USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=30 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= 0.0149 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -0.856 K(o=-0.86,f=-0.11) 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 -119:sc= -3.98! (180deg=-10.6!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot -60:sc= 0.116 USER MOD Single : A 38 HIS : no HD1:sc= -1.01 X(o=-1,f=-1) USER MOD Single : A 42 ASN : amide:sc= -2.98! C(o=-3!,f=-13!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.0146 USER MOD Single : A 51 HIS : no HE2:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= 0.634 K(o=0.63,f=-0.7) USER MOD Single : A 65 THR OG1 : rot -170:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.165) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.238) USER MOD Single : A 78 SER OG : rot 180:sc= 0.0882 USER MOD Single : A 80 TYR OH : rot -55:sc= 0.287 USER MOD Single : A 82 LYS NZ :NH3+ -150:sc= -0.0202 (180deg=-0.516) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.191 K(o=-0.19,f=-1.8!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 110 GLN : amide:sc= -0.185 X(o=-0.18,f=0) USER MOD Single : A 113 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0291) USER MOD Single : A 114 MET CE :methyl -167:sc= 0 (180deg=-0.228) USER MOD Single : A 119 SER OG : rot -16:sc= 0.317 USER MOD Single : A 120 ASN : amide:sc= -0.641 X(o=-0.64,f=-0.73) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 180:sc= -0.141 USER MOD Single : A 126 CYS SG : rot 39:sc= -1.4 USER MOD Single : A 127 ASN : amide:sc= 0.276 K(o=0.28,f=-2.5!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.0064 X(o=-0.0064,f=-0.19) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 49:sc= 0.0223 USER MOD Single : A 144 MET CE :methyl 162:sc= 0 (180deg=-0.0467) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 CYS SG : rot -115:sc= 0.615 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -7.270 -10.485 10.432 1.00 0.00 N ATOM 88 CA ASP A 9 -8.177 -9.359 10.625 1.00 0.00 C ATOM 89 C ASP A 9 -8.805 -8.937 9.301 1.00 0.00 C ATOM 90 O ASP A 9 -8.110 -8.759 8.300 1.00 0.00 O ATOM 91 CB ASP A 9 -7.432 -8.179 11.248 1.00 0.00 C ATOM 92 CG ASP A 9 -7.500 -8.188 12.764 1.00 0.00 C ATOM 93 OD1 ASP A 9 -8.579 -7.876 13.311 1.00 0.00 O ATOM 94 OD2 ASP A 9 -6.475 -8.509 13.402 1.00 0.00 O ATOM 0 HA ASP A 9 -8.972 -9.675 11.301 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -6.389 -8.205 10.934 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -7.855 -7.247 10.873 1.00 0.00 H new ATOM 99 N ILE A 10 -10.124 -8.777 9.302 1.00 0.00 N ATOM 100 CA ILE A 10 -10.846 -8.376 8.101 1.00 0.00 C ATOM 101 C ILE A 10 -11.933 -7.355 8.426 1.00 0.00 C ATOM 102 O ILE A 10 -12.824 -7.619 9.234 1.00 0.00 O ATOM 103 CB ILE A 10 -11.485 -9.591 7.398 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.147 -9.165 6.086 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.496 -10.265 8.314 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.634 -10.328 5.249 1.00 0.00 C ATOM 0 H ILE A 10 -10.715 -8.919 10.121 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.117 -7.921 7.430 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.698 -10.309 7.167 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -12.990 -8.511 6.309 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.436 -8.581 5.502 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.937 -11.120 7.802 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.996 -10.604 9.221 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.280 -9.555 8.576 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -13.092 -9.951 4.334 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.792 -10.971 4.995 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -13.370 -10.900 5.814 1.00 0.00 H new ATOM 118 N VAL A 11 -11.852 -6.191 7.792 1.00 0.00 N ATOM 119 CA VAL A 11 -12.828 -5.131 8.011 1.00 0.00 C ATOM 120 C VAL A 11 -13.861 -5.097 6.891 1.00 0.00 C ATOM 121 O VAL A 11 -13.664 -4.433 5.872 1.00 0.00 O ATOM 122 CB VAL A 11 -12.150 -3.752 8.109 1.00 0.00 C ATOM 123 CG1 VAL A 11 -13.151 -2.692 8.540 1.00 0.00 C ATOM 124 CG2 VAL A 11 -10.971 -3.805 9.071 1.00 0.00 C ATOM 0 H VAL A 11 -11.120 -5.957 7.122 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.325 -5.350 8.956 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.774 -3.482 7.122 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.652 -1.725 8.603 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.959 -2.637 7.810 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.560 -2.954 9.516 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.504 -2.822 9.128 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.322 -4.098 10.061 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.243 -4.533 8.714 1.00 0.00 H new ATOM 134 N GLY A 12 -14.961 -5.818 7.083 1.00 0.00 N ATOM 135 CA GLY A 12 -16.006 -5.858 6.077 1.00 0.00 C ATOM 136 C GLY A 12 -15.614 -6.687 4.870 1.00 0.00 C ATOM 137 O GLY A 12 -15.986 -7.855 4.763 1.00 0.00 O ATOM 0 H GLY A 12 -15.147 -6.375 7.917 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.915 -6.269 6.517 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.238 -4.842 5.757 1.00 0.00 H new ATOM 141 N ILE A 13 -14.860 -6.081 3.960 1.00 0.00 N ATOM 142 CA ILE A 13 -14.414 -6.771 2.755 1.00 0.00 C ATOM 143 C ILE A 13 -12.944 -6.480 2.468 1.00 0.00 C ATOM 144 O ILE A 13 -12.514 -6.486 1.315 1.00 0.00 O ATOM 145 CB ILE A 13 -15.255 -6.365 1.530 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.193 -4.851 1.319 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.695 -6.824 1.700 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.845 -4.394 0.032 1.00 0.00 C ATOM 0 H ILE A 13 -14.545 -5.114 4.033 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.543 -7.838 2.936 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.841 -6.852 0.647 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -15.679 -4.355 2.159 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.150 -4.534 1.321 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.276 -6.530 0.826 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.721 -7.909 1.805 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -17.121 -6.363 2.591 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.764 -3.310 -0.052 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -15.345 -4.862 -0.816 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -16.897 -4.680 0.035 1.00 0.00 H new ATOM 160 N TRP A 14 -12.179 -6.226 3.524 1.00 0.00 N ATOM 161 CA TRP A 14 -10.756 -5.934 3.386 1.00 0.00 C ATOM 162 C TRP A 14 -9.937 -6.732 4.394 1.00 0.00 C ATOM 163 O TRP A 14 -10.134 -6.611 5.604 1.00 0.00 O ATOM 164 CB TRP A 14 -10.501 -4.438 3.576 1.00 0.00 C ATOM 165 CG TRP A 14 -11.322 -3.575 2.667 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.640 -3.253 2.811 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.878 -2.924 1.470 1.00 0.00 C ATOM 168 NE1 TRP A 14 -13.043 -2.440 1.778 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.979 -2.225 0.943 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.655 -2.864 0.795 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.895 -1.475 -0.228 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.573 -2.120 -0.367 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.687 -1.433 -0.869 1.00 0.00 C ATOM 0 H TRP A 14 -12.520 -6.216 4.485 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.447 -6.224 2.382 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.714 -4.169 4.611 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.444 -4.232 3.404 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.274 -3.588 3.619 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.981 -2.059 1.654 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.791 -3.389 1.174 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.753 -0.946 -0.616 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.634 -2.067 -0.898 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.590 -0.860 -1.779 1.00 0.00 H new ATOM 184 N TRP A 15 -9.019 -7.550 3.889 1.00 0.00 N ATOM 185 CA TRP A 15 -8.170 -8.369 4.747 1.00 0.00 C ATOM 186 C TRP A 15 -6.702 -7.986 4.586 1.00 0.00 C ATOM 187 O TRP A 15 -6.219 -7.798 3.469 1.00 0.00 O ATOM 188 CB TRP A 15 -8.362 -9.851 4.424 1.00 0.00 C ATOM 189 CG TRP A 15 -8.168 -10.174 2.974 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.037 -9.915 1.953 1.00 0.00 C ATOM 191 CD2 TRP A 15 -7.034 -10.817 2.382 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.512 -10.358 0.763 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.283 -10.915 1.000 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.830 -11.319 2.887 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.373 -11.494 0.118 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.928 -11.893 2.011 1.00 0.00 C ATOM 197 