1 VAL A 11 -12.865 -2.856 8.346 1.00 0.00 C ATOM 124 CG2 VAL A 11 -10.799 -4.134 8.950 1.00 0.00 C ATOM 0 H VAL A 11 -11.036 -6.259 6.985 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.257 -5.497 8.743 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.501 -3.749 6.976 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.296 -1.931 8.433 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.638 -2.737 7.587 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.330 -3.087 9.304 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.260 -3.190 9.028 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.207 -4.401 9.925 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.116 -4.915 8.617 1.00 0.00 H new ATOM 134 N GLY A 12 -14.844 -5.858 6.800 1.00 0.00 N ATOM 135 CA GLY A 12 -15.857 -5.813 5.762 1.00 0.00 C ATOM 136 C GLY A 12 -15.432 -6.548 4.506 1.00 0.00 C ATOM 137 O GLY A 12 -15.860 -7.675 4.263 1.00 0.00 O ATOM 0 H GLY A 12 -15.086 -6.427 7.611 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.781 -6.251 6.141 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.074 -4.774 5.515 1.00 0.00 H new ATOM 141 N ILE A 13 -14.586 -5.906 3.705 1.00 0.00 N ATOM 142 CA ILE A 13 -14.101 -6.506 2.467 1.00 0.00 C ATOM 143 C ILE A 13 -12.617 -6.216 2.261 1.00 0.00 C ATOM 144 O ILE A 13 -12.152 -6.079 1.130 1.00 0.00 O ATOM 145 CB ILE A 13 -14.888 -5.992 1.245 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.079 -4.475 1.326 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.233 -6.698 1.148 1.00 0.00 C ATOM 148 CD1 ILE A 13 -14.709 -3.751 0.050 1.00 0.00 C ATOM 0 H ILE A 13 -14.223 -4.971 3.891 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.250 -7.582 2.558 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.315 -6.215 0.345 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.120 -4.260 1.567 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.475 -4.084 2.145 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -16.778 -6.325 0.281 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.074 -7.771 1.043 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -16.812 -6.504 2.051 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -14.869 -2.681 0.179 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -13.660 -3.936 -0.182 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.331 -4.115 -0.768 1.00 0.00 H new ATOM 160 N TRP A 14 -11.879 -6.126 3.363 1.00 0.00 N ATOM 161 CA TRP A 14 -10.447 -5.853 3.304 1.00 0.00 C ATOM 162 C TRP A 14 -9.698 -6.657 4.360 1.00 0.00 C ATOM 163 O TRP A 14 -9.932 -6.497 5.558 1.00 0.00 O ATOM 164 CB TRP A 14 -10.182 -4.359 3.501 1.00 0.00 C ATOM 165 CG TRP A 14 -10.955 -3.489 2.557 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.251 -3.084 2.693 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.479 -2.916 1.334 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.612 -2.294 1.627 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.542 -2.176 0.780 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.259 -2.955 0.653 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.419 -1.482 -0.422 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.139 -2.267 -0.539 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.213 -1.538 -1.066 1.00 0.00 C ATOM 0 H TRP A 14 -12.249 -6.238 4.307 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.085 -6.152 2.320 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.434 -4.085 4.525 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.117 -4.166 3.372 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -12.898 -3.346 3.517 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.527 -1.866 1.489 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.425 -3.513 1.052 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.246 -0.920 -0.831 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.201 -2.292 -1.074 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.087 -1.010 -1.999 1.00 0.00 H new ATOM 184 N TRP A 15 -8.795 -7.522 3.910 1.00 0.00 N ATOM 185 CA TRP A 15 -8.010 -8.352 4.818 1.00 0.00 C ATOM 186 C TRP A 15 -6.530 -7.991 4.745 1.00 0.00 C ATOM 187 O TRP A 15 -5.971 -7.840 3.658 1.00 0.00 O ATOM 188 CB TRP A 15 -8.203 -9.832 4.484 1.00 0.00 C ATOM 189 CG TRP A 15 -7.964 -10.153 3.040 1.00 0.00 C ATOM 190 CD1 TRP A 15 -8.860 -10.039 2.016 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.750 -10.642 2.459 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.279 -10.427 0.834 1.00 0.00 N ATOM 193 CE2 TRP A 15 -6.983 -10.801 1.079 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.490 -10.960 2.971 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.001 -11.264 0.208 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.516 -11.419 2.104 1.00 0.00 C ATOM 197 CH2 TRP A 15 -4.776 -11.568 0.736 1.00 0.00 C ATOM 0 H TRP A 15 -8.588 -7.667 2.922 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.360 -8.167 5.833 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.526 -10.426 5.097 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.218 -10.128 4.751 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.878 -9.694 2.121 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.737 -10.436 -0.077 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.281 -10.849 4.025 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.199 -11.379 -0.847 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.538 -11.667 2.488 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -3.994 -11.930 0.085 1.00 0.00 H new ATOM 208 N THR A 16 -5.901 -7.857 5.907 1.00 0.00 N ATOM 209 CA THR A 16 -4.485 -7.515 5.976 1.00 0.00 C ATOM 210 C THR A 16 -3.625 -8.653 5.437 1.00 0.00 C ATOM 211 O THR A 16 -3.727 -9.792 5.895 1.00 0.00 O ATOM 212 CB THR A 16 -4.085 -7.195 7.417 1.00 0.00 C ATOM 213 OG1 THR A 16 -4.995 -6.277 7.998 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.697 -6.603 7.536 1.00 0.00 C ATOM 0 H THR A 16 -6.349 -7.980 6.815 1.00 0.00 H new ATOM 0 HA THR A 16 -4.319 -6.633 5.357 1.00 0.00 H new ATOM 0 HB THR A 16 -4.100 -8.151 7.940 1.00 0.00 H new ATOM 0 HG1 THR A 16 -4.723 -6.086 8.920 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.477 -6.400 8.584 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.966 -7.308 7.142 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.648 -5.674 6.968 1.00 0.00 H new ATOM 222 N VAL A 17 -2.777 -8.339 4.464 1.00 0.00 N ATOM 223 CA VAL A 17 -1.899 -9.336 3.863 1.00 0.00 C ATOM 224 C VAL A 17 -0.801 -9.758 4.832 1.00 0.00 C ATOM 225 O VAL A 17 -0.664 -9.192 5.916 1.00 0.00 O ATOM 226 CB VAL A 17 -1.250 -8.807 2.570 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.301 -8.600 1.491 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.494 -7.515 2.844 1.00 0.00 C ATOM 0 H VAL A 17 -2.679 -7.401 4.074 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.520 -10.199 3.623 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.537 -9.550 2.211 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.824 -8.226 0.585 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.794 -9.548 1.277 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.040 -7.877 1.837 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.042 -7.155 1.920 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.185 -6.764 3.227 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.287 -7.700 3.582 1.00 0.00 H new ATOM 238 N SER A 18 -0.021 -10.759 4.435 1.00 0.00 N ATOM 239 CA SER A 18 1.067 -11.259 5.267 1.00 0.00 C ATOM 240 C SER A 18 2.393 -11.216 4.515 1.00 0.00 C ATOM 241 O SER A 18 3.395 -10.723 5.031 1.00 0.00 O ATOM 242 CB SER A 18 0.771 -12.689 5.722 1.00 0.00 C ATOM 243 OG SER A 18 1.116 -12.873 7.085 1.00 0.00 O ATOM 0 H SER A 18 -0.123 -11.240 3.541 1.00 0.00 H new ATOM 0 HA SER A 18 1.147 -10.615 6.143 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.287 -12.908 5.579 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.328 -13.393 5.104 1.00 0.00 H new ATOM 0 HG SER A 18 0.916 -13.794 7.352 1.00 0.00 H new ATOM 249 N ASN A 19 2.391 -11.735 3.292 1.00 0.00 N ATOM 250 CA ASN A 19 3.594 -11.757 2.467 1.00 0.00 C ATOM 251 C ASN A 19 3.449 -10.827 1.266 1.00 0.00 C ATOM 252 O ASN A 19 2.405 -10.203 1.074 1.00 0.00 O ATOM 253 CB ASN A 19 3.890 -13.181 1.990 1.00 0.00 C ATOM 254 CG ASN A 19 2.647 -13.903 1.507 1.00 0.00 C ATOM 255 OD1 ASN A 19 1.754 -14.221 2.293 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.582 -14.167 0.207 1.00 0.00 N ATOM 0 H ASN A 19 1.569 -12.146 2.850 1.00 0.00 H new ATOM 0 HA ASN A 19 4.426 -11.407 3.078 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.622 -13.145 1.183 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.341 -13.747 2.805 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.770 -14.651 -0.175 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.345 -13.886 -0.409 1.00 0.00 H new ATOM 263 N PHE A 20 4.504 -10.737 0.463 1.00 0.00 N ATOM 264 CA PHE A 20 4.496 -9.882 -0.718 1.00 0.00 C ATOM 265 C PHE A 20 3.651 -10.495 -1.831 1.00 0.00 C ATOM 266 O PHE A 20 3.004 -9.782 -2.596 1.00 0.00 O ATOM 267 CB PHE A 20 5.925 -9.653 -1.215 1.00 0.00 C ATOM 268 CG PHE A 20 6.008 -8.770 -2.427 1.00 0.00 C ATOM 269 CD1 PHE A 20 6.103 -7.394 -2.294 1.00 0.00 C ATOM 270 CD2 PHE A 20 5.990 -9.316 -3.700 1.00 0.00 C ATOM 271 CE1 PHE A 20 6.179 -6.579 -3.408 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.067 -8.507 -4.818 1.00 0.00 C ATOM 273 CZ PHE A 20 6.160 -7.136 -4.672 1.00 0.00 C ATOM 0 H PHE A 20 5.376 -11.246 0.609 1.00 0.00 H new ATOM 0 HA PHE A 20 4.056 -8.925 -0.439 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.513 -9.209 -0.412 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.379 -10.617 -1.447 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.118 -6.953 -1.308 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.915 -10.387 -3.820 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.253 -5.508 -3.290 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.054 -8.946 -5.805 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.218 -6.501 -5.544 1.00 0.00 H new ATOM 283 N GLY A 21 3.664 -11.821 -1.914 1.00 0.00 N ATOM 284 CA GLY A 21 2.895 -12.507 -2.937 1.00 0.00 C ATOM 285 C GLY A 21 1.413 -12.190 -2.862 1.00 0.00 C ATOM 286 O GLY A 21 0.709 -12.241 -3.871 1.00 0.00 O ATOM 0 H GLY A 21 4.193 -12.433 -1.292 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.274 -12.227 -3.920 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.039 -13.583 -2.835 1.00 0.00 H new ATOM 290 N GLU A 22 0.939 -11.862 -1.665 1.00 0.00 N ATOM 291 CA GLU A 22 -0.468 -11.537 -1.463 1.00 0.00 C ATOM 292 C GLU A 22 -0.797 -10.159 -2.029 1.00 0.00 C ATOM 293 O GLU A 22 -1.921 -9.907 -2.460 1.00 0.00 O ATOM 294 CB GLU A 22 -0.815 -11.584 0.027 1.00 0.00 C ATOM 295 CG GLU A 22 -0.354 -12.856 0.719 1.00 0.00 C ATOM 296 CD GLU A 22 -1.426 -13.460 1.605 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.542 -13.710 1.101 1.00 0.00 O ATOM 298 OE2 GLU A 22 -1.151 -13.681 2.803 1.00 0.00 O ATOM 0 H GLU A 22 1.508 -11.814 -0.820 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.065 -12.279 -1.993 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.363 -10.726 0.524 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.894 -11.488 0.143 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.056 -13.586 -0.033 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.529 -12.639 1.320 1.00 0.00 H new ATOM 305 N ILE A 23 0.193 -9.270 -2.026 1.00 0.00 N ATOM 306 CA ILE A 23 0.005 -7.919 -2.540 1.00 0.00 C ATOM 307 C ILE A 23 -0.192 -7.931 -4.053 1.00 0.00 C ATOM 308 O ILE A 23 0.756 -8.130 -4.811 1.00 0.00 O ATOM 309 CB ILE A 23 1.206 -7.014 -2.197 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.513 -7.080 -0.699 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.930 -5.580 -2.622 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.936 -6.696 -0.357 1.00 0.00 C ATOM 0 H ILE A 23 1.131 -9.462 -1.674 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.889 -7.519 -2.062 1.00 0.00 H new ATOM 0 HB ILE A 23 2.078 -7.373 -2.744 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.829 -6.419 -0.167 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.322 -8.092 -0.341 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.788 -4.955 -2.373 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.757 -5.546 -3.698 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.047 -5.210 -2.101 1.00 0.00 H new ATOM 0 HD11 ILE A 23 3.083 -6.765 0.721 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.626 -7.372 -0.861 1.00 0.00 H new ATOM 0 HD13 ILE A 23 3.126 -5.674 -0.684 1.00 0.00 H new ATOM 324 N SER A 24 -1.432 -7.720 -4.483 1.00 0.00 N ATOM 325 CA SER A 24 -1.755 -7.706 -5.905 1.00 0.00 C ATOM 326 C SER A 24 -3.188 -7.233 -6.131 1.00 0.00 C ATOM 327 O SER A 24 -4.142 -7.976 -5.904 1.00 0.00 O ATOM 328 CB SER A 24 -1.566 -9.101 -6.505 1.00 0.00 C ATOM 329 OG SER A 24 -0.286 -9.229 -7.101 1.00 0.00 O ATOM 0 H SER A 24 -2.229 -7.557 -3.868 1.00 0.00 H new ATOM 0 HA SER A 24 -1.078 -7.010 -6.400 1.00 0.00 H new ATOM 0 HB2 SER A 24 -1.686 -9.855 -5.727 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.339 -9.288 -7.251 1.00 0.00 H new ATOM 0 HG SER A 24 0.397 -8.891 -6.485 1.00 0.00 H new ATOM 335 N GLY A 25 -3.331 -5.990 -6.581 1.00 0.00 N ATOM 336 CA GLY A 25 -4.649 -5.438 -6.832 1.00 0.00 C ATOM 337 C GLY A 25 -4.963 -4.257 -5.933 1.00 0.00 C ATOM 338 O GLY A 25 -4.057 -3.619 -5.397 1.00 0.00 O ATOM 0 H GLY A 25 -2.557 -5.355 -6.776 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.717 -5.126 -7.874 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.399 -6.214 -6.683 1.00 0.00 H new ATOM 342 N THR A 26 -6.249 -3.967 -5.768 1.00 0.00 N ATOM 343 CA THR A 26 -6.680 -2.856 -4.928 1.00 0.00 C ATOM 344 C THR A 26 -6.358 -3.126 -3.462 1.00 0.00 C ATOM 345 O THR A 26 -6.643 -4.204 -2.942 1.00 0.00 O ATOM 346 CB THR A 26 -8.181 -2.614 -5.097 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.503 -2.381 -6.456 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.690 -1.434 -4.296 1.00 0.00 C ATOM 0 H THR A 26 -7.011 -4.486 -6.205 1.00 0.00 H new ATOM 0 HA THR A 26 -6.138 -1.964 -5.242 1.00 0.00 H new ATOM 0 HB THR A 26 -8.662 -3.520 -4.728 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.467 -2.230 -6.542 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.761 -1.317 -4.461 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.502 -1.606 -3.236 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.173 -0.528 -4.614 1.00 0.00 H new ATOM 356 N ILE A 27 -5.761 -2.139 -2.802 1.00 0.00 N ATOM 357 CA ILE A 27 -5.400 -2.270 -1.397 1.00 0.00 C ATOM 358 C ILE A 27 -5.690 -0.983 -0.632 1.00 0.00 C ATOM 359 O ILE A 27 -6.053 0.034 -1.224 1.00 0.00 O ATOM 360 CB ILE A 27 -3.911 -2.627 -1.229 1.00 0.00 C ATOM 361 CG1 ILE A 27 -3.034 -1.614 -1.969 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.643 -4.036 -1.734 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.572 -1.692 -1.592 1.00 0.00 C ATOM 0 H ILE A 27 -5.517 -1.240 -3.218 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.008 -3.078 -0.990 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.662 -2.589 -0.169 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -3.133 -1.775 -3.042 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.401 -0.609 -1.763 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.586 -4.273 -1.608 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.244 -4.746 -1.166 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.906 -4.100 -2.790 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.011 -0.946 -2.155 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.461 -1.501 -0.525 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.189 -2.686 -1.824 1.00 0.00 H new ATOM 375 N ALA A 28 -5.528 -1.034 0.686 1.00 0.00 N ATOM 376 CA ALA A 28 -5.773 0.127 1.532 1.00 0.00 C ATOM 377 C ALA A 28 -4.676 0.285 2.579 1.00 0.00 C ATOM 378 O ALA A 28 -4.383 -0.645 3.329 1.00 0.00 O ATOM 379 CB ALA A 28 -7.134 0.015 2.202 1.00 0.00 C ATOM 0 H ALA A 28 -5.228 -1.868 1.191 