USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0117 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN :FLIP amide:sc= 0 F(o=-0.98,f=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -153:sc= -3.48! (180deg=-5.9!) USER MOD Single : A 33 LYS NZ :NH3+ 152:sc= 0.712 (180deg=0.33) USER MOD Single : A 36 TYR OH : rot -81:sc= 0.101 USER MOD Single : A 38 HIS : no HD1:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 42 ASN : amide:sc= -3.24! C(o=-3.2!,f=-9.9!) USER MOD Single : A 46 THR OG1 : rot 82:sc= -0.25 USER MOD Single : A 51 HIS : no HD1:sc= -0.0269 X(o=-0.027,f=-0.014) USER MOD Single : A 59 SER OG : rot 134:sc= 1.17 USER MOD Single : A 63 GLN : amide:sc= 0.653 K(o=0.65,f=-0.49) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 30:sc= 1.25 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 160:sc= 0.103 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= -1.98 K(o=-2,f=-5.2!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot -118:sc= 0.00255 USER MOD Single : A 104 GLN : amide:sc= -1.07 K(o=-1.1,f=-1.7) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0217) USER MOD Single : A 114 MET CE :methyl -136:sc= -1.36 (180deg=-2.22) USER MOD Single : A 119 SER OG : rot -24:sc= 0.317 USER MOD Single : A 120 ASN : amide:sc= -0.593 X(o=-0.59,f=-1.1) USER MOD Single : A 121 SER OG : rot -60:sc= 0.735 USER MOD Single : A 122 CYS SG : rot 68:sc= 0.404 USER MOD Single : A 126 CYS SG : rot 130:sc= -1.4 USER MOD Single : A 127 ASN : amide:sc= 0.0912 X(o=0.091,f=-0.15) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= 0.00303 K(o=0.003,f=-2.9!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 47:sc= 0.0747 USER MOD Single : A 144 MET CE :methyl -155:sc= -1.09 (180deg=-1.7!) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot -129:sc= 0.2 USER MOD Single : A 150 CYS SG : rot -121:sc= 0.952 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -6.656 -10.118 10.231 1.00 0.00 N ATOM 88 CA ASP A 9 -7.763 -9.206 10.497 1.00 0.00 C ATOM 89 C ASP A 9 -8.600 -8.985 9.241 1.00 0.00 C ATOM 90 O ASP A 9 -8.074 -8.619 8.190 1.00 0.00 O ATOM 91 CB ASP A 9 -7.235 -7.868 11.015 1.00 0.00 C ATOM 92 CG ASP A 9 -7.160 -7.823 12.528 1.00 0.00 C ATOM 93 OD1 ASP A 9 -8.208 -7.599 13.168 1.00 0.00 O ATOM 94 OD2 ASP A 9 -6.052 -8.012 13.073 1.00 0.00 O ATOM 0 HA ASP A 9 -8.398 -9.657 11.259 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -6.244 -7.686 10.599 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -7.881 -7.064 10.662 1.00 0.00 H new ATOM 99 N ILE A 10 -9.904 -9.211 9.357 1.00 0.00 N ATOM 100 CA ILE A 10 -10.813 -9.038 8.231 1.00 0.00 C ATOM 101 C ILE A 10 -11.995 -8.150 8.611 1.00 0.00 C ATOM 102 O ILE A 10 -12.716 -8.436 9.569 1.00 0.00 O ATOM 103 CB ILE A 10 -11.339 -10.394 7.719 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.206 -10.196 6.473 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.123 -11.107 8.810 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.002 -11.264 5.421 1.00 0.00 C ATOM 0 H ILE A 10 -10.355 -9.515 10.220 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.245 -8.557 7.435 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.486 -11.016 7.448 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.255 -10.183 6.768 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.986 -9.221 6.038 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.487 -12.062 8.431 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.475 -11.280 9.669 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.969 -10.490 9.112 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.648 -11.061 4.566 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -10.961 -11.262 5.098 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -12.250 -12.239 5.840 1.00 0.00 H new ATOM 118 N VAL A 11 -12.189 -7.075 7.854 1.00 0.00 N ATOM 119 CA VAL A 11 -13.284 -6.147 8.110 1.00 0.00 C ATOM 120 C VAL A 11 -14.186 -6.014 6.888 1.00 0.00 C ATOM 121 O VAL A 11 -13.827 -5.359 5.908 1.00 0.00 O ATOM 122 CB VAL A 11 -12.759 -4.753 8.503 1.00 0.00 C ATOM 123 CG1 VAL A 11 -13.907 -3.843 8.914 1.00 0.00 C ATOM 124 CG2 VAL A 11 -11.732 -4.861 9.621 1.00 0.00 C ATOM 0 H VAL A 11 -11.602 -6.825 7.058 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.859 -6.556 8.940 1.00 0.00 H new ATOM 0 HB VAL A 11 -12.271 -4.314 7.633 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -13.515 -2.864 9.188 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -14.602 -3.736 8.081 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -14.428 -4.277 9.768 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.374 -3.866 9.884 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.192 -5.323 10.494 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.893 -5.472 9.287 1.00 0.00 H new ATOM 134 N GLY A 12 -15.358 -6.638 6.951 1.00 0.00 N ATOM 135 CA GLY A 12 -16.291 -6.576 5.842 1.00 0.00 C ATOM 136 C GLY A 12 -15.769 -7.280 4.605 1.00 0.00 C ATOM 137 O GLY A 12 -16.180 -8.400 4.299 1.00 0.00 O ATOM 0 H GLY A 12 -15.678 -7.185 7.750 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -17.237 -7.028 6.141 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.497 -5.533 5.603 1.00 0.00 H new ATOM 141 N ILE A 13 -14.861 -6.623 3.892 1.00 0.00 N ATOM 142 CA ILE A 13 -14.281 -7.192 2.681 1.00 0.00 C ATOM 143 C ILE A 13 -12.824 -6.772 2.519 1.00 0.00 C ATOM 144 O ILE A 13 -12.323 -6.652 1.401 1.00 0.00 O ATOM 145 CB ILE A 13 -15.069 -6.768 1.426 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.087 -5.243 1.295 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.486 -7.321 1.480 1.00 0.00 C ATOM 148 CD1 ILE A 13 -14.465 -4.741 0.010 1.00 0.00 C ATOM 0 H ILE A 13 -14.511 -5.696 4.132 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.335 -8.276 2.785 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.573 -7.180 0.547 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.118 -4.893 1.351 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.556 -4.807 2.141 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.031 -7.014 0.587 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.450 -8.409 1.526 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -16.993 -6.937 2.365 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -14.512 -3.652 -0.016 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -13.424 -5.061 -0.039 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.010 -5.148 -0.841 1.00 0.00 H new ATOM 160 N TRP A 14 -12.150 -6.549 3.643 1.00 0.00 N ATOM 161 CA TRP A 14 -10.750 -6.142 3.626 1.00 0.00 C ATOM 162 C TRP A 14 -9.930 -6.976 4.605 1.00 0.00 C ATOM 163 O TRP A 14 -10.230 -7.025 5.797 1.00 0.00 O ATOM 164 CB TRP A 14 -10.625 -4.657 3.974 1.00 0.00 C ATOM 165 CG TRP A 14 -11.303 -3.756 2.988 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.623 -3.411 2.965 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.693 -3.086 1.879 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.873 -2.566 1.910 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.702 -2.352 1.229 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.391 -3.034 1.373 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.451 -1.577 0.099 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.142 -2.264 0.252 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.167 -1.545 -0.373 1.00 0.00 C ATOM 0 H TRP A 14 -12.551 -6.643 4.576 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.361 -6.307 2.621 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -11.050 -4.486 4.963 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.569 -4.392 4.031 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.364 -3.752 3.673 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.780 -2.164 1.673 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.594 -3.585 1.849 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.240 -1.022 -0.386 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.140 -2.217 -0.148 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -9.940 -0.952 -1.247 1.00 0.00 H new ATOM 184 N TRP A 15 -8.893 -7.631 4.092 1.00 0.00 N ATOM 185 CA TRP A 15 -8.029 -8.463 4.921 1.00 0.00 C ATOM 186 C TRP A 15 -6.574 -8.026 4.800 1.00 0.00 C ATOM 187 O TRP A 15 -6.108 -7.676 3.715 1.00 0.00 O ATOM 188 CB TRP A 15 -8.167 -9.934 4.521 1.00 0.00 C ATOM 189 CG TRP A 15 -8.024 -10.164 3.046 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.028 -10.205 2.123 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.806 -10.386 2.327 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.510 -10.439 0.873 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.148 -10.554 0.971 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.460 -10.458 2.696 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.191 -10.789 -0.014 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.512 -10.693 1.718 1.00 0.00 C ATOM 197 CH2 TRP A 15 -4.882 -10.856 0.377 1.00 0.00 C ATOM 0 H TRP A 15 -8.631 -7.601 3.107 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.340 -8.345 5.959 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.413 -10.519 5.048 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.140 -10.302 4.846 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.077 -10.073 2.343 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.051 -10.515 0.012 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.166 -10.332 3.727 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.473 -10.914 -1.049 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.469 -10.752 1.992 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.118 -11.038 -0.364 1.00 0.00 H new ATOM 208 N THR A 16 -5.859 -8.047 5.920 1.00 0.00 N ATOM 209 CA THR A 16 -4.456 -7.653 5.941 1.00 0.00 C ATOM 210 C THR A 16 -3.578 -8.731 5.313 1.00 0.00 C ATOM 211 O THR A 16 -3.821 -9.925 5.493 1.00 0.00 O ATOM 212 CB THR A 16 -4.001 -7.381 7.375 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.059 -6.831 8.140 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.830 -6.426 7.461 1.00 0.00 C ATOM 0 H THR A 16 -6.229 -8.333 6.826 1.00 0.00 H new ATOM 0 HA THR A 16 -4.354 -6.739 5.356 1.00 0.00 H new ATOM 0 HB THR A 16 -3.690 -8.349 7.768 1.00 0.00 H new ATOM 0 HG1 THR A 16 -4.749 -6.665 9.055 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.558 -6.277 8.506 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.980 -6.843 6.921 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.107 -5.469 7.018 1.00 0.00 H new ATOM 222 N VAL A 17 -2.559 -8.302 4.575 1.00 0.00 N ATOM 223 CA VAL A 17 -1.645 -9.232 3.921 1.00 0.00 C ATOM 224 C VAL A 17 -0.576 -9.725 4.889 1.00 0.00 C ATOM 225 O VAL A 17 -0.488 -9.254 6.024 1.00 0.00 O ATOM 226 CB VAL A 17 -0.959 -8.583 2.705 1.00 0.00 C ATOM 227 CG1 VAL A 17 -1.977 -8.265 1.621 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.207 -7.329 3.124 1.00 0.00 C ATOM 0 H VAL A 17 -2.346 -7.318 4.415 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.244 -10.078 3.583 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.240 -9.293 2.296 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.472 -7.807 0.771 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.466 -9.185 1.300 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.724 -7.575 2.014 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.272 -6.883 2.252 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.905 -6.614 3.559 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.552 -7.589 3.861 1.00 0.00 H new ATOM 238 N SER A 18 0.234 -10.674 4.435 1.00 0.00 N ATOM 239 CA SER A 18 1.299 -11.232 5.262 1.00 0.00 C ATOM 240 C SER A 18 2.642 -11.158 4.541 1.00 0.00 C ATOM 241 O SER A 18 3.652 -10.773 5.129 1.00 0.00 O ATOM 242 CB SER A 18 0.979 -12.683 5.630 1.00 0.00 C ATOM 243 OG SER A 18 0.755 -12.818 7.023 1.00 0.00 O ATOM 0 H SER A 18 0.174 -11.074 3.499 1.00 0.00 H new ATOM 0 HA SER A 18 1.366 -10.641 6.175 1.00 0.00 H new ATOM 0 HB2 SER A 18 0.096 -13.014 5.083 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.803 -13.329 5.327 1.00 0.00 H new ATOM 0 HG SER A 18 0.551 -13.753 7.232 1.00 0.00 H new ATOM 249 N ASN A 19 2.644 -11.529 3.265 1.00 0.00 N ATOM 250 CA ASN A 19 3.863 -11.504 2.464 1.00 0.00 C ATOM 251 C ASN A 19 3.644 -10.739 1.163 1.00 0.00 C ATOM 252 O ASN A 19 2.510 -10.444 0.788 1.00 0.00 O ATOM 253 CB ASN A 19 4.332 -12.929 2.158 1.00 0.00 C ATOM 254 CG ASN A 19 3.188 -13.850 1.780 1.00 0.00 C ATOM 255 OD1 ASN A 19 2.774 -13.794 0.520 1.00 0.00 O flip ATOM 256 ND2 ASN A 19 2.681 -14.604 2.612 1.00 0.00 N flip ATOM 0 H ASN A 19 1.816 -11.850 2.763 1.00 0.00 H new ATOM 0 HA ASN A 19 4.634 -10.993 3.041 1.00 0.00 H new ATOM 0 HB2 ASN A 19 5.056 -12.902 1.344 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.847 -13.333 3.030 1.00 0.00 H new ATOM 0 HD21 ASN A 19 3.030 -14.615 3.570 1.00 0.00 H new ATOM 0 HD22 ASN A 19 1.912 -15.217 2.343 1.00 0.00 H new ATOM 263 N PHE A 20 4.739 -10.419 0.480 1.00 0.00 N ATOM 264 CA PHE A 20 4.670 -9.687 -0.778 1.00 0.00 C ATOM 265 C PHE A 20 3.894 -10.477 -1.828 1.00 0.00 C ATOM 266 O PHE A 20 3.174 -9.902 -2.645 1.00 0.00 O ATOM 267 CB PHE A 20 6.078 -9.383 -1.292 1.00 0.00 C ATOM 268 CG PHE A 20 6.095 -8.553 -2.544 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.948 -7.177 -2.481 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.255 -9.150 -3.784 1.00 0.00 C ATOM 271 CE1 PHE A 20 5.962 -6.411 -3.630 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.270 -8.390 -4.938 1.00 0.00 C ATOM 273 CZ PHE A 20 6.123 -7.018 -4.861 1.00 0.00 C ATOM 0 H PHE A 20 5.685 -10.656 0.778 1.00 0.00 H new ATOM 0 HA PHE A 20 4.145 -8.749 -0.594 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.635 -8.862 -0.513 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.597 -10.322 -1.482 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.821 -6.697 -1.522 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.369 -10.222 -3.849 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.847 -5.339 -3.567 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.396 -8.867 -5.898 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.134 -6.421 -5.761 1.00 0.00 H new ATOM 283 N GLY A 21 4.044 -11.797 -1.799 1.00 0.00 N ATOM 284 CA GLY A 21 3.352 -12.645 -2.754 1.00 0.00 C ATOM 285 C GLY A 21 1.848 -12.450 -2.721 1.00 0.00 C ATOM 286 O GLY A 21 1.163 -12.690 -3.715 1.00 0.00 O ATOM 0 H GLY A 21 4.632 -12.296 -1.131 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.721 -12.433 -3.758 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.584 -13.689 -2.543 1.00 0.00 H new ATOM 290 N GLU A 22 1.333 -12.016 -1.575 1.00 0.00 N ATOM 291 CA GLU A 22 -0.100 -11.791 -1.419 1.00 0.00 C ATOM 292 C GLU A 22 -0.476 -10.367 -1.818 1.00 0.00 C ATOM 293 O GLU A 22 -1.598 -10.112 -2.258 1.00 0.00 O ATOM 294 CB GLU A 22 -0.524 -12.056 0.027 1.00 0.00 C ATOM 295 CG GLU A 22 -0.601 -13.533 0.377 1.00 0.00 C ATOM 296 CD GLU A 22 -1.975 -14.121 0.128 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.932 -13.703 0.813 1.00 0.00 O ATOM 298 OE2 GLU A 22 -2.095 -15.001 -0.751 1.00 0.00 O ATOM 0 H GLU A 22 1.885 -11.813 -0.742 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.624 -12.483 -2.078 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.182 -11.568 0.699 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.498 -11.599 0.201 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.136 -14.080 -0.210 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.337 -13.668 1.426 1.00 0.00 H new ATOM 305 N ILE A 23 0.467 -9.444 -1.664 1.00 0.00 N ATOM 306 CA ILE A 23 0.232 -8.047 -2.010 1.00 0.00 C ATOM 307 C ILE A 23 0.011 -7.884 -3.510 1.00 0.00 C ATOM 308 O ILE A 23 0.949 -7.980 -4.300 1.00 0.00 O ATOM 309 CB ILE A 23 1.410 -7.153 -1.573 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.723 -7.368 -0.091 1.00 0.00 C ATOM 311 CG2 ILE A 23 1.096 -5.688 -1.844 1.00 0.00 C ATOM 312 CD1 ILE A 23 3.018 -6.725 0.353 1.00 0.00 C ATOM 0 H ILE A 23 1.401 -9.638 -1.302 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.666 -7.735 -1.477 1.00 0.00 H new ATOM 0 HB ILE A 23 2.289 -7.431 -2.155 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.904 -6.967 0.507 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.771 -8.438 0.110 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.938 -5.071 -1.530 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.919 -5.545 -2.910 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.205 -5.398 -1.287 1.00 0.00 H new ATOM 0 HD11 ILE A 23 3.175 -6.918 1.414 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.847 -7.143 -0.219 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.967 -5.649 0.184 1.00 0.00 