CH2 TRP A 15 -5.204 -11.977 0.640 1.00 0.00 C ATOM 0 H TRP A 15 -8.844 -7.663 2.891 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.461 -8.190 5.782 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.660 -10.438 5.016 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.365 -10.154 4.725 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.997 -9.432 2.065 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.964 -10.284 -0.149 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.609 -11.259 3.942 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.583 -11.559 -0.939 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.995 -12.283 2.390 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.479 -12.432 -0.018 1.00 0.00 H new ATOM 208 N THR A 16 -5.999 -7.874 5.708 1.00 0.00 N ATOM 209 CA THR A 16 -4.586 -7.514 5.691 1.00 0.00 C ATOM 210 C THR A 16 -3.743 -8.645 5.109 1.00 0.00 C ATOM 211 O THR A 16 -4.000 -9.820 5.368 1.00 0.00 O ATOM 212 CB THR A 16 -4.106 -7.183 7.106 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.147 -6.589 7.862 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.923 -6.239 7.131 1.00 0.00 C ATOM 0 H THR A 16 -6.384 -8.027 6.640 1.00 0.00 H new ATOM 0 HA THR A 16 -4.469 -6.634 5.058 1.00 0.00 H new ATOM 0 HB THR A 16 -3.799 -8.136 7.538 1.00 0.00 H new ATOM 0 HG1 THR A 16 -4.822 -6.386 8.764 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.633 -6.046 8.164 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.086 -6.690 6.598 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.196 -5.300 6.649 1.00 0.00 H new ATOM 222 N VAL A 17 -2.736 -8.280 4.323 1.00 0.00 N ATOM 223 CA VAL A 17 -1.855 -9.264 3.705 1.00 0.00 C ATOM 224 C VAL A 17 -0.835 -9.793 4.707 1.00 0.00 C ATOM 225 O VAL A 17 -0.790 -9.350 5.855 1.00 0.00 O ATOM 226 CB VAL A 17 -1.108 -8.670 2.497 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.085 -8.314 1.386 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.298 -7.451 2.915 1.00 0.00 C ATOM 0 H VAL A 17 -2.510 -7.311 4.099 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.487 -10.084 3.364 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.418 -9.423 2.115 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.538 -7.896 0.541 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.616 -9.211 1.067 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.802 -7.580 1.753 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.223 -7.045 2.048 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.966 -6.693 3.324 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.430 -7.740 3.673 1.00 0.00 H new ATOM 238 N SER A 18 -0.017 -10.744 4.267 1.00 0.00 N ATOM 239 CA SER A 18 1.003 -11.334 5.125 1.00 0.00 C ATOM 240 C SER A 18 2.384 -11.213 4.490 1.00 0.00 C ATOM 241 O SER A 18 3.359 -10.870 5.158 1.00 0.00 O ATOM 242 CB SER A 18 0.682 -12.804 5.399 1.00 0.00 C ATOM 243 OG SER A 18 -0.623 -12.951 5.930 1.00 0.00 O ATOM 0 H SER A 18 -0.041 -11.122 3.320 1.00 0.00 H new ATOM 0 HA SER A 18 1.008 -10.789 6.069 1.00 0.00 H new ATOM 0 HB2 SER A 18 0.769 -13.377 4.476 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.411 -13.214 6.098 1.00 0.00 H new ATOM 0 HG SER A 18 -0.804 -13.900 6.095 1.00 0.00 H new ATOM 249 N ASN A 19 2.460 -11.499 3.194 1.00 0.00 N ATOM 250 CA ASN A 19 3.721 -11.423 2.465 1.00 0.00 C ATOM 251 C ASN A 19 3.558 -10.620 1.179 1.00 0.00 C ATOM 252 O ASN A 19 2.445 -10.248 0.804 1.00 0.00 O ATOM 253 CB ASN A 19 4.238 -12.827 2.144 1.00 0.00 C ATOM 254 CG ASN A 19 3.135 -13.768 1.701 1.00 0.00 C ATOM 255 OD1 ASN A 19 2.655 -14.592 2.480 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.726 -13.650 0.442 1.00 0.00 N ATOM 0 H ASN A 19 1.662 -11.786 2.627 1.00 0.00 H new ATOM 0 HA ASN A 19 4.447 -10.915 3.099 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.992 -12.762 1.359 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.730 -13.239 3.025 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.986 -14.256 0.087 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.152 -12.953 -0.169 1.00 0.00 H new ATOM 263 N PHE A 20 4.673 -10.354 0.507 1.00 0.00 N ATOM 264 CA PHE A 20 4.655 -9.593 -0.738 1.00 0.00 C ATOM 265 C PHE A 20 3.766 -10.267 -1.778 1.00 0.00 C ATOM 266 O PHE A 20 3.003 -9.604 -2.481 1.00 0.00 O ATOM 267 CB PHE A 20 6.076 -9.442 -1.286 1.00 0.00 C ATOM 268 CG PHE A 20 6.159 -8.575 -2.509 1.00 0.00 C ATOM 269 CD1 PHE A 20 6.014 -7.200 -2.412 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.383 -9.134 -3.757 1.00 0.00 C ATOM 271 CE1 PHE A 20 6.091 -6.400 -3.535 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.462 -8.339 -4.884 1.00 0.00 C ATOM 273 CZ PHE A 20 6.315 -6.970 -4.774 1.00 0.00 C ATOM 0 H PHE A 20 5.602 -10.654 0.804 1.00 0.00 H new ATOM 0 HA PHE A 20 4.246 -8.605 -0.525 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.714 -9.021 -0.508 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.472 -10.429 -1.523 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.839 -6.749 -1.447 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.497 -10.204 -3.850 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.976 -5.330 -3.445 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.639 -8.788 -5.850 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.375 -6.347 -5.654 1.00 0.00 H new ATOM 283 N GLY A 21 3.869 -11.588 -1.871 1.00 0.00 N ATOM 284 CA GLY A 21 3.070 -12.331 -2.827 1.00 0.00 C ATOM 285 C GLY A 21 1.579 -12.153 -2.608 1.00 0.00 C ATOM 286 O GLY A 21 0.781 -12.387 -3.517 1.00 0.00 O ATOM 0 H GLY A 21 4.493 -12.158 -1.300 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.326 -12.009 -3.836 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.319 -13.390 -2.758 1.00 0.00 H new ATOM 290 N GLU A 22 1.199 -11.741 -1.402 1.00 0.00 N ATOM 291 CA GLU A 22 -0.207 -11.537 -1.072 1.00 0.00 C ATOM 292 C GLU A 22 -0.702 -10.194 -1.600 1.00 0.00 C ATOM 293 O GLU A 22 -1.868 -10.055 -1.973 1.00 0.00 O ATOM 294 CB GLU A 22 -0.413 -11.609 0.442 1.00 0.00 C ATOM 295 CG GLU A 22 -0.320 -13.020 1.002 1.00 0.00 C ATOM 296 CD GLU A 22 -1.625 -13.493 1.611 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.592 -13.710 0.850 1.00 0.00 O ATOM 298 OE2 GLU A 22 -1.681 -13.648 2.849 1.00 0.00 O ATOM 0 H GLU A 22 1.845 -11.542 -0.638 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.784 -12.329 -1.549 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.332 -10.983 0.932 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.390 -11.193 0.688 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.026 -13.704 0.206 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.464 -13.056 1.759 1.00 0.00 H new ATOM 305 N ILE A 23 0.189 -9.210 -1.631 1.00 0.00 N ATOM 306 CA ILE A 23 -0.160 -7.879 -2.113 1.00 0.00 C ATOM 307 C ILE A 23 -0.378 -7.882 -3.623 1.00 0.00 C ATOM 308 O ILE A 23 0.494 -8.297 -4.386 1.00 0.00 O ATOM 309 CB ILE A 23 0.932 -6.848 -1.766 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.278 -6.920 -0.277 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.477 -5.445 -2.140 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.657 -6.388 0.049 1.00 0.00 C ATOM 0 H ILE A 23 1.158 -9.309 -1.328 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.086 -7.596 -1.613 1.00 0.00 H new ATOM 0 HB ILE A 23 1.827 -7.084 -2.341 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.536 -6.355 0.288 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.209 -7.956 0.054 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.260 -4.729 -1.888 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.276 -5.401 -3.210 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.431 -5.198 -1.590 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.834 -6.470 1.121 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.407 -6.968 -0.488 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.724 -5.342 -0.251 1.00 0.00 H new ATOM 324 N SER A 24 -1.548 -7.416 -4.047 1.00 0.00 N ATOM 325 CA SER A 24 -1.882 -7.365 -5.466 1.00 0.00 C ATOM 326 C SER A 24 -3.254 -6.731 -5.679 1.00 0.00 C ATOM 327 O SER A 24 -4.132 -6.827 -4.822 1.00 0.00 O ATOM 328 CB SER A 24 -1.859 -8.770 -6.069 1.00 0.00 C ATOM 329 OG SER A 24 -2.220 -8.743 -7.440 1.00 0.00 O ATOM 0 H SER A 24 -2.281 -7.068 -3.429 1.00 0.00 H new ATOM 0 HA SER A 24 -1.134 -6.750 -5.967 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.863 -9.199 -5.960 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.546 -9.415 -5.522 1.00 0.00 H new ATOM 0 HG SER A 24 -2.196 -9.653 -7.803 1.00 0.00 H new ATOM 335 N GLY A 25 -3.429 -6.082 -6.825 1.00 0.00 N ATOM 336 CA GLY A 25 -4.696 -5.441 -7.128 1.00 0.00 C ATOM 337 C GLY A 25 -4.906 -4.168 -6.333 1.00 0.00 C ATOM 338 O GLY A 25 -4.003 -3.336 -6.233 1.00 0.00 O ATOM 0 H GLY A 25 -2.717 -5.988 -7.549 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.738 -5.212 -8.193 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.510 -6.135 -6.919 1.00 0.00 H new ATOM 342 N THR A 26 -6.097 -4.015 -5.766 1.00 0.00 N ATOM 343 CA THR A 26 -6.421 -2.833 -4.976 1.00 0.00 C ATOM 344 C THR A 26 -6.084 -3.054 -3.505 1.00 0.00 C ATOM 345 O THR A 26 -6.509 -4.039 -2.902 1.00 0.00 O ATOM 346 CB THR A 26 -7.903 -2.484 -5.124 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.252 -2.345 -6.490 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.289 -1.202 -4.418 1.00 0.00 C ATOM 0 H THR A 26 -6.854 -4.694 -5.839 1.00 0.00 H new ATOM 0 HA THR A 26 -5.821 -2.003 -5.348 1.00 0.00 H new ATOM 0 HB THR A 26 -8.442 -3.311 -4.662 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.204 -2.124 -6.564 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.353 -1.013 -4.563 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.079 -1.296 -3.353 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.714 -0.373 -4.830 1.00 0.00 H new ATOM 356 N ILE A 27 -5.316 -2.131 -2.934 1.00 0.00 N ATOM 357 CA ILE A 27 -4.922 -2.227 -1.534 1.00 0.00 C ATOM 358 C ILE A 27 -4.935 -0.856 -0.867 1.00 0.00 C ATOM 359 O ILE A 27 -4.444 0.124 -1.427 1.00 0.00 O ATOM 360 CB ILE A 27 -3.521 -2.846 -1.385 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.498 -2.055 -2.203 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.538 -4.305 -1.815 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.693 -1.074 -1.378 1.00 0.00 C ATOM 0 H ILE A 27 -4.955 -1.310 -3.419 1.00 0.00 H new ATOM 0 HA ILE A 27 -5.649 -2.875 -1.044 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.230 -2.800 -0.335 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -1.817 -2.753 -2.690 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.018 -1.513 -2.993 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.540 -4.729 -1.704 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.239 -4.860 -1.192 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.847 -4.373 -2.858 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.988 -0.549 -2.023 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -2.365 -0.353 -0.912 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.145 -1.612 -0.605 1.00 0.00 H new ATOM 375 N ALA A 28 -5.500 -0.794 0.335 1.00 0.00 N ATOM 376 CA ALA A 28 -5.577 0.457 1.079 1.00 0.00 C ATOM 377 C ALA A 28 -4.569 0.479 2.223 1.00 0.00 C ATOM 378 O ALA A 28 -4.255 -0.558 2.808 1.00 0.00 O ATOM 379 CB ALA A 28 -6.987 0.668 1.610 1.00 0.00 C ATOM 0 H ALA A 28 -5.911 -1.596 0.814 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.331 1.272 0.398 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.031 1.606 2.164 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.688 0.706 0.776 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.254 -0.156 2.271 1.00 0.00 H new ATOM 385 N ILE A 29 -4.066 1.669 2.538 1.00 0.00 N ATOM 386 CA ILE A 29 -3.093 1.827 3.612 1.00 0.00 C ATOM 387 C ILE A 29 -3.650 2.701 4.731 1.00 0.00 C ATOM 388 O ILE A 29 -4.549 3.512 4.511 1.00 0.00 O ATOM 389 CB ILE A 29 -1.781 2.449 3.095 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.273 1.684 1.871 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.728 2.458 4.193 1.00 0.00 C ATOM 392 CD1 ILE A 29 -0.706 2.581 0.790 1.00 0.00 C ATOM 0 H ILE A 29 -4.316 2.537 2.065 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.885 0.830 4.001 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.979 3.479 2.800 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.504 0.978 2.187 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.092 1.098 1.453 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.192 2.900 3.811 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.089 3.044 5.038 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.532 1.436 4.517 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.365 1.971 -0.047 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.478 3.270 0.447 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.134 3.148 1.191 1.00 0.00 H new ATOM 404 N GLU A 30 -3.111 2.529 5.934 1.00 0.00 N ATOM 405 CA GLU A 30 -3.554 3.301 7.088 1.00 0.00 C ATOM 406 C GLU A 30 -2.386 3.601 8.023 1.00 0.00 C ATOM 407 O GLU A 30 -1.781 2.690 8.588 1.00 0.00 O ATOM 408 CB GLU A 30 -4.648 2.546 7.845 1.00 0.00 C ATOM 409 CG GLU A 30 -5.418 3.416 8.826 1.00 0.00 C ATOM 410 CD GLU A 30 -6.191 2.600 9.845 1.00 0.00 C ATOM 411 OE1 GLU A 30 -5.587 1.701 10.467 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.401 2.859 10.019 1.00 0.00 O ATOM 0 H GLU A 30 -2.366 1.861 6.134 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.959 4.246 6.727 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.346 2.117 7.126 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.197 1.714 8.386 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.722 4.075 9.346 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.110 4.053 8.276 1.00 0.00 H new ATOM 419 N MET A 31 -2.075 4.883 8.181 1.00 0.00 N ATOM 420 CA MET A 31 -0.980 5.303 9.047 1.00 0.00 C ATOM 421 C MET A 31 -1.454 5.456 10.488 1.00 0.00 C ATOM 422 O MET A 31 -0.867 4.887 11.409 1.00 0.00 O ATOM 423 CB MET A 31 -0.386 6.622 8.551 1.00 0.00 C ATOM 424 CG MET A 31 0.147 6.553 7.129 1.00 0.00 C ATOM 425 SD MET A 31 1.061 8.033 6.657 1.00 0.00 S ATOM 426 CE MET A 31 1.041 7.887 4.872 1.00 0.00 C ATOM 0 H MET A 31 -2.566 5.649 7.720 1.00 0.00 H new ATOM 0 HA MET A 31 -0.210 4.532 9.016 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.149 7.398 8.607 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.422 6.921 9.219 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.796 5.683 7.030 1.00 0.00 H new ATOM 0 HG3 MET A 31 -0.685 6.409 6.440 1.00 0.00 H new ATOM 0 HE1 MET A 31 2.064 7.816 4.501 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.489 6.992 4.586 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.558 8.764 4.441 1.00 0.00 H new ATOM 436 N ASP A 32 -2.520 6.228 10.678 1.00 0.00 N ATOM 437 CA ASP A 32 -3.072 6.455 12.009 1.00 0.00 C ATOM 438 C ASP A 32 -4.115 5.395 12.351 1.00 0.00 C ATOM 439 O ASP A 32 -4.441 4.541 11.528 1.00 0.00 O ATOM 440 CB ASP A 32 -3.698 7.848 12.093 1.00 0.00 C ATOM 441 CG ASP A 32 -3.453 8.511 13.435 1.00 0.00 C ATOM 442 OD1 ASP A 32 -3.216 7.783 14.422 1.00 0.00 O ATOM 443 OD2 ASP A 32 -3.500 9.757 13.498 1.00 0.00 O ATOM 0 H ASP A 32 -3.018 6.706 9.927 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.258 6.386 12.731 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.290 8.475 11.301 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -4.771 7.772 11.919 1.00 0.00 H new ATOM 448 N LYS A 33 -4.632 5.455 13.574 1.00 0.00 N ATOM 449 CA LYS A 33 -5.638 4.501 14.027 1.00 0.00 C ATOM 450 C LYS A 33 -7.031 4.918 13.568 1.00 0.00 C ATOM 451 O LYS A 33 -7.791 5.519 14.326 1.00 0.00 O ATOM 452 CB LYS A 33 -5.605 4.380 15.551 1.00 0.00 C ATOM 453 CG LYS A 33 -6.352 3.166 16.081 1.00 0.00 C ATOM 454 CD LYS A 33 -6.145 2.993 17.576 1.00 0.00 C ATOM 455 CE LYS A 33 -6.266 1.535 17.991 1.00 0.00 C ATOM 456 NZ LYS A 33 -5.291 1.178 19.057 1.00 0.00 N ATOM 0 H LYS A 33 -4.371 6.154 14.269 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.407 3.531 13.587 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.567 4.330 15.881 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.036 5.281 15.988 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.416 3.272 15.870 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.011 2.272 15.560 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.161 3.371 17.854 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.880 3.589 18.117 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.278 1.341 18.346 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.105 0.896 17.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -5.406 0.176 19.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.324 1.338 18.