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.765 1.014 0.899 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.303 0.889 2.831 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.911 -0.040 1.440 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.164 -0.885 2.816 1.00 0.00 H new ATOM 385 N ILE A 29 -4.073 1.469 2.624 1.00 0.00 N ATOM 386 CA ILE A 29 -3.008 1.747 3.579 1.00 0.00 C ATOM 387 C ILE A 29 -3.504 2.642 4.709 1.00 0.00 C ATOM 388 O ILE A 29 -4.008 3.739 4.470 1.00 0.00 O ATOM 389 CB ILE A 29 -1.803 2.422 2.897 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.404 1.650 1.638 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.630 2.514 3.862 1.00 0.00 C ATOM 392 CD1 ILE A 29 -0.448 2.409 0.742 1.00 0.00 C ATOM 0 H ILE A 29 -4.304 2.250 2.010 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.693 0.788 3.989 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.089 3.433 2.606 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.944 0.706 1.931 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.303 1.404 1.072 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.213 2.993 3.365 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -0.920 3.102 4.732 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.342 1.512 4.181 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.208 1.802 -0.131 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.913 3.340 0.420 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.467 2.632 1.292 1.00 0.00 H new ATOM 404 N GLU A 30 -3.358 2.167 5.941 1.00 0.00 N ATOM 405 CA GLU A 30 -3.790 2.925 7.110 1.00 0.00 C ATOM 406 C GLU A 30 -2.593 3.475 7.877 1.00 0.00 C ATOM 407 O GLU A 30 -1.826 2.720 8.476 1.00 0.00 O ATOM 408 CB GLU A 30 -4.639 2.044 8.029 1.00 0.00 C ATOM 409 CG GLU A 30 -5.368 2.822 9.112 1.00 0.00 C ATOM 410 CD GLU A 30 -6.496 2.026 9.741 1.00 0.00 C ATOM 411 OE1 GLU A 30 -6.225 1.261 10.690 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.649 2.168 9.283 1.00 0.00 O ATOM 0 H GLU A 30 -2.944 1.260 6.156 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.392 3.765 6.764 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.369 1.503 7.427 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -3.997 1.298 8.498 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.658 3.113 9.886 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -5.770 3.741 8.686 1.00 0.00 H new ATOM 419 N MET A 31 -2.438 4.794 7.853 1.00 0.00 N ATOM 420 CA MET A 31 -1.332 5.446 8.547 1.00 0.00 C ATOM 421 C MET A 31 -1.690 5.717 10.005 1.00 0.00 C ATOM 422 O MET A 31 -0.914 5.410 10.911 1.00 0.00 O ATOM 423 CB MET A 31 -0.966 6.757 7.848 1.00 0.00 C ATOM 424 CG MET A 31 -0.109 6.566 6.607 1.00 0.00 C ATOM 425 SD MET A 31 1.122 7.869 6.406 1.00 0.00 S ATOM 426 CE MET A 31 1.326 7.871 4.627 1.00 0.00 C ATOM 0 H MET A 31 -3.063 5.433 7.361 1.00 0.00 H new ATOM 0 HA MET A 31 -0.473 4.776 8.520 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.882 7.279 7.570 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.435 7.398 8.551 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.395 5.601 6.663 1.00 0.00 H new ATOM 0 HG3 MET A 31 -0.752 6.540 5.727 1.00 0.00 H new ATOM 0 HE1 MET A 31 2.384 7.967 4.382 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.942 6.938 4.216 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.777 8.710 4.199 1.00 0.00 H new ATOM 436 N ASP A 32 -2.867 6.292 10.223 1.00 0.00 N ATOM 437 CA ASP A 32 -3.327 6.602 11.572 1.00 0.00 C ATOM 438 C ASP A 32 -4.354 5.580 12.046 1.00 0.00 C ATOM 439 O ASP A 32 -4.941 4.855 11.242 1.00 0.00 O ATOM 440 CB ASP A 32 -3.931 8.007 11.616 1.00 0.00 C ATOM 441 CG ASP A 32 -4.191 8.479 13.033 1.00 0.00 C ATOM 442 OD1 ASP A 32 -5.296 8.218 13.553 1.00 0.00 O ATOM 443 OD2 ASP A 32 -3.288 9.110 13.624 1.00 0.00 O ATOM 0 H ASP A 32 -3.520 6.553 9.484 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.467 6.562 12.240 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.256 8.705 11.121 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -4.866 8.016 11.056 1.00 0.00 H new ATOM 448 N LYS A 33 -4.566 5.526 13.357 1.00 0.00 N ATOM 449 CA LYS A 33 -5.523 4.592 13.940 1.00 0.00 C ATOM 450 C LYS A 33 -6.955 5.008 13.618 1.00 0.00 C ATOM 451 O LYS A 33 -7.640 5.607 14.448 1.00 0.00 O ATOM 452 CB LYS A 33 -5.331 4.512 15.455 1.00 0.00 C ATOM 453 CG LYS A 33 -4.025 3.853 15.868 1.00 0.00 C ATOM 454 CD LYS A 33 -3.615 4.265 17.273 1.00 0.00 C ATOM 455 CE LYS A 33 -4.313 3.421 18.327 1.00 0.00 C ATOM 456 NZ LYS A 33 -4.457 4.151 19.617 1.00 0.00 N ATOM 0 H LYS A 33 -4.088 6.118 14.036 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.343 3.608 13.506 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.368 5.519 15.871 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.162 3.957 15.890 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.132 2.769 15.822 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.239 4.126 15.163 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.535 4.165 17.382 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -3.855 5.317 17.430 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.298 3.128 17.964 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -3.748 2.503 18.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -4.938 3.541 20.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -3.516 4.409 19.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -5.018 5.014 19.467 1.00 0.00 H new ATOM 470 N GLY A 34 -7.402 4.686 12.408 1.00 0.00 N ATOM 471 CA GLY A 34 -8.750 5.034 11.998 1.00 0.00 C ATOM 472 C GLY A 34 -8.773 5.910 10.761 1.00 0.00 C ATOM 473 O GLY A 34 -9.706 5.842 9.960 1.00 0.00 O ATOM 0 H GLY A 34 -6.855 4.190 11.704 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.314 4.122 11.804 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.253 5.552 12.815 1.00 0.00 H new ATOM 477 N ALA A 35 -7.742 6.734 10.603 1.00 0.00 N ATOM 478 CA ALA A 35 -7.647 7.627 9.455 1.00 0.00 C ATOM 479 C ALA A 35 -7.003 6.924 8.265 1.00 0.00 C ATOM 480 O ALA A 35 -6.369 5.880 8.418 1.00 0.00 O ATOM 481 CB ALA A 35 -6.859 8.876 9.823 1.00 0.00 C ATOM 0 H ALA A 35 -6.961 6.801 11.256 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.657 7.919 9.168 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.795 9.535 8.957 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.362 9.396 10.638 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.855 8.593 10.138 1.00 0.00 H new ATOM 487 N TYR A 36 -7.168 7.504 7.081 1.00 0.00 N ATOM 488 CA TYR A 36 -6.601 6.933 5.865 1.00 0.00 C ATOM 489 C TYR A 36 -5.975 8.018 4.995 1.00 0.00 C ATOM 490 O TYR A 36 -6.392 9.176 5.033 1.00 0.00 O ATOM 491 CB TYR A 36 -7.678 6.188 5.075 1.00 0.00 C ATOM 492 CG TYR A 36 -7.996 4.816 5.627 1.00 0.00 C ATOM 493 CD1 TYR A 36 -7.129 3.749 5.429 1.00 0.00 C ATOM 494 CD2 TYR A 36 -9.163 4.589 6.347 1.00 0.00 C ATOM 495 CE1 TYR A 36 -7.416 2.494 5.931 1.00 0.00 C ATOM 496 CE2 TYR A 36 -9.456 3.337 6.853 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.580 2.293 6.642 1.00 0.00 C ATOM 498 OH TYR A 36 -8.869 1.045 7.144 1.00 0.00 O ATOM 0 H TYR A 36 -7.690 8.369 6.938 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.821 6.229 6.154 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.589 6.786 5.066 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.352 6.087 4.040 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -6.216 3.903 4.874 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -9.852 5.404 6.514 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -6.732 1.675 5.767 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -10.367 3.177 7.411 1.00 0.00 H new ATOM 0 HH TYR A 36 -8.563 0.987 8.073 1.00 0.00 H new ATOM 508 N ILE A 37 -4.971 7.636 4.212 1.00 0.00 N ATOM 509 CA ILE A 37 -4.287 8.576 3.332 1.00 0.00 C ATOM 510 C ILE A 37 -5.219 9.075 2.232 1.00 0.00 C ATOM 511 O ILE A 37 -5.680 8.298 1.395 1.00 0.00 O ATOM 512 CB ILE A 37 -3.042 7.938 2.685 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.160 7.286 3.752 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.255 8.982 1.906 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.633 5.926 3.352 1.00 0.00 C ATOM 0 H ILE A 37 -4.613 6.682 4.169 1.00 0.00 H new ATOM 0 HA ILE A 37 -3.974 9.418 3.950 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.370 7.165 1.990 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.318 7.944 3.967 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.732 7.188 4.675 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.379 8.516 1.455 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.885 9.403 1.123 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.936 9.776 2.581 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.016 5.524 4.156 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.469 5.252 3.165 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.033 6.020 2.447 1.00 0.00 H new ATOM 527 N HIS A 38 -5.492 10.376 2.239 1.00 0.00 N ATOM 528 CA HIS A 38 -6.368 10.978 1.242 1.00 0.00 C ATOM 529 C HIS A 38 -5.557 11.662 0.146 1.00 0.00 C ATOM 530 O HIS A 38 -4.369 11.937 0.319 1.00 0.00 O ATOM 531 CB HIS A 38 -7.307 11.990 1.902 1.00 0.00 C ATOM 532 CG HIS A 38 -8.493 12.344 1.059 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.479 11.450 0.704 1.00 0.00 N ATOM 534 CD2 HIS A 38 -8.844 13.530 0.498 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.376 12.103 -0.045 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.038 13.368 -0.200 1.00 0.00 N ATOM 0 H HIS A 38 -5.119 11.033 2.924 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.960 10.183 0.789 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.655 11.585 2.852 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -6.748 12.898 2.128 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.286 14.451 0.580 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.262 11.652 -0.468 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -10.546 14.081 -0.723 1.00 0.00 H new ATOM 544 N ALA A 39 -6.206 11.932 -0.982 1.00 0.00 N ATOM 545 CA ALA A 39 -5.546 12.583 -2.107 1.00 0.00 C ATOM 546 C ALA A 39 -6.322 13.814 -2.561 1.00 0.00 C ATOM 547 O ALA A 39 -7.553 13.809 -2.586 1.00 0.00 O ATOM 548 CB ALA A 39 -5.381 11.604 -3.260 1.00 0.00 C ATOM 0 H ALA A 39 -7.189 11.710 -1.141 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.559 12.910 -1.779 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.887 12.103 -4.093 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -4.777 10.757 -2.935 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.361 11.249 -3.579 1.00 0.00 H new ATOM 554 N LEU A 40 -5.596 14.867 -2.921 1.00 0.00 N ATOM 555 CA LEU A 40 -6.217 16.105 -3.375 1.00 0.00 C ATOM 556 C LEU A 40 -6.255 16.169 -4.898 1.00 0.00 C ATOM 557 O LEU A 40 -5.434 15.550 -5.576 1.00 0.00 O ATOM 558 CB LEU A 40 -5.459 17.314 -2.821 1.00 0.00 C ATOM 559 CG LEU A 40 -5.874 17.749 -1.414 1.00 0.00 C ATOM 560 CD1 LEU A 40 -4.914 18.798 -0.876 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.299 18.281 -1.422 1.00 0.00 C ATOM 0 H LEU A 40 -4.576 14.887 -2.907 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.241 16.125 -3.003 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.394 17.084 -2.814 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.599 18.154 -3.501 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.835 16.880 -0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.224 19.096 0.126 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.907 18.383 -0.835 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.921 19.668 -1.532 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.579 18.586 -0.414 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.363 19.138 -2.092 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.977 17.500 -1.766 1.00 0.00 H new ATOM 573 N ASP A 41 -7.212 16.922 -5.431 1.00 0.00 N ATOM 574 CA ASP A 41 -7.357 17.067 -6.874 1.00 0.00 C ATOM 575 C ASP A 41 -6.157 17.796 -7.471 1.00 0.00 C ATOM 576 O ASP A 41 -5.770 17.546 -8.612 1.00 0.00 O ATOM 577 CB ASP A 41 -8.645 17.823 -7.205 1.00 0.00 C ATOM 578 CG ASP A 41 -9.847 16.904 -7.298 1.00 0.00 C ATOM 579 OD1 ASP A 41 -9.687 15.763 -7.778 1.00 0.00 O ATOM 580 OD2 ASP A 41 -10.949 17.327 -6.889 1.00 0.00 O ATOM 0 H ASP A 41 -7.899 17.441 -4.884 1.00 0.00 H new ATOM 0 HA ASP A 41 -7.407 16.070 -7.311 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -8.827 18.578 -6.440 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.521 18.351 -8.151 1.00 0.00 H new ATOM 585 N ASN A 42 -5.573 18.698 -6.691 1.00 0.00 N ATOM 586 CA ASN A 42 -4.416 19.465 -7.141 1.00 0.00 C ATOM 587 C ASN A 42 -3.196 18.564 -7.302 1.00 0.00 C ATOM 588 O ASN A 42 -2.381 18.762 -8.203 1.00 0.00 O ATOM 589 CB ASN A 42 -4.107 20.590 -6.152 1.00 0.00 C ATOM 590 CG ASN A 42 -3.166 21.627 -6.734 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.044 21.757 -7.952 1.00 0.00 O ATOM 592 ND2 ASN A 42 -2.496 22.372 -5.864 1.00 0.00 N ATOM 0 H ASN A 42 -5.881 18.917 -5.744 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.655 19.900 -8.111 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.037 21.074 -5.854 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.664 20.167 -5.250 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -1.849 23.087 -6.197 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.628 22.230 -4.863 1.00 0.00 H new ATOM 599 N GLY A 43 -3.077 17.573 -6.424 1.00 0.00 N ATOM 600 CA GLY A 43 -1.953 16.657 -6.487 1.00 0.00 C ATOM 601 C GLY A 43 -1.402 16.318 -5.116 1.00 0.00 C ATOM 602 O GLY A 43 -0.819 15.251 -4.922 1.00 0.00 O ATOM 0 H GLY A 43 -3.739 17.388 -5.670 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.264 15.740 -6.987 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.162 17.099 -7.094 1.00 0.00 H new ATOM 606 N LEU A 44 -1.584 17.227 -4.164 1.00 0.00 N ATOM 607 CA LEU A 44 -1.098 17.018 -2.804 1.00 0.00 C ATOM 608 C LEU A 44 -1.856 15.883 -2.124 1.00 0.00 C ATOM 609 O LEU A 44 -2.829 15.360 -2.668 1.00 0.00 O ATOM 610 CB LEU A 44 -1.239 18.303 -1.987 1.00 0.00 C ATOM 611 CG LEU A 44 -0.666 19.558 -2.648 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.286 20.809 -2.047 1.00 0.00 C ATOM 613 CD2 LEU A 44 0.848 19.590 -2.507 1.00 0.00 C ATOM 0 H LEU A 44 -2.064 18.115 -4.308 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.044 16.745 -2.859 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.296 18.470 -1.781 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.746 18.160 -1.026 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.912 19.531 -3.710 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.866 21.691 -2.530 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.365 20.790 -2.201 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.072 20.844 -0.979 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.239 20.489 -2.983 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.115 19.593 -1.450 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.277 18.710 -2.987 1.00 0.00 H new ATOM 625 N PHE A 45 -1.405 15.509 -0.932 1.00 0.00 N ATOM 626 CA PHE A 45 -2.042 14.437 -0.176 1.00 0.00 C ATOM 627 C PHE A 45 -2.134 14.795 1.304 1.00 0.00 C ATOM 628 O PHE A 45 -1.167 15.268 1.900 1.00 0.00 O ATOM 629 CB PHE A 45 -1.264 13.131 -0.350 1.00 0.00 C ATOM 630 CG PHE A 45 -1.603 12.396 -1.614 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.206 12.889 -2.846 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.318 11.209 -1.571 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.516 12.214 -4.011 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.632 10.529 -2.732 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.230 11.032 -3.954 1.00 0.00 C ATOM 0 H PHE A 45 -0.601 15.932 -0.468 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.053 14.304 -0.562 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.196 13.350 -0.341 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.463 12.482 0.503 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.647 13.812 -2.897 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.634 