H new ATOM 324 N SER A 24 -1.237 -7.636 -3.895 1.00 0.00 N ATOM 325 CA SER A 24 -1.583 -7.458 -5.300 1.00 0.00 C ATOM 326 C SER A 24 -3.032 -7.005 -5.451 1.00 0.00 C ATOM 327 O SER A 24 -3.903 -7.416 -4.685 1.00 0.00 O ATOM 328 CB SER A 24 -1.363 -8.761 -6.070 1.00 0.00 C ATOM 329 OG SER A 24 -1.646 -8.594 -7.449 1.00 0.00 O ATOM 0 H SER A 24 -2.025 -7.554 -3.253 1.00 0.00 H new ATOM 0 HA SER A 24 -0.934 -6.685 -5.712 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.332 -9.091 -5.945 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.000 -9.543 -5.657 1.00 0.00 H new ATOM 0 HG SER A 24 -1.496 -9.441 -7.919 1.00 0.00 H new ATOM 335 N GLY A 25 -3.281 -6.156 -6.442 1.00 0.00 N ATOM 336 CA GLY A 25 -4.625 -5.661 -6.674 1.00 0.00 C ATOM 337 C GLY A 25 -4.909 -4.377 -5.920 1.00 0.00 C ATOM 338 O GLY A 25 -4.009 -3.568 -5.697 1.00 0.00 O ATOM 0 H GLY A 25 -2.576 -5.802 -7.089 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.767 -5.491 -7.741 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.346 -6.422 -6.374 1.00 0.00 H new ATOM 342 N THR A 26 -6.164 -4.191 -5.525 1.00 0.00 N ATOM 343 CA THR A 26 -6.565 -2.996 -4.791 1.00 0.00 C ATOM 344 C THR A 26 -6.340 -3.176 -3.293 1.00 0.00 C ATOM 345 O THR A 26 -6.983 -4.010 -2.655 1.00 0.00 O ATOM 346 CB THR A 26 -8.036 -2.676 -5.062 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.370 -2.960 -6.410 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.392 -1.229 -4.797 1.00 0.00 C ATOM 0 H THR A 26 -6.921 -4.852 -5.701 1.00 0.00 H new ATOM 0 HA THR A 26 -5.949 -2.165 -5.135 1.00 0.00 H new ATOM 0 HB THR A 26 -8.601 -3.305 -4.373 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.315 -2.751 -6.564 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.449 -1.070 -5.009 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.191 -0.990 -3.753 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.792 -0.583 -5.438 1.00 0.00 H new ATOM 356 N ILE A 27 -5.423 -2.391 -2.739 1.00 0.00 N ATOM 357 CA ILE A 27 -5.112 -2.463 -1.317 1.00 0.00 C ATOM 358 C ILE A 27 -5.162 -1.082 -0.673 1.00 0.00 C ATOM 359 O ILE A 27 -4.712 -0.097 -1.257 1.00 0.00 O ATOM 360 CB ILE A 27 -3.720 -3.078 -1.077 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.660 -2.328 -1.886 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.723 -4.555 -1.437 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.293 -2.327 -1.237 1.00 0.00 C ATOM 0 H ILE A 27 -4.882 -1.697 -3.254 1.00 0.00 H new ATOM 0 HA ILE A 27 -5.868 -3.102 -0.860 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.476 -2.984 -0.019 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.583 -2.779 -2.875 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -2.986 -1.298 -2.030 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.732 -4.974 -1.262 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.453 -5.078 -0.820 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.986 -4.673 -2.488 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.592 -1.778 -1.866 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.355 -1.849 -0.259 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -0.946 -3.353 -1.118 1.00 0.00 H new ATOM 375 N ALA A 28 -5.713 -1.018 0.535 1.00 0.00 N ATOM 376 CA ALA A 28 -5.822 0.243 1.259 1.00 0.00 C ATOM 377 C ALA A 28 -4.723 0.370 2.309 1.00 0.00 C ATOM 378 O ALA A 28 -4.196 -0.632 2.794 1.00 0.00 O ATOM 379 CB ALA A 28 -7.192 0.359 1.911 1.00 0.00 C ATOM 0 H ALA A 28 -6.091 -1.824 1.033 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.701 1.056 0.544 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.260 1.305 2.448 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.965 0.321 1.143 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.334 -0.466 2.609 1.00 0.00 H new ATOM 385 N ILE A 29 -4.382 1.607 2.656 1.00 0.00 N ATOM 386 CA ILE A 29 -3.346 1.865 3.649 1.00 0.00 C ATOM 387 C ILE A 29 -3.846 2.816 4.730 1.00 0.00 C ATOM 388 O ILE A 29 -4.405 3.872 4.431 1.00 0.00 O ATOM 389 CB ILE A 29 -2.083 2.461 3.001 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.666 1.633 1.783 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.950 2.531 4.015 1.00 0.00 C ATOM 392 CD1 ILE A 29 -2.077 2.249 0.465 1.00 0.00 C ATOM 0 H ILE A 29 -4.808 2.447 2.264 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.095 0.905 4.101 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.309 3.474 2.667 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.583 1.506 1.794 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.105 0.638 1.862 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.064 2.954 3.542 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.250 3.160 4.853 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.724 1.528 4.377 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.749 1.609 -0.354 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -3.162 2.351 0.434 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.617 3.232 0.364 1.00 0.00 H new ATOM 404 N GLU A 30 -3.643 2.436 5.986 1.00 0.00 N ATOM 405 CA GLU A 30 -4.072 3.256 7.114 1.00 0.00 C ATOM 406 C GLU A 30 -2.874 3.732 7.927 1.00 0.00 C ATOM 407 O GLU A 30 -2.155 2.928 8.520 1.00 0.00 O ATOM 408 CB GLU A 30 -5.031 2.467 8.007 1.00 0.00 C ATOM 409 CG GLU A 30 -5.777 3.331 9.011 1.00 0.00 C ATOM 410 CD GLU A 30 -6.339 2.527 10.167 1.00 0.00 C ATOM 411 OE1 GLU A 30 -5.548 2.116 11.043 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.568 2.310 10.198 1.00 0.00 O ATOM 0 H GLU A 30 -3.184 1.564 6.250 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.590 4.131 6.721 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.755 1.947 7.379 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.469 1.703 8.544 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.103 4.095 9.398 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.591 3.850 8.505 1.00 0.00 H new ATOM 419 N MET A 31 -2.666 5.045 7.953 1.00 0.00 N ATOM 420 CA MET A 31 -1.555 5.629 8.695 1.00 0.00 C ATOM 421 C MET A 31 -1.927 5.832 10.161 1.00 0.00 C ATOM 422 O MET A 31 -1.299 5.265 11.055 1.00 0.00 O ATOM 423 CB MET A 31 -1.144 6.965 8.071 1.00 0.00 C ATOM 424 CG MET A 31 -0.508 6.823 6.698 1.00 0.00 C ATOM 425 SD MET A 31 -0.098 8.415 5.956 1.00 0.00 S ATOM 426 CE MET A 31 1.436 8.015 5.122 1.00 0.00 C ATOM 0 H MET A 31 -3.253 5.724 7.469 1.00 0.00 H new ATOM 0 HA MET A 31 -0.713 4.938 8.645 1.00 0.00 H new ATOM 0 HB2 MET A 31 -2.023 7.605 7.991 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.443 7.468 8.737 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.397 6.221 6.781 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.190 6.284 6.040 1.00 0.00 H new ATOM 0 HE1 MET A 31 2.047 8.913 5.034 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.977 7.262 5.696 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.219 7.626 4.127 1.00 0.00 H new ATOM 436 N ASP A 32 -2.951 6.645 10.399 1.00 0.00 N ATOM 437 CA ASP A 32 -3.407 6.923 11.756 1.00 0.00 C ATOM 438 C ASP A 32 -4.437 5.891 12.205 1.00 0.00 C ATOM 439 O ASP A 32 -4.836 5.020 11.432 1.00 0.00 O ATOM 440 CB ASP A 32 -4.004 8.329 11.838 1.00 0.00 C ATOM 441 CG ASP A 32 -3.031 9.338 12.416 1.00 0.00 C ATOM 442 OD1 ASP A 32 -2.192 8.941 13.252 1.00 0.00 O ATOM 443 OD2 ASP A 32 -3.108 10.524 12.034 1.00 0.00 O ATOM 0 H ASP A 32 -3.481 7.123 9.670 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.546 6.863 12.422 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -4.307 8.651 10.842 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -4.904 8.303 12.452 1.00 0.00 H new ATOM 448 N LYS A 33 -4.862 5.995 13.459 1.00 0.00 N ATOM 449 CA LYS A 33 -5.846 5.071 14.012 1.00 0.00 C ATOM 450 C LYS A 33 -7.247 5.397 13.503 1.00 0.00 C ATOM 451 O LYS A 33 -8.033 6.048 14.192 1.00 0.00 O ATOM 452 CB LYS A 33 -5.823 5.122 15.541 1.00 0.00 C ATOM 453 CG LYS A 33 -4.429 4.991 16.132 1.00 0.00 C ATOM 454 CD LYS A 33 -3.906 6.329 16.631 1.00 0.00 C ATOM 455 CE LYS A 33 -2.425 6.494 16.334 1.00 0.00 C ATOM 456 NZ LYS A 33 -2.079 7.902 15.995 1.00 0.00 N ATOM 0 H LYS A 33 -4.541 6.710 14.112 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.585 4.065 13.684 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.262 6.063 15.872 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.451 4.322 15.933 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.448 4.277 16.955 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.750 4.592 15.379 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.465 7.138 16.160 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.074 6.409 17.705 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.844 6.176 17.199 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -2.146 5.842 15.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.090 8.089 16.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.200 8.053 14.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.704 8.548 16.517 1.00 0.00 H new ATOM 470 N GLY A 34 -7.553 4.942 12.292 1.00 0.00 N ATOM 471 CA GLY A 34 -8.858 5.196 11.711 1.00 0.00 C ATOM 472 C GLY A 34 -8.787 6.098 10.494 1.00 0.00 C ATOM 473 O GLY A 34 -9.588 5.967 9.569 1.00 0.00 O ATOM 0 H GLY A 34 -6.920 4.402 11.703 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.318 4.248 11.430 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.503 5.654 12.461 1.00 0.00 H new ATOM 477 N ALA A 35 -7.825 7.016 10.496 1.00 0.00 N ATOM 478 CA ALA A 35 -7.653 7.943 9.384 1.00 0.00 C ATOM 479 C ALA A 35 -6.799 7.325 8.282 1.00 0.00 C ATOM 480 O ALA A 35 -5.756 6.729 8.551 1.00 0.00 O ATOM 481 CB ALA A 35 -7.027 9.240 9.874 1.00 0.00 C ATOM 0 H ALA A 35 -7.154 7.137 11.254 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.636 8.160 8.967 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.904 9.924 9.035 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.675 9.697 10.622 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.053 9.030 10.317 1.00 0.00 H new ATOM 487 N TYR A 36 -7.248 7.471 7.040 1.00 0.00 N ATOM 488 CA TYR A 36 -6.525 6.929 5.896 1.00 0.00 C ATOM 489 C TYR A 36 -5.948 8.048 5.035 1.00 0.00 C ATOM 490 O TYR A 36 -6.163 9.229 5.310 1.00 0.00 O ATOM 491 CB TYR A 36 -7.450 6.047 5.054 1.00 0.00 C ATOM 492 CG TYR A 36 -7.961 4.830 5.789 1.00 0.00 C ATOM 493 CD1 TYR A 36 -8.968 4.940 6.740 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.439 3.568 5.532 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.438 3.830 7.414 1.00 0.00 C ATOM 496 CE2 TYR A 36 -7.904 2.452 6.201 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.904 2.589 7.141 1.00 0.00 C ATOM 498 OH TYR A 36 -9.370 1.480 7.810 1.00 0.00 O ATOM 0 H TYR A 36 -8.110 7.961 6.800 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.700 6.324 6.273 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.300 6.642 4.719 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -6.916 5.724 4.161 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.390 5.910 6.956 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.656 3.458 4.796 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -10.220 3.934 8.151 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.487 1.479 5.989 1.00 0.00 H new ATOM 0 HH TYR A 36 -8.943 1.426 8.691 1.00 0.00 H new ATOM 508 N ILE A 37 -5.214 7.669 3.994 1.00 0.00 N ATOM 509 CA ILE A 37 -4.607 8.641 3.093 1.00 0.00 C ATOM 510 C ILE A 37 -5.622 9.168 2.086 1.00 0.00 C ATOM 511 O ILE A 37 -6.213 8.401 1.326 1.00 0.00 O ATOM 512 CB ILE A 37 -3.413 8.033 2.332 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.473 7.316 3.301 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.669 9.114 1.563 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.311 6.628 2.619 1.00 0.00 C ATOM 0 H ILE A 37 -5.025 6.696 3.754 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.252 9.466 3.711 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.791 7.302 1.617 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -2.086 8.038 4.020 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.041 6.577 3.866 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.828 8.669 1.031 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.345 9.582 0.847 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.300 9.867 2.259 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.686 6.141 3.368 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.689 5.882 1.920 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.719 7.365 2.077 1.00 0.00 H new ATOM 527 N HIS A 38 -5.822 10.483 2.089 1.00 0.00 N ATOM 528 CA HIS A 38 -6.769 11.113 1.175 1.00 0.00 C ATOM 529 C HIS A 38 -6.038 11.847 0.054 1.00 0.00 C ATOM 530 O HIS A 38 -5.085 12.585 0.301 1.00 0.00 O ATOM 531 CB HIS A 38 -7.671 12.086 1.935 1.00 0.00 C ATOM 532 CG HIS A 38 -8.716 12.730 1.077 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.627 12.027 0.321 1.00 0.00 N ATOM 534 CD2 HIS A 38 -8.987 14.043 0.865 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.404 12.914 -0.314 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.058 14.151 -0.018 1.00 0.00 N ATOM 0 H HIS A 38 -5.342 11.132 2.713 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.384 10.330 0.731 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -8.160 11.553 2.751 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -7.054 12.863 2.386 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.456 14.872 1.310 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.210 12.650 -0.982 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -10.486 15.010 -0.364 1.00 0.00 H new ATOM 544 N ALA A 39 -6.493 11.639 -1.177 1.00 0.00 N ATOM 545 CA ALA A 39 -5.884 12.282 -2.335 1.00 0.00 C ATOM 546 C ALA A 39 -6.462 13.675 -2.556 1.00 0.00 C ATOM 547 O ALA A 39 -7.676 13.873 -2.485 1.00 0.00 O ATOM 548 CB ALA A 39 -6.079 11.424 -3.576 1.00 0.00 C ATOM 0 H ALA A 39 -7.281 11.030 -1.398 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.816 12.387 -2.143 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.620 11.915 -4.434 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.613 10.451 -3.422 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.145 11.290 -3.762 1.00 0.00 H new ATOM 554 N LEU A 40 -5.587 14.638 -2.823 1.00 0.00 N ATOM 555 CA LEU A 40 -6.011 16.015 -3.052 1.00 0.00 C ATOM 556 C LEU A 40 -6.054 16.329 -4.545 1.00 0.00 C ATOM 557 O LEU A 40 -5.744 15.478 -5.379 1.00 0.00 O ATOM 558 CB LEU A 40 -5.069 16.987 -2.342 1.00 0.00 C ATOM 559 CG LEU A 40 -5.228 17.049 -0.822 1.00 0.00 C ATOM 560 CD1 LEU A 40 -3.988 17.649 -0.179 1.00 0.00 C ATOM 561 CD2 LEU A 40 -6.465 17.853 -0.451 1.00 0.00 C ATOM 0 H LEU A 40 -4.580 14.491 -2.886 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.015 16.132 -2.644 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.041 16.707 -2.573 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.227 17.985 -2.750 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.351 16.033 -0.446 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.120 17.685 0.902 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.120 17.034 -0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.833 18.659 -0.559 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.564 17.888 0.634 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -6.370 18.867 -0.840 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.348 17.381 -0.881 1.00 0.00 H new ATOM 573 N ASP A 41 -6.443 17.556 -4.873 1.00 0.00 N ATOM 574 CA ASP A 41 -6.528 17.986 -6.265 1.00 0.00 C ATOM 575 C ASP A 41 -5.377 18.921 -6.631 1.00 0.00 C ATOM 576 O ASP A 41 -5.175 19.239 -7.803 1.00 0.00 O ATOM 577 CB ASP A 41 -7.866 18.682 -6.522 1.00 0.00 C ATOM 578 CG ASP A 41 -8.086 19.868 -5.603 1.00 0.00 C ATOM 579 OD1 ASP A 41 -7.348 20.867 -5.735 1.00 0.00 O ATOM 580 OD2 ASP A 41 -8.997 19.797 -4.751 1.00 0.00 O ATOM 0 H ASP A 41 -6.705 18.271 -4.194 1.00 0.00 H new ATOM 0 HA ASP A 41 -6.456 17.098 -6.893 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -7.905 19.017 -7.559 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.677 17.966 -6.387 1.00 0.00 H new ATOM 585 N ASN A 42 -4.623 19.363 -5.626 1.00 0.00 N ATOM 586 CA ASN A 42 -3.497 20.262 -5.854 1.00 0.00 C ATOM 587 C ASN A 42 -2.183 19.488 -5.923 1.00 0.00 C ATOM 588 O ASN A 42 -1.126 20.009 -5.567 1.00 0.00 O ATOM 589 CB ASN A 42 -3.425 21.313 -4.744 1.00 0.00 C ATOM 590 CG ASN A 42 -3.481 20.697 -3.360 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.192 19.513 -3.182 1.00 0.00 O ATOM 592 ND2 ASN A 42 -3.854 21.500 -2.370 1.00 0.00 N ATOM 0 H ASN A 42 -4.772 19.113 -4.648 1.00 0.00 H new ATOM 0 HA ASN A 42 -3.652 20.761 -6.810 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -2.502 21.884 -4.847 