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -5.461 1.770 19.895 1.00 0.00 H new ATOM 470 N GLY A 34 -7.359 4.596 12.321 1.00 0.00 N ATOM 471 CA GLY A 34 -8.661 4.944 11.782 1.00 0.00 C ATOM 472 C GLY A 34 -8.566 5.914 10.620 1.00 0.00 C ATOM 473 O GLY A 34 -9.427 5.926 9.740 1.00 0.00 O ATOM 0 H GLY A 34 -6.746 4.100 11.674 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.169 4.037 11.454 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.271 5.384 12.570 1.00 0.00 H new ATOM 477 N ALA A 35 -7.516 6.729 10.616 1.00 0.00 N ATOM 478 CA ALA A 35 -7.313 7.707 9.552 1.00 0.00 C ATOM 479 C ALA A 35 -6.548 7.095 8.385 1.00 0.00 C ATOM 480 O ALA A 35 -5.596 6.339 8.580 1.00 0.00 O ATOM 481 CB ALA A 35 -6.575 8.923 10.091 1.00 0.00 C ATOM 0 H ALA A 35 -6.794 6.732 11.336 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.291 8.021 9.186 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.429 9.646 9.288 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.161 9.380 10.889 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.605 8.616 10.483 1.00 0.00 H new ATOM 487 N TYR A 36 -6.969 7.428 7.168 1.00 0.00 N ATOM 488 CA TYR A 36 -6.324 6.910 5.967 1.00 0.00 C ATOM 489 C TYR A 36 -5.811 8.049 5.091 1.00 0.00 C ATOM 490 O TYR A 36 -6.156 9.212 5.304 1.00 0.00 O ATOM 491 CB TYR A 36 -7.300 6.040 5.172 1.00 0.00 C ATOM 492 CG TYR A 36 -7.765 4.812 5.921 1.00 0.00 C ATOM 493 CD1 TYR A 36 -8.538 4.926 7.069 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.431 3.538 5.480 1.00 0.00 C ATOM 495 CE1 TYR A 36 -8.966 3.807 7.757 1.00 0.00 C ATOM 496 CE2 TYR A 36 -7.854 2.413 6.160 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.621 2.553 7.298 1.00 0.00 C ATOM 498 OH TYR A 36 -9.045 1.435 7.980 1.00 0.00 O ATOM 0 H TYR A 36 -7.754 8.054 6.988 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.474 6.301 6.276 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.169 6.639 4.899 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -6.823 5.729 4.243 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -8.809 5.907 7.430 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.830 3.425 4.590 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -9.567 3.913 8.648 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.586 1.430 5.803 1.00 0.00 H new ATOM 0 HH TYR A 36 -8.700 1.461 8.897 1.00 0.00 H new ATOM 508 N ILE A 37 -4.987 7.707 4.107 1.00 0.00 N ATOM 509 CA ILE A 37 -4.428 8.700 3.198 1.00 0.00 C ATOM 510 C ILE A 37 -5.483 9.206 2.221 1.00 0.00 C ATOM 511 O ILE A 37 -6.158 8.416 1.560 1.00 0.00 O ATOM 512 CB ILE A 37 -3.239 8.129 2.403 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.253 7.431 3.344 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.544 9.235 1.621 1.00 0.00 C ATOM 515 CD1 ILE A 37 -2.297 5.921 3.253 1.00 0.00 C ATOM 0 H ILE A 37 -4.691 6.749 3.919 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.078 9.529 3.813 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.616 7.392 1.694 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.243 7.771 3.116 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.467 7.732 4.370 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.706 8.816 1.064 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.251 9.688 0.926 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.177 9.994 2.312 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.573 5.493 3.947 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.297 5.570 3.510 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.053 5.610 2.237 1.00 0.00 H new ATOM 527 N HIS A 38 -5.618 10.525 2.132 1.00 0.00 N ATOM 528 CA HIS A 38 -6.592 11.134 1.233 1.00 0.00 C ATOM 529 C HIS A 38 -5.895 11.936 0.139 1.00 0.00 C ATOM 530 O HIS A 38 -4.906 12.624 0.394 1.00 0.00 O ATOM 531 CB HIS A 38 -7.546 12.039 2.016 1.00 0.00 C ATOM 532 CG HIS A 38 -8.790 12.391 1.262 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.708 11.465 0.821 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.263 13.603 0.872 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.688 12.126 0.190 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.466 13.426 0.194 1.00 0.00 N ATOM 0 H HIS A 38 -5.066 11.192 2.671 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.165 10.334 0.764 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.823 11.543 2.946 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -7.023 12.956 2.287 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.783 14.552 1.058 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.548 11.655 -0.263 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.054 14.152 -0.215 1.00 0.00 H new ATOM 544 N ALA A 39 -6.416 11.843 -1.080 1.00 0.00 N ATOM 545 CA ALA A 39 -5.844 12.559 -2.212 1.00 0.00 C ATOM 546 C ALA A 39 -6.625 13.835 -2.508 1.00 0.00 C ATOM 547 O ALA A 39 -7.856 13.831 -2.528 1.00 0.00 O ATOM 548 CB ALA A 39 -5.812 11.663 -3.441 1.00 0.00 C ATOM 0 H ALA A 39 -7.234 11.278 -1.308 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.823 12.841 -1.953 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.382 12.211 -4.280 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.204 10.782 -3.233 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.826 11.353 -3.692 1.00 0.00 H new ATOM 554 N LEU A 40 -5.901 14.926 -2.736 1.00 0.00 N ATOM 555 CA LEU A 40 -6.527 16.211 -3.030 1.00 0.00 C ATOM 556 C LEU A 40 -6.654 16.422 -4.535 1.00 0.00 C ATOM 557 O LEU A 40 -5.911 15.832 -5.319 1.00 0.00 O ATOM 558 CB LEU A 40 -5.715 17.351 -2.410 1.00 0.00 C ATOM 559 CG LEU A 40 -6.044 17.661 -0.950 1.00 0.00 C ATOM 560 CD1 LEU A 40 -5.234 18.852 -0.461 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.534 17.924 -0.784 1.00 0.00 C ATOM 0 H LEU A 40 -4.881 14.947 -2.723 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.527 16.208 -2.596 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.656 17.104 -2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.873 18.253 -3.001 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.778 16.794 -0.346 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.482 19.058 0.580 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.171 18.627 -0.543 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.468 19.726 -1.069 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.751 18.143 0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.824 18.775 -1.401 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.096 17.043 -1.094 1.00 0.00 H new ATOM 573 N ASP A 41 -7.601 17.266 -4.930 1.00 0.00 N ATOM 574 CA ASP A 41 -7.826 17.555 -6.341 1.00 0.00 C ATOM 575 C ASP A 41 -6.631 18.284 -6.946 1.00 0.00 C ATOM 576 O ASP A 41 -6.326 18.126 -8.129 1.00 0.00 O ATOM 577 CB ASP A 41 -9.094 18.395 -6.515 1.00 0.00 C ATOM 578 CG ASP A 41 -9.957 17.909 -7.663 1.00 0.00 C ATOM 579 OD1 ASP A 41 -10.790 17.006 -7.439 1.00 0.00 O ATOM 580 OD2 ASP A 41 -9.800 18.432 -8.787 1.00 0.00 O ATOM 0 H ASP A 41 -8.225 17.762 -4.293 1.00 0.00 H new ATOM 0 HA ASP A 41 -7.952 16.607 -6.864 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -9.673 18.369 -5.592 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.817 19.435 -6.688 1.00 0.00 H new ATOM 585 N ASN A 42 -5.954 19.082 -6.125 1.00 0.00 N ATOM 586 CA ASN A 42 -4.790 19.835 -6.580 1.00 0.00 C ATOM 587 C ASN A 42 -3.611 18.905 -6.847 1.00 0.00 C ATOM 588 O ASN A 42 -2.782 19.174 -7.718 1.00 0.00 O ATOM 589 CB ASN A 42 -4.399 20.887 -5.540 1.00 0.00 C ATOM 590 CG ASN A 42 -4.287 20.309 -4.142 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.705 19.242 -3.944 1.00 0.00 O ATOM 592 ND2 ASN A 42 -4.847 21.011 -3.164 1.00 0.00 N ATOM 0 H ASN A 42 -6.191 19.224 -5.143 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.053 20.335 -7.512 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -3.446 21.335 -5.822 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -5.140 21.687 -5.541 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -4.805 20.671 -2.203 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -5.319 21.890 -3.373 1.00 0.00 H new ATOM 599 N GLY A 43 -3.541 17.813 -6.094 1.00 0.00 N ATOM 600 CA GLY A 43 -2.460 16.862 -6.265 1.00 0.00 C ATOM 601 C GLY A 43 -1.841 16.443 -4.945 1.00 0.00 C ATOM 602 O GLY A 43 -1.292 15.347 -4.830 1.00 0.00 O ATOM 0 H GLY A 43 -4.215 17.570 -5.368 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.835 15.979 -6.783 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.691 17.301 -6.900 1.00 0.00 H new ATOM 606 N LEU A 44 -1.928 17.317 -3.949 1.00 0.00 N ATOM 607 CA LEU A 44 -1.372 17.032 -2.631 1.00 0.00 C ATOM 608 C LEU A 44 -2.108 15.871 -1.971 1.00 0.00 C ATOM 609 O LEU A 44 -3.040 15.307 -2.544 1.00 0.00 O ATOM 610 CB LEU A 44 -1.451 18.273 -1.741 1.00 0.00 C ATOM 611 CG LEU A 44 -0.879 19.552 -2.357 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.394 20.777 -1.621 1.00 0.00 C ATOM 613 CD2 LEU A 44 0.642 19.515 -2.339 1.00 0.00 C ATOM 0 H LEU A 44 -2.378 18.229 -4.029 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.326 16.752 -2.758 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.495 18.449 -1.481 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.921 18.068 -0.811 1.00 0.00 H new ATOM 0 HG LEU A 44 -1.210 19.614 -3.394 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.976 21.676 -2.074 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.482 20.810 -1.686 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.095 20.725 -0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.033 20.431 -2.780 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.992 19.430 -1.310 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.992 18.657 -2.914 1.00 0.00 H new ATOM 625 N PHE A 45 -1.684 15.521 -0.761 1.00 0.00 N ATOM 626 CA PHE A 45 -2.303 14.427 -0.022 1.00 0.00 C ATOM 627 C PHE A 45 -2.389 14.754 1.465 1.00 0.00 C ATOM 628 O PHE A 45 -1.392 15.119 2.089 1.00 0.00 O ATOM 629 CB PHE A 45 -1.512 13.133 -0.226 1.00 0.00 C