10.811 -0.618 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.201 12.610 -4.965 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.191 9.606 -2.684 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.473 10.503 -4.863 1.00 0.00 H new ATOM 645 N THR A 46 -3.305 14.565 1.891 1.00 0.00 N ATOM 646 CA THR A 46 -3.524 14.861 3.302 1.00 0.00 C ATOM 647 C THR A 46 -4.050 13.636 4.040 1.00 0.00 C ATOM 648 O THR A 46 -4.238 12.573 3.447 1.00 0.00 O ATOM 649 CB THR A 46 -4.508 16.022 3.452 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.745 16.306 4.820 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.848 15.760 2.799 1.00 0.00 C ATOM 0 H THR A 46 -4.116 14.175 1.411 1.00 0.00 H new ATOM 0 HA THR A 46 -2.567 15.144 3.741 1.00 0.00 H new ATOM 0 HB THR A 46 -4.036 16.866 2.949 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.595 15.903 5.095 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.498 16.623 2.943 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.705 15.587 1.732 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.307 14.881 3.251 1.00 0.00 H new ATOM 659 N LEU A 47 -4.285 13.789 5.340 1.00 0.00 N ATOM 660 CA LEU A 47 -4.789 12.694 6.160 1.00 0.00 C ATOM 661 C LEU A 47 -6.309 12.746 6.262 1.00 0.00 C ATOM 662 O LEU A 47 -6.868 13.621 6.924 1.00 0.00 O ATOM 663 CB LEU A 47 -4.169 12.750 7.558 1.00 0.00 C ATOM 664 CG LEU A 47 -3.954 11.391 8.225 1.00 0.00 C ATOM 665 CD1 LEU A 47 -2.957 10.560 7.434 1.00 0.00 C ATOM 666 CD2 LEU A 47 -3.479 11.572 9.659 1.00 0.00 C ATOM 0 H LEU A 47 -4.134 14.661 5.847 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.508 11.755 5.683 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.209 13.262 7.493 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.810 13.355 8.199 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.906 10.861 8.241 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.817 9.596 7.924 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.335 10.402 6.424 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.003 11.085 7.386 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.331 10.595 10.119 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.538 12.122 9.664 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.228 12.129 10.223 1.00 0.00 H new ATOM 678 N GLY A 48 -6.975 11.805 5.600 1.00 0.00 N ATOM 679 CA GLY A 48 -8.424 11.763 5.630 1.00 0.00 C ATOM 680 C GLY A 48 -8.972 11.602 7.034 1.00 0.00 C ATOM 681 O GLY A 48 -8.242 11.232 7.954 1.00 0.00 O ATOM 0 H GLY A 48 -6.536 11.071 5.044 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.820 12.679 5.192 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.773 10.937 5.010 1.00 0.00 H new ATOM 685 N ALA A 49 -10.261 11.881 7.199 1.00 0.00 N ATOM 686 CA ALA A 49 -10.906 11.766 8.502 1.00 0.00 C ATOM 687 C ALA A 49 -11.149 10.305 8.868 1.00 0.00 C ATOM 688 O ALA A 49 -11.370 9.466 7.993 1.00 0.00 O ATOM 689 CB ALA A 49 -12.216 12.539 8.511 1.00 0.00 C ATOM 0 H ALA A 49 -10.879 12.188 6.448 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.238 12.194 9.250 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.687 12.445 9.489 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.019 13.591 8.303 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.881 12.136 7.747 1.00 0.00 H new ATOM 695 N PRO A 50 -11.112 9.978 10.171 1.00 0.00 N ATOM 696 CA PRO A 50 -11.330 8.609 10.649 1.00 0.00 C ATOM 697 C PRO A 50 -12.781 8.167 10.497 1.00 0.00 C ATOM 698 O PRO A 50 -13.703 8.975 10.623 1.00 0.00 O ATOM 699 CB PRO A 50 -10.943 8.682 12.126 1.00 0.00 C ATOM 700 CG PRO A 50 -11.171 10.104 12.506 1.00 0.00 C ATOM 701 CD PRO A 50 -10.855 10.916 11.281 1.00 0.00 C ATOM 0 HA PRO A 50 -10.751 7.881 10.080 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.552 8.008 12.729 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -9.903 8.393 12.278 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.201 10.262 12.824 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.532 10.392 13.341 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.487 11.802 11.213 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.821 11.261 11.284 1.00 0.00 H new ATOM 709 N HIS A 51 -12.978 6.881 10.228 1.00 0.00 N ATOM 710 CA HIS A 51 -14.320 6.334 10.059 1.00 0.00 C ATOM 711 C HIS A 51 -15.021 6.187 11.406 1.00 0.00 C ATOM 712 O HIS A 51 -14.398 5.831 12.406 1.00 0.00 O ATOM 713 CB HIS A 51 -14.255 4.976 9.356 1.00 0.00 C ATOM 714 CG HIS A 51 -13.785 5.060 7.937 1.00 0.00 C ATOM 715 ND1 HIS A 51 -14.538 4.558 6.903 1.00 0.00 N ATOM 716 CD2 HIS A 51 -12.643 5.591 7.437 1.00 0.00 C ATOM 717 CE1 HIS A 51 -13.845 4.793 5.804 1.00 0.00 C ATOM 718 NE2 HIS A 51 -12.688 5.417 6.076 1.00 0.00 N ATOM 0 H HIS A 51 -12.227 6.199 10.122 1.00 0.00 H new ATOM 0 HA HIS A 51 -14.893 7.028 9.444 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -13.587 4.319 9.913 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.244 4.517 9.376 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -11.850 6.061 8.001 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.168 4.518 4.811 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -11.979 5.706 5.402 1.00 0.00 H new ATOM 726 N ARG A 52 -16.320 6.466 11.423 1.00 0.00 N ATOM 727 CA ARG A 52 -17.107 6.367 12.648 1.00 0.00 C ATOM 728 C ARG A 52 -17.281 4.910 13.065 1.00 0.00 C ATOM 729 O ARG A 52 -17.269 4.589 14.253 1.00 0.00 O ATOM 730 CB ARG A 52 -18.475 7.022 12.454 1.00 0.00 C ATOM 731 CG ARG A 52 -19.246 7.217 13.749 1.00 0.00 C ATOM 732 CD ARG A 52 -20.410 8.177 13.565 1.00 0.00 C ATOM 733 NE ARG A 52 -20.782 8.832 14.817 1.00 0.00 N ATOM 734 CZ ARG A 52 -21.514 8.255 15.766 1.00 0.00 C ATOM 735 NH1 ARG A 52 -21.953 7.012 15.612 1.00 0.00 N ATOM 736 NH2 ARG A 52 -21.807 8.922 16.874 1.00 0.00 N ATOM 0 H ARG A 52 -16.850 6.762 10.604 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.571 6.891 13.439 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -18.340 7.990 11.972 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.069 6.409 11.776 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -19.619 6.255 14.100 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.576 7.599 14.519 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.144 8.932 12.826 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -21.269 7.634 13.171 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.462 9.788 14.972 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -21.729 6.494 14.762 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -22.514 6.575 16.343 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -21.471 9.877 16.998 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -22.368 8.480 17.602 1.00 0.00 H new ATOM 750 N GLU A 53 -17.445 4.033 12.080 1.00 0.00 N ATOM 751 CA GLU A 53 -17.624 2.610 12.345 1.00 0.00 C ATOM 752 C GLU A 53 -16.275 1.913 12.502 1.00 0.00 C ATOM 753 O GLU A 53 -15.293 2.288 11.862 1.00 0.00 O ATOM 754 CB GLU A 53 -18.425 1.957 11.216 1.00 0.00 C ATOM 755 CG GLU A 53 -19.693 1.268 11.691 1.00 0.00 C ATOM 756 CD GLU A 53 -19.884 -0.100 11.065 1.00 0.00 C ATOM 757 OE1 GLU A 53 -19.647 -0.233 9.845 1.00 0.00 O ATOM 758 OE2 GLU A 53 -20.269 -1.039 11.793 1.00 0.00 O ATOM 0 H GLU A 53 -17.458 4.283 11.091 1.00 0.00 H new ATOM 0 HA GLU A 53 -18.176 2.504 13.279 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.688 2.718 10.481 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -17.794 1.228 10.708 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -19.662 1.166 12.776 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.553 1.895 11.455 1.00 0.00 H new ATOM 765 N VAL A 54 -16.236 0.898 13.358 1.00 0.00 N ATOM 766 CA VAL A 54 -15.009 0.148 13.599 1.00 0.00 C ATOM 767 C VAL A 54 -14.567 -0.599 12.346 1.00 0.00 C ATOM 768 O VAL A 54 -13.410 -0.513 11.935 1.00 0.00 O ATOM 769 CB VAL A 54 -15.183 -0.861 14.749 1.00 0.00 C ATOM 770 CG1 VAL A 54 -13.848 -1.487 15.118 1.00 0.00 C ATOM 771 CG2 VAL A 54 -15.817 -0.189 15.958 1.00 0.00 C ATOM 0 H VAL A 54 -17.040 0.576 13.897 1.00 0.00 H new ATOM 0 HA VAL A 54 -14.244 0.874 13.876 1.00 0.00 H new ATOM 0 HB VAL A 54 -15.849 -1.655 14.412 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -13.992 -2.197 15.932 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -13.438 -2.006 14.252 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -13.156 -0.707 15.435 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -15.932 -0.918 16.761 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -15.179 0.627 16.297 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -16.795 0.206 15.683 1.00 0.00 H new ATOM 781 N ASP A 55 -15.497 -1.333 11.741 1.00 0.00 N ATOM 782 CA ASP A 55 -15.204 -2.095 10.534 1.00 0.00 C ATOM 783 C ASP A 55 -15.901 -1.485 9.322 1.00 0.00 C ATOM 784 O ASP A 55 -16.940 -1.974 8.879 1.00 0.00 O ATOM 785 CB ASP A 55 -15.639 -3.552 10.708 1.00 0.00 C ATOM 786 CG ASP A 55 -14.871 -4.257 11.808 1.00 0.00 C ATOM 787 OD1 ASP A 55 -13.668 -3.965 11.974 1.00 0.00 O ATOM 788 OD2 ASP A 55 -15.472 -5.103 12.503 1.00 0.00 O ATOM 0 H ASP A 55 -16.460 -1.415 12.068 1.00 0.00 H new ATOM 0 HA ASP A 55 -14.128 -2.062 10.366 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -16.705 -3.586 10.934 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -15.495 -4.086 9.769 1.00 0.00 H new ATOM 793 N GLU A 56 -15.321 -0.415 8.789 1.00 0.00 N ATOM 794 CA GLU A 56 -15.885 0.263 7.628 1.00 0.00 C ATOM 795 C GLU A 56 -14.853 0.382 6.512 1.00 0.00 C ATOM 796 O GLU A 56 -13.712 0.781 6.749 1.00 0.00 O ATOM 797 CB GLU A 56 -16.394 1.652 8.018 1.00 0.00 C ATOM 798 CG GLU A 56 -17.047 2.406 6.871 1.00 0.00 C ATOM 799 CD GLU A 56 -18.559 2.429 6.975 1.00 0.00 C ATOM 800 OE1 GLU A 56 -19.076 2.406 8.112 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.226 2.471 5.920 1.00 0.00 O ATOM 0 H GLU A 56 -14.460 0.002 9.143 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.721 -0.333 7.263 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -17.113 1.551 8.831 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.560 2.241 8.401 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -16.672 3.429 6.854 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -16.758 1.945 5.927 1.00 0.00 H new ATOM 808 N GLY A 57 -15.259 0.034 5.296 1.00 0.00 N ATOM 809 CA GLY A 57 -14.357 0.110 4.162 1.00 0.00 C ATOM 810 C GLY A 57 -13.956 1.536 3.834 1.00 0.00 C ATOM 811 O GLY A 57 -14.724 2.469 4.072 1.00 0.00 O ATOM 0 H GLY A 57 -16.197 -0.300 5.075 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.463 -0.476 4.373 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -14.834 -0.339 3.291 1.00 0.00 H new ATOM 815 N PRO A 58 -12.748 1.740 3.281 1.00 0.00 N ATOM 816 CA PRO A 58 -12.258 3.075 2.923 1.00 0.00 C ATOM 817 C PRO A 58 -13.023 3.676 1.749 1.00 0.00 C ATOM 818 O PRO A 58 -13.696 2.964 1.003 1.00 0.00 O ATOM 819 CB PRO A 58 -10.797 2.830 2.541 1.00 0.00 C ATOM 820 CG PRO A 58 -10.750 1.403 2.117 1.00 0.00 C ATOM 821 CD PRO A 58 -11.767 0.686 2.962 1.00 0.00 C ATOM 0 HA PRO A 58 -12.383 3.787 3.739 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.482 3.493 1.735 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.131 3.015 3.384 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -10.983 1.303 1.057 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -9.755 0.984 2.265 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.227 -0.141 2.422 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.318 0.268 3.863 1.00 0.00 H new ATOM 829 N SER A 59 -12.914 4.991 1.589 1.00 0.00 N ATOM 830 CA SER A 59 -13.594 5.690 0.506 1.00 0.00 C ATOM 831 C SER A 59 -12.882 5.452 -0.825 1.00 0.00 C ATOM 832 O SER A 59 -11.721 5.044 -0.852 1.00 0.00 O ATOM 833 CB SER A 59 -13.659 7.188 0.803 1.00 0.00 C ATOM 834 OG SER A 59 -14.300 7.435 2.043 1.00 0.00 O ATOM 0 H SER A 59 -12.360 5.594 2.197 1.00 0.00 H new ATOM 0 HA SER A 59 -14.608 5.297 0.430 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.651 7.602 0.822 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.198 7.697 0.004 1.00 0.00 H new ATOM 0 HG SER A 59 -13.630 7.465 2.757 1.00 0.00 H new ATOM 840 N PRO A 60 -13.571 5.709 -1.950 1.00 0.00 N ATOM 841 CA PRO A 60 -12.996 5.523 -3.286 1.00 0.00 C ATOM 842 C PRO A 60 -11.643 6.215 -3.445 1.00 0.00 C ATOM 843 O PRO A 60 -10.686 5.608 -3.929 1.00 0.00 O ATOM 844 CB PRO A 60 -14.036 6.152 -4.215 1.00 0.00 C ATOM 845 CG PRO A 60 -15.319 6.060 -3.465 1.00 0.00 C ATOM 846 CD PRO A 60 -14.960 6.201 -2.011 1.00 0.00 C ATOM 0 HA PRO A 60 -12.798 4.472 -3.498 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.786 7.187 -4.446 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -14.093 5.619 -5.164 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -16.009 6.845 -3.774 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.814 5.108 -3.654 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -15.034 7.236 -1.678 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.622 5.613 -1.375 1.00 0.00 H new ATOM 854 N PRO A 61 -11.533 7.497 -3.041 1.00 0.00 N ATOM 855 CA PRO A 61 -10.276 8.245 -3.152 1.00 0.00 C ATOM 856 C PRO A 61 -9.220 7.750 -2.170 1.00 0.00 C ATOM 857 O PRO A 61 -8.021 7.903 -2.405 1.00 0.00 O ATOM 858 CB PRO A 61 -10.685 9.682 -2.821 1.00 0.00 C ATOM 859 CG PRO A 61 -11.893 9.544 -1.963 1.00 0.00 C ATOM 860 CD PRO A 61 -12.611 8.315 -2.448 1.00 0.00 C ATOM 0 HA PRO A 61 -9.822 8.135 -4.137 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.887 10.210 -2.299 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.905 10.249 -3.725 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.616 9.445 -0.913 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.530 10.425 -2.043 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.108 7.792 -1.631 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.378 8.562 -3.182 1.00 0.00 H new ATOM 868 N GLU A 62 -9.671 7.154 -1.071 1.00 0.00 N ATOM 869 CA GLU A 62 -8.762 6.635 -0.056 1.00 0.00 C ATOM 870 C GLU A 62 -8.175 5.296 -0.488 1.00 0.00 C ATOM 871 O GLU A 62 -7.042 4.962 -0.140 1.00 0.00 O ATOM 872 CB GLU A 62 -9.492 6.476 1.280 1.00 0.00 C ATOM 873 CG GLU A 62 -9.468 7.730 2.138 1.00 0.00 C ATOM 874 CD GLU A 62 -10.513 7.705 3.236 1.00 0.00 C ATOM 875 OE1 GLU A 62 -11.641 7.238 2.972 1.00 0.00 O ATOM 876 OE2 GLU A 62 -10.205 8.152 4.361 1.00 0.00 O ATOM 0 H GLU A 62 -10.660 7.019 -0.861 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.947 7.349 0.066 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.528 6.197 1.088 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.039 5.656 1.837 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.480 7.842 2.584 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.632 8.602 1.505 1.00 0.00 H new ATOM 883 N GLN A 63 -8.952 4.533 -1.250 1.00 0.00 N ATOM 884 CA GLN A 63 -8.508 3.229 -1.732 1.00 0.00 C ATOM 885 C GLN A 63 -7.369 3.380 -2.734 1.00 0.00 C ATOM 886 O GLN A 63 -7.426 4.219 -3.634 1.00 0.00 O ATOM 887 CB GLN A 63 -9.675 2.478 -2.376 1.00 0.00 C ATOM 888 CG GLN A 63 -10.705 1.980 -1.376 1.00 0.00 C ATOM 889 CD GLN A 63 -11.953 1.439 -2.044 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.937 1.089 -3.225 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.044 1.367 -1.292 1.00 0.00 N ATOM 0 H GLN A 63 -9.892 4.795 -1.547 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.143 2.657 -0.879 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.166 3.134 -3.094 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.284 1.628 -2.936 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.260 1.199 -0.760 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -10.980 2.795 -0.707 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.013 1.668 -0.318 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.914 1.011 -1.688 1.00 0.00 H new ATOM 900 N PHE A 64 -6.335 2.561 -2.574 1.00 0.00 N ATOM 901 CA PHE A 64 -5.180 2.602 -3.465 1.00 0.00 C ATOM 902 C PHE A 64 -5.065 1.309 -4.265 1.00 0.00 C ATOM 903 O PHE A 64 -5.596 0.272 -3.867 1.00 0.00 O ATOM 904 CB PHE A 64 -3.899 2.836 -2.663 1.00 0.00 C ATOM 905 CG PHE A 64 -3.844 4.183 -2.000 