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.250 22.016 -4.859 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -3.910 21.142 -1.417 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -4.084 22.475 -2.563 1.00 0.00 H new ATOM 599 N GLY A 43 -2.257 18.243 -6.384 1.00 0.00 N ATOM 600 CA GLY A 43 -1.067 17.420 -6.491 1.00 0.00 C ATOM 601 C GLY A 43 -0.461 17.095 -5.140 1.00 0.00 C ATOM 602 O GLY A 43 0.759 16.987 -5.009 1.00 0.00 O ATOM 0 H GLY A 43 -3.120 17.790 -6.685 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.316 16.492 -7.006 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.327 17.935 -7.103 1.00 0.00 H new ATOM 606 N LEU A 44 -1.313 16.937 -4.133 1.00 0.00 N ATOM 607 CA LEU A 44 -0.855 16.621 -2.786 1.00 0.00 C ATOM 608 C LEU A 44 -1.691 15.502 -2.175 1.00 0.00 C ATOM 609 O LEU A 44 -2.617 14.991 -2.807 1.00 0.00 O ATOM 610 CB LEU A 44 -0.919 17.865 -1.896 1.00 0.00 C ATOM 611 CG LEU A 44 -0.068 19.044 -2.370 1.00 0.00 C ATOM 612 CD1 LEU A 44 -0.498 20.326 -1.676 1.00 0.00 C ATOM 613 CD2 LEU A 44 1.408 18.770 -2.119 1.00 0.00 C ATOM 0 H LEU A 44 -2.325 17.023 -4.225 1.00 0.00 H new ATOM 0 HA LEU A 44 0.179 16.283 -2.852 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.957 18.190 -1.827 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.603 17.590 -0.890 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.218 19.168 -3.442 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.119 21.154 -2.026 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.544 20.531 -1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.378 20.214 -0.598 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.999 19.619 -2.462 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.574 18.620 -1.052 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.709 17.875 -2.663 1.00 0.00 H new ATOM 625 N PHE A 45 -1.361 15.125 -0.945 1.00 0.00 N ATOM 626 CA PHE A 45 -2.083 14.065 -0.251 1.00 0.00 C ATOM 627 C PHE A 45 -2.129 14.331 1.250 1.00 0.00 C ATOM 628 O PHE A 45 -1.109 14.260 1.935 1.00 0.00 O ATOM 629 CB PHE A 45 -1.427 12.711 -0.520 1.00 0.00 C ATOM 630 CG PHE A 45 -1.811 12.110 -1.842 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.274 12.597 -3.023 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.710 11.057 -1.904 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.626 12.047 -4.240 1.00 0.00 C ATOM 634 CE2 PHE A 45 -3.067 10.503 -3.119 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.524 10.998 -4.288 1.00 0.00 C ATOM 0 H PHE A 45 -0.598 15.537 -0.408 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.105 14.047 -0.631 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.344 12.828 -0.484 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.700 12.019 0.277 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.572 13.417 -2.991 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.136 10.665 -0.993 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.200 12.436 -5.153 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.770 9.684 -3.154 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.801 10.566 -5.238 1.00 0.00 H new ATOM 645 N THR A 46 -3.320 14.636 1.755 1.00 0.00 N ATOM 646 CA THR A 46 -3.501 14.912 3.175 1.00 0.00 C ATOM 647 C THR A 46 -4.155 13.728 3.880 1.00 0.00 C ATOM 648 O THR A 46 -4.554 12.756 3.240 1.00 0.00 O ATOM 649 CB THR A 46 -4.350 16.168 3.368 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.500 16.465 4.745 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.736 16.051 2.771 1.00 0.00 C ATOM 0 H THR A 46 -4.174 14.698 1.201 1.00 0.00 H new ATOM 0 HA THR A 46 -2.518 15.076 3.616 1.00 0.00 H new ATOM 0 HB THR A 46 -3.813 16.962 2.848 1.00 0.00 H new ATOM 0 HG1 THR A 46 -3.709 16.947 5.064 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.286 16.976 2.943 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.656 15.870 1.699 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.265 15.222 3.240 1.00 0.00 H new ATOM 659 N LEU A 47 -4.262 13.818 5.202 1.00 0.00 N ATOM 660 CA LEU A 47 -4.868 12.755 5.994 1.00 0.00 C ATOM 661 C LEU A 47 -6.389 12.844 5.949 1.00 0.00 C ATOM 662 O LEU A 47 -6.984 13.774 6.493 1.00 0.00 O ATOM 663 CB LEU A 47 -4.383 12.829 7.443 1.00 0.00 C ATOM 664 CG LEU A 47 -4.848 11.681 8.341 1.00 0.00 C ATOM 665 CD1 LEU A 47 -4.049 10.420 8.050 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.719 12.068 9.807 1.00 0.00 C ATOM 0 H LEU A 47 -3.937 14.617 5.747 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.565 11.799 5.566 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.293 12.853 7.445 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.723 13.770 7.876 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.898 11.479 8.128 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.393 9.614 8.698 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.189 10.133 7.008 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.992 10.608 8.236 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.054 11.241 10.433 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.677 12.295 10.033 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.333 12.946 10.007 1.00 0.00 H new ATOM 678 N GLY A 48 -7.015 11.868 5.298 1.00 0.00 N ATOM 679 CA GLY A 48 -8.462 11.855 5.195 1.00 0.00 C ATOM 680 C GLY A 48 -9.138 11.785 6.550 1.00 0.00 C ATOM 681 O GLY A 48 -8.583 11.234 7.500 1.00 0.00 O ATOM 0 H GLY A 48 -6.546 11.087 4.840 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.794 12.752 4.672 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.773 11.001 4.593 1.00 0.00 H new ATOM 685 N ALA A 49 -10.340 12.346 6.640 1.00 0.00 N ATOM 686 CA ALA A 49 -11.091 12.345 7.890 1.00 0.00 C ATOM 687 C ALA A 49 -11.365 10.918 8.364 1.00 0.00 C ATOM 688 O ALA A 49 -11.712 10.048 7.566 1.00 0.00 O ATOM 689 CB ALA A 49 -12.396 13.106 7.720 1.00 0.00 C ATOM 0 H ALA A 49 -10.814 12.806 5.863 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.489 12.843 8.649 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.947 13.098 8.660 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.182 14.136 7.434 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.996 12.631 6.944 1.00 0.00 H new ATOM 695 N PRO A 50 -11.213 10.657 9.675 1.00 0.00 N ATOM 696 CA PRO A 50 -11.446 9.326 10.246 1.00 0.00 C ATOM 697 C PRO A 50 -12.925 8.955 10.261 1.00 0.00 C ATOM 698 O PRO A 50 -13.761 9.714 10.749 1.00 0.00 O ATOM 699 CB PRO A 50 -10.913 9.453 11.674 1.00 0.00 C ATOM 700 CG PRO A 50 -11.034 10.902 11.994 1.00 0.00 C ATOM 701 CD PRO A 50 -10.800 11.634 10.702 1.00 0.00 C ATOM 0 HA PRO A 50 -10.961 8.542 9.665 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.492 8.844 12.369 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -9.878 9.117 11.742 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.020 11.131 12.399 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.304 11.197 12.747 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.390 12.549 10.646 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.755 11.921 10.586 1.00 0.00 H new ATOM 709 N HIS A 51 -13.241 7.780 9.725 1.00 0.00 N ATOM 710 CA HIS A 51 -14.620 7.307 9.680 1.00 0.00 C ATOM 711 C HIS A 51 -15.194 7.176 11.086 1.00 0.00 C ATOM 712 O HIS A 51 -14.468 7.274 12.076 1.00 0.00 O ATOM 713 CB HIS A 51 -14.695 5.961 8.958 1.00 0.00 C ATOM 714 CG HIS A 51 -14.105 5.983 7.583 1.00 0.00 C ATOM 715 ND1 HIS A 51 -14.819 6.442 6.504 1.00 0.00 N ATOM 716 CD2 HIS A 51 -12.875 5.594 7.167 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.016 6.325 5.462 1.00 0.00 C ATOM 718 NE2 HIS A 51 -12.827 5.816 5.814 1.00 0.00 N ATOM 0 H HIS A 51 -12.561 7.139 9.316 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.213 8.039 9.131 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -14.177 5.210 9.554 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.738 5.652 8.891 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.085 5.188 7.782 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.284 6.604 4.454 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.038 5.630 5.195 1.00 0.00 H new ATOM 726 N ARG A 52 -16.501 6.953 11.168 1.00 0.00 N ATOM 727 CA ARG A 52 -17.173 6.807 12.454 1.00 0.00 C ATOM 728 C ARG A 52 -17.472 5.341 12.749 1.00 0.00 C ATOM 729 O ARG A 52 -17.309 4.878 13.878 1.00 0.00 O ATOM 730 CB ARG A 52 -18.470 7.618 12.473 1.00 0.00 C ATOM 731 CG ARG A 52 -19.507 7.134 11.472 1.00 0.00 C ATOM 732 CD ARG A 52 -20.436 8.257 11.044 1.00 0.00 C ATOM 733 NE ARG A 52 -20.792 8.164 9.631 1.00 0.00 N ATOM 734 CZ ARG A 52 -21.709 7.327 9.150 1.00 0.00 C ATOM 735 NH1 ARG A 52 -22.362 6.508 9.965 1.00 0.00 N ATOM 736 NH2 ARG A 52 -21.972 7.307 7.851 1.00 0.00 N ATOM 0 H ARG A 52 -17.116 6.869 10.359 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.505 7.186 13.228 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -18.898 7.579 13.475 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -18.238 8.663 12.266 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -19.005 6.723 10.596 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -20.091 6.326 11.913 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -21.342 8.228 11.649 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -19.956 9.217 11.235 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.310 8.777 8.973 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -22.162 6.518 10.965 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -23.064 5.869 9.591 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -21.472 7.933 7.220 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -22.675 6.666 7.483 1.00 0.00 H new ATOM 750 N GLU A 53 -17.908 4.615 11.725 1.00 0.00 N ATOM 751 CA GLU A 53 -18.229 3.200 11.873 1.00 0.00 C ATOM 752 C GLU A 53 -16.963 2.351 11.848 1.00 0.00 C ATOM 753 O GLU A 53 -16.120 2.502 10.964 1.00 0.00 O ATOM 754 CB GLU A 53 -19.177 2.754 10.759 1.00 0.00 C ATOM 755 CG GLU A 53 -20.480 3.538 10.718 1.00 0.00 C ATOM 756 CD GLU A 53 -21.688 2.681 11.044 1.00 0.00 C ATOM 757 OE1 GLU A 53 -21.740 1.525 10.573 1.00 0.00 O ATOM 758 OE2 GLU A 53 -22.583 3.165 11.769 1.00 0.00 O ATOM 0 H GLU A 53 -18.047 4.983 10.784 1.00 0.00 H new ATOM 0 HA GLU A 53 -18.719 3.061 12.837 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.670 2.857 9.799 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -19.403 1.696 10.888 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -20.424 4.365 11.426 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.606 3.975 9.727 1.00 0.00 H new ATOM 765 N VAL A 54 -16.835 1.458 12.823 1.00 0.00 N ATOM 766 CA VAL A 54 -15.672 0.584 12.911 1.00 0.00 C ATOM 767 C VAL A 54 -15.543 -0.284 11.665 1.00 0.00 C ATOM 768 O VAL A 54 -14.446 -0.483 11.145 1.00 0.00 O ATOM 769 CB VAL A 54 -15.744 -0.326 14.152 1.00 0.00 C ATOM 770 CG1 VAL A 54 -14.440 -1.087 14.334 1.00 0.00 C ATOM 771 CG2 VAL A 54 -16.072 0.490 15.394 1.00 0.00 C ATOM 0 H VAL A 54 -17.523 1.321 13.564 1.00 0.00 H new ATOM 0 HA VAL A 54 -14.797 1.229 12.994 1.00 0.00 H new ATOM 0 HB VAL A 54 -16.543 -1.052 14.001 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -14.511 -1.724 15.216 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -14.253 -1.703 13.455 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -13.621 -0.380 14.462 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -16.119 -0.169 16.261 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -15.298 1.241 15.551 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -17.035 0.984 15.261 1.00 0.00 H new ATOM 781 N ASP A 55 -16.673 -0.799 11.191 1.00 0.00 N ATOM 782 CA ASP A 55 -16.689 -1.645 10.004 1.00 0.00 C ATOM 783 C ASP A 55 -17.113 -0.850 8.773 1.00 0.00 C ATOM 784 O ASP A 55 -18.227 -1.006 8.273 1.00 0.00 O ATOM 785 CB ASP A 55 -17.632 -2.832 10.211 1.00 0.00 C ATOM 786 CG ASP A 55 -17.106 -3.819 11.233 1.00 0.00 C ATOM 787 OD1 ASP A 55 -16.793 -3.392 12.365 1.00 0.00 O ATOM 788 OD2 ASP A 55 -17.005 -5.020 10.902 1.00 0.00 O ATOM 0 H ASP A 55 -17.590 -0.645 11.611 1.00 0.00 H new ATOM 0 HA ASP A 55 -15.678 -2.018 9.841 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -18.607 -2.466 10.533 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -17.781 -3.343 9.260 1.00 0.00 H new ATOM 793 N GLU A 56 -16.217 0.006 8.292 1.00 0.00 N ATOM 794 CA GLU A 56 -16.498 0.828 7.120 1.00 0.00 C ATOM 795 C GLU A 56 -15.399 0.676 6.073 1.00 0.00 C ATOM 796 O GLU A 56 -14.265 0.323 6.397 1.00 0.00 O ATOM 797 CB GLU A 56 -16.635 2.297 7.523 1.00 0.00 C ATOM 798 CG GLU A 56 -17.601 3.080 6.649 1.00 0.00 C ATOM 799 CD GLU A 56 -19.002 3.129 7.226 1.00 0.00 C ATOM 800 OE1 GLU A 56 -19.748 2.141 7.058 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.354 4.154 7.846 1.00 0.00 O ATOM 0 H GLU A 56 -15.291 0.149 8.695 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.438 0.488 6.686 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -16.970 2.351 8.559 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.654 2.770 7.480 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.228 4.097 6.523 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.636 2.628 5.658 1.00 0.00 H new ATOM 808 N GLY A 57 -15.743 0.947 4.819 1.00 0.00 N ATOM 809 CA GLY A 57 -14.775 0.834 3.744 1.00 0.00 C ATOM 810 C GLY A 57 -14.141 2.167 3.391 1.00 0.00 C ATOM 811 O GLY A 57 -14.716 3.221 3.665 1.00 0.00 O ATOM 0 H GLY A 57 -16.675 1.243 4.528 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.995 0.130 4.034 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.264 0.422 2.861 1.00 0.00 H new ATOM 815 N PRO A 58 -12.946 2.154 2.776 1.00 0.00 N ATOM 816 CA PRO A 58 -12.243 3.381 2.389 1.00 0.00 C ATOM 817 C PRO A 58 -12.948 4.119 1.257 1.00 0.00 C ATOM 818 O PRO A 58 -13.641 3.511 0.441 1.00 0.00 O ATOM 819 CB PRO A 58 -10.873 2.879 1.927 1.00 0.00 C ATOM 820 CG PRO A 58 -11.109 1.470 1.507 1.00 0.00 C ATOM 821 CD PRO A 58 -12.188 0.944 2.411 1.00 0.00 C ATOM 0 HA PRO A 58 -12.194 4.097 3.210 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.489 3.479 1.102 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.139 2.935 2.731 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.417 1.420 0.462 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.199 0.877 1.600 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.817 0.213 1.903 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.772 0.450 3.289 1.00 0.00 H new ATOM 829 N SER A 59 -12.766 5.436 1.212 1.00 0.00 N ATOM 830 CA SER A 59 -13.383 6.259 0.179 1.00 0.00 C ATOM 831 C SER A 59 -12.778 5.960 -1.191 1.00 0.00 C ATOM 832 O SER A 59 -11.759 5.277 -1.292 1.00 0.00 O ATOM 833 CB SER A 59 -13.214 7.743 0.513 1.00 0.00 C ATOM 834 OG SER A 59 -13.294 7.963 1.911 1.00 0.00 O ATOM 0 H SER A 59 -12.196 5.955 1.880 1.00 0.00 H new ATOM 0 HA SER A 59 -14.446 6.020 0.145 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.252 8.096 0.141 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.985 8.323 0.006 1.00 0.00 H new ATOM 0 HG SER A 59 -12.565 8.555 2.191 1.00 0.00 H new ATOM 840 N PRO A 60 -13.400 6.470 -2.268 1.00 0.00 N ATOM 841 CA PRO A 60 -12.918 6.253 -3.635 1.00 0.00 C ATOM 842 C PRO A 60 -11.460 6.677 -3.819 1.00 0.00 C ATOM 843 O PRO A 60 -10.660 5.929 -4.380 1.00 0.00 O ATOM 844 CB PRO A 60 -13.842 7.123 -4.492 1.00 0.00 C ATOM 845 CG PRO A 60 -15.075 7.296 -3.672 1.00 0.00 C ATOM 846 CD PRO A 60 -14.621 7.295 -2.238 1.00 0.00 C ATOM 0 HA PRO A 60 -12.940 5.197 -3.904 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.381 8.084 -4.720 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -14.065 6.643 -5.445 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -15.581 8.229 -3.921 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.784 6.489 -3.858 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -14.416 8.304 -1.881 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.377 6.870 -1.577 1.00 0.00 H new ATOM 854 N PRO A 61 -11.088 7.885 -3.350 1.00 0.00 N ATOM 855 CA PRO A 61 -9.716 8.383 -3.477 1.00 0.00 C ATOM 856 C PRO A 61 -8.766 7.724 -2.483 1.00 0.00 C ATOM 857 O PRO A 61 -7.564 7.624 -2.732 1.00 0.00 O ATOM 858 CB PRO A 61 -9.857 9.875 -3.179 1.00 0.00 C ATOM 859 CG PRO A 61 -11.028 9.964 -2.261 1.00 0.00 C ATOM 860 CD PRO A 61 -11.966 8.856 -2.664 1.00 0.00 C ATOM 0 HA PRO A 61 -9.290 8.168 -4.457 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -8.956 10.273 -2.713 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.024 10.448 -4.091 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -10.717 9.852 -1.222 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -11.515 10.936 -2.345 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -12.455 8.411 -1.798 