ATOM 630 CG PHE A 45 -1.871 12.404 -1.490 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.419 12.857 -2.719 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.658 11.265 -1.448 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.747 12.187 -3.883 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.990 10.592 -2.608 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.533 11.053 -3.827 1.00 0.00 C ATOM 0 H PHE A 45 -0.915 15.979 -0.272 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.314 14.291 -0.405 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.447 13.366 -0.240 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.683 12.474 0.625 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.804 13.743 -2.768 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.016 10.899 -0.497 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.389 12.550 -4.835 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.606 9.706 -2.562 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.790 10.528 -4.735 1.00 0.00 H new ATOM 645 N THR A 46 -3.586 14.621 2.027 1.00 0.00 N ATOM 646 CA THR A 46 -3.802 14.901 3.441 1.00 0.00 C ATOM 647 C THR A 46 -4.430 13.702 4.144 1.00 0.00 C ATOM 648 O THR A 46 -5.073 12.866 3.511 1.00 0.00 O ATOM 649 CB THR A 46 -4.697 16.130 3.608 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.929 16.399 4.980 1.00 0.00 O ATOM 651 CG2 THR A 46 -6.044 15.984 2.935 1.00 0.00 C ATOM 0 H THR A 46 -4.421 14.321 1.524 1.00 0.00 H new ATOM 0 HA THR A 46 -2.833 15.101 3.898 1.00 0.00 H new ATOM 0 HB THR A 46 -4.157 16.948 3.131 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.502 17.189 5.066 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.629 16.890 3.092 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.901 15.824 1.866 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.573 15.132 3.361 1.00 0.00 H new ATOM 659 N LEU A 47 -4.238 13.624 5.457 1.00 0.00 N ATOM 660 CA LEU A 47 -4.786 12.528 6.246 1.00 0.00 C ATOM 661 C LEU A 47 -6.297 12.666 6.396 1.00 0.00 C ATOM 662 O LEU A 47 -6.785 13.604 7.027 1.00 0.00 O ATOM 663 CB LEU A 47 -4.126 12.486 7.625 1.00 0.00 C ATOM 664 CG LEU A 47 -4.144 11.119 8.312 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.441 10.080 7.451 1.00 0.00 C ATOM 666 CD2 LEU A 47 -3.493 11.205 9.684 1.00 0.00 C ATOM 0 H LEU A 47 -3.707 14.307 5.997 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.576 11.596 5.721 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.091 12.811 7.525 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.626 13.207 8.272 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.182 10.812 8.442 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.463 9.114 7.955 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.949 10.000 6.490 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.406 10.381 7.290 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.514 10.224 10.159 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.459 11.534 9.576 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.038 11.919 10.301 1.00 0.00 H new ATOM 678 N GLY A 48 -7.034 11.726 5.812 1.00 0.00 N ATOM 679 CA GLY A 48 -8.483 11.762 5.894 1.00 0.00 C ATOM 680 C GLY A 48 -8.988 11.554 7.308 1.00 0.00 C ATOM 681 O GLY A 48 -8.354 10.863 8.105 1.00 0.00 O ATOM 0 H GLY A 48 -6.654 10.941 5.284 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.841 12.721 5.521 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.900 10.992 5.245 1.00 0.00 H new ATOM 685 N ALA A 49 -10.132 12.154 7.621 1.00 0.00 N ATOM 686 CA ALA A 49 -10.721 12.031 8.948 1.00 0.00 C ATOM 687 C ALA A 49 -11.080 10.578 9.258 1.00 0.00 C ATOM 688 O ALA A 49 -11.599 9.866 8.399 1.00 0.00 O ATOM 689 CB ALA A 49 -11.952 12.917 9.063 1.00 0.00 C ATOM 0 H ALA A 49 -10.669 12.730 6.973 1.00 0.00 H new ATOM 0 HA ALA A 49 -9.982 12.359 9.679 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.382 12.815 10.059 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.669 13.956 8.894 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.688 12.616 8.318 1.00 0.00 H new ATOM 695 N PRO A 50 -10.808 10.117 10.492 1.00 0.00 N ATOM 696 CA PRO A 50 -11.109 8.741 10.902 1.00 0.00 C ATOM 697 C PRO A 50 -12.566 8.368 10.651 1.00 0.00 C ATOM 698 O PRO A 50 -13.431 9.238 10.547 1.00 0.00 O ATOM 699 CB PRO A 50 -10.810 8.739 12.403 1.00 0.00 C ATOM 700 CG PRO A 50 -9.834 9.847 12.599 1.00 0.00 C ATOM 701 CD PRO A 50 -10.190 10.895 11.583 1.00 0.00 C ATOM 0 HA PRO A 50 -10.526 8.013 10.338 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.716 8.902 12.987 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.393 7.784 12.722 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.896 10.247 13.611 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -8.812 9.497 12.457 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -10.881 11.633 11.992 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.309 11.438 11.240 1.00 0.00 H new ATOM 709 N HIS A 51 -12.830 7.068 10.554 1.00 0.00 N ATOM 710 CA HIS A 51 -14.183 6.580 10.315 1.00 0.00 C ATOM 711 C HIS A 51 -14.976 6.519 11.617 1.00 0.00 C ATOM 712 O HIS A 51 -14.402 6.536 12.706 1.00 0.00 O ATOM 713 CB HIS A 51 -14.141 5.195 9.666 1.00 0.00 C ATOM 714 CG HIS A 51 -13.976 5.236 8.179 1.00 0.00 C ATOM 715 ND1 HIS A 51 -15.050 5.424 7.343 1.00 0.00 N ATOM 716 CD2 HIS A 51 -12.851 5.109 7.432 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.561 5.408 6.117 1.00 0.00 C ATOM 718 NE2 HIS A 51 -13.233 5.219 6.119 1.00 0.00 N ATOM 0 H HIS A 51 -12.125 6.335 10.637 1.00 0.00 H new ATOM 0 HA HIS A 51 -14.680 7.276 9.639 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -13.319 4.625 10.099 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.061 4.662 9.907 1.00 0.00 H new ATOM 0 HD1 HIS A 51 -16.025 5.550 7.614 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -11.848 4.952 7.800 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -15.156 5.532 5.224 1.00 0.00 H new ATOM 726 N ARG A 52 -16.297 6.448 11.498 1.00 0.00 N ATOM 727 CA ARG A 52 -17.168 6.384 12.665 1.00 0.00 C ATOM 728 C ARG A 52 -17.061 5.025 13.350 1.00 0.00 C ATOM 729 O ARG A 52 -16.454 4.901 14.415 1.00 0.00 O ATOM 730 CB ARG A 52 -18.619 6.652 12.262 1.00 0.00 C ATOM 731 CG ARG A 52 -18.902 8.112 11.941 1.00 0.00 C ATOM 732 CD ARG A 52 -20.234 8.564 12.517 1.00 0.00 C ATOM 733 NE ARG A 52 -21.041 9.282 11.532 1.00 0.00 N ATOM 734 CZ ARG A 52 -22.062 10.076 11.847 1.00 0.00 C ATOM 735 NH1 ARG A 52 -22.404 10.257 13.117 1.00 0.00 N ATOM 736 NH2 ARG A 52 -22.743 10.691 10.890 1.00 0.00 N ATOM 0 H ARG A 52 -16.788 6.433 10.604 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.847 7.152 13.368 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -18.864 6.043 11.392 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.277 6.332 13.070 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -18.102 8.735 12.341 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.906 8.253 10.860 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.787 7.696 12.876 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.057 9.207 13.379 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.808 9.168 10.546 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -21.884 9.787 13.857 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -23.187 10.867 13.352 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -22.485 10.556 9.913 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -23.525 11.299 11.131 1.00 0.00 H new ATOM 750 N GLU A 53 -17.653 4.009 12.732 1.00 0.00 N ATOM 751 CA GLU A 53 -17.625 2.659 13.283 1.00 0.00 C ATOM 752 C GLU A 53 -16.257 2.016 13.076 1.00 0.00 C ATOM 753 O GLU A 53 -15.489 2.431 12.207 1.00 0.00 O ATOM 754 CB GLU A 53 -18.709 1.800 12.632 1.00 0.00 C ATOM 755 CG GLU A 53 -20.082 2.453 12.627 1.00 0.00 C ATOM 756 CD GLU A 53 -20.691 2.539 14.012 1.00 0.00 C ATOM 757 OE1 GLU A 53 -20.030 3.087 14.919 1.00 0.00 O ATOM 758 OE2 GLU A 53 -21.831 2.061 14.190 1.00 0.00 O ATOM 0 H GLU A 53 -18.158 4.094 11.850 1.00 0.00 H new ATOM 0 HA GLU A 53 -17.817 2.725 14.354 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.418 1.579 11.605 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -18.771 0.847 13.158 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -20.002 3.455 12.206 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.748 1.886 11.976 1.00 0.00 H new ATOM 765 N VAL A 54 -15.958 1.001 13.880 1.00 0.00 N ATOM 766 CA VAL A 54 -14.683 0.301 13.786 1.00 0.00 C ATOM 767 C VAL A 54 -14.650 -0.619 12.570 1.00 0.00 C ATOM 768 O VAL A 54 -13.594 -0.844 11.978 1.00 0.00 O ATOM 769 CB VAL A 54 -14.405 -0.532 15.051 1.00 0.00 C ATOM 770 CG1 VAL A 54 -12.992 -1.093 15.022 1.00 0.00 C ATOM 771 CG2 VAL A 54 -14.628 0.306 16.301 1.00 0.00 C ATOM 0 H VAL A 54 -16.582 0.645 14.604 1.00 0.00 H new ATOM 0 HA VAL A 54 -13.911 1.063 13.684 1.00 0.00 H new