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.409 5.297 -2.700 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.226 4.335 -0.676 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.356 6.537 -2.092 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.176 5.573 -0.064 1.00 0.00 C ATOM 910 CZ PHE A 64 -3.740 6.675 -0.772 1.00 0.00 C ATOM 0 H PHE A 64 -6.273 1.860 -1.835 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.319 3.428 -4.162 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.810 2.061 -1.901 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.040 2.731 -3.326 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.108 5.195 -3.732 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.566 3.476 -0.117 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.015 7.397 -2.648 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.478 5.678 0.968 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.699 7.643 -0.295 1.00 0.00 H new ATOM 920 N THR A 65 -4.370 1.378 -5.396 1.00 0.00 N ATOM 921 CA THR A 65 -4.186 0.212 -6.253 1.00 0.00 C ATOM 922 C THR A 65 -2.735 -0.257 -6.234 1.00 0.00 C ATOM 923 O THR A 65 -1.811 0.550 -6.334 1.00 0.00 O ATOM 924 CB THR A 65 -4.612 0.535 -7.686 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.530 1.613 -7.706 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.262 -0.635 -8.394 1.00 0.00 C ATOM 0 H THR A 65 -3.925 2.229 -5.740 1.00 0.00 H new ATOM 0 HA THR A 65 -4.812 -0.593 -5.867 1.00 0.00 H new ATOM 0 HB THR A 65 -3.691 0.791 -8.210 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.910 1.702 -8.605 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.540 -0.339 -9.405 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.560 -1.468 -8.440 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.154 -0.941 -7.847 1.00 0.00 H new ATOM 934 N ALA A 66 -2.543 -1.565 -6.108 1.00 0.00 N ATOM 935 CA ALA A 66 -1.204 -2.141 -6.077 1.00 0.00 C ATOM 936 C ALA A 66 -0.874 -2.833 -7.396 1.00 0.00 C ATOM 937 O ALA A 66 -1.684 -3.591 -7.930 1.00 0.00 O ATOM 938 CB ALA A 66 -1.077 -3.121 -4.920 1.00 0.00 C ATOM 0 H ALA A 66 -3.297 -2.246 -6.026 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.490 -1.330 -5.932 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -0.072 -3.543 -4.909 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -1.262 -2.600 -3.980 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.806 -3.922 -5.040 1.00 0.00 H new ATOM 944 N VAL A 67 0.320 -2.566 -7.916 1.00 0.00 N ATOM 945 CA VAL A 67 0.755 -3.162 -9.173 1.00 0.00 C ATOM 946 C VAL A 67 2.180 -3.695 -9.065 1.00 0.00 C ATOM 947 O VAL A 67 3.076 -3.005 -8.579 1.00 0.00 O ATOM 948 CB VAL A 67 0.687 -2.147 -10.330 1.00 0.00 C ATOM 949 CG1 VAL A 67 0.948 -2.833 -11.661 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.660 -1.441 -10.342 1.00 0.00 C ATOM 0 H VAL A 67 1.002 -1.941 -7.486 1.00 0.00 H new ATOM 0 HA VAL A 67 0.075 -3.988 -9.382 1.00 0.00 H new ATOM 0 HB VAL A 67 1.464 -1.398 -10.176 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.895 -2.099 -12.465 1.00 0.00 H new ATOM 0 HG12 VAL A 67 1.939 -3.287 -11.648 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.197 -3.606 -11.826 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.690 -0.728 -11.166 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.455 -2.176 -10.469 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.802 -0.912 -9.399 1.00 0.00 H new ATOM 960 N LYS A 68 2.382 -4.928 -9.522 1.00 0.00 N ATOM 961 CA LYS A 68 3.700 -5.553 -9.478 1.00 0.00 C ATOM 962 C LYS A 68 4.604 -4.994 -10.571 1.00 0.00 C ATOM 963 O LYS A 68 4.143 -4.678 -11.668 1.00 0.00 O ATOM 964 CB LYS A 68 3.573 -7.070 -9.632 1.00 0.00 C ATOM 965 CG LYS A 68 3.396 -7.804 -8.312 1.00 0.00 C ATOM 966 CD LYS A 68 4.024 -9.187 -8.356 1.00 0.00 C ATOM 967 CE LYS A 68 5.539 -9.114 -8.256 1.00 0.00 C ATOM 968 NZ LYS A 68 6.178 -8.973 -9.594 1.00 0.00 N ATOM 0 H LYS A 68 1.651 -5.513 -9.926 1.00 0.00 H new ATOM 0 HA LYS A 68 4.149 -5.329 -8.510 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.723 -7.291 -10.278 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.462 -7.451 -10.134 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.848 -7.223 -7.508 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.334 -7.892 -8.083 1.00 0.00 H new ATOM 0 HD2 LYS A 68 3.633 -9.792 -7.538 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.743 -9.686 -9.283 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.821 -8.269 -7.628 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.914 -10.013 -7.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.978 -9.633 -9.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.482 -9.189 -10.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 6.521 -7.998 -9.714 1.00 0.00 H new ATOM 982 N LEU A 69 5.892 -4.873 -10.266 1.00 0.00 N ATOM 983 CA LEU A 69 6.857 -4.353 -11.227 1.00 0.00 C ATOM 984 C LEU A 69 8.107 -5.229 -11.276 1.00 0.00 C ATOM 985 O LEU A 69 8.328 -5.954 -12.247 1.00 0.00 O ATOM 986 CB LEU A 69 7.235 -2.911 -10.875 1.00 0.00 C ATOM 987 CG LEU A 69 6.063 -2.017 -10.466 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.571 -0.721 -9.852 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.171 -1.728 -11.665 1.00 0.00 C ATOM 0 H LEU A 69 6.291 -5.128 -9.362 1.00 0.00 H new ATOM 0 HA LEU A 69 6.393 -4.366 -12.213 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.960 -2.930 -10.061 1.00 0.00 H new ATOM 0 HB3 LEU A 69 7.733 -2.462 -11.734 1.00 0.00 H new ATOM 0 HG LEU A 69 5.472 -2.543 -9.717 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.724 -0.097 -9.567 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.169 -0.947 -8.969 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.184 -0.190 -10.580 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.342 -1.091 -11.357 1.00 0.00 H new ATOM 0 HD22 LEU A 69 5.751 -1.221 -12.436 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.780 -2.665 -12.062 1.00 0.00 H new ATOM 1001 N SER A 70 8.921 -5.160 -10.227 1.00 0.00 N ATOM 1002 CA SER A 70 10.147 -5.950 -10.157 1.00 0.00 C ATOM 1003 C SER A 70 10.895 -5.681 -8.856 1.00 0.00 C ATOM 1004 O SER A 70 10.721 -4.633 -8.232 1.00 0.00 O ATOM 1005 CB SER A 70 11.051 -5.640 -11.351 1.00 0.00 C ATOM 1006 OG SER A 70 11.285 -4.247 -11.466 1.00 0.00 O ATOM 0 H SER A 70 8.755 -4.566 -9.415 1.00 0.00 H new ATOM 0 HA SER A 70 9.870 -7.004 -10.185 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.000 -6.163 -11.238 1.00 0.00 H new ATOM 0 HB3 SER A 70 10.590 -6.011 -12.266 1.00 0.00 H new ATOM 0 HG SER A 70 11.867 -4.075 -12.236 1.00 0.00 H new ATOM 1012 N ASP A 71 11.733 -6.632 -8.453 1.00 0.00 N ATOM 1013 CA ASP A 71 12.514 -6.497 -7.227 1.00 0.00 C ATOM 1014 C ASP A 71 11.612 -6.212 -6.029 1.00 0.00 C ATOM 1015 O ASP A 71 11.979 -5.456 -5.130 1.00 0.00 O ATOM 1016 CB ASP A 71 13.548 -5.381 -7.378 1.00 0.00 C ATOM 1017 CG ASP A 71 14.858 -5.880 -7.955 1.00 0.00 C ATOM 1018 OD1 ASP A 71 14.843 -6.422 -9.080 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.899 -5.729 -7.282 1.00 0.00 O ATOM 0 H ASP A 71 11.889 -7.505 -8.958 1.00 0.00 H new ATOM 0 HA ASP A 71 13.029 -7.441 -7.051 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.144 -4.600 -8.023 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.733 -4.927 -6.405 1.00 0.00 H new ATOM 1024 N SER A 72 10.432 -6.821 -6.024 1.00 0.00 N ATOM 1025 CA SER A 72 9.478 -6.632 -4.938 1.00 0.00 C ATOM 1026 C SER A 72 9.059 -5.169 -4.830 1.00 0.00 C ATOM 1027 O SER A 72 8.732 -4.685 -3.747 1.00 0.00 O ATOM 1028 CB SER A 72 10.083 -7.100 -3.612 1.00 0.00 C ATOM 1029 OG SER A 72 10.950 -8.204 -3.808 1.00 0.00 O ATOM 0 H SER A 72 10.113 -7.450 -6.760 1.00 0.00 H new ATOM 0 HA SER A 72 8.593 -7.230 -5.157 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.632 -6.280 -3.150 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.286 -7.378 -2.923 1.00 0.00 H new ATOM 0 HG SER A 72 11.325 -8.483 -2.946 1.00 0.00 H new ATOM 1035 N ARG A 73 9.070 -4.471 -5.962 1.00 0.00 N ATOM 1036 CA ARG A 73 8.691 -3.063 -5.996 1.00 0.00 C ATOM 1037 C ARG A 73 7.314 -2.890 -6.626 1.00 0.00 C ATOM 1038 O ARG A 73 7.162 -2.982 -7.844 1.00 0.00 O ATOM 1039 CB ARG A 73 9.727 -2.250 -6.775 1.00 0.00 C ATOM 1040 CG ARG A 73 11.167 -2.612 -6.442 1.00 0.00 C ATOM 1041 CD ARG A 73 11.654 -1.877 -5.204 1.00 0.00 C ATOM 1042 NE ARG A 73 11.968 -0.478 -5.487 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.767 0.272 -4.730 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.331 -0.235 -3.640 1.00 0.00 N ATOM 1045 NH2 ARG A 73 13.002 1.534 -5.063 1.00 0.00 N ATOM 0 H ARG A 73 9.337 -4.858 -6.867 1.00 0.00 H new ATOM 0 HA ARG A 73 8.653 -2.697 -4.970 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.563 -2.397 -7.842 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.572 -1.190 -6.571 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.245 -3.687 -6.282 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.810 -2.368 -7.288 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.890 -1.927 -4.428 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.540 -2.375 -4.811 1.00 0.00 H new ATOM 0 HE ARG A 73 11.550 -0.050 -6.314 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.153 -1.205 -3.378 1.00 0.00 H new ATOM 0 HH12 ARG A 73 13.942 0.345 -3.065 1.00 0.00 H new ATOM 0 HH21 ARG A 73 12.571 1.930 -5.898 1.00 0.00 H new ATOM 0 HH22 ARG A 73 13.614 2.109 -4.484 1.00 0.00 H new ATOM 1059 N ILE A 74 6.311 -2.641 -5.789 1.00 0.00 N ATOM 1060 CA ILE A 74 4.947 -2.459 -6.266 1.00 0.00 C ATOM 1061 C ILE A 74 4.621 -0.981 -6.461 1.00 0.00 C ATOM 1062 O ILE A 74 5.018 -0.136 -5.659 1.00 0.00 O ATOM 1063 CB ILE A 74 3.924 -3.072 -5.291 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.117 -2.495 -3.886 1.00 0.00 C ATOM 1065 CG2 ILE A 74 4.054 -4.587 -5.270 1.00 0.00 C ATOM 1066 CD1 ILE A 74 3.010 -2.867 -2.924 1.00 0.00 C ATOM 0 H ILE A 74 6.419 -2.561 -4.778 1.00 0.00 H new ATOM 0 HA ILE A 74 4.879 -2.972 -7.225 1.00 0.00 H new ATOM 0 HB ILE A 74 2.921 -2.818 -5.633 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.068 -2.845 -3.486 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.180 -1.409 -3.953 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.325 -5.005 -4.576 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.872 -4.982 -6.270 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.059 -4.862 -4.949 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.212 -2.424 -1.949 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.058 -2.493 -3.302 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.961 -3.952 -2.827 1.00 0.00 H new ATOM 1078 N ALA A 75 3.896 -0.679 -7.534 1.00 0.00 N ATOM 1079 CA ALA A 75 3.514 0.695 -7.835 1.00 0.00 C ATOM 1080 C ALA A 75 2.134 1.016 -7.271 1.00 0.00 C ATOM 1081 O ALA A 75 1.198 0.228 -7.411 1.00 0.00 O ATOM 1082 CB ALA A 75 3.539 0.931 -9.339 1.00 0.00 C ATOM 0 H ALA A 75 3.562 -1.367 -8.209 1.00 0.00 H new ATOM 0 HA ALA A 75 4.236 1.360 -7.361 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.252 1.961 -9.551 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.544 0.749 -9.719 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.839 0.252 -9.826 1.00 0.00 H new ATOM 1088 N LEU A 76 2.016 2.173 -6.631 1.00 0.00 N ATOM 1089 CA LEU A 76 0.750 2.595 -6.042 1.00 0.00 C ATOM 1090 C LEU A 76 -0.008 3.523 -6.986 1.00 0.00 C ATOM 1091 O LEU A 76 0.594 4.303 -7.724 1.00 0.00 O ATOM 1092 CB LEU A 76 0.994 3.296 -4.705 1.00 0.00 C ATOM 1093 CG LEU A 76 1.308 2.365 -3.534 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.994 3.129 -2.413 1.00 0.00 C ATOM 1095 CD2 LEU A 76 0.039 1.698 -3.029 1.00 0.00 C ATOM 0 H LEU A 76 2.781 2.836 -6.506 1.00 0.00 H new ATOM 0 HA LEU A 76 0.143 1.706 -5.872 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.821 3.996 -4.825 1.00 0.00 H new ATOM 0 HB3 LEU A 76 0.112 3.885 -4.455 1.00 0.00 H new ATOM 0 HG LEU A 76 1.988 1.588 -3.884 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.210 2.450 -1.588 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.925 3.558 -2.782 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.340 3.928 -2.063 1.00 0.00 H new ATOM 0 HD21 LEU A 76 0.281 1.039 -2.195 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -0.665 2.461 -2.696 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.411 1.116 -3.833 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.334 3.432 -6.957 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.177 4.264 -7.809 1.00 0.00 C ATOM 1109 C LYS A 77 -3.303 4.900 -7.001 1.00 0.00 C ATOM 1110 O LYS A 77 -4.066 4.208 -6.329 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.760 3.431 -8.952 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.351 4.269 -10.075 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.631 3.652 -10.619 1.00 0.00 C ATOM 1114 CE LYS A 77 -4.679 3.709 -12.138 1.00 0.00 C ATOM 1115 NZ LYS A 77 -4.568 2.355 -12.749 1.00 0.00 N ATOM 0 H LYS A 77 -1.848 2.791 -6.353 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.560 5.059 -8.227 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.978 2.791 -9.360 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.534 2.774 -8.554 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.558 5.275 -9.709 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.622 4.366 -10.880 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.704 2.615 -10.291 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -5.492 4.178 -10.207 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -5.612 4.175 -12.454 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.868 4.340 -12.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -4.605 2.438 -13.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -3.666 1.920 -12.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.356 1.760 -12.421 1.00 0.00 H new ATOM 1129 N SER A 78 -3.400 6.225 -7.073 1.00 0.00 N ATOM 1130 CA SER A 78 -4.433 6.955 -6.348 1.00 0.00 C ATOM 1131 C SER A 78 -5.822 6.575 -6.852 1.00 0.00 C ATOM 1132 O SER A 78 -5.975 6.089 -7.973 1.00 0.00 O ATOM 1133 CB SER A 78 -4.220 8.462 -6.495 1.00 0.00 C ATOM 1134 OG SER A 78 -4.209 8.845 -7.859 1.00 0.00 O ATOM 0 H SER A 78 -2.776 6.813 -7.626 1.00 0.00 H new ATOM 0 HA SER A 78 -4.362 6.686 -5.294 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.011 8.997 -5.970 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.278 8.747 -6.027 1.00 0.00 H new ATOM 0 HG SER A 78 -3.556 8.301 -8.346 1.00 0.00 H new ATOM 1140 N GLY A 79 -6.831 6.799 -6.017 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.195 6.474 -6.396 1.00 0.00 C ATOM 1142 C GLY A 79 -8.628 7.180 -7.667 1.00 0.00 C ATOM 1143 O GLY A 79 -9.492 6.690 -8.394 1.00 0.00 O ATOM 0 H GLY A 79 -6.729 7.200 -5.085 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.283 5.396 -6.534 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.869 6.747 -5.584 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.026 8.334 -7.935 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.353 9.108 -9.127 1.00 0.00 C ATOM 1149 C TYR A 80 -7.798 8.438 -10.381 1.00 0.00 C ATOM 1150 O TYR A 80 -8.382 8.536 -11.459 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.800 10.529 -9.006 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.571 11.399 -8.039 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -8.236 11.437 -6.691 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -9.633 12.182 -8.473 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -8.938 12.231 -5.803 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -10.339 12.979 -7.592 1.00 0.00 C ATOM 1157 CZ TYR A 80 -9.988 12.999 -6.258 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.688 13.791 -5.378 1.00 0.00 O ATOM 0 H TYR A 80 -7.309 8.754 -7.343 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.439 9.155 -9.213 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.759 10.479 -8.686 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.809 10.998 -9.990 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -7.414 10.836 -6.331 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -9.912 12.168 -9.516 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -8.665 12.249 -4.758 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -11.161 13.583 -7.946 1.00 0.00 H new ATOM 0 HH TYR A 80 -11.395 14.269 -5.859 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.665 7.759 -10.229 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.049 7.083 -11.358 1.00 0.00 C ATOM 1170 C GLY A 81 -4.574 7.407 -11.498 1.00 0.00 C ATOM 1171 O GLY A 81 -3.834 6.681 -12.163 1.00 0.00 O ATOM 0 H GLY A 81 -6.163 7.665 -9.346 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.171 6.006 -11.243 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.568 7.366 -12.274 1.00 0.00 H new ATOM 1175 N LYS A 82 -4.143 8.497 -10.871 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.746 8.913 -10.934 1.00 0.00 C ATOM 1177 C LYS A 82 -1.861 7.965 -10.131 1.00 0.00 C ATOM 1178 O LYS A 82 -2.354 7.119 -9.386 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.593 10.341 -10.407 1.00 0.00 C ATOM 1180 CG LYS A 82 -3.346 11.375 -11.227 1.00 0.00 C ATOM 1181 CD LYS A 82 -3.444 12.703 -10.494 1.00 0.00 C ATOM 1182 CE LYS A 82 -4.438 13.637 -11.164 1.00 0.00 C ATOM 1183 NZ LYS A 82 -4.102 15.068 -10.928 1.00 0.00 N ATOM 0 H LYS A 82 -4.740 9.108 -10.314 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.430 8.882 -11.977 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -2.946 10.379 -9.377 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.535 10.602 -10.391 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.841 11.522 -12.182 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -4.347 11.006 -11.449 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.746 12.528 -9.461 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.462 13.176 -10.463 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.455 13.440 -12.236 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.440 13.432 -10.