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -12.754 9.219 -3.324 1.00 0.00 H new ATOM 868 N GLU A 62 -9.311 7.277 -1.356 1.00 0.00 N ATOM 869 CA GLU A 62 -8.510 6.627 -0.326 1.00 0.00 C ATOM 870 C GLU A 62 -8.014 5.266 -0.800 1.00 0.00 C ATOM 871 O GLU A 62 -6.935 4.817 -0.413 1.00 0.00 O ATOM 872 CB GLU A 62 -9.327 6.467 0.958 1.00 0.00 C ATOM 873 CG GLU A 62 -9.202 7.646 1.910 1.00 0.00 C ATOM 874 CD GLU A 62 -10.333 7.704 2.918 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.442 6.772 3.742 1.00 0.00 O ATOM 876 OE2 GLU A 62 -11.112 8.680 2.881 1.00 0.00 O ATOM 0 H GLU A 62 -10.303 7.353 -1.133 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.644 7.257 -0.122 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.376 6.332 0.696 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.007 5.560 1.472 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.251 7.582 2.439 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.185 8.572 1.335 1.00 0.00 H new ATOM 883 N GLN A 63 -8.810 4.612 -1.641 1.00 0.00 N ATOM 884 CA GLN A 63 -8.452 3.301 -2.169 1.00 0.00 C ATOM 885 C GLN A 63 -7.328 3.416 -3.195 1.00 0.00 C ATOM 886 O GLN A 63 -7.450 4.138 -4.185 1.00 0.00 O ATOM 887 CB GLN A 63 -9.673 2.634 -2.806 1.00 0.00 C ATOM 888 CG GLN A 63 -10.711 2.176 -1.795 1.00 0.00 C ATOM 889 CD GLN A 63 -11.924 1.546 -2.451 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.816 0.900 -3.494 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.089 1.730 -1.842 1.00 0.00 N ATOM 0 H GLN A 63 -9.707 4.969 -1.971 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.102 2.686 -1.340 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.138 3.334 -3.501 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.344 1.775 -3.391 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.257 1.457 -1.113 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -11.029 3.028 -1.194 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.133 2.272 -0.979 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.940 1.329 -2.237 1.00 0.00 H new ATOM 900 N PHE A 64 -6.236 2.700 -2.952 1.00 0.00 N ATOM 901 CA PHE A 64 -5.091 2.722 -3.854 1.00 0.00 C ATOM 902 C PHE A 64 -4.915 1.373 -4.543 1.00 0.00 C ATOM 903 O PHE A 64 -5.244 0.329 -3.981 1.00 0.00 O ATOM 904 CB PHE A 64 -3.818 3.083 -3.086 1.00 0.00 C ATOM 905 CG PHE A 64 -3.902 4.404 -2.373 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.633 5.586 -3.045 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.249 4.461 -1.033 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.711 6.802 -2.392 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.328 5.674 -0.375 1.00 0.00 C ATOM 910 CZ PHE A 64 -4.058 6.846 -1.056 1.00 0.00 C ATOM 0 H PHE A 64 -6.120 2.097 -2.138 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.276 3.479 -4.617 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.608 2.299 -2.358 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.978 3.107 -3.781 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.360 5.557 -4.089 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.460 3.548 -0.497 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.501 7.717 -2.926 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.600 5.706 0.670 1.00 0.00 H new ATOM 0 HZ PHE A 64 -4.118 7.795 -0.544 1.00 0.00 H new ATOM 920 N THR A 65 -4.397 1.403 -5.767 1.00 0.00 N ATOM 921 CA THR A 65 -4.178 0.184 -6.535 1.00 0.00 C ATOM 922 C THR A 65 -2.693 -0.162 -6.597 1.00 0.00 C ATOM 923 O THR A 65 -1.884 0.622 -7.094 1.00 0.00 O ATOM 924 CB THR A 65 -4.737 0.340 -7.950 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.864 1.197 -7.952 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.156 -0.972 -8.577 1.00 0.00 C ATOM 0 H THR A 65 -4.121 2.259 -6.248 1.00 0.00 H new ATOM 0 HA THR A 65 -4.701 -0.630 -6.033 1.00 0.00 H new ATOM 0 HB THR A 65 -3.921 0.760 -8.538 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.206 1.285 -8.866 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.543 -0.789 -9.579 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.295 -1.638 -8.636 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.932 -1.435 -7.967 1.00 0.00 H new ATOM 934 N ALA A 66 -2.344 -1.339 -6.090 1.00 0.00 N ATOM 935 CA ALA A 66 -0.956 -1.788 -6.087 1.00 0.00 C ATOM 936 C ALA A 66 -0.615 -2.521 -7.380 1.00 0.00 C ATOM 937 O ALA A 66 -1.455 -3.214 -7.953 1.00 0.00 O ATOM 938 CB ALA A 66 -0.693 -2.683 -4.886 1.00 0.00 C ATOM 0 H ALA A 66 -3.002 -1.999 -5.676 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.315 -0.909 -6.017 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.347 -3.010 -4.897 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.889 -2.128 -3.969 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.348 -3.553 -4.930 1.00 0.00 H new ATOM 944 N VAL A 67 0.624 -2.362 -7.835 1.00 0.00 N ATOM 945 CA VAL A 67 1.077 -3.010 -9.060 1.00 0.00 C ATOM 946 C VAL A 67 2.512 -3.507 -8.919 1.00 0.00 C ATOM 947 O VAL A 67 3.454 -2.715 -8.901 1.00 0.00 O ATOM 948 CB VAL A 67 0.992 -2.054 -10.265 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.277 -2.801 -11.560 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.370 -1.380 -10.318 1.00 0.00 C ATOM 0 H VAL A 67 1.332 -1.790 -7.374 1.00 0.00 H new ATOM 0 HA VAL A 67 0.416 -3.859 -9.233 1.00 0.00 H new ATOM 0 HB VAL A 67 1.749 -1.279 -10.145 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.213 -2.110 -12.400 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.278 -3.231 -11.519 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.545 -3.598 -11.689 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.411 -0.709 -11.176 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.148 -2.138 -10.413 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.530 -0.810 -9.403 1.00 0.00 H new ATOM 960 N LYS A 68 2.668 -4.822 -8.821 1.00 0.00 N ATOM 961 CA LYS A 68 3.989 -5.426 -8.682 1.00 0.00 C ATOM 962 C LYS A 68 4.874 -5.083 -9.876 1.00 0.00 C ATOM 963 O LYS A 68 4.392 -4.955 -11.001 1.00 0.00 O ATOM 964 CB LYS A 68 3.867 -6.945 -8.543 1.00 0.00 C ATOM 965 CG LYS A 68 3.110 -7.383 -7.300 1.00 0.00 C ATOM 966 CD LYS A 68 2.930 -8.892 -7.261 1.00 0.00 C ATOM 967 CE LYS A 68 4.243 -9.602 -6.972 1.00 0.00 C ATOM 968 NZ LYS A 68 4.290 -10.955 -7.592 1.00 0.00 N ATOM 0 H LYS A 68 1.898 -5.490 -8.835 1.00 0.00 H new ATOM 0 HA LYS A 68 4.452 -5.021 -7.782 1.00 0.00 H new ATOM 0 HB2 LYS A 68 3.363 -7.343 -9.424 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.866 -7.381 -8.523 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.649 -7.057 -6.411 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.134 -6.898 -7.277 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.198 -9.153 -6.496 1.00 0.00 H new ATOM 0 HD3 LYS A 68 2.531 -9.237 -8.215 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.071 -9.001 -7.348 1.00 0.00 H new ATOM 0 HE3 LYS A 68 4.378 -9.692 -5.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 5.201 -11.406 -7.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 3.515 -11.537 -7.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 4.187 -10.868 -8.623 1.00 0.00 H new ATOM 982 N LEU A 69 6.170 -4.935 -9.622 1.00 0.00 N ATOM 983 CA LEU A 69 7.123 -4.606 -10.675 1.00 0.00 C ATOM 984 C LEU A 69 8.314 -5.558 -10.648 1.00 0.00 C ATOM 985 O LEU A 69 8.498 -6.364 -11.560 1.00 0.00 O ATOM 986 CB LEU A 69 7.604 -3.161 -10.525 1.00 0.00 C ATOM 987 CG LEU A 69 6.492 -2.117 -10.418 1.00 0.00 C ATOM 988 CD1 LEU A 69 7.053 -0.789 -9.934 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.792 -1.945 -11.758 1.00 0.00 C ATOM 0 H LEU A 69 6.584 -5.038 -8.696 1.00 0.00 H new ATOM 0 HA LEU A 69 6.617 -4.714 -11.635 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.232 -3.093 -9.636 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.233 -2.913 -11.380 1.00 0.00 H new ATOM 0 HG LEU A 69 5.760 -2.466 -9.690 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.248 -0.058 -9.864 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.509 -0.922 -8.953 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.805 -0.434 -10.638 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.004 -1.198 -11.663 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.514 -1.618 -12.506 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.356 -2.896 -12.066 1.00 0.00 H new ATOM 1001 N SER A 70 9.122 -5.457 -9.597 1.00 0.00 N ATOM 1002 CA SER A 70 10.297 -6.310 -9.450 1.00 0.00 C ATOM 1003 C SER A 70 11.030 -6.007 -8.148 1.00 0.00 C ATOM 1004 O SER A 70 10.932 -4.903 -7.612 1.00 0.00 O ATOM 1005 CB SER A 70 11.244 -6.119 -10.637 1.00 0.00 C ATOM 1006 OG SER A 70 10.918 -7.001 -11.697 1.00 0.00 O ATOM 0 H SER A 70 8.985 -4.793 -8.835 1.00 0.00 H new ATOM 0 HA SER A 70 9.961 -7.347 -9.425 1.00 0.00 H new ATOM 0 HB2 SER A 70 11.189 -5.088 -10.988 1.00 0.00 H new ATOM 0 HB3 SER A 70 12.272 -6.293 -10.318 1.00 0.00 H new ATOM 0 HG SER A 70 9.957 -7.192 -11.679 1.00 0.00 H new ATOM 1012 N ASP A 71 11.764 -6.993 -7.644 1.00 0.00 N ATOM 1013 CA ASP A 71 12.514 -6.831 -6.404 1.00 0.00 C ATOM 1014 C ASP A 71 11.582 -6.494 -5.243 1.00 0.00 C ATOM 1015 O ASP A 71 11.929 -5.704 -4.365 1.00 0.00 O ATOM 1016 CB ASP A 71 13.569 -5.736 -6.562 1.00 0.00 C ATOM 1017 CG ASP A 71 14.762 -5.946 -5.650 1.00 0.00 C ATOM 1018 OD1 ASP A 71 14.553 -6.298 -4.470 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.906 -5.760 -6.116 1.00 0.00 O ATOM 0 H ASP A 71 11.856 -7.913 -8.075 1.00 0.00 H new ATOM 0 HA ASP A 71 13.011 -7.776 -6.183 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.907 -5.708 -7.598 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.118 -4.767 -6.348 1.00 0.00 H new ATOM 1024 N SER A 72 10.399 -7.098 -5.247 1.00 0.00 N ATOM 1025 CA SER A 72 9.417 -6.862 -4.195 1.00 0.00 C ATOM 1026 C SER A 72 9.020 -5.389 -4.141 1.00 0.00 C ATOM 1027 O SER A 72 9.064 -4.761 -3.083 1.00 0.00 O ATOM 1028 CB SER A 72 9.974 -7.306 -2.841 1.00 0.00 C ATOM 1029 OG SER A 72 10.527 -8.609 -2.919 1.00 0.00 O ATOM 0 H SER A 72 10.097 -7.755 -5.967 1.00 0.00 H new ATOM 0 HA SER A 72 8.527 -7.449 -4.423 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.738 -6.603 -2.510 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.180 -7.289 -2.094 1.00 0.00 H new ATOM 0 HG SER A 72 10.878 -8.869 -2.041 1.00 0.00 H new ATOM 1035 N ARG A 73 8.632 -4.845 -5.289 1.00 0.00 N ATOM 1036 CA ARG A 73 8.227 -3.446 -5.374 1.00 0.00 C ATOM 1037 C ARG A 73 6.870 -3.315 -6.059 1.00 0.00 C ATOM 1038 O ARG A 73 6.606 -3.973 -7.066 1.00 0.00 O ATOM 1039 CB ARG A 73 9.276 -2.634 -6.135 1.00 0.00 C ATOM 1040 CG ARG A 73 10.700 -2.885 -5.662 1.00 0.00 C ATOM 1041 CD ARG A 73 11.046 -2.021 -4.459 1.00 0.00 C ATOM 1042 NE ARG A 73 11.053 -0.599 -4.791 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.060 0.014 -5.410 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.143 -0.667 -5.764 1.00 0.00 N ATOM 1045 NH2 ARG A 73 11.984 1.311 -5.673 1.00 0.00 N ATOM 0 H ARG A 73 8.589 -5.351 -6.174 1.00 0.00 H new ATOM 0 HA ARG A 73 8.142 -3.055 -4.360 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.207 -2.871 -7.197 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.049 -1.573 -6.030 1.00 0.00 H new ATOM 0 HG2 ARG A 73 10.819 -3.937 -5.402 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.397 -2.677 -6.474 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.325 -2.204 -3.662 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.025 -2.309 -4.076 1.00 0.00 H new ATOM 0 HE ARG A 73 10.238 -0.042 -4.533 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.207 -1.665 -5.562 1.00 0.00 H new ATOM 0 HH12 ARG A 73 13.912 -0.193 -6.238 1.00 0.00 H new ATOM 0 HH21 ARG A 73 11.155 1.839 -5.401 1.00 0.00 H new ATOM 0 HH22 ARG A 73 12.755 1.781 -6.147 1.00 0.00 H new ATOM 1059 N ILE A 74 6.014 -2.462 -5.507 1.00 0.00 N ATOM 1060 CA ILE A 74 4.685 -2.245 -6.065 1.00 0.00 C ATOM 1061 C ILE A 74 4.461 -0.773 -6.395 1.00 0.00 C ATOM 1062 O ILE A 74 5.039 0.111 -5.762 1.00 0.00 O ATOM 1063 CB ILE A 74 3.584 -2.715 -5.096 1.00 0.00 C ATOM 1064 CG1 ILE A 74 3.787 -2.086 -3.716 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.578 -4.233 -4.996 1.00 0.00 C ATOM 1066 CD1 ILE A 74 2.651 -2.357 -2.755 1.00 0.00 C ATOM 0 H ILE A 74 6.217 -1.910 -4.674 1.00 0.00 H new ATOM 0 HA ILE A 74 4.627 -2.833 -6.981 1.00 0.00 H new ATOM 0 HB ILE A 74 2.618 -2.392 -5.484 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.714 -2.465 -3.286 1.00 0.00 H new ATOM 0 HG13 ILE A 74 3.906 -1.009 -3.831 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.794 -4.549 -4.307 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.391 -4.662 -5.980 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.545 -4.577 -4.628 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.863 -1.881 -1.798 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.725 -1.953 -3.164 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.546 -3.432 -2.610 1.00 0.00 H new ATOM 1078 N ALA A 75 3.616 -0.517 -7.389 1.00 0.00 N ATOM 1079 CA ALA A 75 3.315 0.848 -7.802 1.00 0.00 C ATOM 1080 C ALA A 75 1.885 1.229 -7.435 1.00 0.00 C ATOM 1081 O ALA A 75 0.932 0.813 -8.093 1.00 0.00 O ATOM 1082 CB ALA A 75 3.537 1.007 -9.299 1.00 0.00 C ATOM 0 H ALA A 75 3.128 -1.237 -7.923 1.00 0.00 H new ATOM 0 HA ALA A 75 3.990 1.519 -7.272 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.308 2.031 -9.594 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.577 0.784 -9.538 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.885 0.320 -9.839 1.00 0.00 H new ATOM 1088 N LEU A 76 1.743 2.024 -6.379 1.00 0.00 N ATOM 1089 CA LEU A 76 0.429 2.462 -5.925 1.00 0.00 C ATOM 1090 C LEU A 76 -0.188 3.449 -6.911 1.00 0.00 C ATOM 1091 O LEU A 76 0.525 4.158 -7.621 1.00 0.00 O ATOM 1092 CB LEU A 76 0.532 3.104 -4.539 1.00 0.00 C ATOM 1093 CG LEU A 76 0.486 2.123 -3.367 1.00 0.00 C ATOM 1094 CD1 LEU A 76 0.550 2.872 -2.044 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.770 1.267 -3.438 1.00 0.00 C ATOM 0 H LEU A 76 2.521 2.377 -5.823 1.00 0.00 H new ATOM 0 HA LEU A 76 -0.217 1.586 -5.865 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.463 3.668 -4.485 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.282 3.820 -4.426 1.00 0.00 H new ATOM 0 HG LEU A 76 1.353 1.466 -3.432 1.00 0.00 H new ATOM 0 HD11 LEU A 76 0.516 2.159 -1.220 1.00 0.00 H new ATOM 0 HD12 LEU A 76 1.478 3.442 -1.993 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.298 3.553 -1.970 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.786 0.575 -2.596 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.650 1.909 -3.397 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.774 0.704 -4.371 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.515 3.488 -6.950 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.226 4.388 -7.851 1.00 0.00 C ATOM 1109 C LYS A 77 -3.422 5.026 -7.151 1.00 0.00 C ATOM 1110 O LYS A 77 -4.327 4.331 -6.691 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.692 3.633 -9.097 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.094 4.543 -10.246 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.091 3.866 -11.171 1.00 0.00 C ATOM 1114 CE LYS A 77 -3.390 3.027 -12.228 1.00 0.00 C ATOM 1115 NZ LYS A 77 -4.074 3.114 -13.548 1.00 0.00 N ATOM 0 H LYS A 77 -2.120 2.908 -6.369 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.539 5.179 -8.150 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.892 2.972 -9.431 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.539 3.000 -8.832 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.529 5.460 -9.850 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.207 4.829 -10.812 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.759 3.233 -10.587 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.710 4.621 -11.656 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.358 3.361 -12.331 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.358 1.987 -11.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -3.566 2.529 -14.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -5.052 2.771 -13.