ATOM 0 HB VAL A 54 -15.103 -1.369 15.073 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -12.814 -1.679 15.924 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -12.872 -1.730 14.146 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -12.276 -0.273 14.975 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -14.427 -0.299 17.185 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -13.956 1.164 16.288 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -15.661 0.654 16.326 1.00 0.00 H new ATOM 781 N ASP A 55 -15.812 -1.148 12.203 1.00 0.00 N ATOM 782 CA ASP A 55 -15.917 -2.044 11.057 1.00 0.00 C ATOM 783 C ASP A 55 -16.534 -1.328 9.860 1.00 0.00 C ATOM 784 O ASP A 55 -17.742 -1.402 9.636 1.00 0.00 O ATOM 785 CB ASP A 55 -16.755 -3.273 11.419 1.00 0.00 C ATOM 786 CG ASP A 55 -16.497 -4.443 10.490 1.00 0.00 C ATOM 787 OD1 ASP A 55 -15.325 -4.656 10.115 1.00 0.00 O ATOM 788 OD2 ASP A 55 -17.467 -5.146 10.138 1.00 0.00 O ATOM 0 H ASP A 55 -16.695 -0.972 12.683 1.00 0.00 H new ATOM 0 HA ASP A 55 -14.911 -2.365 10.786 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -16.534 -3.571 12.444 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -17.813 -3.011 11.384 1.00 0.00 H new ATOM 793 N GLU A 56 -15.697 -0.635 9.096 1.00 0.00 N ATOM 794 CA GLU A 56 -16.161 0.096 7.921 1.00 0.00 C ATOM 795 C GLU A 56 -15.091 0.114 6.834 1.00 0.00 C ATOM 796 O GLU A 56 -13.899 0.213 7.124 1.00 0.00 O ATOM 797 CB GLU A 56 -16.541 1.528 8.304 1.00 0.00 C ATOM 798 CG GLU A 56 -17.404 2.225 7.265 1.00 0.00 C ATOM 799 CD GLU A 56 -18.692 2.775 7.848 1.00 0.00 C ATOM 800 OE1 GLU A 56 -18.616 3.587 8.794 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.776 2.393 7.359 1.00 0.00 O ATOM 0 H GLU A 56 -14.694 -0.564 9.268 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.041 -0.414 7.530 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -17.073 1.512 9.255 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.631 2.108 8.457 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -16.837 3.040 6.815 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.642 1.523 6.466 1.00 0.00 H new ATOM 808 N GLY A 57 -15.525 0.018 5.582 1.00 0.00 N ATOM 809 CA GLY A 57 -14.592 0.026 4.470 1.00 0.00 C ATOM 810 C GLY A 57 -14.126 1.425 4.114 1.00 0.00 C ATOM 811 O GLY A 57 -14.844 2.397 4.345 1.00 0.00 O ATOM 0 H GLY A 57 -16.506 -0.065 5.317 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.728 -0.589 4.721 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.065 -0.429 3.600 1.00 0.00 H new ATOM 815 N PRO A 58 -12.916 1.559 3.544 1.00 0.00 N ATOM 816 CA PRO A 58 -12.366 2.863 3.158 1.00 0.00 C ATOM 817 C PRO A 58 -13.069 3.451 1.939 1.00 0.00 C ATOM 818 O PRO A 58 -13.646 2.723 1.131 1.00 0.00 O ATOM 819 CB PRO A 58 -10.906 2.547 2.833 1.00 0.00 C ATOM 820 CG PRO A 58 -10.912 1.116 2.419 1.00 0.00 C ATOM 821 CD PRO A 58 -11.991 0.453 3.231 1.00 0.00 C ATOM 0 HA PRO A 58 -12.491 3.608 3.944 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.530 3.188 2.036 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.264 2.706 3.699 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.112 1.020 1.352 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -9.943 0.652 2.605 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.487 -0.338 2.669 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.589 -0.003 4.136 1.00 0.00 H new ATOM 829 N SER A 59 -13.013 4.772 1.813 1.00 0.00 N ATOM 830 CA SER A 59 -13.643 5.460 0.691 1.00 0.00 C ATOM 831 C SER A 59 -12.807 5.308 -0.578 1.00 0.00 C ATOM 832 O SER A 59 -11.626 4.965 -0.513 1.00 0.00 O ATOM 833 CB SER A 59 -13.834 6.942 1.020 1.00 0.00 C ATOM 834 OG SER A 59 -14.614 7.109 2.192 1.00 0.00 O ATOM 0 H SER A 59 -12.538 5.388 2.473 1.00 0.00 H new ATOM 0 HA SER A 59 -14.618 5.006 0.516 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.862 7.416 1.156 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.319 7.444 0.183 1.00 0.00 H new ATOM 0 HG SER A 59 -14.720 8.065 2.381 1.00 0.00 H new ATOM 840 N PRO A 60 -13.409 5.561 -1.753 1.00 0.00 N ATOM 841 CA PRO A 60 -12.710 5.447 -3.037 1.00 0.00 C ATOM 842 C PRO A 60 -11.421 6.265 -3.082 1.00 0.00 C ATOM 843 O PRO A 60 -10.386 5.778 -3.537 1.00 0.00 O ATOM 844 CB PRO A 60 -13.724 5.978 -4.054 1.00 0.00 C ATOM 845 CG PRO A 60 -15.050 5.802 -3.399 1.00 0.00 C ATOM 846 CD PRO A 60 -14.814 5.973 -1.924 1.00 0.00 C ATOM 0 HA PRO A 60 -12.395 4.422 -3.231 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.536 7.025 -4.290 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.670 5.425 -4.992 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -15.766 6.537 -3.767 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.464 4.817 -3.616 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -14.972 7.004 -1.609 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.489 5.353 -1.334 1.00 0.00 H new ATOM 854 N PRO A 61 -11.463 7.521 -2.607 1.00 0.00 N ATOM 855 CA PRO A 61 -10.287 8.398 -2.597 1.00 0.00 C ATOM 856 C PRO A 61 -9.158 7.831 -1.743 1.00 0.00 C ATOM 857 O PRO A 61 -7.981 8.074 -2.012 1.00 0.00 O ATOM 858 CB PRO A 61 -10.810 9.705 -1.989 1.00 0.00 C ATOM 859 CG PRO A 61 -12.293 9.634 -2.126 1.00 0.00 C ATOM 860 CD PRO A 61 -12.648 8.183 -2.044 1.00 0.00 C ATOM 0 HA PRO A 61 -9.865 8.521 -3.594 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -10.515 9.799 -0.944 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.407 10.572 -2.513 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -12.785 10.201 -1.336 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.618 10.062 -3.075 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -12.835 7.871 -1.017 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.548 7.955 -2.615 1.00 0.00 H new ATOM 868 N GLU A 62 -9.525 7.077 -0.712 1.00 0.00 N ATOM 869 CA GLU A 62 -8.545 6.475 0.183 1.00 0.00 C ATOM 870 C GLU A 62 -7.983 5.186 -0.410 1.00 0.00 C ATOM 871 O GLU A 62 -6.841 4.815 -0.142 1.00 0.00 O ATOM 872 CB GLU A 62 -9.178 6.188 1.546 1.00 0.00 C ATOM 873 CG GLU A 62 -9.156 7.380 2.489 1.00 0.00 C ATOM 874 CD GLU A 62 -10.219 7.290 3.567 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.488 6.168 4.043 1.00 0.00 O ATOM 876 OE2 GLU A 62 -10.782 8.343 3.934 1.00 0.00 O ATOM 0 H GLU A 62 -10.495 6.868 -0.476 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.725 7.182 0.311 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.210 5.871 1.399 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.652 5.355 2.014 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.174 7.450 2.957 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.302 8.295 1.915 1.00 0.00 H new ATOM 883 N GLN A 63 -8.793 4.506 -1.215 1.00 0.00 N ATOM 884 CA GLN A 63 -8.376 3.258 -1.844 1.00 0.00 C ATOM 885 C GLN A 63 -7.277 3.507 -2.872 1.00 0.00 C ATOM 886 O GLN A 63 -7.281 4.524 -3.567 1.00 0.00 O ATOM 887 CB GLN A 63 -9.570 2.575 -2.511 1.00 0.00 C ATOM 888 CG GLN A 63 -10.636 2.116 -1.529 1.00 0.00 C ATOM 889 CD GLN A 63 -11.959 1.813 -2.204 1.00 0.00 C ATOM 890 OE1 GLN A 63 -12.036 1.715 -3.429 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.010 1.661 -1.405 1.00 0.00 N ATOM 0 H GLN A 63 -9.742 4.798 -1.447 1.00 0.00 H new ATOM 0 HA GLN A 63 -7.980 2.604 -1.068 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.019 3.264 -3.226 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.215 1.714 -3.078 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.286 1.225 -1.008 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -10.786 2.888 -0.774 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -12.900 1.751 -0.395 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.927 1.454 -1.802 1.00 0.00 H new ATOM 900 N PHE A 64 -6.338 2.571 -2.964 1.00 0.00 N ATOM 901 CA PHE A 64 -5.232 2.687 -3.908 1.00 0.00 C ATOM 902 C PHE A 64 -5.008 1.372 -4.647 1.00 0.00 C ATOM 903 O PHE A 64 -5.272 0.295 -4.111 1.00 0.00 O ATOM 904 CB PHE A 64 -3.953 3.100 -3.178 1.00 0.00 C ATOM 905 CG PHE A 64 -4.006 4.489 -2.611 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.706 5.587 -3.401 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.357 4.698 -1.287 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.756 6.867 -2.882 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.408 5.976 -0.762 1.00 0.00 C ATOM 910 CZ PHE A 64 -4.107 7.062 -1.561 1.00 0.00 C ATOM 0 H PHE A 64 -6.321 1.724 -2.396 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.489 3.454 -4.639 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.762 2.394 -2.370 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.112 3.030 -3.868 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.430 5.441 -4.435 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.594 3.853 -0.658 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.521 7.714 -3.509 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.683 6.125 0.272 1.00 0.00 H new ATOM 0 