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.804 15.672 -11.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.110 15.263 -9.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -3.157 15.270 -11.311 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.549 8.116 -10.288 1.00 0.00 N ATOM 1198 CA TYR A 83 0.408 7.275 -9.578 1.00 0.00 C ATOM 1199 C TYR A 83 1.100 8.059 -8.468 1.00 0.00 C ATOM 1200 O TYR A 83 1.550 9.185 -8.677 1.00 0.00 O ATOM 1201 CB TYR A 83 1.448 6.718 -10.551 1.00 0.00 C ATOM 1202 CG TYR A 83 0.918 5.614 -11.439 1.00 0.00 C ATOM 1203 CD1 TYR A 83 0.751 4.325 -10.953 1.00 0.00 C ATOM 1204 CD2 TYR A 83 0.583 5.865 -12.764 1.00 0.00 C ATOM 1205 CE1 TYR A 83 0.267 3.314 -11.762 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.098 4.860 -13.579 1.00 0.00 C ATOM 1207 CZ TYR A 83 -0.058 3.587 -13.074 1.00 0.00 C ATOM 1208 OH TYR A 83 -0.540 2.584 -13.883 1.00 0.00 O ATOM 0 H TYR A 83 -0.125 8.813 -10.900 1.00 0.00 H new ATOM 0 HA TYR A 83 -0.137 6.446 -9.127 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.819 7.530 -11.177 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.298 6.339 -9.983 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.003 4.108 -9.926 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.704 6.861 -13.163 1.00 0.00 H new ATOM 0 HE1 TYR A 83 0.144 2.316 -11.369 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -0.158 5.071 -14.607 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.721 2.943 -14.777 1.00 0.00 H new ATOM 1218 N LEU A 84 1.184 7.454 -7.287 1.00 0.00 N ATOM 1219 CA LEU A 84 1.823 8.095 -6.144 1.00 0.00 C ATOM 1220 C LEU A 84 3.329 8.203 -6.354 1.00 0.00 C ATOM 1221 O LEU A 84 3.987 7.226 -6.711 1.00 0.00 O ATOM 1222 CB LEU A 84 1.529 7.312 -4.863 1.00 0.00 C ATOM 1223 CG LEU A 84 0.055 7.256 -4.461 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.155 6.251 -3.340 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.434 8.634 -4.043 1.00 0.00 C ATOM 0 H LEU A 84 0.818 6.521 -7.097 1.00 0.00 H new ATOM 0 HA LEU A 84 1.415 9.101 -6.048 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.895 6.293 -4.987 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.096 7.757 -4.045 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.526 6.932 -5.324 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.210 6.225 -3.067 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.158 5.262 -3.675 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.437 6.544 -2.473 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.485 8.577 -3.760 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.152 8.986 -3.194 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.320 9.329 -4.875 1.00 0.00 H new ATOM 1237 N GLY A 85 3.869 9.395 -6.128 1.00 0.00 N ATOM 1238 CA GLY A 85 5.295 9.608 -6.296 1.00 0.00 C ATOM 1239 C GLY A 85 5.817 10.743 -5.438 1.00 0.00 C ATOM 1240 O GLY A 85 5.275 11.848 -5.464 1.00 0.00 O ATOM 0 H GLY A 85 3.345 10.218 -5.831 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.828 8.691 -6.044 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.506 9.822 -7.344 1.00 0.00 H new ATOM 1244 N ILE A 86 6.870 10.469 -4.676 1.00 0.00 N ATOM 1245 CA ILE A 86 7.464 11.477 -3.805 1.00 0.00 C ATOM 1246 C ILE A 86 8.112 12.592 -4.618 1.00 0.00 C ATOM 1247 O ILE A 86 8.321 12.456 -5.823 1.00 0.00 O ATOM 1248 CB ILE A 86 8.518 10.858 -2.867 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.630 10.192 -3.681 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.867 9.853 -1.929 1.00 0.00 C ATOM 1251 CD1 ILE A 86 11.004 10.351 -3.069 1.00 0.00 C ATOM 0 H ILE A 86 7.329 9.559 -4.644 1.00 0.00 H new ATOM 0 HA ILE A 86 6.655 11.893 -3.204 1.00 0.00 H new ATOM 0 HB ILE A 86 8.960 11.653 -2.267 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.408 9.130 -3.784 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.637 10.615 -4.686 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.624 9.424 -1.273 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.108 10.354 -1.328 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.401 9.059 -2.513 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.742 9.855 -3.699 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.247 11.411 -2.991 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.014 9.902 -2.076 1.00 0.00 H new ATOM 1263 N ASN A 87 8.430 13.697 -3.950 1.00 0.00 N ATOM 1264 CA ASN A 87 9.056 14.837 -4.611 1.00 0.00 C ATOM 1265 C ASN A 87 10.492 15.022 -4.133 1.00 0.00 C ATOM 1266 O ASN A 87 10.962 14.304 -3.250 1.00 0.00 O ATOM 1267 CB ASN A 87 8.249 16.110 -4.350 1.00 0.00 C ATOM 1268 CG ASN A 87 7.305 16.441 -5.490 1.00 0.00 C ATOM 1269 OD1 ASN A 87 7.574 16.120 -6.647 1.00 0.00 O ATOM 1270 ND2 ASN A 87 6.191 17.086 -5.166 1.00 0.00 N ATOM 0 H ASN A 87 8.264 13.827 -2.952 1.00 0.00 H new ATOM 0 HA ASN A 87 9.073 14.640 -5.683 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.676 15.991 -3.430 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.933 16.945 -4.194 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.517 17.335 -5.890 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.009 17.332 -4.193 1.00 0.00 H new ATOM 1277 N SER A 88 11.186 15.991 -4.723 1.00 0.00 N ATOM 1278 CA SER A 88 12.569 16.273 -4.357 1.00 0.00 C ATOM 1279 C SER A 88 12.661 16.772 -2.918 1.00 0.00 C ATOM 1280 O SER A 88 13.655 16.534 -2.232 1.00 0.00 O ATOM 1281 CB SER A 88 13.169 17.310 -5.308 1.00 0.00 C ATOM 1282 OG SER A 88 12.210 18.293 -5.663 1.00 0.00 O ATOM 0 H SER A 88 10.813 16.594 -5.456 1.00 0.00 H new ATOM 0 HA SER A 88 13.136 15.345 -4.437 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.027 17.788 -4.835 1.00 0.00 H new ATOM 0 HB3 SER A 88 13.536 16.814 -6.207 1.00 0.00 H new ATOM 0 HG SER A 88 12.619 18.945 -6.270 1.00 0.00 H new ATOM 1288 N ASP A 89 11.619 17.464 -2.470 1.00 0.00 N ATOM 1289 CA ASP A 89 11.584 17.995 -1.112 1.00 0.00 C ATOM 1290 C ASP A 89 11.377 16.878 -0.095 1.00 0.00 C ATOM 1291 O ASP A 89 11.901 16.933 1.017 1.00 0.00 O ATOM 1292 CB ASP A 89 10.469 19.034 -0.979 1.00 0.00 C ATOM 1293 CG ASP A 89 10.912 20.417 -1.415 1.00 0.00 C ATOM 1294 OD1 ASP A 89 11.634 20.515 -2.429 1.00 0.00 O ATOM 1295 OD2 ASP A 89 10.538 21.400 -0.743 1.00 0.00 O ATOM 0 H ASP A 89 10.789 17.670 -3.026 1.00 0.00 H new ATOM 0 HA ASP A 89 12.543 18.471 -0.910 1.00 0.00 H new ATOM 0 HB2 ASP A 89 9.614 18.724 -1.579 1.00 0.00 H new ATOM 0 HB3 ASP A 89 10.134 19.073 0.058 1.00 0.00 H new ATOM 1300 N GLY A 90 10.610 15.864 -0.484 1.00 0.00 N ATOM 1301 CA GLY A 90 10.348 14.748 0.406 1.00 0.00 C ATOM 1302 C GLY A 90 8.869 14.439 0.533 1.00 0.00 C ATOM 1303 O GLY A 90 8.489 13.314 0.857 1.00 0.00 O ATOM 0 H GLY A 90 10.165 15.796 -1.399 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.870 13.864 0.038 1.00 0.00 H new ATOM 0 HA3 GLY A 90 10.755 14.971 1.392 1.00 0.00 H new ATOM 1307 N LEU A 91 8.032 15.441 0.280 1.00 0.00 N ATOM 1308 CA LEU A 91 6.585 15.271 0.370 1.00 0.00 C ATOM 1309 C LEU A 91 6.108 14.146 -0.542 1.00 0.00 C ATOM 1310 O LEU A 91 6.767 13.811 -1.528 1.00 0.00 O ATOM 1311 CB LEU A 91 5.875 16.576 0.003 1.00 0.00 C ATOM 1312 CG LEU A 91 4.550 16.818 0.729 1.00 0.00 C ATOM 1313 CD1 LEU A 91 4.782 17.580 2.024 1.00 0.00 C ATOM 1314 CD2 LEU A 91 3.582 17.574 -0.170 1.00 0.00 C ATOM 0 H LEU A 91 8.330 16.379 0.011 1.00 0.00 H new ATOM 0 HA LEU A 91 6.340 15.006 1.399 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.545 17.409 0.215 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.690 16.582 -1.071 1.00 0.00 H new ATOM 0 HG LEU A 91 4.110 15.852 0.975 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.828 17.743 2.526 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.440 17.002 2.673 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.244 18.542 1.802 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.645 17.738 0.361 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.016 18.535 -0.445 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.391 16.991 -1.071 1.00 0.00 H new ATOM 1326 N VAL A 92 4.959 13.566 -0.208 1.00 0.00 N ATOM 1327 CA VAL A 92 4.392 12.480 -0.997 1.00 0.00 C ATOM 1328 C VAL A 92 3.246 12.976 -1.870 1.00 0.00 C ATOM 1329 O VAL A 92 2.105 13.074 -1.417 1.00 0.00 O ATOM 1330 CB VAL A 92 3.881 11.339 -0.097 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.480 10.135 -0.935 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.936 10.956 0.930 1.00 0.00 C ATOM 0 H VAL A 92 4.403 13.831 0.605 1.00 0.00 H new ATOM 0 HA VAL A 92 5.192 12.100 -1.633 1.00 0.00 H new ATOM 0 HB VAL A 92 2.998 11.690 0.437 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.122 9.340 -0.281 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.687 10.421 -1.627 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.343 9.780 -1.499 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.557 10.149 1.557 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.839 10.625 0.418 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.168 11.820 1.552 1.00 0.00 H new ATOM 1342 N VAL A 93 3.555 13.289 -3.124 1.00 0.00 N ATOM 1343 CA VAL A 93 2.550 13.776 -4.060 1.00 0.00 C ATOM 1344 C VAL A 93 2.158 12.693 -5.059 1.00 0.00 C ATOM 1345 O VAL A 93 2.809 11.652 -5.149 1.00 0.00 O ATOM 1346 CB VAL A 93 3.051 15.011 -4.831 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.228 16.193 -3.889 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.350 14.698 -5.555 1.00 0.00 C ATOM 0 H VAL A 93 4.494 13.214 -3.515 1.00 0.00 H new ATOM 0 HA VAL A 93 1.678 14.055 -3.469 1.00 0.00 H new ATOM 0 HB VAL A 93 2.303 15.279 -5.577 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.583 17.057 -4.452 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.273 16.432 -3.421 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.956 15.938 -3.118 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.688 15.583 -6.094 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.109 14.403 -4.830 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.186 13.884 -6.261 1.00 0.00 H new ATOM 1358 N GLY A 94 1.089 12.946 -5.808 1.00 0.00 N ATOM 1359 CA GLY A 94 0.628 11.983 -6.791 1.00 0.00 C ATOM 1360 C GLY A 94 0.238 12.635 -8.103 1.00 0.00 C ATOM 1361 O GLY A 94 -0.884 13.116 -8.256 1.00 0.00 O ATOM 0 H GLY A 94 0.534 13.800 -5.752 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.414 11.250 -6.973 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.228 11.440 -6.390 1.00 0.00 H new ATOM 1365 N ARG A 95 1.168 12.649 -9.053 1.00 0.00 N ATOM 1366 CA ARG A 95 0.916 13.244 -10.360 1.00 0.00 C ATOM 1367 C ARG A 95 2.010 12.861 -11.351 1.00 0.00 C ATOM 1368 O ARG A 95 3.138 13.345 -11.264 1.00 0.00 O ATOM 1369 CB ARG A 95 0.829 14.768 -10.241 1.00 0.00 C ATOM 1370 CG ARG A 95 2.121 15.417 -9.772 1.00 0.00 C ATOM 1371 CD ARG A 95 1.874 16.809 -9.216 1.00 0.00 C ATOM 1372 NE ARG A 95 1.771 17.812 -10.273 1.00 0.00 N ATOM 1373 CZ ARG A 95 1.908 19.121 -10.070 1.00 0.00 C ATOM 1374 NH1 ARG A 95 2.153 19.588 -8.852 1.00 0.00 N ATOM 1375 NH2 ARG A 95 1.800 19.964 -11.087 1.00 0.00 N ATOM 0 H ARG A 95 2.102 12.255 -8.942 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.035 12.861 -10.730 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.554 15.185 -11.210 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.030 15.025 -9.545 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.585 14.795 -9.006 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.823 15.475 -10.604 1.00 0.00 H new ATOM 0 HD2 ARG A 95 0.956 16.807 -8.628 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.685 17.078 -8.539 1.00 0.00 H new ATOM 0 HE ARG A 95 1.583 17.491 -11.223 1.00 0.00 H new ATOM 0 HH11 ARG A 95 2.237 18.943 -8.066 1.00 0.00 H new ATOM 0 HH12 ARG A 95 2.257 20.592 -8.702 1.00 0.00 H new ATOM 0 HH21 ARG A 95 1.612 19.610 -12.025 1.00 0.00 H new ATOM 0 HH22 ARG A 95 1.905 20.967 -10.932 1.00 0.00 H new ATOM 1389 N SER A 96 1.667 11.989 -12.294 1.00 0.00 N ATOM 1390 CA SER A 96 2.621 11.540 -13.301 1.00 0.00 C ATOM 1391 C SER A 96 1.949 10.627 -14.321 1.00 0.00 C ATOM 1392 O SER A 96 2.230 10.703 -15.517 1.00 0.00 O ATOM 1393 CB SER A 96 3.789 10.808 -12.637 1.00 0.00 C ATOM 1394 OG SER A 96 5.011 11.094 -13.296 1.00 0.00 O ATOM 0 H SER A 96 0.737 11.580 -12.381 1.00 0.00 H new ATOM 0 HA SER A 96 3.000 12.419 -13.822 1.00 0.00 H new ATOM 0 HB2 SER A 96 3.859 11.103 -11.590 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.606 9.734 -12.654 1.00 0.00 H new ATOM 0 HG SER A 96 5.742 10.616 -12.852 1.00 0.00 H new ATOM 1400 N ASP A 97 1.061 9.761 -13.841 1.00 0.00 N ATOM 1401 CA ASP A 97 0.349 8.832 -14.710 1.00 0.00 C ATOM 1402 C ASP A 97 1.318 7.852 -15.366 1.00 0.00 C ATOM 1403 O ASP A 97 1.085 7.385 -16.482 1.00 0.00 O ATOM 1404 CB ASP A 97 -0.430 9.598 -15.783 1.00 0.00 C ATOM 1405 CG ASP A 97 -1.900 9.737 -15.439 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -2.213 10.394 -14.423 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -2.739 9.190 -16.185 1.00 0.00 O ATOM 0 H ASP A 97 0.818 9.684 -12.853 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.354 8.265 -14.099 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.007 10.589 -15.908 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.330 9.083 -16.738 1.00 0.00 H new ATOM 1412 N ALA A 98 2.404 7.543 -14.665 1.00 0.00 N ATOM 1413 CA ALA A 98 3.407 6.618 -15.179 1.00 0.00 C ATOM 1414 C ALA A 98 4.131 5.909 -14.038 1.00 0.00 C ATOM 1415 O ALA A 98 3.715 5.986 -12.882 1.00 0.00 O ATOM 1416 CB ALA A 98 4.403 7.356 -16.062 1.00 0.00 C ATOM 0 H ALA A 98 2.612 7.919 -13.740 1.00 0.00 H new ATOM 0 HA ALA A 98 2.899 5.863 -15.779 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.146 6.653 -16.439 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.877 7.812 -16.901 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.900 8.132 -15.480 1.00 0.00 H new ATOM 1422 N ILE A 99 5.217 5.219 -14.373 1.00 0.00 N ATOM 1423 CA ILE A 99 5.998 4.495 -13.377 1.00 0.00 C ATOM 1424 C ILE A 99 7.451 4.959 -13.375 1.00 0.00 C ATOM 1425 O ILE A 99 8.289 4.413 -14.093 1.00 0.00 O ATOM 1426 CB ILE A 99 5.958 2.976 -13.626 1.00 0.00 C ATOM 1427 CG1 ILE A 99 4.515 2.508 -13.824 1.00 0.00 C ATOM 1428 