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.083 4.103 -13.870 1.00 0.00 H new ATOM 1129 N SER A 78 -3.418 6.353 -7.076 1.00 0.00 N ATOM 1130 CA SER A 78 -4.504 7.084 -6.434 1.00 0.00 C ATOM 1131 C SER A 78 -5.829 6.827 -7.145 1.00 0.00 C ATOM 1132 O SER A 78 -5.857 6.542 -8.342 1.00 0.00 O ATOM 1133 CB SER A 78 -4.201 8.584 -6.425 1.00 0.00 C ATOM 1134 OG SER A 78 -4.221 9.117 -7.738 1.00 0.00 O ATOM 0 H SER A 78 -2.676 6.943 -7.451 1.00 0.00 H new ATOM 0 HA SER A 78 -4.589 6.730 -5.407 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.935 9.103 -5.808 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.224 8.758 -5.973 1.00 0.00 H new ATOM 0 HG SER A 78 -4.347 10.088 -7.695 1.00 0.00 H new ATOM 1140 N GLY A 79 -6.925 6.930 -6.400 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.237 6.706 -6.976 1.00 0.00 C ATOM 1142 C GLY A 79 -8.549 7.673 -8.101 1.00 0.00 C ATOM 1143 O GLY A 79 -9.305 7.348 -9.017 1.00 0.00 O ATOM 0 H GLY A 79 -6.927 7.165 -5.407 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.296 5.685 -7.352 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.994 6.803 -6.197 1.00 0.00 H new ATOM 1147 N TYR A 80 -7.967 8.866 -8.031 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.187 9.885 -9.052 1.00 0.00 C ATOM 1149 C TYR A 80 -7.670 9.416 -10.408 1.00 0.00 C ATOM 1150 O TYR A 80 -8.210 9.786 -11.451 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.499 11.192 -8.654 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.270 11.996 -7.632 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.636 12.209 -7.775 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -7.633 12.543 -6.526 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.344 12.943 -6.843 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -8.334 13.279 -5.589 1.00 0.00 C ATOM 1157 CZ TYR A 80 -9.690 13.476 -5.753 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.392 14.208 -4.823 1.00 0.00 O ATOM 0 H TYR A 80 -7.340 9.151 -7.279 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.260 10.058 -9.133 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.510 10.965 -8.255 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.351 11.801 -9.546 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -10.152 11.794 -8.628 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -6.572 12.391 -6.396 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.405 13.099 -6.968 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -7.824 13.697 -4.734 1.00 0.00 H new ATOM 0 HH TYR A 80 -9.783 14.511 -4.117 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.621 8.600 -10.387 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.049 8.095 -11.621 1.00 0.00 C ATOM 1170 C GLY A 81 -4.612 8.536 -11.820 1.00 0.00 C ATOM 1171 O GLY A 81 -4.189 8.809 -12.943 1.00 0.00 O ATOM 0 H GLY A 81 -6.157 8.280 -9.537 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.094 7.006 -11.619 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.650 8.438 -12.463 1.00 0.00 H new ATOM 1175 N LYS A 82 -3.860 8.605 -10.726 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.462 9.017 -10.786 1.00 0.00 C ATOM 1177 C LYS A 82 -1.575 8.049 -10.008 1.00 0.00 C ATOM 1178 O LYS A 82 -2.057 7.286 -9.172 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.301 10.433 -10.229 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.741 11.521 -11.194 1.00 0.00 C ATOM 1181 CD LYS A 82 -2.139 12.869 -10.827 1.00 0.00 C ATOM 1182 CE LYS A 82 -3.158 13.989 -10.960 1.00 0.00 C ATOM 1183 NZ LYS A 82 -2.504 15.321 -11.088 1.00 0.00 N ATOM 0 H LYS A 82 -4.195 8.381 -9.789 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.151 9.007 -11.831 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -2.879 10.520 -9.309 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.256 10.594 -9.966 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.443 11.252 -12.207 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.829 11.594 -11.190 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -1.765 12.835 -9.804 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -1.284 13.075 -11.472 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.786 13.807 -11.832 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.814 13.989 -10.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.232 16.058 -11.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -1.925 15.506 -10.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -1.898 15.330 -11.933 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.277 8.090 -10.289 1.00 0.00 N ATOM 1198 CA TYR A 83 0.678 7.218 -9.616 1.00 0.00 C ATOM 1199 C TYR A 83 1.320 7.930 -8.429 1.00 0.00 C ATOM 1200 O TYR A 83 1.888 9.013 -8.576 1.00 0.00 O ATOM 1201 CB TYR A 83 1.761 6.759 -10.595 1.00 0.00 C ATOM 1202 CG TYR A 83 1.427 5.468 -11.309 1.00 0.00 C ATOM 1203 CD1 TYR A 83 1.410 4.259 -10.626 1.00 0.00 C ATOM 1204 CD2 TYR A 83 1.128 5.461 -12.666 1.00 0.00 C ATOM 1205 CE1 TYR A 83 1.106 3.077 -11.275 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.822 4.283 -13.321 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.813 3.095 -12.622 1.00 0.00 C ATOM 1208 OH TYR A 83 0.510 1.921 -13.272 1.00 0.00 O ATOM 0 H TYR A 83 0.138 8.718 -10.978 1.00 0.00 H new ATOM 0 HA TYR A 83 0.138 6.346 -9.247 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.924 7.542 -11.336 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.698 6.632 -10.053 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.638 4.242 -9.570 1.00 0.00 H new ATOM 0 HD2 TYR A 83 1.135 6.390 -13.217 1.00 0.00 H new ATOM 0 HE1 TYR A 83 1.098 2.145 -10.730 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.591 4.293 -14.376 1.00 0.00 H new ATOM 0 HH TYR A 83 0.327 2.108 -14.217 1.00 0.00 H new ATOM 1218 N LEU A 84 1.224 7.317 -7.254 1.00 0.00 N ATOM 1219 CA LEU A 84 1.795 7.895 -6.042 1.00 0.00 C ATOM 1220 C LEU A 84 3.300 8.091 -6.190 1.00 0.00 C ATOM 1221 O LEU A 84 4.052 7.124 -6.317 1.00 0.00 O ATOM 1222 CB LEU A 84 1.500 6.998 -4.838 1.00 0.00 C ATOM 1223 CG LEU A 84 0.148 7.243 -4.165 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.036 6.305 -2.982 1.00 0.00 C ATOM 1225 CD2 LEU A 84 0.030 8.694 -3.722 1.00 0.00 C ATOM 0 H LEU A 84 0.757 6.421 -7.115 1.00 0.00 H new ATOM 0 HA LEU A 84 1.335 8.870 -5.881 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.546 5.957 -5.159 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.288 7.138 -4.098 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.641 7.040 -4.889 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.003 6.493 -2.515 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.005 5.272 -3.327 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.757 6.477 -2.255 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.938 8.851 -3.245 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.825 8.924 -3.013 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.117 9.348 -4.590 1.00 0.00 H new ATOM 1237 N GLY A 85 3.732 9.347 -6.175 1.00 0.00 N ATOM 1238 CA GLY A 85 5.146 9.647 -6.309 1.00 0.00 C ATOM 1239 C GLY A 85 5.673 10.490 -5.163 1.00 0.00 C ATOM 1240 O GLY A 85 4.911 11.187 -4.494 1.00 0.00 O ATOM 0 H GLY A 85 3.129 10.163 -6.072 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.709 8.715 -6.358 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.315 10.172 -7.249 1.00 0.00 H new ATOM 1244 N ILE A 86 6.981 10.423 -4.936 1.00 0.00 N ATOM 1245 CA ILE A 86 7.611 11.185 -3.864 1.00 0.00 C ATOM 1246 C ILE A 86 8.478 12.308 -4.423 1.00 0.00 C ATOM 1247 O ILE A 86 9.221 12.112 -5.384 1.00 0.00 O ATOM 1248 CB ILE A 86 8.477 10.280 -2.967 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.475 9.489 -3.814 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.597 9.339 -2.158 1.00 0.00 C ATOM 1251 CD1 ILE A 86 10.599 8.874 -3.007 1.00 0.00 C ATOM 0 H ILE A 86 7.625 9.849 -5.480 1.00 0.00 H new ATOM 0 HA ILE A 86 6.807 11.615 -3.266 1.00 0.00 H new ATOM 0 HB ILE A 86 9.036 10.909 -2.274 1.00 0.00 H new ATOM 0 HG12 ILE A 86 8.944 8.698 -4.343 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.900 10.149 -4.570 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.223 8.706 -1.529 1.00 0.00 H new ATOM 0 HG22 ILE A 86 6.923 9.921 -1.530 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.014 8.715 -2.835 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.268 8.328 -3.672 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.155 9.662 -2.499 1.00 0.00 H new ATOM 0 HD13 ILE A 86 10.184 8.189 -2.268 1.00 0.00 H new ATOM 1263 N ASN A 87 8.378 13.485 -3.815 1.00 0.00 N ATOM 1264 CA ASN A 87 9.153 14.641 -4.252 1.00 0.00 C ATOM 1265 C ASN A 87 10.614 14.505 -3.835 1.00 0.00 C ATOM 1266 O ASN A 87 10.953 13.684 -2.983 1.00 0.00 O ATOM 1267 CB ASN A 87 8.560 15.927 -3.673 1.00 0.00 C ATOM 1268 CG ASN A 87 7.686 16.662 -4.670 1.00 0.00 C ATOM 1269 OD1 ASN A 87 7.417 16.162 -5.762 1.00 0.00 O ATOM 1270 ND2 ASN A 87 7.239 17.856 -4.300 1.00 0.00 N ATOM 0 H ASN A 87 7.768 13.664 -3.018 1.00 0.00 H new ATOM 0 HA ASN A 87 9.109 14.688 -5.340 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.972 15.686 -2.787 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.368 16.583 -3.350 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.648 18.397 -4.931 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.487 18.232 -3.385 1.00 0.00 H new ATOM 1277 N SER A 88 11.474 15.318 -4.440 1.00 0.00 N ATOM 1278 CA SER A 88 12.899 15.289 -4.133 1.00 0.00 C ATOM 1279 C SER A 88 13.163 15.816 -2.725 1.00 0.00 C ATOM 1280 O SER A 88 14.105 15.388 -2.059 1.00 0.00 O ATOM 1281 CB SER A 88 13.679 16.119 -5.154 1.00 0.00 C ATOM 1282 OG SER A 88 14.118 15.316 -6.235 1.00 0.00 O ATOM 0 H SER A 88 11.209 16.005 -5.146 1.00 0.00 H new ATOM 0 HA SER A 88 13.235 14.253 -4.184 1.00 0.00 H new ATOM 0 HB2 SER A 88 13.049 16.926 -5.529 1.00 0.00 H new ATOM 0 HB3 SER A 88 14.538 16.584 -4.670 1.00 0.00 H new ATOM 0 HG SER A 88 14.612 15.870 -6.874 1.00 0.00 H new ATOM 1288 N ASP A 89 12.325 16.747 -2.281 1.00 0.00 N ATOM 1289 CA ASP A 89 12.469 17.333 -0.953 1.00 0.00 C ATOM 1290 C ASP A 89 12.103 16.321 0.129 1.00 0.00 C ATOM 1291 O ASP A 89 12.652 16.348 1.230 1.00 0.00 O ATOM 1292 CB ASP A 89 11.591 18.579 -0.825 1.00 0.00 C ATOM 1293 CG ASP A 89 12.352 19.768 -0.270 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.930 20.530 -1.073 1.00 0.00 O ATOM 1295 OD2 ASP A 89 12.370 19.936 0.967 1.00 0.00 O ATOM 0 H ASP A 89 11.540 17.112 -2.821 1.00 0.00 H new ATOM 0 HA ASP A 89 13.512 17.619 -0.818 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.184 18.836 -1.803 1.00 0.00 H new ATOM 0 HB3 ASP A 89 10.744 18.358 -0.176 1.00 0.00 H new ATOM 1300 N GLY A 90 11.170 15.430 -0.192 1.00 0.00 N ATOM 1301 CA GLY A 90 10.746 14.423 0.763 1.00 0.00 C ATOM 1302 C GLY A 90 9.277 14.540 1.117 1.00 0.00 C ATOM 1303 O GLY A 90 8.892 14.349 2.270 1.00 0.00 O ATOM 0 H GLY A 90 10.700 15.388 -1.096 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.939 13.432 0.351 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.343 14.513 1.670 1.00 0.00 H new ATOM 1307 N LEU A 91 8.454 14.856 0.123 1.00 0.00 N ATOM 1308 CA LEU A 91 7.017 15.000 0.335 1.00 0.00 C ATOM 1309 C LEU A 91 6.232 14.165 -0.671 1.00 0.00 C ATOM 1310 O LEU A 91 6.347 14.363 -1.881 1.00 0.00 O ATOM 1311 CB LEU A 91 6.608 16.470 0.226 1.00 0.00 C ATOM 1312 CG LEU A 91 5.179 16.779 0.674 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.150 17.160 2.146 1.00 0.00 C ATOM 1314 CD2 LEU A 91 4.582 17.891 -0.177 1.00 0.00 C ATOM 0 H LEU A 91 8.757 15.017 -0.838 1.00 0.00 H new ATOM 0 HA LEU A 91 6.786 14.640 1.337 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.297 17.068 0.822 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.725 16.788 -0.810 1.00 0.00 H new ATOM 0 HG LEU A 91 4.576 15.881 0.540 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.125 17.376 2.446 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.536 16.334 2.743 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.768 18.043 2.305 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.565 18.098 0.156 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.187 18.792 -0.075 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.566 17.581 -1.222 1.00 0.00 H new ATOM 1326 N VAL A 92 5.432 13.234 -0.164 1.00 0.00 N ATOM 1327 CA VAL A 92 4.625 12.371 -1.018 1.00 0.00 C ATOM 1328 C VAL A 92 3.611 13.183 -1.815 1.00 0.00 C ATOM 1329 O VAL A 92 2.727 13.824 -1.243 1.00 0.00 O ATOM 1330 CB VAL A 92 3.881 11.302 -0.195 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.171 10.317 -1.113 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.841 10.576 0.735 1.00 0.00 C ATOM 0 H VAL A 92 5.325 13.058 0.835 1.00 0.00 H new ATOM 0 HA VAL A 92 5.310 11.875 -1.706 1.00 0.00 H new ATOM 0 HB VAL A 92 3.129 11.802 0.416 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.651 9.570 -0.513 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.450 10.851 -1.732 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.903 9.824 -1.753 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.296 9.825 1.307 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.619 10.089 0.147 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.297 11.292 1.418 1.00 0.00 H new ATOM 1342 N VAL A 93 3.742 13.152 -3.137 1.00 0.00 N ATOM 1343 CA VAL A 93 2.836 13.887 -4.012 1.00 0.00 C ATOM 1344 C VAL A 93 2.534 13.097 -5.280 1.00 0.00 C ATOM 1345 O VAL A 93 3.442 12.585 -5.936 1.00 0.00 O ATOM 1346 CB VAL A 93 3.420 15.257 -4.402 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.383 16.211 -3.217 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.840 15.103 -4.926 1.00 0.00 C ATOM 0 H VAL A 93 4.466 12.626 -3.626 1.00 0.00 H new ATOM 0 HA VAL A 93 1.912 14.039 -3.454 1.00 0.00 H new ATOM 0 HB VAL A 93 2.807 15.679 -5.198 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.800 17.174 -3.512 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.352 16.347 -2.891 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.971 15.797 -2.398 1.00 0.00 H new ATOM 0 HG21 VAL A 93 5.236 16.082 -5.197 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.467 14.659 -4.153 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.836 14.458 -5.805 1.00 0.00 H new ATOM 1358 N GLY A 94 1.252 12.999 -5.619 1.00 0.00 N ATOM 1359 CA GLY A 94 0.853 12.268 -6.808 1.00 0.00 C ATOM 1360 C GLY A 94 0.525 13.184 -7.970 1.00 0.00 C ATOM 1361 O GLY A 94 -0.530 13.818 -7.990 1.00 0.00 O ATOM 0 H GLY A 94 0.483 13.413 -5.092 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.655 11.590 -7.100 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.017 11.653 -6.578 1.00 0.00 H new ATOM 1365 N ARG A 95 1.430 13.255 -8.940 1.00 0.00 N ATOM 1366 CA ARG A 95 1.231 14.101 -10.112 1.00 0.00 C ATOM 1367 C ARG A 95 2.326 13.860 -11.147 1.00 0.00 C ATOM 1368 O ARG A 95 3.106 14.758 -11.464 1.00 0.00 O ATOM 1369 CB ARG A 95 1.210 15.575 -9.704 1.00 0.00 C ATOM 1370 CG ARG A 95 2.343 15.964 -8.768 1.00 0.00 C ATOM 1371 CD ARG A 95 2.361 17.461 -8.506 1.00 0.00 C ATOM 1372 NE ARG A 95 3.721 17.996 -8.482 1.00 0.00 N ATOM 1373 CZ ARG A 95 4.009 19.293 -8.545 1.00 0.00 C ATOM 1374 NH1 ARG A 95 3.036 20.193 -8.633 1.00 0.00 N ATOM 1375 NH2 ARG A 95 5.272 19.695 -8.518 1.00 0.00 N ATOM 0 H ARG A 95 2.309 12.737 -8.938 1.00 0.00 H new ATOM 0 HA ARG A 95 0.271 13.843 -10.559 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.263 16.192 -10.601 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.258 15.796 -9.220 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.236 15.430 -7.824 1.00 0.00 H new ATOM 0 HG3 ARG A 95 3.295 15.658 -9.201 1.00 0.00 H new ATOM 0 HD2 ARG A 95 1.784 17.971 -9.278 1.00 0.00 H new ATOM 0 HD3 ARG A 95 1.873 17.668 -7.554 1.00 0.00 H new ATOM 0 HE ARG A 95 4.495 17.335 -8.413 1.00 0.00 H new ATOM 0 HH11 ARG A 95 2.062 19.891 -8.653 1.00 0.00 H new ATOM 0 HH12 ARG A 95 3.263 21.186 -8.681 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.024 19.009 -8.449 1.00 0.00 H new ATOM 0 HH22 ARG A 95 5.492 20.690 -8.566 1.00 0.00 H new ATOM 1389 N SER A 96 2.378 12.639 -11.671 1.00 0.00 N ATOM 1390 CA SER A 96 3.378 12.277 -12.670 1.00 0.00 C ATOM 1391 C SER A 96 2.717 11.758 -13.944 1.00 0.00 C ATOM 1392 O SER A 96 3.163 12.059 -15.052 1.00 0.00 O ATOM 1393 CB SER A 96 4.329 11.219 -12.109 1.00 0.00 C ATOM 1394 OG SER A 96 5.365 10.924 -13.030 1.00 0.00 O ATOM 0 H SER A 96 1.740 11.884 -11.421 1.00 0.00 H new ATOM 0 HA SER A 96 3.946 13.174 -12.918 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.761 11.573 -11.173 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.772 10.310 -11.880 1.00 0.00 H new ATOM 0 HG SER A 96 5.315 9.980 -13.288 1.00 0.00 H new ATOM 1400 N ASP A 97 1.654 10.975 -13.780 1.00 0.00 N ATOM 1401 CA ASP A 97 0.935 10.412 -14.917 1.00 0.00 C ATOM 1402 C ASP A 97 1.807 9.413 -15.670 1.00 0.00 C ATOM 1403 O ASP A 97 1.687 9.261 -16.886 1.00 0.00 O ATOM 1404 CB ASP A 97 0.476 11.524 -15.865 1.00 0.00 C ATOM 1405 CG ASP A 97 -0.233 12.649 -15.136 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -1.075 12.352 -14.262 1.00 0.00 O ATOM 1407 OD2 ASP A 97 0.053 13.826 -15.439 1.00 0.00 O ATOM 0 H ASP A 97 1.272 10.717 -12.870 1.00 0.00 H new ATOM 0 HA ASP A 97 0.058 9.888 -14.535 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.340 11.926 -16.395 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.192 11.104 -16.617 1.00 0.00 H new ATOM 1412 N ALA A 98 2.684 8.735 -14.939 1.00 0.00 N ATOM 1413 CA ALA A 98 3.579 7.750 -15.534 1.00 0.00 C ATOM 1414 C ALA A 98 4.407 7.044 -14.464 1.00 0.00 C ATOM 1415 O ALA A 98 4.828 7.661 -13.486 1.00 0.00 O ATOM 1416 CB ALA A 98 4.488 8.412 -16.557 1.00 0.00 C ATOM 0 H ALA A 98 2.794 8.850 -13.932 1.00 0.00 H new ATOM 0 HA ALA A 98 2.970 7.000 -16.039 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.151 7.664 -16.993 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.883 8.863 -17.343 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.083 9.184 -16.069 1.00 0.00 H new ATOM 1422 N ILE A 99 4.635 5.750 -14.657 1.00 0.00 N ATOM 1423 CA ILE A 99 5.413 4.963 -13.707 1.00 0.00 C ATOM 1424 C ILE A 99 6.876 5.393 -13.707 1.00 0.00 C ATOM 1425 O ILE A 99 7.663 4.955 -14.545 1.00 0.00 O ATOM 1426 CB ILE A 99 5.332 3.456 -14.024 1.00 0.00 C ATOM 1427 CG1 ILE A 99 3.873 3.023 -14.185 1.00 0.00 C ATOM 1428 CG2 ILE A 99 6.013 2.646 -12.932 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.709 1.553 -14.502 1.00 0.00 C ATOM 0 H ILE A 99 4.293 5.224 -15.461 1.00 0.00 H new ATOM 0 HA ILE A 99 4.983 5.142 -12.721 1.00 0.00 H new ATOM 0 HB ILE A 99 5.852 3.270 -14.964 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.332 3.251 -13.267 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.414 3.611 -14.980 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.947 1.585 -13.171 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.061 2.938 -12.863 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.520 2.834 -11.978 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.649 1.318 -14.602 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.221 1.323 -15.436 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.138 0.957 -13.696 1.00 0.00 H new ATOM 1441 N GLY A 100 7.233 6.254 -12.759 1.00 0.00 N ATOM 1442 CA GLY A 100 8.601 6.730 -12.666 1.00 0.00 C ATOM 1443 C GLY A 100 9.370 6.071 -11.536 1.00 0.00 C ATOM 1444 O GLY A 100 8.782 5.376 -10.707 1.00 0.00 O ATOM 0 H GLY A 100 6.599 6.630 -12.054 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.113 6.540 -13.609 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.597 7.810 -12.517 1.00 0.00 H new ATOM 1448 N PRO A 101 10.697 6.273 -11.476 1.00 0.00 N ATOM 1449 CA PRO A 101 11.539 5.685 -10.428 1.00 0.00 C ATOM 1450 C PRO A 101 11.049 6.035 -9.027 1.00 0.00 C ATOM 1451 O PRO A 101 10.859 5.155 -8.186 1.00 0.00 O ATOM 1452 CB PRO A 101 12.916 6.305 -10.682 1.00 0.00 C ATOM 1453 CG PRO A 101 12.899 6.698 -12.119 1.00 0.00 C ATOM 1454 CD PRO A 101 11.480 7.086 -12.424 1.00 0.00 C ATOM 0 HA PRO A 101 11.535 4.596 -10.469 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.086 7.168 -10.038 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.715 5.592 -10.477 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.579 7.529 -12.305 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.223 5.873 -12.753 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.313 8.153 -12.273 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.216 6.865 -13.458 1.00 0.00 H new ATOM 1462 N ARG A 102 10.844 7.325 -8.781 1.00 0.00 N ATOM 1463 CA ARG A 102 10.376 7.792 -7.482 1.00 0.00 C ATOM 1464 C ARG A 102 9.005 7.209 -7.154 1.00 0.00 C ATOM 1465 O ARG A 102 8.696 6.939 -5.993 1.00 0.00 O ATOM 1466 CB ARG A 102 10.313 9.320 -7.459 1.00 0.00 C ATOM 1467 CG ARG A 102 11.655 9.989 -7.705 1.00 0.00 C ATOM 1468 CD ARG A 102 11.487 11.439 -8.129 1.00 0.00 C ATOM 1469 NE ARG A 102 12.724 11.999 -8.667 1.00 0.00 N ATOM 1470 CZ ARG A 102 13.162 11.776 -9.905 1.00 0.00 C ATOM 1471 NH1 ARG A 102 12.467 11.006 -10.733 1.00 0.00 N ATOM 1472 NH2 ARG A 102 14.297 12.324 -10.314 1.00 0.00 N ATOM 0 H ARG A 102 10.995 8.066 -9.465 1.00 0.00 H new ATOM 0 HA ARG A 102 11.084 7.453 -6.726 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.604 9.657 -8.215 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.926 9.645 -6.493 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.258 9.942 -6.798 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.198 9.444 -8.477 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.701 11.508 -8.881 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.163 12.032 -7.274 1.00 0.00 H new ATOM 0 HE ARG A 102 13.285 12.596 -8.059 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.593 10.582 -10.422 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.807 10.838 -11.680 1.00 0.00 H new ATOM 0 HH21 ARG A 102 14.835 12.916 -9.681 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.633 12.154 -11.262 1.00 0.00 H new ATOM 1486 N GLU A 103 8.187 7.018 -8.183 1.00 0.00 N ATOM 1487 CA GLU A 103 6.849 6.467 -8.003 1.00 0.00 C ATOM 1488 C GLU A 103 6.912 5.050 -7.439 1.00 0.00 C ATOM 1489 O GLU A 103 5.991 4.603 -6.757 1.00 0.00 O ATOM 1490 CB GLU A 103 6.093 6.465 -9.333 1.00 0.00 C ATOM 1491 CG GLU A 103 5.583 7.837 -9.745 1.00 0.00 C ATOM 1492 CD GLU A 103 6.680 8.882 -9.775 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.792 8.563 -10.248 1.00 0.00 O ATOM 1494 OE2 GLU A 103 6.429 10.020 -9.326 1.00 0.00 O ATOM 0 H GLU A 103 8.427 7.236 -9.150 1.00 0.00 H new ATOM 0 HA GLU A 103 6.318 7.098 -7.290 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.749 6.081 -10.114 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.249 5.779 -9.261 1.00 0.00 H new ATOM 0 HG2 GLU A 103 5.124 7.769 -10.731 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.803 8.154 -9.052 1.00 0.00 H new ATOM 1501 N GLN A 104 8.004 4.350 -7.729 1.00 0.00 N ATOM 1502 CA GLN A 104 8.185 2.984 -7.250 1.00 0.00 C ATOM 1503 C GLN A 104 8.190 2.936 -5.725 1.00 0.00 C ATOM 1504 O GLN A 104 8.707 3.838 -5.067 1.00 0.00 O ATOM 1505 CB GLN A 104 9.490 2.400 -7.793 1.00 0.00 C ATOM 1506 CG GLN A 104 9.600 2.458 -9.309 1.00 0.00 C ATOM 1507 CD GLN A 104 10.988 2.109 -9.805 1.00 0.00 C ATOM 1508 OE1 GLN A 104 11.856 1.710 -9.029 1.00 0.00 O ATOM 1509 NE2 GLN A 104 11.206 2.258 -11.107 1.00 0.00 N ATOM 0 H GLN A 104 8.776 4.705 -8.293 1.00 0.00 H new ATOM 0 HA GLN A 104 7.348 2.386 -7.611 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.330 2.940 -7.355 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.576 1.362 -7.470 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.877 1.771 -9.749 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.337 3.459 -9.651 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.458 2.592 -11.714 1.00 0.00 H new ATOM 0 HE22 GLN A 104 12.122 2.039 -11.499 1.00 0.00 H new ATOM 1518 N TRP A 105 7.614 1.874 -5.170 1.00 0.00 N ATOM 1519 CA TRP A 105 7.554 1.704 -3.723 1.00 0.00 C ATOM 1520 C TRP A 105 8.137 0.355 -3.312 1.00 0.00 C ATOM 1521 O TRP A 105 8.227 -0.565 -4.124 1.00 0.00 O ATOM 1522 CB TRP A 105 6.108 1.819 -3.234 1.00 0.00 C ATOM 1523 CG TRP A 105 5.480 3.143 -3.543 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.692 3.445 -4.617 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.586 4.345 -2.772 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.303 4.761 -4.560 1.00 0.00 N ATOM 1527 CE2 TRP A 105 4.838 5.335 -3.438 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.240 4.681 -1.583 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.727 6.636 -2.954 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.129 5.973 -1.104 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.378 6.936 -1.788 1.00 0.00 C ATOM 0 H TRP A 105 7.182 1.118 -5.701 1.00 0.00 H new ATOM 0 HA TRP A 105 8.148 2.493 -3.263 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.514 1.028 -3.691 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.082 1.655 -2.157 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.415 2.751 -5.397 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.711 5.234 -5.243 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.821 3.945 -1.048 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.148 7.381 -3.480 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.630 6.244 -0.187 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.311 7.937 -1.387 1.00 0.00 H new ATOM 1542 N GLU A 106 8.531 0.245 -2.048 1.00 0.00 N ATOM 1543 CA GLU A 106 9.107 -0.992 -1.533 1.00 0.00 C ATOM 1544 C GLU A 106 8.525 -1.339 -0.163 1.00 0.00 C ATOM 1545 O GLU A 106 8.975 -0.819 0.858 1.00 0.00 O ATOM 1546 CB GLU A 106 10.629 -0.867 -1.434 1.00 0.00 C ATOM 1547 CG GLU A 106 11.331 -2.192 -1.177 1.00 0.00 C ATOM 1548 CD GLU A 106 12.092 -2.203 0.135 1.00 0.00 C ATOM 1549 OE1 GLU A 106 12.841 -1.238 0.395 1.00 0.00 O ATOM 1550 OE2 GLU A 106 11.942 -3.178 0.901 1.00 0.00 O ATOM 0 H GLU A 106 8.462 0.996 -1.362 1.00 0.00 H new ATOM 0 HA GLU A 106 8.857 -1.794 -2.227 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.011 -0.436 -2.359 1.00 0.00 H new ATOM 0 HB3 GLU A 106 10.877 -0.172 -0.632 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.594 -2.995 -1.172 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.021 -2.398 -1.995 1.00 0.00 H new ATOM 1557 N PRO A 107 7.515 -2.226 -0.121 1.00 0.00 N ATOM 1558 CA PRO A 107 6.880 -2.637 1.135 1.00 0.00 C ATOM 1559 C PRO A 107 7.803 -3.495 1.994 1.00 0.00 C ATOM 1560 O PRO A 107 8.577 -4.300 1.476 1.00 0.00 O ATOM 1561 CB PRO A 107 5.669 -3.449 0.675 1.00 0.00 C ATOM 1562 CG PRO A 107 6.047 -3.961 -0.672 1.00 0.00 C ATOM 1563 CD PRO A 107 6.915 -2.899 -1.289 1.00 0.00 C ATOM 0 HA PRO A 107 6.621 -1.782 1.760 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.455 -4.266 1.364 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.773 -2.831 0.626 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.583 -4.907 -0.594 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.163 -4.145 -1.282 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.676 -3.330 -1.939 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.332 -2.206 -1.896 1.00 0.00 H new ATOM 1571 N VAL A 108 7.717 -3.318 3.308 1.00 0.00 N ATOM 1572 CA VAL A 108 8.547 -4.077 4.236 1.00 0.00 C ATOM 1573 C VAL A 108 7.723 -4.609 5.405 1.00 0.00 C ATOM 1574 O VAL A 108 6.748 -3.986 5.824 1.00 0.00 O ATOM 1575 CB VAL A 108 9.702 -3.220 4.786 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.669 -4.078 5.588 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.424 -2.508 3.653 1.00 0.00 C ATOM 0 H VAL A 108 7.082 -2.656 3.754 1.00 0.00 H new ATOM 0 HA VAL A 108 8.960 -4.916 3.676 1.00 0.00 H new ATOM 0 HB VAL A 108 9.285 -2.465 5.452 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.478 -3.455 5.969 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.141 -4.537 6.424 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.081 -4.857 4.947 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.237 -1.907 4.060 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.830 -3.245 2.960 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.724 -1.861 3.125 1.00 0.00 H new ATOM 1587 N PHE A 109 8.124 -5.764 5.926 1.00 0.00 N ATOM 1588 CA PHE A 109 7.425 -6.381 7.047 1.00 0.00 C ATOM 1589 C PHE A 109 8.386 -6.656 8.199 1.00 0.00 C ATOM 1590 O PHE A 109 9.444 -7.257 8.008 1.00 0.00 O ATOM 1591 CB PHE A 109 6.757 -7.684 6.605 1.00 0.00 C ATOM 1592 CG PHE A 109 5.620 -7.479 5.644 1.00 0.00 C ATOM 1593 CD1 PHE A 109 5.863 -7.110 4.331 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.309 -7.659 6.054 1.00 0.00 C ATOM 1595 CE1 PHE A 109 4.818 -6.921 3.445 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.261 -7.472 5.174 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.516 -7.103 3.867 1.00 0.00 C ATOM 0 H PHE A 109 8.930 -6.292 5.590 1.00 0.00 H new ATOM 0 HA PHE A 109 6.658 -5.687 7.392 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.504 -8.326 6.139 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.388 -8.211 7.485 1.00 0.00 H new ATOM 0 HD1 PHE A 109 6.880 -6.968 3.996 1.00 0.00 H new ATOM 0 HD2 PHE A 109 4.104 -7.949 7.074 1.00 0.00 H new ATOM 0 HE1 PHE A 109 5.020 -6.631 2.424 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.243 -7.614 5.507 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.698 -6.957 3.177 1.00 0.00 H new ATOM 1607 N GLN A 110 8.014 -6.211 9.395 1.00 0.00 N ATOM 1608 CA GLN A 110 8.845 -6.411 10.576 1.00 0.00 C ATOM 1609 C GLN A 110 7.988 -6.737 11.796 1.00 0.00 C ATOM 1610 O GLN A 110 7.102 -5.969 12.168 1.00 0.00 O ATOM 1611 CB GLN A 110 9.691 -5.163 10.846 1.00 0.00 C ATOM 1612 CG GLN A 110 11.179 -5.450 10.955 1.00 0.00 C ATOM 1613 CD GLN A 110 11.823 -4.750 12.136 1.00 0.00 C ATOM 1614 OE1 GLN A 110 11.771 -3.526 12.252 1.00 0.00 O ATOM 1615 NE2 GLN A 110 12.437 -5.527 13.021 1.00 0.00 N ATOM 0 H GLN A 110 7.143 -5.710 9.571 1.00 0.00 H new ATOM 0 HA GLN A 110 9.508 -7.256 10.387 1.00 0.00 H new ATOM 0 HB2 GLN A 110 9.526 -4.442 10.045 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.351 -4.696 11.770 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.332 -6.525 11.047 1.00 0.00 H new ATOM 0 HG3 GLN A 110 11.674 -5.135 10.036 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.456 -6.538 12.886 1.00 0.00 H new ATOM 0 HE22 GLN A 110 12.890 -5.113 13.836 1.00 0.00 H new ATOM 1624 N ASP A 111 8.262 -7.882 12.415 1.00 0.00 N ATOM 1625 CA ASP A 111 7.517 -8.311 13.593 1.00 0.00 C ATOM 1626 C ASP A 111 6.032 -8.452 13.278 1.00 0.00 C ATOM 1627 O ASP A 111 5.181 -8.250 14.144 1.00 0.00 O ATOM 1628 CB ASP A 111 7.715 -7.314 14.736 1.00 0.00 C ATOM 1629 CG ASP A 111 9.099 -7.404 15.349 1.00 0.00 C ATOM 1630 OD1 ASP A 111 9.473 -8.500 15.815 1.00 0.00 O ATOM 1631 OD2 ASP A 111 9.811 -6.377 15.361 1.00 0.00 O ATOM 0 H ASP A 111 8.994 -8.528 12.120 1.00 0.00 H new ATOM 0 HA ASP A 111 7.898 -9.286 13.898 1.00 0.00 H new ATOM 0 HB2 ASP A 111 7.550 -6.303 14.365 1.00 0.00 H new ATOM 0 HB3 ASP A 111 6.967 -7.496 15.507 1.00 0.00 H new ATOM 1636 N GLY A 112 5.727 -8.800 12.032 1.00 0.00 N ATOM 1637 CA GLY A 112 4.343 -8.963 11.624 1.00 0.00 C ATOM 1638 C GLY A 112 3.782 -7.718 10.967 1.00 0.00 C ATOM 1639 O GLY A 112 2.997 -7.807 10.022 1.00 0.00 O ATOM 0 H GLY A 112 6.413 -8.972 11.297 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.268 -9.801 10.931 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.738 -9.215 12.495 1.00 0.00 H new ATOM 1643 N LYS A 113 4.184 -6.554 11.467 1.00 0.00 N ATOM 1644 CA LYS A 113 3.717 -5.285 10.923 1.00 0.00 C ATOM 1645 C LYS A 113 4.127 -5.136 9.461 1.00 0.00 C ATOM 1646 O LYS A 113 4.768 -6.020 8.892 1.00 0.00 O ATOM 1647 CB LYS A 113 4.274 -4.119 11.742 1.00 0.00 C ATOM 1648 CG LYS A 113 3.517 -3.870 13.037 1.00 0.00 C ATOM 1649 CD LYS A 113 4.464 -3.565 14.187 1.00 0.00 C ATOM 1650 CE LYS A 113 3.904 -2.486 15.100 1.00 0.00 C ATOM 1651 NZ LYS A 113 4.443 -2.594 16.483 1.00 0.00 N ATOM 0 H LYS A 113 4.833 -6.464 12.249 1.00 0.00 H new ATOM 0 HA LYS A 113 2.629 -5.273 10.980 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.321 -4.316 11.975 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.247 -3.214 11.135 1.00 0.00 H new ATOM 0 HG2 LYS A 113 2.827 -3.037 12.902 1.00 0.00 H new ATOM 0 HG3 LYS A 113 2.916 -4.745 13.282 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.643 -4.473 14.763 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.427 -3.244 13.791 1.00 0.00 H new ATOM 0 HE2 LYS A 113 4.145 -1.504 14.692 1.00 0.00 H new ATOM 0 HE3 LYS A 113 2.817 -2.562 15.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 3.974 -1.895 17.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.265 -3.550 16.