HZ PHE A 64 -4.146 8.061 -1.153 1.00 0.00 H new ATOM 920 N THR A 65 -4.520 1.466 -5.879 1.00 0.00 N ATOM 921 CA THR A 65 -4.261 0.282 -6.691 1.00 0.00 C ATOM 922 C THR A 65 -2.770 -0.036 -6.729 1.00 0.00 C ATOM 923 O THR A 65 -1.955 0.810 -7.096 1.00 0.00 O ATOM 924 CB THR A 65 -4.789 0.487 -8.111 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.987 1.242 -8.097 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.072 -0.811 -8.837 1.00 0.00 C ATOM 0 H THR A 65 -4.296 2.349 -6.337 1.00 0.00 H new ATOM 0 HA THR A 65 -4.781 -0.561 -6.237 1.00 0.00 H new ATOM 0 HB THR A 65 -3.996 1.015 -8.640 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.392 1.229 -8.989 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.444 -0.594 -9.838 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.155 -1.395 -8.909 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.822 -1.380 -8.287 1.00 0.00 H new ATOM 934 N ALA A 66 -2.421 -1.261 -6.349 1.00 0.00 N ATOM 935 CA ALA A 66 -1.028 -1.689 -6.341 1.00 0.00 C ATOM 936 C ALA A 66 -0.661 -2.387 -7.646 1.00 0.00 C ATOM 937 O ALA A 66 -1.534 -2.833 -8.390 1.00 0.00 O ATOM 938 CB ALA A 66 -0.767 -2.609 -5.157 1.00 0.00 C ATOM 0 H ALA A 66 -3.083 -1.974 -6.043 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.401 -0.803 -6.245 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.277 -2.922 -5.162 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.982 -2.078 -4.230 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.409 -3.487 -5.230 1.00 0.00 H new ATOM 944 N VAL A 67 0.637 -2.480 -7.916 1.00 0.00 N ATOM 945 CA VAL A 67 1.120 -3.124 -9.132 1.00 0.00 C ATOM 946 C VAL A 67 2.512 -3.711 -8.927 1.00 0.00 C ATOM 947 O VAL A 67 3.493 -2.979 -8.802 1.00 0.00 O ATOM 948 CB VAL A 67 1.162 -2.136 -10.313 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.476 -2.866 -11.610 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.153 -1.379 -10.423 1.00 0.00 C ATOM 0 H VAL A 67 1.373 -2.118 -7.310 1.00 0.00 H new ATOM 0 HA VAL A 67 0.420 -3.926 -9.364 1.00 0.00 H new ATOM 0 HB VAL A 67 1.957 -1.413 -10.129 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.501 -2.151 -12.433 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.446 -3.357 -11.526 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.706 -3.614 -11.802 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.105 -0.686 -11.263 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -0.967 -2.086 -10.582 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.330 -0.822 -9.503 1.00 0.00 H new ATOM 960 N LYS A 68 2.589 -5.038 -8.891 1.00 0.00 N ATOM 961 CA LYS A 68 3.862 -5.724 -8.700 1.00 0.00 C ATOM 962 C LYS A 68 4.815 -5.435 -9.855 1.00 0.00 C ATOM 963 O LYS A 68 4.460 -5.600 -11.022 1.00 0.00 O ATOM 964 CB LYS A 68 3.638 -7.232 -8.573 1.00 0.00 C ATOM 965 CG LYS A 68 3.332 -7.683 -7.154 1.00 0.00 C ATOM 966 CD LYS A 68 3.189 -9.195 -7.068 1.00 0.00 C ATOM 967 CE LYS A 68 4.501 -9.897 -7.376 1.00 0.00 C ATOM 968 NZ LYS A 68 4.517 -10.470 -8.750 1.00 0.00 N ATOM 0 H LYS A 68 1.786 -5.659 -8.991 1.00 0.00 H new ATOM 0 HA LYS A 68 4.312 -5.352 -7.780 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.814 -7.525 -9.224 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.526 -7.754 -8.928 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.128 -7.353 -6.487 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.412 -7.209 -6.811 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.852 -9.473 -6.070 1.00 0.00 H new ATOM 0 HD3 LYS A 68 2.423 -9.529 -7.768 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.324 -9.191 -7.268 1.00 0.00 H new ATOM 0 HE3 LYS A 68 4.666 -10.693 -6.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 5.501 -10.616 -9.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.015 -11.381 -8.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 4.046 -9.814 -9.405 1.00 0.00 H new ATOM 982 N LEU A 69 6.027 -5.002 -9.522 1.00 0.00 N ATOM 983 CA LEU A 69 7.031 -4.690 -10.531 1.00 0.00 C ATOM 984 C LEU A 69 8.187 -5.684 -10.477 1.00 0.00 C ATOM 985 O LEU A 69 8.290 -6.578 -11.318 1.00 0.00 O ATOM 986 CB LEU A 69 7.556 -3.266 -10.335 1.00 0.00 C ATOM 987 CG LEU A 69 6.536 -2.158 -10.601 1.00 0.00 C ATOM 988 CD1 LEU A 69 7.092 -0.806 -10.181 1.00 0.00 C ATOM 989 CD2 LEU A 69 6.140 -2.140 -12.070 1.00 0.00 C ATOM 0 H LEU A 69 6.337 -4.859 -8.561 1.00 0.00 H new ATOM 0 HA LEU A 69 6.559 -4.764 -11.511 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.919 -3.167 -9.312 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.412 -3.117 -10.993 1.00 0.00 H new ATOM 0 HG LEU A 69 5.645 -2.361 -10.007 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.351 -0.031 -10.378 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.325 -0.823 -9.116 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.999 -0.594 -10.747 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.414 -1.346 -12.241 1.00 0.00 H new ATOM 0 HD22 LEU A 69 7.024 -1.962 -12.683 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.699 -3.099 -12.340 1.00 0.00 H new ATOM 1001 N SER A 70 9.057 -5.524 -9.484 1.00 0.00 N ATOM 1002 CA SER A 70 10.205 -6.409 -9.320 1.00 0.00 C ATOM 1003 C SER A 70 11.031 -6.008 -8.103 1.00 0.00 C ATOM 1004 O SER A 70 11.016 -4.851 -7.682 1.00 0.00 O ATOM 1005 CB SER A 70 11.081 -6.382 -10.574 1.00 0.00 C ATOM 1006 OG SER A 70 11.382 -5.051 -10.959 1.00 0.00 O ATOM 0 H SER A 70 8.988 -4.789 -8.780 1.00 0.00 H new ATOM 0 HA SER A 70 9.831 -7.422 -9.167 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.006 -6.927 -10.387 1.00 0.00 H new ATOM 0 HB3 SER A 70 10.569 -6.893 -11.390 1.00 0.00 H new ATOM 0 HG SER A 70 11.944 -5.062 -11.762 1.00 0.00 H new ATOM 1012 N ASP A 71 11.755 -6.972 -7.540 1.00 0.00 N ATOM 1013 CA ASP A 71 12.588 -6.718 -6.370 1.00 0.00 C ATOM 1014 C ASP A 71 11.746 -6.217 -5.200 1.00 0.00 C ATOM 1015 O ASP A 71 12.150 -5.306 -4.476 1.00 0.00 O ATOM 1016 CB ASP A 71 13.676 -5.697 -6.705 1.00 0.00 C ATOM 1017 CG ASP A 71 14.924 -6.347 -7.273 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.289 -7.443 -6.800 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.535 -5.758 -8.189 1.00 0.00 O ATOM 0 H ASP A 71 11.781 -7.935 -7.875 1.00 0.00 H new ATOM 0 HA ASP A 71 13.058 -7.657 -6.079 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.286 -4.977 -7.424 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.937 -5.140 -5.805 1.00 0.00 H new ATOM 1024 N SER A 72 10.574 -6.817 -5.020 1.00 0.00 N ATOM 1025 CA SER A 72 9.675 -6.431 -3.939 1.00 0.00 C ATOM 1026 C SER A 72 9.229 -4.981 -4.096 1.00 0.00 C ATOM 1027 O SER A 72 8.981 -4.288 -3.108 1.00 0.00 O ATOM 1028 CB SER A 72 10.359 -6.624 -2.583 1.00 0.00 C ATOM 1029 OG SER A 72 11.072 -7.847 -2.542 1.00 0.00 O ATOM 0 H SER A 72 10.225 -7.573 -5.609 1.00 0.00 H new ATOM 0 HA SER A 72 8.794 -7.071 -3.986 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.041 -5.795 -2.395 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.612 -6.608 -1.790 1.00 0.00 H new ATOM 0 HG SER A 72 11.501 -7.946 -1.667 1.00 0.00 H new ATOM 1035 N ARG A 73 9.127 -4.530 -5.341 1.00 0.00 N ATOM 1036 CA ARG A 73 8.711 -3.162 -5.627 1.00 0.00 C ATOM 1037 C ARG A 73 7.331 -3.139 -6.278 1.00 0.00 C ATOM 1038 O ARG A 73 7.101 -3.797 -7.292 1.00 0.00 O ATOM 1039 CB ARG A 73 9.728 -2.476 -6.540 1.00 0.00 C ATOM 1040 CG ARG A 73 11.167 -2.638 -6.078 1.00 0.00 C ATOM 1041 CD ARG A 73 11.509 -1.661 -4.966 1.00 0.00 C ATOM 1042 NE ARG A 73 11.555 -0.282 -5.445 1.00 0.00 N ATOM 1043 CZ ARG A 73 11.995 0.743 -4.716 1.00 0.00 C ATOM 1044 NH1 ARG A 73 12.425 0.546 -3.475 1.00 0.00 N ATOM 1045 NH2 ARG A 73 12.003 1.965 -5.228 1.00 0.00 N ATOM 0 H ARG A 73 9.327 -5.092 -6.169 1.00 0.00 H new ATOM 0 HA ARG A 73 8.658 -2.620 -4.683 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.631 -2.881 -7.547 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.492 -1.414 -6.600 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.325 -3.658 -5.729 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.840 -2.482 -6.921 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.769 -1.744 -4.170 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.473 -1.927 -4.533 1.00 0.00 H new ATOM 0 HE ARG A 73 11.231 -0.092 -6.393 1.00 0.00 H new ATOM 0 HH11 ARG A 73 12.419 -0.393 -3.076 1.00 0.00 H new ATOM 0 HH12 ARG A 73 12.761 1.334 -2.921 1.00 0.00 H new ATOM 0 HH21 ARG A 73 11.672 2.121 -6.180 1.00 0.00 H new ATOM 0 HH22 ARG A 73 12.340 2.750 -4.670 1.00 0.00 H new ATOM 1059 N ILE A 74 6.416 -2.375 -5.688 1.00 0.00 N ATOM 1060 CA ILE A 74 5.060 -2.267 -6.210 1.00 0.00 C ATOM 1061 C ILE A 74 4.647 -0.808 -6.363 1.00 0.00 C ATOM 1062 O ILE A 74 5.018 0.042 -5.553 1.00 0.00 O ATOM 1063 CB ILE A 74 4.046 -2.981 -5.296 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.158 -2.455 -3.864 1.00 0.00 C ATOM 1065 CG2 ILE A 74 4.268 -4.487 -5.333 1.00 0.00 C ATOM 1066 CD1 ILE A 