CG2 ILE A 99 6.608 2.232 -12.469 1.00 0.00 C ATOM 1429 CD1 ILE A 99 4.406 1.145 -14.472 1.00 0.00 C ATOM 0 H ILE A 99 5.575 5.146 -15.325 1.00 0.00 H new ATOM 0 HA ILE A 99 5.548 4.709 -12.407 1.00 0.00 H new ATOM 0 HB ILE A 99 6.519 2.757 -14.534 1.00 0.00 H new ATOM 0 HG12 ILE A 99 4.014 2.483 -12.856 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.986 3.237 -14.438 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.572 1.159 -12.660 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.646 2.548 -12.371 1.00 0.00 H new ATOM 0 HG23 ILE A 99 6.072 2.455 -11.546 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.355 0.877 -14.581 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.878 1.170 -15.454 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.906 0.404 -13.848 1.00 0.00 H new ATOM 1441 N GLY A 100 7.743 5.971 -12.564 1.00 0.00 N ATOM 1442 CA GLY A 100 9.096 6.490 -12.484 1.00 0.00 C ATOM 1443 C GLY A 100 9.841 5.981 -11.264 1.00 0.00 C ATOM 1444 O GLY A 100 9.460 4.964 -10.683 1.00 0.00 O ATOM 0 H GLY A 100 7.067 6.441 -11.961 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.643 6.209 -13.384 1.00 0.00 H new ATOM 0 HA3 GLY A 100 9.063 7.579 -12.458 1.00 0.00 H new ATOM 1448 N PRO A 101 10.915 6.672 -10.847 1.00 0.00 N ATOM 1449 CA PRO A 101 11.708 6.271 -9.680 1.00 0.00 C ATOM 1450 C PRO A 101 10.957 6.483 -8.370 1.00 0.00 C ATOM 1451 O PRO A 101 10.942 5.609 -7.503 1.00 0.00 O ATOM 1452 CB PRO A 101 12.930 7.188 -9.750 1.00 0.00 C ATOM 1453 CG PRO A 101 12.460 8.391 -10.490 1.00 0.00 C ATOM 1454 CD PRO A 101 11.441 7.896 -11.480 1.00 0.00 C ATOM 0 HA PRO A 101 11.954 5.209 -9.699 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.285 7.450 -8.754 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.759 6.704 -10.267 1.00 0.00 H new ATOM 0 HG2 PRO A 101 12.021 9.121 -9.810 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.288 8.886 -10.997 1.00 0.00 H new ATOM 0 HD2 PRO A 101 10.654 8.631 -11.648 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.892 7.685 -12.449 1.00 0.00 H new ATOM 1462 N ARG A 102 10.332 7.648 -8.232 1.00 0.00 N ATOM 1463 CA ARG A 102 9.579 7.973 -7.025 1.00 0.00 C ATOM 1464 C ARG A 102 8.368 7.059 -6.876 1.00 0.00 C ATOM 1465 O ARG A 102 7.968 6.720 -5.763 1.00 0.00 O ATOM 1466 CB ARG A 102 9.128 9.435 -7.059 1.00 0.00 C ATOM 1467 CG ARG A 102 10.266 10.418 -7.283 1.00 0.00 C ATOM 1468 CD ARG A 102 10.157 11.104 -8.636 1.00 0.00 C ATOM 1469 NE ARG A 102 10.772 12.430 -8.629 1.00 0.00 N ATOM 1470 CZ ARG A 102 10.814 13.233 -9.689 1.00 0.00 C ATOM 1471 NH1 ARG A 102 10.280 12.849 -10.843 1.00 0.00 N ATOM 1472 NH2 ARG A 102 11.392 14.423 -9.597 1.00 0.00 N ATOM 0 H ARG A 102 10.332 8.382 -8.940 1.00 0.00 H new ATOM 0 HA ARG A 102 10.233 7.821 -6.167 1.00 0.00 H new ATOM 0 HB2 ARG A 102 8.390 9.560 -7.851 1.00 0.00 H new ATOM 0 HB3 ARG A 102 8.631 9.675 -6.119 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.260 11.169 -6.493 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.219 9.893 -7.217 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.636 10.486 -9.395 1.00 0.00 H new ATOM 0 HD3 ARG A 102 9.107 11.193 -8.914 1.00 0.00 H new ATOM 0 HE ARG A 102 11.194 12.759 -7.760 1.00 0.00 H new ATOM 0 HH11 ARG A 102 9.835 11.934 -10.920 1.00 0.00 H new ATOM 0 HH12 ARG A 102 10.315 13.469 -11.652 1.00 0.00 H new ATOM 0 HH21 ARG A 102 11.804 14.723 -8.714 1.00 0.00 H new ATOM 0 HH22 ARG A 102 11.424 15.039 -10.410 1.00 0.00 H new ATOM 1486 N GLU A 103 7.788 6.662 -8.004 1.00 0.00 N ATOM 1487 CA GLU A 103 6.623 5.786 -7.999 1.00 0.00 C ATOM 1488 C GLU A 103 6.974 4.403 -7.455 1.00 0.00 C ATOM 1489 O GLU A 103 6.094 3.649 -7.037 1.00 0.00 O ATOM 1490 CB GLU A 103 6.048 5.658 -9.411 1.00 0.00 C ATOM 1491 CG GLU A 103 5.072 6.766 -9.773 1.00 0.00 C ATOM 1492 CD GLU A 103 5.731 7.899 -10.533 1.00 0.00 C ATOM 1493 OE1 GLU A 103 6.471 8.685 -9.904 1.00 0.00 O ATOM 1494 OE2 GLU A 103 5.508 8.001 -11.758 1.00 0.00 O ATOM 0 H GLU A 103 8.107 6.934 -8.934 1.00 0.00 H new ATOM 0 HA GLU A 103 5.873 6.232 -7.345 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.868 5.658 -10.130 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.543 4.696 -9.503 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.264 6.351 -10.376 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.620 7.159 -8.862 1.00 0.00 H new ATOM 1501 N GLN A 104 8.263 4.073 -7.463 1.00 0.00 N ATOM 1502 CA GLN A 104 8.723 2.779 -6.971 1.00 0.00 C ATOM 1503 C GLN A 104 8.610 2.700 -5.452 1.00 0.00 C ATOM 1504 O GLN A 104 9.137 3.550 -4.735 1.00 0.00 O ATOM 1505 CB GLN A 104 10.170 2.533 -7.400 1.00 0.00 C ATOM 1506 CG GLN A 104 10.393 2.669 -8.897 1.00 0.00 C ATOM 1507 CD GLN A 104 11.629 1.930 -9.372 1.00 0.00 C ATOM 1508 OE1 GLN A 104 12.070 0.967 -8.745 1.00 0.00 O ATOM 1509 NE2 GLN A 104 12.194 2.379 -10.487 1.00 0.00 N ATOM 0 H GLN A 104 9.006 4.683 -7.804 1.00 0.00 H new ATOM 0 HA GLN A 104 8.086 2.008 -7.404 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.819 3.237 -6.879 1.00 0.00 H new ATOM 0 HB3 GLN A 104 10.468 1.533 -7.086 1.00 0.00 H new ATOM 0 HG2 GLN A 104 9.520 2.288 -9.427 1.00 0.00 H new ATOM 0 HG3 GLN A 104 10.485 3.725 -9.153 1.00 0.00 H new ATOM 0 HE21 GLN A 104 11.794 3.181 -10.974 1.00 0.00 H new ATOM 0 HE22 GLN A 104 13.028 1.922 -10.856 1.00 0.00 H new ATOM 1518 N TRP A 105 7.919 1.671 -4.968 1.00 0.00 N ATOM 1519 CA TRP A 105 7.738 1.477 -3.534 1.00 0.00 C ATOM 1520 C TRP A 105 8.225 0.096 -3.109 1.00 0.00 C ATOM 1521 O TRP A 105 8.036 -0.888 -3.826 1.00 0.00 O ATOM 1522 CB TRP A 105 6.266 1.650 -3.156 1.00 0.00 C ATOM 1523 CG TRP A 105 5.731 3.017 -3.459 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.990 3.385 -4.546 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.896 4.197 -2.665 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.685 4.723 -4.476 1.00 0.00 N ATOM 1527 CE2 TRP A 105 5.229 5.244 -3.331 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.541 4.472 -1.456 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 5.191 6.542 -2.828 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.502 5.761 -0.958 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.831 6.782 -1.643 1.00 0.00 C ATOM 0 H TRP A 105 7.476 0.959 -5.549 1.00 0.00 H new ATOM 0 HA TRP A 105 8.330 2.229 -3.012 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.672 0.909 -3.690 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.146 1.448 -2.092 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.688 2.722 -5.343 1.00 0.00 H new ATOM 0 HE1 TRP A 105 4.142 5.244 -5.164 1.00 0.00 H new ATOM 0 HE3 TRP A 105 7.061 3.691 -0.920 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.675 7.331 -3.355 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.997 5.985 -0.025 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.819 7.779 -1.227 1.00 0.00 H new ATOM 1542 N GLU A 106 8.856 0.028 -1.941 1.00 0.00 N ATOM 1543 CA GLU A 106 9.373 -1.235 -1.425 1.00 0.00 C ATOM 1544 C GLU A 106 8.730 -1.581 -0.082 1.00 0.00 C ATOM 1545 O GLU A 106 9.155 -1.087 0.962 1.00 0.00 O ATOM 1546 CB GLU A 106 10.893 -1.160 -1.268 1.00 0.00 C ATOM 1547 CG GLU A 106 11.602 -2.465 -1.593 1.00 0.00 C ATOM 1548 CD GLU A 106 12.883 -2.644 -0.801 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.859 -1.917 -1.079 1.00 0.00 O ATOM 1550 OE2 GLU A 106 12.908 -3.510 0.098 1.00 0.00 O ATOM 0 H GLU A 106 9.022 0.831 -1.335 1.00 0.00 H new ATOM 0 HA GLU A 106 9.124 -2.019 -2.140 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.279 -0.375 -1.918 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.131 -0.872 -0.244 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.932 -3.300 -1.387 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.830 -2.495 -2.658 1.00 0.00 H new ATOM 1557 N PRO A 107 7.694 -2.441 -0.090 1.00 0.00 N ATOM 1558 CA PRO A 107 7.001 -2.848 1.137 1.00 0.00 C ATOM 1559 C PRO A 107 7.872 -3.728 2.027 1.00 0.00 C ATOM 1560 O PRO A 107 8.779 -4.408 1.548 1.00 0.00 O ATOM 1561 CB PRO A 107 5.794 -3.636 0.620 1.00 0.00 C ATOM 1562 CG PRO A 107 6.212 -4.136 -0.718 1.00 0.00 C ATOM 1563 CD PRO A 107 7.121 -3.082 -1.288 1.00 0.00 C ATOM 0 HA PRO A 107 6.733 -1.993 1.757 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.543 -4.459 1.289 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.910 -3.003 0.547 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.728 -5.092 -0.634 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.348 -4.296 -1.362 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.895 -3.518 -1.920 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.573 -2.368 -1.902 1.00 0.00 H new ATOM 1571 N VAL A 108 7.594 -3.708 3.327 1.00 0.00 N ATOM 1572 CA VAL A 108 8.356 -4.504 4.283 1.00 0.00 C ATOM 1573 C VAL A 108 7.449 -5.100 5.355 1.00 0.00 C ATOM 1574 O VAL A 108 6.339 -4.615 5.582 1.00 0.00 O ATOM 1575 CB VAL A 108 9.451 -3.662 4.966 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.366 -4.546 5.799 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.247 -2.883 3.931 1.00 0.00 C ATOM 0 H VAL A 108 6.848 -3.150 3.742 1.00 0.00 H new ATOM 0 HA VAL A 108 8.823 -5.311 3.719 1.00 0.00 H new ATOM 0 HB VAL A 108 8.970 -2.948 5.635 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.132 -3.932 6.273 1.00 0.00 H new ATOM 0 HG12 VAL A 108 9.782 -5.054 6.566 1.00 0.00 H new ATOM 0 HG13 VAL A 108 10.841 -5.287 5.156 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.016 -2.294 4.431 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.717 -3.578 3.235 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.579 -2.218 3.384 1.00 0.00 H new ATOM 1587 N PHE A 109 7.926 -6.153 6.009 1.00 0.00 N ATOM 1588 CA PHE A 109 7.161 -6.816 7.058 1.00 0.00 C ATOM 1589 C PHE A 109 8.030 -7.073 8.285 1.00 0.00 C ATOM 1590 O PHE A 109 9.206 -7.417 8.164 1.00 0.00 O ATOM 1591 CB PHE A 109 6.586 -8.137 6.541 1.00 0.00 C ATOM 1592 CG PHE A 109 5.398 -7.962 5.638 1.00 0.00 C ATOM 1593 CD1 PHE A 109 5.568 -7.610 4.309 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.113 -8.149 6.121 1.00 0.00 C ATOM 1595 CE1 PHE A 109 4.477 -7.448 3.477 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.017 -7.989 5.293 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.199 -7.638 3.969 1.00 0.00 C ATOM 0 H PHE A 109 8.841 -6.567 5.831 1.00 0.00 H new ATOM 0 HA PHE A 109 6.341 -6.158 7.346 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.365 -8.677 6.003 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.298 -8.756 7.391 1.00 0.00 H new ATOM 0 HD1 PHE A 109 6.564 -7.461 3.919 1.00 0.00 H new ATOM 0 HD2 PHE A 109 3.966 -8.423 7.155 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.622 -7.173 2.443 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.020 -8.138 5.681 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.345 -7.512 3.320 1.00 0.00 H new ATOM 1607 N GLN A 110 7.444 -6.902 9.466 1.00 0.00 N ATOM 1608 CA GLN A 110 8.169 -7.115 10.715 1.00 0.00 C ATOM 1609 C GLN A 110 7.246 -7.681 11.791 1.00 0.00 C ATOM 1610 O GLN A 110 6.466 -6.950 12.401 1.00 0.00 O ATOM 1611 CB GLN A 110 8.793 -5.802 11.196 1.00 0.00 C ATOM 1612 CG GLN A 110 10.286 -5.901 11.462 1.00 0.00 C ATOM 1613 CD GLN A 110 10.693 -5.231 12.760 1.00 0.00 C ATOM 1614 OE1 GLN A 110 9.904 -5.143 13.700 1.00 0.00 O ATOM 1615 NE2 GLN A 110 11.931 -4.754 12.815 1.00 0.00 N ATOM 0 H GLN A 110 6.472 -6.617 9.585 1.00 0.00 H new ATOM 0 HA GLN A 110 8.963 -7.839 10.528 1.00 0.00 H new ATOM 0 HB2 GLN A 110 8.616 -5.029 10.448 1.00 0.00 H new ATOM 0 HB3 GLN A 110 8.290 -5.483 12.109 1.00 0.00 H new ATOM 0 HG2 GLN A 110 10.577 -6.951 11.493 1.00 0.00 H new ATOM 0 HG3 GLN A 110 10.830 -5.444 10.635 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.551 -4.850 12.010 1.00 0.00 H new ATOM 0 HE22 GLN A 110 12.262 -4.292 13.662 1.00 0.00 H new ATOM 1624 N ASP A 111 7.345 -8.987 12.021 1.00 0.00 N ATOM 1625 CA ASP A 111 6.522 -9.651 13.026 1.00 0.00 C ATOM 1626 C ASP A 111 5.037 -9.436 12.746 1.00 0.00 C ATOM 1627 O ASP A 111 4.268 -9.086 13.643 1.00 0.00 O ATOM 1628 CB ASP A 111 6.872 -9.133 14.423 1.00 0.00 C ATOM 1629 CG ASP A 111 8.345 -9.293 14.746 1.00 0.00 C ATOM 1630 OD1 ASP A 111 8.819 -10.447 14.793 1.00 0.00 O ATOM 1631 OD2 ASP A 111 9.022 -8.265 14.951 1.00 0.00 O ATOM 0 H ASP A 111 7.987 -9.606 11.525 1.00 0.00 H new ATOM 0 HA ASP A 111 6.728 -10.720 12.980 1.00 0.00 H new ATOM 0 HB2 ASP A 111 6.599 -8.080 14.496 1.00 0.00 H new ATOM 0 HB3 ASP A 111 6.280 -9.668 15.165 1.00 0.00 H new ATOM 1636 N GLY A 112 4.639 -9.648 11.496 1.00 0.00 N ATOM 1637 CA GLY A 112 3.248 -9.472 11.121 1.00 0.00 C ATOM 1638 C GLY A 112 2.968 -8.086 10.574 1.00 0.00 C ATOM 1639 O GLY A 112 2.292 -7.937 9.556 1.00 0.00 O ATOM 0 H GLY A 112 5.254 -9.938 10.736 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.980 -10.217 10.372 1.00 0.00 H new ATOM 0 HA3 GLY A 112 2.615 -9.652 11.990 1.00 0.00 H new ATOM 1643 N LYS A 113 3.490 -7.069 11.253 1.00 0.00 N ATOM 1644 CA LYS A 113 3.294 -5.687 10.832 1.00 0.00 C ATOM 1645 C LYS A 113 3.867 -5.458 9.436 1.00 0.00 C ATOM 1646 O LYS A 113 4.407 -6.375 8.818 1.00 0.00 O ATOM 1647 CB LYS A 113 3.951 -4.730 11.829 1.00 0.00 C ATOM 1648 CG LYS A 113 3.406 -4.855 13.242 1.00 0.00 C ATOM 1649 CD LYS A 113 2.122 -4.060 13.418 1.00 0.00 C ATOM 1650 CE LYS A 113 2.093 -3.335 14.754 1.00 0.00 C ATOM 1651 NZ LYS A 113 1.364 -4.114 15.793 1.00 0.00 N ATOM 0 H LYS A 113 4.052 -7.177 12.097 1.00 0.00 H new ATOM 0 HA LYS A 113 2.222 -5.490 10.803 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.025 -4.916 11.845 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.810 -3.706 11.484 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.219 -5.905 13.469 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.153 -4.503 13.953 1.00 0.00 H new ATOM 0 HD2 LYS A 113 2.027 -3.336 12.608 1.00 0.00 H new ATOM 0 HD3 LYS A 113 1.265 -4.730 13.348 1.00 0.00 H new ATOM 0 HE2 LYS A 113 3.114 -3.150 15.089 1.00 0.00 H new ATOM 0 HE3 LYS A 113 1.617 -2.362 14.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 1.367 -3.586 16.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 0.383 -4.269 15.