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 5.467 -2.412 16.472 1.00 0.00 H new ATOM 1665 N MET A 114 3.754 -4.012 8.859 1.00 0.00 N ATOM 1666 CA MET A 114 4.083 -3.747 7.462 1.00 0.00 C ATOM 1667 C MET A 114 4.211 -2.249 7.208 1.00 0.00 C ATOM 1668 O MET A 114 3.502 -1.443 7.812 1.00 0.00 O ATOM 1669 CB MET A 114 3.015 -4.343 6.543 1.00 0.00 C ATOM 1670 CG MET A 114 1.600 -3.920 6.901 1.00 0.00 C ATOM 1671 SD MET A 114 0.357 -5.082 6.306 1.00 0.00 S ATOM 1672 CE MET A 114 0.595 -6.444 7.443 1.00 0.00 C ATOM 0 H MET A 114 3.224 -3.270 9.316 1.00 0.00 H new ATOM 0 HA MET A 114 5.042 -4.217 7.245 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.225 -4.046 5.515 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.081 -5.430 6.581 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.516 -3.827 7.984 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.402 -2.934 6.480 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.586 -7.384 6.892 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.553 -6.331 7.951 1.00 0.00 H new ATOM 0 HE3 MET A 114 -0.208 -6.448 8.180 1.00 0.00 H new ATOM 1682 N ALA A 115 5.121 -1.882 6.311 1.00 0.00 N ATOM 1683 CA ALA A 115 5.343 -0.481 5.976 1.00 0.00 C ATOM 1684 C ALA A 115 5.705 -0.320 4.504 1.00 0.00 C ATOM 1685 O ALA A 115 6.169 -1.263 3.863 1.00 0.00 O ATOM 1686 CB ALA A 115 6.434 0.105 6.857 1.00 0.00 C ATOM 0 H ALA A 115 5.716 -2.536 5.803 1.00 0.00 H new ATOM 0 HA ALA A 115 4.415 0.062 6.156 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.589 1.152 6.596 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.135 0.032 7.903 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.361 -0.448 6.705 1.00 0.00 H new ATOM 1692 N LEU A 116 5.489 0.879 3.973 1.00 0.00 N ATOM 1693 CA LEU A 116 5.795 1.164 2.575 1.00 0.00 C ATOM 1694 C LEU A 116 6.972 2.125 2.459 1.00 0.00 C ATOM 1695 O LEU A 116 6.817 3.335 2.623 1.00 0.00 O ATOM 1696 CB LEU A 116 4.569 1.753 1.874 1.00 0.00 C ATOM 1697 CG LEU A 116 4.697 1.891 0.356 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.609 0.527 -0.312 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.622 2.823 -0.185 1.00 0.00 C ATOM 0 H LEU A 116 5.103 1.669 4.489 1.00 0.00 H new ATOM 0 HA LEU A 116 6.068 0.226 2.091 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.706 1.125 2.095 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.365 2.736 2.297 1.00 0.00 H new ATOM 0 HG LEU A 116 5.672 2.322 0.128 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.702 0.644 -1.392 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.414 -0.110 0.055 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.648 0.069 -0.078 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.727 2.911 -1.266 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.638 2.420 0.053 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.731 3.807 0.271 1.00 0.00 H new ATOM 1711 N LEU A 117 8.150 1.579 2.175 1.00 0.00 N ATOM 1712 CA LEU A 117 9.354 2.389 2.037 1.00 0.00 C ATOM 1713 C LEU A 117 9.402 3.065 0.671 1.00 0.00 C ATOM 1714 O LEU A 117 9.199 2.420 -0.359 1.00 0.00 O ATOM 1715 CB LEU A 117 10.602 1.527 2.234 1.00 0.00 C ATOM 1716 CG LEU A 117 11.930 2.286 2.164 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.477 2.537 3.560 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.941 1.517 1.324 1.00 0.00 C ATOM 0 H LEU A 117 8.296 0.579 2.036 1.00 0.00 H new ATOM 0 HA LEU A 117 9.329 3.162 2.805 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.534 1.032 3.203 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.608 0.744 1.476 1.00 0.00 H new ATOM 0 HG LEU A 117 11.750 3.250 1.688 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.421 3.077 3.489 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.761 3.130 4.130 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.641 1.584 4.063 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.879 2.071 1.285 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.116 0.538 1.771 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.553 1.390 0.313 1.00 0.00 H new ATOM 1730 N ALA A 118 9.671 4.365 0.668 1.00 0.00 N ATOM 1731 CA ALA A 118 9.747 5.127 -0.572 1.00 0.00 C ATOM 1732 C ALA A 118 11.053 4.850 -1.307 1.00 0.00 C ATOM 1733 O ALA A 118 11.963 4.225 -0.762 1.00 0.00 O ATOM 1734 CB ALA A 118 9.605 6.615 -0.287 1.00 0.00 C ATOM 0 H ALA A 118 9.840 4.914 1.511 1.00 0.00 H new ATOM 0 HA ALA A 118 8.925 4.811 -1.214 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.664 7.172 -1.222 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.642 6.804 0.188 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.407 6.936 0.377 1.00 0.00 H new ATOM 1740 N SER A 119 11.141 5.322 -2.545 1.00 0.00 N ATOM 1741 CA SER A 119 12.338 5.126 -3.356 1.00 0.00 C ATOM 1742 C SER A 119 13.496 5.985 -2.849 1.00 0.00 C ATOM 1743 O SER A 119 14.633 5.830 -3.295 1.00 0.00 O ATOM 1744 CB SER A 119 12.046 5.459 -4.820 1.00 0.00 C ATOM 1745 OG SER A 119 13.165 5.175 -5.641 1.00 0.00 O ATOM 0 H SER A 119 10.398 5.843 -3.010 1.00 0.00 H new ATOM 0 HA SER A 119 12.629 4.078 -3.276 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.185 4.885 -5.162 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.783 6.513 -4.911 1.00 0.00 H new ATOM 0 HG SER A 119 13.981 5.194 -5.099 1.00 0.00 H new ATOM 1751 N ASN A 120 13.205 6.892 -1.918 1.00 0.00 N ATOM 1752 CA ASN A 120 14.230 7.769 -1.361 1.00 0.00 C ATOM 1753 C ASN A 120 14.786 7.208 -0.054 1.00 0.00 C ATOM 1754 O ASN A 120 15.295 7.954 0.783 1.00 0.00 O ATOM 1755 CB ASN A 120 13.657 9.168 -1.124 1.00 0.00 C ATOM 1756 CG ASN A 120 14.726 10.172 -0.742 1.00 0.00 C ATOM 1757 OD1 ASN A 120 15.835 10.150 -1.276 1.00 0.00 O ATOM 1758 ND2 ASN A 120 14.397 11.061 0.188 1.00 0.00 N ATOM 0 H ASN A 120 12.271 7.038 -1.535 1.00 0.00 H new ATOM 0 HA ASN A 120 15.046 7.831 -2.081 1.00 0.00 H new ATOM 0 HB2 ASN A 120 13.149 9.508 -2.027 1.00 0.00 H new ATOM 0 HB3 ASN A 120 12.907 9.122 -0.335 1.00 0.00 H new ATOM 0 HD21 ASN A 120 15.075 11.762 0.486 1.00 0.00 H new ATOM 0 HD22 ASN A 120 13.466 11.043 0.604 1.00 0.00 H new ATOM 1765 N SER A 121 14.690 5.892 0.115 1.00 0.00 N ATOM 1766 CA SER A 121 15.188 5.236 1.320 1.00 0.00 C ATOM 1767 C SER A 121 14.588 5.863 2.575 1.00 0.00 C ATOM 1768 O SER A 121 15.233 5.920 3.621 1.00 0.00 O ATOM 1769 CB SER A 121 16.715 5.317 1.376 1.00 0.00 C ATOM 1770 OG SER A 121 17.142 6.609 1.771 1.00 0.00 O ATOM 0 H SER A 121 14.272 5.259 -0.567 1.00 0.00 H new ATOM 0 HA SER A 121 14.886 4.189 1.282 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.096 4.574 2.077 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.131 5.076 0.398 1.00 0.00 H new ATOM 0 HG SER A 121 16.814 7.273 1.129 1.00 0.00 H new ATOM 1776 N CYS A 122 13.350 6.332 2.463 1.00 0.00 N ATOM 1777 CA CYS A 122 12.665 6.956 3.590 1.00 0.00 C ATOM 1778 C CYS A 122 11.244 6.420 3.729 1.00 0.00 C ATOM 1779 O CYS A 122 10.546 6.217 2.735 1.00 0.00 O ATOM 1780 CB CYS A 122 12.633 8.476 3.417 1.00 0.00 C ATOM 1781 SG CYS A 122 14.250 9.269 3.570 1.00 0.00 S ATOM 0 H CYS A 122 12.801 6.292 1.605 1.00 0.00 H new ATOM 0 HA CYS A 122 13.217 6.711 4.497 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.216 8.711 2.438 1.00 0.00 H new ATOM 0 HB3 CYS A 122 11.959 8.902 4.161 1.00 0.00 H new ATOM 0 HG CYS A 122 14.999 8.925 2.564 1.00 0.00 H new ATOM 1787 N PHE A 123 10.822 6.193 4.969 1.00 0.00 N ATOM 1788 CA PHE A 123 9.484 5.681 5.240 1.00 0.00 C ATOM 1789 C PHE A 123 8.443 6.788 5.112 1.00 0.00 C ATOM 1790 O PHE A 123 8.738 7.961 5.342 1.00 0.00 O ATOM 1791 CB PHE A 123 9.423 5.068 6.640 1.00 0.00 C ATOM 1792 CG PHE A 123 9.961 3.668 6.708 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.398 2.658 5.943 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.029 3.359 7.535 1.00 0.00 C ATOM 1795 CE1 PHE A 123 9.891 1.368 6.002 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.526 2.072 7.599 1.00 0.00 C ATOM 1797 CZ PHE A 123 10.956 1.074 6.831 1.00 0.00 C ATOM 0 H PHE A 123 11.388 6.356 5.802 1.00 0.00 H new ATOM 0 HA PHE A 123 9.261 4.909 4.503 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.986 5.698 7.328 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.388 5.068 6.982 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.565 2.882 5.294 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.479 4.135 8.137 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.444 0.591 5.400 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.359 1.846 8.248 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.342 0.067 6.879 1.00 0.00 H new ATOM 1807 N ILE A 124 7.223 6.408 4.744 1.00 0.00 N ATOM 1808 CA ILE A 124 6.139 7.369 4.586 1.00 0.00 C ATOM 1809 C ILE A 124 5.386 7.569 5.897 1.00 0.00 C ATOM 1810 O ILE A 124 5.427 6.717 6.784 1.00 0.00 O ATOM 1811 CB ILE A 124 5.142 6.918 3.501 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.678 5.484 3.763 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.775 7.034 2.121 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.179 5.306 3.668 1.00 0.00 C ATOM 0 H ILE A 124 6.961 5.441 4.550 1.00 0.00 H new ATOM 0 HA ILE A 124 6.595 8.312 4.283 1.00 0.00 H new ATOM 0 HB ILE A 124 4.270 7.571 3.537 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.161 4.818 3.047 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.010 5.179 4.756 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.060 6.712 1.364 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.057 8.070 1.936 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.662 6.403 2.073 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.923 4.265 3.865 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.689 5.946 4.402 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.843 5.579 2.668 1.00 0.00 H new ATOM 1826 N ARG A 125 4.700 8.702 6.011 1.00 0.00 N ATOM 1827 CA ARG A 125 3.937 9.015 7.214 1.00 0.00 C ATOM 1828 C ARG A 125 3.192 10.336 7.056 1.00 0.00 C ATOM 1829 O ARG A 125 3.554 11.169 6.224 1.00 0.00 O ATOM 1830 CB ARG A 125 4.864 9.081 8.431 1.00 0.00 C ATOM 1831 CG ARG A 125 5.890 10.199 8.354 1.00 0.00 C ATOM 1832 CD ARG A 125 6.847 10.158 9.534 1.00 0.00 C ATOM 1833 NE ARG A 125 6.177 10.468 10.795 1.00 0.00 N ATOM 1834 CZ ARG A 125 5.879 11.703 11.192 1.00 0.00 C ATOM 1835 NH1 ARG A 125 6.191 12.746 10.433 1.00 0.00 N ATOM 1836 NH2 ARG A 125 5.267 11.895 12.352 1.00 0.00 N ATOM 0 H ARG A 125 4.657 9.418 5.286 1.00 0.00 H new ATOM 0 HA ARG A 125 3.206 8.221 7.367 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.261 9.213 9.330 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.384 8.128 8.533 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.453 10.114 7.424 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.380 11.162 8.331 1.00 0.00 H new ATOM 0 HD2 ARG A 125 7.301 9.169 9.598 1.00 0.00 H new ATOM 0 HD3 ARG A 125 7.656 10.870 9.369 1.00 0.00 H new ATOM 0 HE ARG A 125 5.923 9.693 11.407 1.00 0.00 H new ATOM 0 HH11 ARG A 125 6.662 12.604 9.539 1.00 0.00 H new ATOM 0 HH12 ARG A 125 5.960 13.690 10.743 1.00 0.00 H new ATOM 0 HH21 ARG A 125 5.025 11.097 12.939 1.00 0.00 H new ATOM 0 HH22 ARG A 125 5.038 12.841 12.657 1.00 0.00 H new ATOM 1850 N CYS A 126 2.150 10.524 7.860 1.00 0.00 N ATOM 1851 CA CYS A 126 1.355 11.744 7.807 1.00 0.00 C ATOM 1852 C CYS A 126 1.706 12.672 8.965 1.00 0.00 C ATOM 1853 O CYS A 126 2.549 12.347 9.802 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.136 11.408 7.843 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.622 10.355 9.231 1.00 0.00 S ATOM 0 H CYS A 126 1.837 9.847 8.556 1.00 0.00 H new ATOM 0 HA CYS A 126 1.583 12.256 6.872 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.706 12.336 7.888 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.408 10.912 6.912 1.00 0.00 H new ATOM 0 HG CYS A 126 -1.644 10.882 9.838 1.00 0.00 H new ATOM 1861 N ASN A 127 1.054 13.830 9.008 1.00 0.00 N ATOM 1862 CA ASN A 127 1.297 14.806 10.064 1.00 0.00 C ATOM 1863 C ASN A 127 -0.016 15.271 10.687 1.00 0.00 C ATOM 1864 O ASN A 127 -1.060 15.268 10.034 1.00 0.00 O ATOM 1865 CB ASN A 127 2.065 16.007 9.509 1.00 0.00 C ATOM 1866 CG ASN A 127 3.550 15.732 9.380 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.250 15.552 10.377 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.041 15.701 8.146 1.00 0.00 N ATOM 0 H ASN A 127 0.353 14.115 8.324 1.00 0.00 H new ATOM 0 HA ASN A 127 1.896 14.326 10.838 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.661 16.274 8.532 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.912 16.866 10.162 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.034 15.523 7.997 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.425 15.855 7.348 1.00 0.00 H new ATOM 1875 N GLU A 128 0.044 15.671 11.952 1.00 0.00 N ATOM 1876 CA GLU A 128 -1.141 16.139 12.663 1.00 0.00 C ATOM 1877 C GLU A 128 -1.741 17.360 11.972 1.00 0.00 C ATOM 1878 O GLU A 128 -2.954 17.568 12.001 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.789 16.476 14.114 1.00 0.00 C ATOM 1880 CG GLU A 128 -1.275 15.438 15.113 1.00 0.00 C ATOM 1881 CD GLU A 128 -2.726 15.640 15.504 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -3.002 16.560 16.303 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -3.585 14.880 15.011 1.00 0.00 O ATOM 0 H GLU A 128 0.900 15.681 12.507 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.882 15.340 12.654 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.293 16.576 14.203 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.221 17.444 14.369 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.153 14.443 14.686 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -0.652 15.480 16.007 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.884 18.165 11.352 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.330 19.365 10.654 1.00 0.00 C ATOM 1892 C ALA A 129 -2.066 19.009 9.367 1.00 0.00 C ATOM 1893 O ALA A 129 -2.971 19.724 8.940 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.145 20.271 10.354 1.00 0.00 C ATOM 0 H ALA A 129 0.123 18.008 11.319 1.00 0.00 H new ATOM 0 HA ALA A 129 -2.025 19.897 11.303 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.492 21.163 9.833 1.00 0.00 H new ATOM 0 HB2 ALA A 129 0.337 20.561 11.288 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.570 19.739 9.726 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.669 17.898 8.753 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.302 17.467 7.520 1.00 0.00 C ATOM 1902 C GLY A 130 -1.337 17.443 6.351 1.00 0.00 C ATOM 1903 O GLY A 130 -1.626 17.993 5.288 1.00 0.00 O ATOM 0 H GLY A 130 -0.921 17.290 9.087 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.723 16.471 7.660 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -3.132 18.135 7.289 1.00 0.00 H new ATOM 1907 N ASP A 131 -0.188 16.806 6.547 1.00 0.00 N ATOM 1908 CA ASP A 131 0.824 16.713 5.500 1.00 0.00 C ATOM 1909 C ASP A 131 1.555 15.377 5.567 1.00 0.00 C ATOM 1910 O ASP A 131 1.906 14.903 6.649 1.00 0.00 O ATOM 1911 CB ASP A 131 1.825 17.863 5.626 1.00 0.00 C ATOM 1912 CG ASP A 131 1.157 19.222 5.559 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.504 19.513 4.535 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.285 19.995 6.531 1.00 0.00 O ATOM 0 H ASP A 131 0.066 16.346 7.421 1.00 0.00 H new ATOM 0 HA ASP A 131 0.321 16.783 4.536 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.362 17.772 6.570 1.00 0.00 H new ATOM 0 HB3 ASP A 131 2.565 17.786 4.830 1.00 0.00 H new ATOM 1919 N ILE A 132 1.782 14.774 4.405 1.00 0.00 N ATOM 1920 CA ILE A 132 2.473 13.491 4.332 1.00 0.00 C ATOM 1921 C ILE A 132 3.872 13.653 3.747 1.00 0.00 C ATOM 1922 O ILE A 132 4.034 14.144 2.629 1.00 0.00 O ATOM 1923 CB ILE A 132 1.687 12.476 3.480 1.00 0.00 C ATOM 1924 CG1 ILE A 132 0.221 12.438 3.914 1.00 0.00 C ATOM 1925 CG2 ILE A 132 2.314 11.095 3.590 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.639 11.530 3.062 1.00 0.00 C ATOM 0 H ILE A 132 1.498 15.152 3.501 1.00 0.00 H new ATOM 0 HA ILE A 132 2.549 13.115 5.352 1.00 0.00 H new ATOM 0 HB ILE A 132 1.728 12.791 2.437 1.00 0.00 H new ATOM 0 HG12 ILE A 132 0.166 12.108 4.951 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.186 13.449 3.879 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.748 10.389 2.983 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.344 11.134 3.236 1.00 0.00 H new ATOM 0 HG23 ILE A 132 2.300 10.771 4.631 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.666 11.553 3.428 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -0.615 11.872 2.027 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.257 10.511 3.117 1.00 0.00 H new ATOM 1938 N GLU A 133 4.878 13.238 4.509 1.00 0.00 N ATOM 1939 CA GLU A 133 6.264 13.338 4.065 1.00 0.00 C ATOM 1940 C GLU A 133 7.067 12.122 4.513 1.00 0.00 C ATOM 1941 O GLU A 133 6.588 11.303 5.299 1.00 0.00 O ATOM 1942 CB GLU A 133 6.904 14.616 4.609 1.00 0.00 C ATOM 1943 CG GLU A 133 6.634 14.851 6.087 1.00 0.00 C ATOM 1944 CD GLU A 133 7.800 15.512 6.795 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.932 15.000 6.679 1.00 0.00 O ATOM 1946 OE2 GLU A 133 7.579 16.542 7.467 1.00 0.00 O ATOM 0 H GLU A 133 4.760 12.830 5.436 1.00 0.00 H new ATOM 0 HA GLU A 133 6.270 13.373 2.976 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.981 14.570 4.448 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.533 15.469 4.040 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.747 15.475 6.196 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.414 13.898 6.568 1.00 0.00 H new ATOM 1953 N ALA A 134 8.292 12.010 4.010 1.00 0.00 N ATOM 1954 CA ALA A 134 9.162 10.894 4.358 1.00 0.00 C ATOM 1955 C ALA A 134 9.715 11.049 5.770 1.00 0.00 C ATOM 1956 O ALA A 134 9.462 12.050 6.441 1.00 0.00 O ATOM 1957 CB ALA A 134 10.299 10.778 3.353 1.00 0.00 C ATOM 0 H ALA A 134 8.704 12.679 3.360 1.00 0.00 H new ATOM 0 HA ALA A 134 8.569 9.980 4.327 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.941 9.940 3.625 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.889 10.612 2.357 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.883 11.699 3.356 1.00 0.00 H new ATOM 1963 N LYS A 135 10.473 10.052 6.216 1.00 0.00 N ATOM 1964 CA LYS A 135 11.062 10.077 7.550 1.00 0.00 C ATOM 1965 C LYS A 135 12.345 9.251 7.592 1.00 0.00 C ATOM 1966 O LYS A 135 12.640 8.498 6.665 1.00 0.00 O ATOM 1967 CB LYS A 135 10.064 9.546 8.581 1.00 0.00 C ATOM 1968 CG LYS A 135 10.129 10.262 9.920 1.00 0.00 C ATOM 1969 CD LYS A 135 9.940 11.763 9.762 1.00 0.00 C ATOM 1970 CE LYS A 135 11.247 12.515 9.959 1.00 0.00 C ATOM 1971 NZ LYS A 135 11.390 13.026 11.351 1.00 0.00 N ATOM 0 H LYS A 135 10.694 9.217 5.673 1.00 0.00 H new ATOM 0 HA LYS A 135 11.308 11.111 7.794 1.00 0.00 H new ATOM 0 HB2 LYS A 135 9.055 9.638 8.178 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.248 8.483 8.738 1.00 0.00 H new ATOM 0 HG2 LYS A 135 9.360 9.866 10.583 1.00 0.00 H new ATOM 0 HG3 LYS A 135 11.091 10.064 10.393 1.00 0.00 H new ATOM 0 HD2 LYS A 135 9.542 11.978 8.770 1.00 0.00 H new ATOM 0 HD3 LYS A 135 9.204 12.116 10.484 1.00 0.00 H new ATOM 0 HE2 LYS A 135 12.084 11.856 9.727 1.00 0.00 H new ATOM 0 HE3 LYS A 135 11.295 13.349 9.