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 1.833 -5.032 15.931 1.00 0.00 H new ATOM 1665 N MET A 114 3.744 -4.228 8.945 1.00 0.00 N ATOM 1666 CA MET A 114 4.251 -3.879 7.623 1.00 0.00 C ATOM 1667 C MET A 114 4.412 -2.370 7.482 1.00 0.00 C ATOM 1668 O MET A 114 3.720 -1.596 8.144 1.00 0.00 O ATOM 1669 CB MET A 114 3.309 -4.407 6.537 1.00 0.00 C ATOM 1670 CG MET A 114 1.847 -4.067 6.782 1.00 0.00 C ATOM 1671 SD MET A 114 0.731 -5.376 6.240 1.00 0.00 S ATOM 1672 CE MET A 114 0.906 -6.547 7.584 1.00 0.00 C ATOM 0 H MET A 114 3.298 -3.458 9.443 1.00 0.00 H new ATOM 0 HA MET A 114 5.230 -4.343 7.503 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.612 -3.997 5.574 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.415 -5.490 6.470 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.694 -3.881 7.845 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.600 -3.144 6.258 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.331 -7.446 7.361 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.957 -6.809 7.703 1.00 0.00 H new ATOM 0 HE3 MET A 114 0.537 -6.100 8.507 1.00 0.00 H new ATOM 1682 N ALA A 115 5.331 -1.956 6.615 1.00 0.00 N ATOM 1683 CA ALA A 115 5.584 -0.539 6.385 1.00 0.00 C ATOM 1684 C ALA A 115 5.926 -0.273 4.923 1.00 0.00 C ATOM 1685 O ALA A 115 6.257 -1.192 4.176 1.00 0.00 O ATOM 1686 CB ALA A 115 6.708 -0.052 7.289 1.00 0.00 C ATOM 0 H ALA A 115 5.913 -2.583 6.060 1.00 0.00 H new ATOM 0 HA ALA A 115 4.674 0.012 6.624 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.887 1.008 7.108 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.426 -0.199 8.332 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.616 -0.615 7.076 1.00 0.00 H new ATOM 1692 N LEU A 116 5.842 0.991 4.523 1.00 0.00 N ATOM 1693 CA LEU A 116 6.141 1.379 3.148 1.00 0.00 C ATOM 1694 C LEU A 116 7.356 2.300 3.093 1.00 0.00 C ATOM 1695 O LEU A 116 7.380 3.351 3.734 1.00 0.00 O ATOM 1696 CB LEU A 116 4.933 2.071 2.517 1.00 0.00 C ATOM 1697 CG LEU A 116 4.804 1.897 1.003 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.610 0.430 0.651 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.652 2.734 0.466 1.00 0.00 C ATOM 0 H LEU A 116 5.570 1.764 5.130 1.00 0.00 H new ATOM 0 HA LEU A 116 6.368 0.475 2.584 1.00 0.00 H new ATOM 0 HB2 LEU A 116 4.028 1.690 2.989 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.986 3.136 2.742 1.00 0.00 H new ATOM 0 HG LEU A 116 5.726 2.243 0.536 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.520 0.324 -0.430 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.467 -0.145 1.002 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.704 0.058 1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.575 2.598 -0.613 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.722 2.419 0.939 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.833 3.786 0.687 1.00 0.00 H new ATOM 1711 N LEU A 117 8.362 1.899 2.323 1.00 0.00 N ATOM 1712 CA LEU A 117 9.579 2.689 2.183 1.00 0.00 C ATOM 1713 C LEU A 117 9.625 3.377 0.822 1.00 0.00 C ATOM 1714 O LEU A 117 9.550 2.724 -0.218 1.00 0.00 O ATOM 1715 CB LEU A 117 10.812 1.801 2.360 1.00 0.00 C ATOM 1716 CG LEU A 117 12.150 2.545 2.370 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.591 2.832 3.797 1.00 0.00 C ATOM 1718 CD2 LEU A 117 13.212 1.743 1.633 1.00 0.00 C ATOM 0 H LEU A 117 8.358 1.032 1.786 1.00 0.00 H new ATOM 0 HA LEU A 117 9.578 3.455 2.959 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.713 1.250 3.295 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.829 1.065 1.557 1.00 0.00 H new ATOM 0 HG LEU A 117 12.018 3.496 1.854 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.544 3.361 3.784 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.841 3.448 4.293 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.705 1.893 4.338 1.00 0.00 H new ATOM 0 HD21 LEU A 117 14.156 2.287 1.650 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.341 0.776 2.120 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.900 1.590 0.600 1.00 0.00 H new ATOM 1730 N ALA A 118 9.750 4.701 0.839 1.00 0.00 N ATOM 1731 CA ALA A 118 9.807 5.478 -0.393 1.00 0.00 C ATOM 1732 C ALA A 118 11.063 5.153 -1.194 1.00 0.00 C ATOM 1733 O ALA A 118 12.000 4.544 -0.678 1.00 0.00 O ATOM 1734 CB ALA A 118 9.749 6.966 -0.080 1.00 0.00 C ATOM 0 H ALA A 118 9.814 5.257 1.692 1.00 0.00 H new ATOM 0 HA ALA A 118 8.943 5.210 -1.001 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.792 7.535 -1.009 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.819 7.192 0.441 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.594 7.238 0.552 1.00 0.00 H new ATOM 1740 N SER A 119 11.074 5.566 -2.457 1.00 0.00 N ATOM 1741 CA SER A 119 12.215 5.321 -3.332 1.00 0.00 C ATOM 1742 C SER A 119 13.460 6.056 -2.837 1.00 0.00 C ATOM 1743 O SER A 119 14.576 5.752 -3.255 1.00 0.00 O ATOM 1744 CB SER A 119 11.889 5.755 -4.763 1.00 0.00 C ATOM 1745 OG SER A 119 12.511 4.902 -5.708 1.00 0.00 O ATOM 0 H SER A 119 10.306 6.072 -2.898 1.00 0.00 H new ATOM 0 HA SER A 119 12.422 4.251 -3.319 1.00 0.00 H new ATOM 0 HB2 SER A 119 10.809 5.743 -4.913 1.00 0.00 H new ATOM 0 HB3 SER A 119 12.222 6.781 -4.920 1.00 0.00 H new ATOM 0 HG SER A 119 12.252 5.173 -6.613 1.00 0.00 H new ATOM 1751 N ASN A 120 13.263 7.024 -1.945 1.00 0.00 N ATOM 1752 CA ASN A 120 14.374 7.797 -1.400 1.00 0.00 C ATOM 1753 C ASN A 120 14.871 7.201 -0.084 1.00 0.00 C ATOM 1754 O ASN A 120 15.508 7.887 0.714 1.00 0.00 O ATOM 1755 CB ASN A 120 13.951 9.252 -1.184 1.00 0.00 C ATOM 1756 CG ASN A 120 12.737 9.373 -0.284 1.00 0.00 C ATOM 1757 OD1 ASN A 120 12.239 8.378 0.244 1.00 0.00 O ATOM 1758 ND2 ASN A 120 12.254 10.597 -0.103 1.00 0.00 N ATOM 0 H ASN A 120 12.346 7.291 -1.586 1.00 0.00 H new ATOM 0 HA ASN A 120 15.191 7.762 -2.121 1.00 0.00 H new ATOM 0 HB2 ASN A 120 14.781 9.808 -0.747 1.00 0.00 H new ATOM 0 HB3 ASN A 120 13.732 9.711 -2.148 1.00 0.00 H new ATOM 0 HD21 ASN A 120 11.439 10.741 0.493 1.00 0.00 H new ATOM 0 HD22 ASN A 120 12.698 11.393 -0.560 1.00 0.00 H new ATOM 1765 N SER A 121 14.578 5.921 0.137 1.00 0.00 N ATOM 1766 CA SER A 121 15.000 5.239 1.355 1.00 0.00 C ATOM 1767 C SER A 121 14.506 5.977 2.597 1.00 0.00 C ATOM 1768 O SER A 121 15.287 6.296 3.494 1.00 0.00 O ATOM 1769 CB SER A 121 16.524 5.113 1.391 1.00 0.00 C ATOM 1770 OG SER A 121 16.921 3.862 1.925 1.00 0.00 O ATOM 0 H SER A 121 14.050 5.337 -0.512 1.00 0.00 H new ATOM 0 HA SER A 121 14.560 4.242 1.353 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.925 5.225 0.384 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.944 5.919 1.993 1.00 0.00 H new ATOM 0 HG SER A 121 17.899 3.806 1.936 1.00 0.00 H new ATOM 1776 N CYS A 122 13.206 6.246 2.641 1.00 0.00 N ATOM 1777 CA CYS A 122 12.609 6.946 3.773 1.00 0.00 C ATOM 1778 C CYS A 122 11.178 6.474 4.011 1.00 0.00 C ATOM 1779 O CYS A 122 10.345 6.503 3.105 1.00 0.00 O ATOM 1780 CB CYS A 122 12.627 8.456 3.532 1.00 0.00 C ATOM 1781 SG CYS A 122 14.136 9.275 4.101 1.00 0.00 S ATOM 0 H CYS A 122 12.546 5.990 1.907 1.00 0.00 H new ATOM 0 HA CYS A 122 13.199 6.720 4.661 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.504 8.645 2.466 1.00 0.00 H new ATOM 0 HB3 CYS A 122 11.771 8.904 4.036 1.00 0.00 H new ATOM 0 HG CYS A 122 15.119 8.425 4.097 1.00 0.00 H new ATOM 1787 N PHE A 123 10.899 6.040 5.236 1.00 0.00 N ATOM 1788 CA PHE A 123 9.569 5.561 5.593 1.00 0.00 C ATOM 1789 C PHE A 123 8.540 6.682 5.485 1.00 0.00 C ATOM 1790 O PHE A 123 8.733 7.771 6.025 1.00 0.00 O ATOM 1791 CB PHE A 123 9.573 4.993 7.013 1.00 0.00 C ATOM 1792 CG PHE A 123 10.161 3.615 7.107 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.450 2.513 6.661 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.425 3.422 7.642 1.00 0.00 C ATOM 1795 CE1 PHE A 123 9.989 1.242 6.746 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.968 2.154 7.730 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.249 1.063 7.281 1.00 0.00 C ATOM 0 H PHE A 123 11.576 6.010 5.998 1.00 0.00 H new ATOM 0 HA PHE A 123 9.295 4.771 4.894 1.00 0.00 H new ATOM 0 HB2 PHE A 123 10.135 5.664 7.662 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.550 4.969 7.389 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.464 2.648 6.242 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.992 4.271 7.994 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.425 0.391 6.394 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.954 2.016 8.149 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.672 0.072 7.348 1.00 0.00 H new ATOM 1807 N ILE A 124 7.445 6.407 4.783 1.00 0.00 N ATOM 1808 CA ILE A 124 6.384 7.390 4.606 1.00 0.00 C ATOM 1809 C ILE A 124 5.665 7.670 5.921 1.00 0.00 C ATOM 1810 O ILE A 124 5.742 6.878 6.862 1.00 0.00 O ATOM 1811 CB ILE A 124 5.353 6.922 3.561 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.746 5.581 3.975 1.00 0.00 C ATOM 1813 CG2 ILE A 124 6.001 6.815 2.188 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.512 5.206 3.186 1.00 0.00 C ATOM 0 H ILE A 124 7.270 5.511 4.328 1.00 0.00 H new ATOM 0 HA ILE A 124 6.859 8.305 4.254 1.00 0.00 H new ATOM 0 HB ILE A 124 4.553 7.660 3.507 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.496 4.799 3.854 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.492 5.618 5.034 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.260 6.483 1.461 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.389 7.790 1.892 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.819 6.095 2.227 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.136 4.244 3.534 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.745 5.967 3.327 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.764 5.136 2.128 1.00 0.00 H new ATOM 1826 N ARG A 125 4.967 8.799 5.981 1.00 0.00 N ATOM 1827 CA ARG A 125 4.234 9.182 7.182 1.00 0.00 C ATOM 1828 C ARG A 125 3.382 10.421 6.927 1.00 0.00 C ATOM 1829 O ARG A 125 3.464 11.034 5.862 1.00 0.00 O ATOM 1830 CB ARG A 125 5.205 9.442 8.336 1.00 0.00 C ATOM 1831 CG ARG A 125 4.743 8.860 9.663 1.00 0.00 C ATOM 1832 CD ARG A 125 4.660 9.926 10.744 1.00 0.00 C ATOM 1833 NE ARG A 125 3.850 9.492 11.880 1.00 0.00 N ATOM 1834 CZ ARG A 125 3.327 10.323 12.778 1.00 0.00 C ATOM 1835 NH1 ARG A 125 3.526 11.632 12.677 1.00 0.00 N ATOM 1836 NH2 ARG A 125 2.602 9.846 13.780 1.00 0.00 N ATOM 0 H ARG A 125 4.893 9.465 5.212 1.00 0.00 H new ATOM 0 HA ARG A 125 3.572 8.359 7.453 1.00 0.00 H new ATOM 0 HB2 ARG A 125 6.178 9.021 8.083 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.343 10.517 8.449 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.766 8.393 9.536 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.432 8.076 9.977 1.00 0.00 H new ATOM 0 HD2 ARG A 125 5.665 10.172 11.088 1.00 0.00 H new ATOM 0 HD3 ARG A 125 4.235 10.837 10.323 1.00 0.00 H new ATOM 0 HE ARG A 125 3.675 8.493 11.991 1.00 0.00 H new ATOM 0 HH11 ARG A 125 4.082 12.005 11.908 1.00 0.00 H new ATOM 0 HH12 ARG A 125 3.122 12.264 13.368 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.445 8.842 13.863 1.00 0.00 H new ATOM 0 HH22 ARG A 125 2.201 10.483 14.468 1.00 0.00 H new ATOM 1850 N CYS A 126 2.564 10.784 7.910 1.00 0.00 N ATOM 1851 CA CYS A 126 1.696 11.950 7.791 1.00 0.00 C ATOM 1852 C CYS A 126 1.961 12.943 8.918 1.00 0.00 C ATOM 1853 O CYS A 126 2.470 12.575 9.976 1.00 0.00 O ATOM 1854 CB CYS A 126 0.228 11.521 7.807 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.257 10.606 9.290 1.00 0.00 S ATOM 0 H CYS A 126 2.484 10.288 8.797 1.00 0.00 H new ATOM 0 HA CYS A 126 1.914 12.440 6.842 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.400 12.408 7.719 1.00 0.00 H new ATOM 0 HB3 CYS A 126 0.032 10.903 6.931 1.00 0.00 H new ATOM 0 HG CYS A 126 0.544 10.908 10.268 1.00 0.00 H new ATOM 1861 N ASN A 127 1.612 14.203 8.683 1.00 0.00 N ATOM 1862 CA ASN A 127 1.810 15.251 9.677 1.00 0.00 C ATOM 1863 C ASN A 127 0.504 15.570 10.398 1.00 0.00 C ATOM 1864 O ASN A 127 -0.557 15.064 10.035 1.00 0.00 O ATOM 1865 CB ASN A 127 2.363 16.514 9.015 1.00 0.00 C ATOM 1866 CG ASN A 127 3.772 16.321 8.488 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.419 15.314 8.769 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.254 17.291 7.719 1.00 0.00 N ATOM 0 H ASN A 127 1.190 14.524 7.811 1.00 0.00 H new ATOM 0 HA ASN A 127 2.530 14.890 10.411 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.708 16.807 8.195 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.356 17.331 9.736 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.196 17.217 7.336 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.682 18.109 7.512 1.00 0.00 H new ATOM 1875 N GLU A 128 0.590 16.414 11.421 1.00 0.00 N ATOM 1876 CA GLU A 128 -0.587 16.801 12.192 1.00 0.00 C ATOM 1877 C GLU A 128 -1.496 17.713 11.376 1.00 0.00 C ATOM 1878 O GLU A 128 -2.707 17.501 11.311 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.166 17.504 13.485 1.00 0.00 C ATOM 1880 CG GLU A 128 0.755 16.670 14.360 1.00 0.00 C ATOM 1881 CD GLU A 128 0.494 16.870 15.838 1.00 0.00 C ATOM 1882 OE1 GLU A 128 0.024 17.964 16.216 1.00 0.00 O ATOM 1883 OE2 GLU A 128 0.759 15.933 16.621 1.00 0.00 O ATOM 0 H GLU A 128 1.461 16.843 11.735 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.141 15.896 12.442 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.334 18.439 13.234 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.058 17.763 14.055 1.00 0.00 H new ATOM 0 HG2 GLU A 128 0.629 15.616 14.112 1.00 0.00 H new ATOM 0 HG3 GLU A 128 1.791 16.928 14.140 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.904 18.726 10.753 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.659 19.671 9.940 1.00 0.00 C ATOM 1892 C ALA A 129 -2.371 18.961 8.792 1.00 0.00 C ATOM 1893 O ALA A 129 -3.443 19.381 8.358 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.741 20.758 9.403 1.00 0.00 C ATOM 0 H ALA A 129 0.098 18.914 10.796 1.00 0.00 H new ATOM 0 HA ALA A 129 -2.417 20.132 10.573 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -1.319 21.456 8.798 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -0.284 21.292 10.236 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.039 20.306 8.790 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.765 17.882 8.306 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.355 17.130 7.212 1.00 0.00 C ATOM 1902 C GLY A 130 -1.464 17.097 5.985 1.00 0.00 C ATOM 1903 O GLY A 130 -1.907 17.410 4.880 1.00 0.00 O ATOM 0 H GLY A 130 -0.877 17.515 8.649 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.553 16.110 7.541 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -3.316 17.572 6.948 1.00 0.00 H new ATOM 1907 N ASP A 131 -0.206 16.717 6.180 1.00 0.00 N ATOM 1908 CA ASP A 131 0.750 16.644 5.081 1.00 0.00 C ATOM 1909 C ASP A 131 1.519 15.328 5.113 1.00 0.00 C ATOM 1910 O ASP A 131 2.101 14.963 6.135 1.00 0.00 O ATOM 1911 CB ASP A 131 1.724 17.821 5.146 1.00 0.00 C ATOM 1912 CG ASP A 131 1.016 19.161 5.154 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.176 19.383 6.051 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.300 19.987 4.261 1.00 0.00 O ATOM 0 H ASP A 131 0.176 16.455 7.089 1.00 0.00 H new ATOM 0 HA ASP A 131 0.193 16.694 4.145 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.337 17.732 6.043 1.00 0.00 H new ATOM 0 HB3 ASP A 131 2.400 17.776 4.292 1.00 0.00 H new ATOM 1919 N ILE A 132 1.518 14.618 3.989 1.00 0.00 N ATOM 1920 CA ILE A 132 2.216 13.343 3.890 1.00 0.00 C ATOM 1921 C ILE A 132 3.654 13.539 3.422 1.00 0.00 C ATOM 1922 O ILE A 132 3.900 13.860 2.260 1.00 0.00 O ATOM 1923 CB ILE A 132 1.499 12.384 2.921 1.00 0.00 C ATOM 1924 CG1 ILE A 132 0.004 12.325 3.240 1.00 0.00 C ATOM 1925 CG2 ILE A 132 2.118 10.996 2.994 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.298 11.795 4.624 1.00 0.00 C ATOM 0 H ILE A 132 1.041 14.905 3.134 1.00 0.00 H new ATOM 0 HA ILE A 132 2.218 12.905 4.888 1.00 0.00 H new ATOM 0 HB ILE A 132 1.619 12.761 1.905 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -0.420 13.324 3.142 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.492 11.695 2.502 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.600 10.330 2.304 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.172 11.053 2.722 1.00 0.00 H new ATOM 0 HG23 ILE A 132 2.026 10.609 4.009 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.377 11.781 4.781 1.00 0.00 H new ATOM 0 HD12 ILE A 132 0.096 10.783 4.720 1.00 0.00 H new ATOM 0 HD13 ILE A 132 0.169 12.438 5.370 1.00 0.00 H new ATOM 1938 N GLU A 133 4.600 13.342 4.334 1.00 0.00 N ATOM 1939 CA GLU A 133 6.014 13.497 4.016 1.00 0.00 C ATOM 1940 C GLU A 133 6.767 12.189 4.234 1.00 0.00 C ATOM 1941 O GLU A 133 6.238 11.248 4.825 1.00 0.00 O ATOM 1942 CB GLU A 133 6.633 14.605 4.871 1.00 0.00 C ATOM 1943 CG GLU A 133 6.425 14.407 6.365 1.00 0.00 C ATOM 1944 CD GLU A 133 7.730 14.238 7.119 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.747 14.820 6.684 1.00 0.00 O ATOM 1946 OE2 GLU A 133 7.736 13.524 8.144 1.00 0.00 O ATOM 0 H GLU A 133 4.412 13.074 5.300 1.00 0.00 H new ATOM 0 HA GLU A 133 6.096 13.771 2.964 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.702 14.658 4.665 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.204 15.563 4.576 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.885 15.263 6.769 1.00 0.00 H new ATOM 0 HG3 GLU A 133 5.800 13.529 6.528 1.00 0.00 H new ATOM 1953 N ALA A 134 8.005 12.137 3.752 1.00 0.00 N ATOM 1954 CA ALA A 134 8.830 10.944 3.893 1.00 0.00 C ATOM 1955 C ALA A 134 9.669 11.004 5.165 1.00 0.00 C ATOM 1956 O ALA A 134 10.710 11.662 5.204 1.00 0.00 O ATOM 1957 CB ALA A 134 9.725 10.775 2.675 1.00 0.00 C ATOM 0 H ALA A 134 8.458 12.907 3.261 1.00 0.00 H new ATOM 0 HA ALA A 134 8.168 10.081 3.966 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.336 9.880 2.794 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.109 10.678 1.781 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.373 11.646 2.576 1.00 0.00 H new ATOM 1963 N LYS A 135 9.212 10.313 6.203 1.00 0.00 N ATOM 1964 CA LYS A 135 9.922 10.288 7.477 1.00 0.00 C ATOM 1965 C LYS A 135 11.315 9.692 7.311 1.00 0.00 C ATOM 1966 O LYS A 135 11.628 9.095 6.281 1.00 0.00 O ATOM 1967 CB LYS A 135 9.130 9.483 8.510 1.00 0.00 C ATOM 1968 CG LYS A 135 9.565 9.740 9.943 1.00 0.00 C ATOM 1969 CD LYS A 135 8.383 9.706 10.899 1.00 0.00 C ATOM 1970 CE LYS A 135 8.766 10.222 12.277 1.00 0.00 C ATOM 1971 NZ LYS A 135 7.576 10.397 13.154 1.00 0.00 N ATOM 0 H LYS A 135 8.353 9.763 6.188 1.00 0.00 H new ATOM 0 HA LYS A 135 10.025 11.315 7.828 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.071 9.723 8.412 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.238 8.421 8.291 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.298 8.990 10.242 1.00 0.00 H new ATOM 0 HG3 LYS A 135 10.058 10.710 10.006 1.00 0.00 H new ATOM 0 HD2 LYS A 135 7.570 10.310 10.496 1.00 0.00 H new ATOM 0 HD3 LYS A 135 8.010 8.685 10.982 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.463 9.526 12.745 1.00 0.00 H new ATOM 0 HE3 LYS A 135 9.286 11.175 12.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 7.875 10.782 14.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 6.907 11.054 12.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 7.113 9.477 13.299 1.00 0.00 H new ATOM 1985 N ASN A 136 12.151 9.859 8.332 1.00 0.00 N ATOM 1986 CA ASN A 136 13.512 9.337 8.299 1.00 0.00 C ATOM 1987 C ASN A 136 13.512 7.822 8.121 1.00 0.00 C ATOM 1988 O ASN A 136 12.455 7.199 8.024 1.00 0.00 O ATOM 1989 CB ASN A 136 14.257 9.716 9.582 1.00 0.00 C ATOM 1990 CG ASN A 136 15.565 10.429 9.302 1.00 0.00 C ATOM 1991 OD1 ASN A 136 15.587 11.631 9.038 1.00 0.00 O ATOM 1992 ND2 ASN A 136 16.666 9.687 9.357 1.00 0.00 N ATOM 0 H ASN A 136 11.909 10.352 9.192 1.00 0.00 H new ATOM 0 HA ASN A 136 14.025 9.782 7.446 1.00 0.00 H new ATOM 0 HB2 ASN A 136 13.621 10.357 10.193 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.455 8.816 10.164 1.00 0.00 H new ATOM 0 HD21 ASN A 136 17.576 10.111 9.177 1.00 0.00 H new ATOM 0 HD22 ASN A 136 16.601 8.694 9.580 1.00 0.00 H new ATOM 1999 N LYS A 137 14.704 7.236 8.077 1.00 0.00 N ATOM 2000 CA LYS A 137 14.842 5.794 7.910 1.00 0.00 C ATOM 2001 C LYS A 137 14.382 5.050 9.161 1.00 0.00 C ATOM 2002 O LYS A 137 13.913 3.915 9.081 1.00 0.00 O ATOM 2003 CB LYS A 137 16.295 5.434 7.589 1.00 0.00 C ATOM 2004 CG LYS A 137 16.522 5.064 6.132 1.00 0.00 C ATOM 2005 CD LYS A 137 17.533 3.936 5.994 1.00 0.00 C ATOM 2006 CE LYS A 137 18.914 4.368 6.460 1.00 0.00 C ATOM 2007 NZ LYS A 137 19.991 3.810 5.596 1.00 0.00 N ATOM 0 H LYS A 137 15.589 7.738 8.155 1.00 0.00 H new ATOM 0 HA LYS A 137 14.207 5.488 7.078 1.00 0.00 H new ATOM 0 HB2 LYS A 137 16.935 6.278 7.845 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.602 4.599 8.219 1.00 0.00 H new ATOM 0 HG2 LYS A 137 15.577 4.764 5.680 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.874 5.938 5.584 1.00 0.00 H new ATOM 0 HD2 LYS A 137 17.203 3.076 6.577 1.00 0.00 H new ATOM 0 HD3 LYS A 137 17.582 3.615 4.953 1.00 0.00 H new ATOM 0 HE2 LYS A 137 18.974 5.456 6.458 1.00 0.00 H new ATOM 0 HE3 LYS A 137 19.068 4.042 7.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 20.917 4.128 5.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 19.950 2.771 5.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 19.859 4.141 4.619 1.00 0.00 H new ATOM 2021 N THR A 138 14.522 5.695 10.315 1.00 0.00 N ATOM 2022 CA THR A 138 14.121 5.090 11.582 1.00 0.00 C ATOM 2023 C THR A 138 12.651 4.686 11.554 1.00 0.00 C ATOM 2024 O THR A 138 11.781 5.494 11.227 1.00 0.00 O ATOM 2025 CB THR A 138 14.373 6.058 12.740 1.00 0.00 C ATOM 2026 OG1 THR A 138 13.928 7.364 12.411 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.830 6.151 13.137 1.00 0.00 C ATOM 0 H THR A 138 14.909 6.635 10.400 1.00 0.00 H new ATOM 0 HA THR A 138 14.723 4.193 11.730 1.00 0.00 H new ATOM 0 HB THR A 138 13.811 5.653 13.582 1.00 0.00 H new ATOM 0 HG1 THR A 138 13.048 7.312 11.982 1.00 0.00 H new ATOM 0 HG21 THR A 138 15.938 6.854 13.963 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.186 5.169 13.448 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.417 6.497 12.287 1.00 0.00 H new ATOM 2035 N ALA A 139 12.381 3.432 11.897 1.00 0.00 N ATOM 2036 CA ALA A 139 11.016 2.919 11.912 1.00 0.00 C ATOM 2037 C ALA A 139 10.535 2.683 13.340 1.00 0.00 C ATOM 2038 O ALA A 139 10.829 1.651 13.943 1.00 0.00 O ATOM 2039 CB ALA A 139 10.929 1.633 11.103 1.00 0.00 C ATOM 0 H ALA A 139 13.090 2.751 12.169 1.00 0.00 H new ATOM 0 HA ALA A 139 10.366 3.666 11.457 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.905 1.260 11.122 1.00 0.00 H new ATOM 0 HB2 ALA A 139 11.224 1.831 10.073 1.00 0.00 H new ATOM 0 HB3 ALA A 139 11.595 0.886 11.534 1.00 0.00 H new ATOM 2045 N GLY A 140 9.792 3.646 13.874 1.00 0.00 N ATOM 2046 CA GLY A 140 9.280 3.524 15.227 1.00 0.00 C ATOM 2047 C GLY A 140 7.982 2.745 15.287 1.00 0.00 C ATOM 2048 O GLY A 140 7.472 2.293 14.262 1.00 0.00 O ATOM 0 H GLY A 140 9.535 4.509 13.395 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.025 3.031 15.851 1.00 0.00 H new ATOM 0 HA3 GLY A 140 9.123 4.519 15.644 1.00 0.00 H new ATOM 2052 N GLU A 141 7.444 2.586 16.493 1.00 0.00 N ATOM 2053 CA GLU A 141 6.196 1.856 16.684 1.00 0.00 C ATOM 2054 C GLU A 141 5.061 2.506 15.899 1.00 0.00 C ATOM 2055 O GLU A 141 4.332 1.834 15.170 1.00 0.00 O ATOM 2056 CB GLU A 141 5.836 1.797 18.170 1.00 0.00 C ATOM 2057 CG GLU A 141 6.726 0.864 18.974 1.00 0.00 C ATOM 2058 CD GLU A 141 6.096 0.447 20.288 1.00 0.00 C ATOM 2059 OE1 GLU A 141 5.641 1.337 21.038 1.00 0.00 O ATOM 2060 OE2 GLU A 141 6.056 -0.769 20.569 1.00 0.00 O ATOM 0 H GLU A 141 7.853 2.953 17.352 1.00 0.00 H new ATOM 0 HA GLU A 141 6.337 0.841 16.312 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.901 2.800 18.591 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.800 1.475 18.272 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.944 -0.025 18.382 1.00 0.00 H new ATOM 0 HG3 GLU A 141 7.678 1.357 19.172 1.00 0.00 H new ATOM 2067 N GLU A 142 4.917 3.818 16.054 1.00 0.00 N ATOM 2068 CA GLU A 142 3.871 4.560 15.360 1.00 0.00 C ATOM 2069 C GLU A 142 4.111 4.557 13.854 1.00 0.00 C ATOM 2070 O GLU A 142 3.166 4.604 13.065 1.00 0.00 O ATOM 2071 CB GLU A 142 3.809 5.999 15.876 1.00 0.00 C ATOM 2072 CG GLU A 142 5.147 6.720 15.828 1.00 0.00 C ATOM 2073 CD GLU A 142 5.445 7.483 17.104 1.00 0.00 C ATOM 2074 OE1 GLU A 142 4.990 7.042 18.180 1.00 0.00 O ATOM 2075 OE2 GLU A 142 6.131 8.524 17.027 1.00 0.00 O ATOM 0 H GLU A 142 5.512 4.389 16.654 1.00 0.00 H new ATOM 0 HA GLU A 142 2.918 4.069 15.559 1.00 0.00 H new ATOM 0 HB2 GLU A 142 3.083 6.557 15.285 1.00 0.00 H new ATOM 0 HB3 GLU A 142 3.446 5.993 16.904 1.00 0.00 H new ATOM 0 HG2 GLU A 142 5.940 5.994 15.650 1.00 0.00 H new ATOM 0 HG3 GLU A 142 5.153 7.412 14.986 1.00 0.00 H new ATOM 2082 N GLU A 143 5.379 4.503 13.461 1.00 0.00 N ATOM 2083 CA GLU A 143 5.744 4.496 12.049 1.00 0.00 C ATOM 2084 C GLU A 143 5.114 3.305 11.329 1.00 0.00 C ATOM 2085 O GLU A 143 4.800 3.382 10.141 1.00 0.00 O ATOM 2086 CB GLU A 143 7.266 4.453 11.893 1.00 0.00 C ATOM 2087 CG GLU A 143 7.900 5.828 11.754 1.00 0.00 C ATOM 2088 CD GLU A 143 7.765 6.662 13.013 1.00 0.00 C ATOM 2089 OE1 GLU A 143 8.603 6.501 13.925 1.00 0.00 O ATOM 2090 OE2 GLU A 143 6.823 7.478 13.085 1.00 0.00 O ATOM 0 H GLU A 143 6.172 4.463 14.101 1.00 0.00 H new ATOM 0 HA GLU A 143 5.365 5.413 11.598 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.698 3.948 12.757 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.517 3.856 11.016 1.00 0.00 H new ATOM 0 HG2 GLU A 143 8.956 5.714 11.510 1.00 0.00 H new ATOM 0 HG3 GLU A 143 7.435 6.356 10.921 1.00 0.00 H new ATOM 2097 N MET A 144 4.933 2.209 12.058 1.00 0.00 N ATOM 2098 CA MET A 144 4.342 1.003 11.488 1.00 0.00 C ATOM 2099 C MET A 144 2.934 1.281 10.969 1.00 0.00 C ATOM 2100 O MET A 144 2.213 2.116 11.516 1.00 0.00 O ATOM 2101 CB MET A 144 4.301 -0.113 12.534 1.00 0.00 C ATOM 2102 CG MET A 144 5.677 -0.602 12.954 1.00 0.00 C ATOM 2103 SD MET A 144 6.180 -2.096 12.077 1.00 0.00 S ATOM 2104 CE MET A 144 7.941 -1.816 11.912 1.00 0.00 C ATOM 0 H MET A 144 5.186 2.131 13.043 1.00 0.00 H new ATOM 0 HA MET A 144 4.963 0.684 10.651 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.767 0.245 13.414 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.732 -0.953 12.135 1.00 0.00 H new ATOM 0 HG2 MET A 144 6.409 0.185 12.773 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.677 -0.797 14.026 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.396 -2.657 11.388 1.00 0.00 H new ATOM 0 HE2 MET A 144 8.112 -0.900 11.346 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.388 -1.720 12.901 1.00 0.00 H new ATOM 2114 N ILE A 145 2.549 0.575 9.910 1.00 0.00 N ATOM 2115 CA ILE A 145 1.229 0.745 9.318 1.00 0.00 C ATOM 2116 C ILE A 145 0.570 -0.603 9.047 1.00 0.00 C ATOM 2117 O ILE A 145 1.183 -1.654 9.235 1.00 0.00 O ATOM 2118 CB ILE A 145 1.302 1.541 8.001 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.347 0.929 7.066 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.623 3.001 8.281 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.127 1.268 5.608 1.00 0.00 C ATOM 0 H ILE A 145 3.133 -0.120 9.445 1.00 0.00 H new ATOM 0 HA ILE A 145 0.629 1.302 10.038 1.00 0.00 H new ATOM 0 HB ILE A 145 0.330 1.491 7.510 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.337 1.274 7.365 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.338 -0.155 7.184 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.671 3.550 7.340 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.845 3.430 8.912 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.584 3.071 8.791 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.905 0.801 5.004 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.151 0.899 5.292 1.00 0.00 H new ATOM 0 HD13 ILE A 145 2.166 2.349 5.476 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.683 -0.566 8.603 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.425 -1.785 8.306 1.00 0.00 C ATOM 2135 C LYS A 146 -1.988 -1.747 6.888 1.00 0.00 C ATOM 2136 O LYS A 146 -2.956 -1.040 6.614 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.561 -1.974 9.312 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.095 -2.487 10.666 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.089 -3.471 11.261 1.00 0.00 C ATOM 2140 CE LYS A 146 -3.236 -3.275 12.762 1.00 0.00 C ATOM 2141 NZ LYS A 146 -1.915 -3.203 13.444 1.00 0.00 N ATOM 0 H LYS A 146 -1.205 0.295 8.441 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.737 -2.627 8.383 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.075 -1.023 9.450 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.289 -2.672 8.899 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.124 -2.970 10.559 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -1.960 -1.647 11.348 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -4.059 -3.346 10.780 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -2.761 -4.490 11.056 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -3.795 -2.359 12.956 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -3.816 -4.097 13.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -2.021 -3.491 14.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -1.244 -3.840 12.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -1.556 -2.228 13.403 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.373 -2.512 5.993 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.812 -2.566 4.603 1.00 0.00 C ATOM 2157 C ILE A 147 -2.864 -3.651 4.401 1.00 0.00 C ATOM 2158 O ILE A 147 -2.607 -4.831 4.637 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.631 -2.829 3.650 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.528 -1.881 3.965 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.073 -2.672 2.203 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.845 -2.312 3.355 1.00 0.00 C ATOM 0 H ILE A 147 -0.569 -3.103 6.205 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.247 -1.594 4.371 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.287 -3.853 3.795 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.279 -0.883 3.604 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.644 -1.809 5.046 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.227 -2.861 1.542 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -1.869 -3.384 1.986 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.440 -1.658 2.042 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.621 -1.594 3.620 1.00 0.00 H new ATOM 0 HD12 ILE A 147 2.117 -3.297 3.735 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.746 -2.356 2.270 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.050 -3.242 3.962 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.142 -4.180 3.727 1.00 0.00 C ATOM 2176 C ARG A 148 -5.340 -4.422 2.234 1.00 0.00 C ATOM 2177 O ARG A 148 -4.889 -3.635 1.403 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.438 -3.652 4.346 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.390 -3.547 5.862 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.254 -2.405 6.370 1.00 0.00 C ATOM 2181 NE ARG A 148 -6.607 -1.667 7.451 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.558 -2.090 8.713 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -7.117 -3.245 9.055 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -5.948 -1.357 9.634 1.00 0.00 N ATOM 0 H ARG A 148 -4.279 -2.268 3.762 1.00 0.00 H new ATOM 0 HA ARG A 148 -4.881 -5.127 4.199 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.656 -2.669 3.929 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.260 -4.308 4.061 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.728 -4.484 6.303 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.360 -3.396 6.185 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.475 -1.724 5.548 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.207 -2.800 6.721 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.167 -0.775 7.226 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.587 -3.813 8.350 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -7.077 -3.564 10.023 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -5.516 -0.470 9.376 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -5.910 -1.681 10.601 1.00 0.00 H new ATOM 2198 N SER A 149 -6.019 -5.516 1.902 1.00 0.00 N ATOM 2199 CA SER A 149 -6.276 -5.862 0.510 1.00 0.00 C ATOM 2200 C SER A 149 -7.648 -6.511 0.356 1.00 0.00 C ATOM 2201 O SER A 149 -8.088 -7.269 1.219 1.00 0.00 O ATOM 2202 CB SER A 149 -5.192 -6.805 -0.013 1.00 0.00 C ATOM 2203 OG SER A 149 -5.203 -6.863 -1.428 1.00 0.00 O ATOM 0 H SER A 149 -6.401 -6.177 2.578 1.00 0.00 H new ATOM 0 HA SER A 149 -6.260 -4.943 -0.075 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.215 -6.467 0.332 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.347 -7.804 0.396 1.00 0.00 H new ATOM 0 HG SER A 149 -4.499 -7.471 -1.736 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.321 -6.206 -0.750 1.00 0.00 N ATOM 2210 CA CYS A 150 -9.643 -6.758 -1.017 1.00 0.00 C ATOM 2211 C CYS A 150 -9.594 -7.749 -2.175 1.00 0.00 C ATOM 2212 O CYS A 150 -10.552 -7.877 -2.937 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.634 -5.636 -1.334 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.154 -4.603 -2.739 1.00 0.00 S ATOM 0 H CYS A 150 -7.971 -5.579 -1.475 1.00 0.00 H new ATOM 0 HA CYS A 150 -9.976 -7.285 -0.123 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.611 -6.075 -1.536 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.745 -5.004 -0.453 1.00 0.00 H new ATOM 0 HG CYS A 150 -9.740 -3.449 -2.308 1.00 0.00 H new ATOM 2220 N ALA A 151 -8.472 -8.450 -2.301 1.00 0.00 N ATOM 2221 CA ALA A 151 -8.298 -9.431 -3.366 1.00 0.00 C ATOM 2222 C ALA A 151 -9.160 -10.665 -3.122 1.00 0.00 C ATOM 2223 O ALA A 151 -9.357 -11.081 -1.981 1.00 0.00 O ATOM 2224 CB ALA A 151 -6.833 -9.823 -3.487 1.00 0.00 C ATOM 0 H ALA A 151 -7.669 -8.357 -1.679 1.00 0.00 H new ATOM 0 HA ALA A 151 -8.620 -8.976 -4.303 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -6.717 -10.556 -4.286 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -6.238 -8.939 -3.716 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -6.493 -10.255 -2.546 1.00 0.00 H new