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 12.294 13.532 11.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 10.606 13.675 11.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 11.370 12.228 12.018 1.00 0.00 H new ATOM 1985 N ASN A 136 13.103 9.398 8.674 1.00 0.00 N ATOM 1986 CA ASN A 136 14.354 8.666 8.838 1.00 0.00 C ATOM 1987 C ASN A 136 14.121 7.160 8.748 1.00 0.00 C ATOM 1988 O ASN A 136 12.986 6.692 8.821 1.00 0.00 O ATOM 1989 CB ASN A 136 15.002 9.015 10.179 1.00 0.00 C ATOM 1990 CG ASN A 136 15.449 10.462 10.245 1.00 0.00 C ATOM 1991 OD1 ASN A 136 14.630 11.379 10.205 1.00 0.00 O ATOM 1992 ND2 ASN A 136 16.757 10.673 10.346 1.00 0.00 N ATOM 0 H ASN A 136 12.873 10.018 9.451 1.00 0.00 H new ATOM 0 HA ASN A 136 15.025 8.960 8.031 1.00 0.00 H new ATOM 0 HB2 ASN A 136 14.293 8.819 10.984 1.00 0.00 H new ATOM 0 HB3 ASN A 136 15.861 8.364 10.345 1.00 0.00 H new ATOM 0 HD21 ASN A 136 17.118 11.626 10.394 1.00 0.00 H new ATOM 0 HD22 ASN A 136 17.400 9.882 10.376 1.00 0.00 H new ATOM 1999 N LYS A 137 15.206 6.408 8.590 1.00 0.00 N ATOM 2000 CA LYS A 137 15.122 4.956 8.489 1.00 0.00 C ATOM 2001 C LYS A 137 14.474 4.358 9.734 1.00 0.00 C ATOM 2002 O LYS A 137 13.815 3.320 9.664 1.00 0.00 O ATOM 2003 CB LYS A 137 16.515 4.357 8.288 1.00 0.00 C ATOM 2004 CG LYS A 137 17.088 4.602 6.902 1.00 0.00 C ATOM 2005 CD LYS A 137 18.404 3.864 6.702 1.00 0.00 C ATOM 2006 CE LYS A 137 19.463 4.767 6.087 1.00 0.00 C ATOM 2007 NZ LYS A 137 20.219 4.079 5.004 1.00 0.00 N ATOM 0 H LYS A 137 16.154 6.781 8.529 1.00 0.00 H new ATOM 0 HA LYS A 137 14.501 4.713 7.627 1.00 0.00 H new ATOM 0 HB2 LYS A 137 17.193 4.777 9.032 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.469 3.283 8.469 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.370 4.278 6.148 1.00 0.00 H new ATOM 0 HG3 LYS A 137 17.244 5.671 6.756 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.759 3.486 7.661 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.243 2.999 6.058 1.00 0.00 H new ATOM 0 HE2 LYS A 137 18.988 5.662 5.686 1.00 0.00 H new ATOM 0 HE3 LYS A 137 20.156 5.094 6.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 20.931 4.728 4.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 20.693 3.239 5.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 19.562 3.789 4.252 1.00 0.00 H new ATOM 2021 N THR A 138 14.665 5.017 10.872 1.00 0.00 N ATOM 2022 CA THR A 138 14.099 4.549 12.131 1.00 0.00 C ATOM 2023 C THR A 138 12.575 4.545 12.073 1.00 0.00 C ATOM 2024 O THR A 138 11.935 5.587 12.207 1.00 0.00 O ATOM 2025 CB THR A 138 14.576 5.427 13.288 1.00 0.00 C ATOM 2026 OG1 THR A 138 14.549 6.796 12.924 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.981 5.101 13.747 1.00 0.00 C ATOM 0 H THR A 138 15.208 5.877 10.948 1.00 0.00 H new ATOM 0 HA THR A 138 14.441 3.527 12.297 1.00 0.00 H new ATOM 0 HB THR A 138 13.887 5.223 14.108 1.00 0.00 H new ATOM 0 HG1 THR A 138 13.692 7.004 12.496 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.257 5.760 14.570 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.023 4.065 14.083 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.676 5.243 12.920 1.00 0.00 H new ATOM 2035 N ALA A 139 11.999 3.364 11.873 1.00 0.00 N ATOM 2036 CA ALA A 139 10.550 3.222 11.796 1.00 0.00 C ATOM 2037 C ALA A 139 9.941 3.044 13.182 1.00 0.00 C ATOM 2038 O ALA A 139 10.244 2.079 13.884 1.00 0.00 O ATOM 2039 CB ALA A 139 10.182 2.049 10.900 1.00 0.00 C ATOM 0 H ALA A 139 12.514 2.491 11.761 1.00 0.00 H new ATOM 0 HA ALA A 139 10.142 4.136 11.365 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.097 1.955 10.852 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.577 2.219 9.898 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.608 1.132 11.307 1.00 0.00 H new ATOM 2045 N GLY A 140 9.082 3.980 13.571 1.00 0.00 N ATOM 2046 CA GLY A 140 8.444 3.906 14.872 1.00 0.00 C ATOM 2047 C GLY A 140 7.157 3.104 14.844 1.00 0.00 C ATOM 2048 O GLY A 140 6.754 2.603 13.795 1.00 0.00 O ATOM 0 H GLY A 140 8.816 4.788 13.009 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.133 3.455 15.586 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.232 4.915 15.227 1.00 0.00 H new ATOM 2052 N GLU A 141 6.514 2.983 16.000 1.00 0.00 N ATOM 2053 CA GLU A 141 5.265 2.236 16.105 1.00 0.00 C ATOM 2054 C GLU A 141 4.139 2.950 15.365 1.00 0.00 C ATOM 2055 O GLU A 141 3.226 2.312 14.840 1.00 0.00 O ATOM 2056 CB GLU A 141 4.887 2.041 17.576 1.00 0.00 C ATOM 2057 CG GLU A 141 4.599 0.594 17.943 1.00 0.00 C ATOM 2058 CD GLU A 141 4.673 0.346 19.437 1.00 0.00 C ATOM 2059 OE1 GLU A 141 3.683 0.647 20.137 1.00 0.00 O ATOM 2060 OE2 GLU A 141 5.719 -0.149 19.906 1.00 0.00 O ATOM 0 H GLU A 141 6.836 3.392 16.877 1.00 0.00 H new ATOM 0 HA GLU A 141 5.413 1.260 15.643 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.698 2.412 18.203 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.008 2.646 17.800 1.00 0.00 H new ATOM 0 HG2 GLU A 141 3.607 0.322 17.582 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.312 -0.055 17.435 1.00 0.00 H new ATOM 2067 N GLU A 142 4.210 4.276 15.326 1.00 0.00 N ATOM 2068 CA GLU A 142 3.195 5.076 14.650 1.00 0.00 C ATOM 2069 C GLU A 142 3.437 5.102 13.144 1.00 0.00 C ATOM 2070 O GLU A 142 2.493 5.101 12.354 1.00 0.00 O ATOM 2071 CB GLU A 142 3.190 6.503 15.201 1.00 0.00 C ATOM 2072 CG GLU A 142 4.567 7.143 15.249 1.00 0.00 C ATOM 2073 CD GLU A 142 4.506 8.643 15.467 1.00 0.00 C ATOM 2074 OE1 GLU A 142 3.937 9.344 14.605 1.00 0.00 O ATOM 2075 OE2 GLU A 142 5.026 9.115 16.500 1.00 0.00 O ATOM 0 H GLU A 142 4.959 4.820 15.754 1.00 0.00 H new ATOM 0 HA GLU A 142 2.224 4.618 14.837 1.00 0.00 H new ATOM 0 HB2 GLU A 142 2.534 7.119 14.585 1.00 0.00 H new ATOM 0 HB3 GLU A 142 2.768 6.494 16.206 1.00 0.00 H new ATOM 0 HG2 GLU A 142 5.148 6.686 16.050 1.00 0.00 H new ATOM 0 HG3 GLU A 142 5.092 6.936 14.317 1.00 0.00 H new ATOM 2082 N GLU A 143 4.707 5.124 12.754 1.00 0.00 N ATOM 2083 CA GLU A 143 5.072 5.149 11.342 1.00 0.00 C ATOM 2084 C GLU A 143 4.535 3.918 10.619 1.00 0.00 C ATOM 2085 O GLU A 143 4.228 3.969 9.428 1.00 0.00 O ATOM 2086 CB GLU A 143 6.593 5.226 11.189 1.00 0.00 C ATOM 2087 CG GLU A 143 7.113 6.639 10.985 1.00 0.00 C ATOM 2088 CD GLU A 143 7.748 7.211 12.237 1.00 0.00 C ATOM 2089 OE1 GLU A 143 8.898 6.835 12.545 1.00 0.00 O ATOM 2090 OE2 GLU A 143 7.095 8.039 12.909 1.00 0.00 O ATOM 0 H GLU A 143 5.500 5.125 13.395 1.00 0.00 H new ATOM 0 HA GLU A 143 4.624 6.035 10.891 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.061 4.800 12.076 1.00 0.00 H new ATOM 0 HB3 GLU A 143 6.896 4.610 10.342 1.00 0.00 H new ATOM 0 HG2 GLU A 143 7.845 6.640 10.177 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.292 7.283 10.671 1.00 0.00 H new ATOM 2097 N MET A 144 4.425 2.811 11.347 1.00 0.00 N ATOM 2098 CA MET A 144 3.925 1.566 10.775 1.00 0.00 C ATOM 2099 C MET A 144 2.515 1.749 10.222 1.00 0.00 C ATOM 2100 O MET A 144 1.655 2.343 10.873 1.00 0.00 O ATOM 2101 CB MET A 144 3.931 0.457 11.828 1.00 0.00 C ATOM 2102 CG MET A 144 5.318 0.131 12.360 1.00 0.00 C ATOM 2103 SD MET A 144 6.199 -1.051 11.322 1.00 0.00 S ATOM 2104 CE MET A 144 7.454 0.002 10.599 1.00 0.00 C ATOM 0 H MET A 144 4.675 2.751 12.334 1.00 0.00 H new ATOM 0 HA MET A 144 4.584 1.282 9.955 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.292 0.754 12.660 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.495 -0.444 11.397 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.900 1.050 12.433 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.231 -0.272 13.369 1.00 0.00 H new ATOM 0 HE1 MET A 144 7.780 -0.420 9.648 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.042 0.997 10.432 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.305 0.071 11.276 1.00 0.00 H new ATOM 2114 N ILE A 145 2.285 1.236 9.018 1.00 0.00 N ATOM 2115 CA ILE A 145 0.980 1.343 8.379 1.00 0.00 C ATOM 2116 C ILE A 145 0.279 -0.010 8.330 1.00 0.00 C ATOM 2117 O ILE A 145 0.831 -1.022 8.760 1.00 0.00 O ATOM 2118 CB ILE A 145 1.099 1.899 6.946 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.183 1.149 6.172 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.399 3.390 6.980 1.00 0.00 C ATOM 2121 CD1 ILE A 145 1.915 1.063 4.686 1.00 0.00 C ATOM 0 H ILE A 145 2.986 0.742 8.466 1.00 0.00 H new ATOM 0 HA ILE A 145 0.390 2.034 8.981 1.00 0.00 H new ATOM 0 HB ILE A 145 0.148 1.751 6.435 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.141 1.644 6.332 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.274 0.141 6.575 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.480 3.768 5.961 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.594 3.911 7.497 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.338 3.560 7.506 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.725 0.518 4.201 1.00 0.00 H new ATOM 0 HD12 ILE A 145 0.973 0.541 4.516 1.00 0.00 H new ATOM 0 HD13 ILE A 145 1.853 2.068 4.269 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.942 -0.020 7.802 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.719 -1.250 7.697 1.00 0.00 C ATOM 2135 C LYS A 146 -2.253 -1.437 6.282 1.00 0.00 C ATOM 2136 O LYS A 146 -3.274 -0.856 5.912 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.879 -1.232 8.695 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.472 -1.611 10.110 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.648 -2.164 10.898 1.00 0.00 C ATOM 2140 CE LYS A 146 -3.225 -3.314 11.797 1.00 0.00 C ATOM 2141 NZ LYS A 146 -4.265 -4.377 11.868 1.00 0.00 N ATOM 0 H LYS A 146 -1.414 0.809 7.441 1.00 0.00 H new ATOM 0 HA LYS A 146 -1.061 -2.087 7.931 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.321 -0.236 8.708 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.653 -1.919 8.352 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.675 -2.354 10.074 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -2.069 -0.736 10.621 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -4.087 -1.371 11.503 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -4.421 -2.505 10.209 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -2.294 -3.742 11.425 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -3.024 -2.936 12.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -3.937 -5.142 12.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -5.146 -3.976 12.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -4.439 -4.757 10.916 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.559 -2.250 5.494 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.964 -2.514 4.119 1.00 0.00 C ATOM 2157 C ILE A 147 -3.076 -3.556 4.064 1.00 0.00 C ATOM 2158 O ILE A 147 -2.833 -4.748 4.258 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.778 -3.001 3.266 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.430 -2.081 3.458 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.172 -3.067 1.798 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.731 -2.686 2.979 1.00 0.00 C ATOM 0 H ILE A 147 -0.712 -2.738 5.785 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.331 -1.572 3.712 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.503 -4.004 3.594 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.254 -1.147 2.924 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.522 -1.831 4.515 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.323 -3.413 1.209 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.005 -3.759 1.676 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.471 -2.076 1.457 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.544 -1.979 3.146 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.930 -3.605 3.531 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.658 -2.910 1.915 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.295 -3.100 3.799 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.445 -3.994 3.718 1.00 0.00 C ATOM 2176 C ARG A 148 -5.758 -4.347 2.268 1.00 0.00 C ATOM 2177 O ARG A 148 -5.705 -3.491 1.385 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.667 -3.348 4.374 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.662 -3.440 5.892 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.746 -2.569 6.508 1.00 0.00 C ATOM 2181 NE ARG A 148 -7.218 -1.699 7.557 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.940 -2.110 8.792 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -7.141 -3.376 9.138 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.461 -1.254 9.684 1.00 0.00 N ATOM 0 H ARG A 148 -4.513 -2.117 3.637 1.00 0.00 H new ATOM 0 HA ARG A 148 -5.199 -4.912 4.251 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.714 -2.299 4.082 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.569 -3.826 3.992 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.811 -4.476 6.195 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.688 -3.133 6.273 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -8.208 -1.960 5.730 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.529 -3.204 6.923 1.00 0.00 H new ATOM 0 HE ARG A 148 -7.053 -0.719 7.329 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.510 -4.039 8.456 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -6.926 -3.686 10.086 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -6.305 -0.280 9.424 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -6.248 -1.569 10.630 1.00 0.00 H new ATOM 2198 N SER A 149 -6.087 -5.612 2.029 1.00 0.00 N ATOM 2199 CA SER A 149 -6.410 -6.078 0.686 1.00 0.00 C ATOM 2200 C SER A 149 -7.882 -6.462 0.582 1.00 0.00 C ATOM 2201 O SER A 149 -8.490 -6.902 1.557 1.00 0.00 O ATOM 2202 CB SER A 149 -5.531 -7.274 0.312 1.00 0.00 C ATOM 2203 OG SER A 149 -5.678 -7.607 -1.057 1.00 0.00 O ATOM 0 H SER A 149 -6.137 -6.333 2.749 1.00 0.00 H new ATOM 0 HA SER A 149 -6.216 -5.262 -0.010 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.487 -7.042 0.523 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.798 -8.132 0.929 1.00 0.00 H new ATOM 0 HG SER A 149 -5.873 -8.564 -1.142 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.449 -6.294 -0.609 1.00 0.00 N ATOM 2210 CA CYS A 150 -9.851 -6.624 -0.841 1.00 0.00 C ATOM 2211 C CYS A 150 -10.009 -7.477 -2.095 1.00 0.00 C ATOM 2212 O CYS A 150 -10.984 -7.339 -2.834 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.682 -5.347 -0.970 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.151 -4.253 -2.309 1.00 0.00 S ATOM 0 H CYS A 150 -7.960 -5.932 -1.427 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.210 -7.198 0.014 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.725 -5.620 -1.130 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.636 -4.800 -0.028 1.00 0.00 H new ATOM 0 HG CYS A 150 -9.828 -3.093 -1.819 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.043 -8.359 -2.332 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.075 -9.235 -3.496 1.00 0.00 C ATOM 2222 C ALA A 151 -10.088 -10.358 -3.310 1.00 0.00 C ATOM 2223 O ALA A 151 -10.625 -10.549 -2.219 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.691 -9.808 -3.764 1.00 0.00 C ATOM 0 H ALA A 151 -8.228 -8.485 -1.732 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.383 -8.642 -4.357 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.730 -10.460 -4.636 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -6.990 -8.994 -3.951 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.360 -10.380 -2.897 1.00 0.00 H new