74 2.940 -2.751 -3.015 1.00 0.00 C ATOM 0 H ILE A 74 6.590 -1.822 -4.849 1.00 0.00 H new ATOM 0 HA ILE A 74 5.058 -2.749 -7.188 1.00 0.00 H new ATOM 0 HB ILE A 74 3.040 -2.773 -5.661 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.036 -2.895 -3.391 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.318 -1.377 -3.893 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.544 -4.978 -4.682 1.00 0.00 H new ATOM 0 HG22 ILE A 74 4.142 -4.848 -6.354 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.277 -4.715 -4.990 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.089 -2.349 -2.013 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.062 -2.288 -3.465 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.791 -3.829 -2.956 1.00 0.00 H new ATOM 1078 N ALA A 75 3.872 -0.523 -7.405 1.00 0.00 N ATOM 1079 CA ALA A 75 3.408 0.834 -7.663 1.00 0.00 C ATOM 1080 C ALA A 75 2.118 1.125 -6.901 1.00 0.00 C ATOM 1081 O ALA A 75 1.569 0.249 -6.234 1.00 0.00 O ATOM 1082 CB ALA A 75 3.201 1.046 -9.156 1.00 0.00 C ATOM 0 H ALA A 75 3.553 -1.214 -8.084 1.00 0.00 H new ATOM 0 HA ALA A 75 4.172 1.527 -7.312 1.00 0.00 H new ATOM 0 HB1 ALA A 75 2.854 2.064 -9.334 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.143 0.886 -9.680 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.457 0.340 -9.524 1.00 0.00 H new ATOM 1088 N LEU A 76 1.641 2.360 -7.007 1.00 0.00 N ATOM 1089 CA LEU A 76 0.416 2.765 -6.327 1.00 0.00 C ATOM 1090 C LEU A 76 -0.359 3.781 -7.159 1.00 0.00 C ATOM 1091 O LEU A 76 0.203 4.769 -7.632 1.00 0.00 O ATOM 1092 CB LEU A 76 0.742 3.355 -4.953 1.00 0.00 C ATOM 1093 CG LEU A 76 1.307 2.360 -3.938 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.711 3.077 -2.659 1.00 0.00 C ATOM 1095 CD2 LEU A 76 0.290 1.268 -3.642 1.00 0.00 C ATOM 0 H LEU A 76 2.083 3.097 -7.556 1.00 0.00 H new ATOM 0 HA LEU A 76 -0.207 1.880 -6.197 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.460 4.165 -5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.165 3.797 -4.540 1.00 0.00 H new ATOM 0 HG LEU A 76 2.195 1.895 -4.366 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.111 2.354 -1.948 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.473 3.823 -2.885 1.00 0.00 H new ATOM 0 HD13 LEU A 76 0.839 3.568 -2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 76 0.708 0.568 -2.918 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -0.616 1.716 -3.233 1.00 0.00 H new ATOM 0 HD23 LEU A 76 0.048 0.737 -4.563 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.653 3.533 -7.334 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.506 4.426 -8.108 1.00 0.00 C ATOM 1109 C LYS A 77 -3.689 4.906 -7.275 1.00 0.00 C ATOM 1110 O LYS A 77 -4.363 4.112 -6.619 1.00 0.00 O ATOM 1111 CB LYS A 77 -3.009 3.720 -9.368 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.679 4.654 -10.363 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.639 3.904 -11.272 1.00 0.00 C ATOM 1114 CE LYS A 77 -6.076 4.024 -10.787 1.00 0.00 C ATOM 1115 NZ LYS A 77 -7.027 4.228 -11.915 1.00 0.00 N ATOM 0 H LYS A 77 -2.134 2.720 -6.949 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.913 5.293 -8.398 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -2.170 3.224 -9.856 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.716 2.942 -9.081 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.219 5.433 -9.825 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.919 5.151 -10.966 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.562 4.296 -12.286 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.355 2.853 -11.314 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -6.351 3.123 -10.239 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -6.155 4.858 -10.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -7.947 4.539 -11.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.651 4.953 -12.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -7.148 3.334 -12.433 1.00 0.00 H new ATOM 1129 N SER A 78 -3.936 6.212 -7.304 1.00 0.00 N ATOM 1130 CA SER A 78 -5.038 6.799 -6.550 1.00 0.00 C ATOM 1131 C SER A 78 -6.360 6.619 -7.291 1.00 0.00 C ATOM 1132 O SER A 78 -6.380 6.413 -8.504 1.00 0.00 O ATOM 1133 CB SER A 78 -4.778 8.285 -6.300 1.00 0.00 C ATOM 1134 OG SER A 78 -3.992 8.847 -7.337 1.00 0.00 O ATOM 0 H SER A 78 -3.388 6.884 -7.841 1.00 0.00 H new ATOM 0 HA SER A 78 -5.106 6.284 -5.592 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.727 8.817 -6.230 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.270 8.413 -5.344 1.00 0.00 H new ATOM 0 HG SER A 78 -3.841 9.798 -7.154 1.00 0.00 H new ATOM 1140 N GLY A 79 -7.461 6.700 -6.552 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.772 6.543 -7.154 1.00 0.00 C ATOM 1142 C GLY A 79 -9.042 7.578 -8.230 1.00 0.00 C ATOM 1143 O GLY A 79 -9.797 7.324 -9.169 1.00 0.00 O ATOM 0 H GLY A 79 -7.469 6.872 -5.547 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.854 5.545 -7.585 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.536 6.620 -6.380 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.427 8.747 -8.091 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.605 9.824 -9.058 1.00 0.00 C ATOM 1149 C TYR A 80 -8.107 9.405 -10.438 1.00 0.00 C ATOM 1150 O TYR A 80 -8.620 9.862 -11.460 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.867 11.081 -8.596 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.728 12.027 -7.787 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.829 12.654 -8.358 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -8.439 12.291 -6.454 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.617 13.518 -7.623 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -9.224 13.154 -5.713 1.00 0.00 C ATOM 1157 CZ TYR A 80 -10.311 13.766 -6.301 1.00 0.00 C ATOM 1158 OH TYR A 80 -11.094 14.625 -5.567 1.00 0.00 O ATOM 0 H TYR A 80 -7.801 8.973 -7.318 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.671 10.043 -9.128 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -7.005 10.787 -7.998 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.484 11.609 -9.469 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -10.072 12.463 -9.393 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -7.588 11.815 -5.990 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.469 13.997 -8.081 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -8.987 13.348 -4.677 1.00 0.00 H new ATOM 0 HH TYR A 80 -11.145 15.491 -6.023 1.00 0.00 H new ATOM 1168 N GLY A 81 -7.104 8.533 -10.461 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.553 8.067 -11.720 1.00 0.00 C ATOM 1170 C GLY A 81 -5.110 8.491 -11.917 1.00 0.00 C ATOM 1171 O GLY A 81 -4.662 8.678 -13.048 1.00 0.00 O ATOM 0 H GLY A 81 -6.663 8.141 -9.629 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.617 6.980 -11.760 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -7.157 8.453 -12.542 1.00 0.00 H new ATOM 1175 N LYS A 82 -4.383 8.640 -10.816 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.983 9.044 -10.873 1.00 0.00 C ATOM 1177 C LYS A 82 -2.096 8.039 -10.144 1.00 0.00 C ATOM 1178 O LYS A 82 -2.589 7.084 -9.544 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.804 10.435 -10.262 1.00 0.00 C ATOM 1180 CG LYS A 82 -3.085 11.567 -11.237 1.00 0.00 C ATOM 1181 CD LYS A 82 -2.132 12.735 -11.026 1.00 0.00 C ATOM 1182 CE LYS A 82 -1.693 13.343 -12.348 1.00 0.00 C ATOM 1183 NZ LYS A 82 -1.811 14.828 -12.343 1.00 0.00 N ATOM 0 H LYS A 82 -4.740 8.487 -9.873 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.684 9.074 -11.921 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.467 10.534 -9.403 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.784 10.531 -9.890 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.991 11.200 -12.259 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -4.113 11.908 -11.114 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -2.619 13.497 -10.418 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -1.257 12.396 -10.472 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -0.660 13.062 -12.552 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.300 12.933 -13.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -2.006 15.164 -13.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -2.588 15.112 -11.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -0.921 15.246 -12.004 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.788 8.262 -10.200 1.00 0.00 N ATOM 1198 CA TYR A 83 0.168 7.377 -9.545 1.00 0.00 C ATOM 1199 C TYR A 83 0.897 8.100 -8.418 1.00 0.00 C ATOM 1200 O TYR A 83 1.430 9.193 -8.612 1.00 0.00 O ATOM 1201 CB TYR A 83 1.179 6.841 -10.561 1.00 0.00 C ATOM 1202 CG TYR A 83 0.751 5.549 -11.219 1.00 0.00 C ATOM 1203 CD1 TYR A 83 -0.502 5.427 -11.807 1.00 0.00 C ATOM 1204 CD2 TYR A 83 1.600 4.449 -11.251 1.00 0.00 C ATOM 1205 CE1 TYR A 83 -0.895 4.248 -12.409 1.00 0.00 C ATOM 1206 CE2 TYR A 83 1.214 3.266 -11.851 1.00 0.00 C ATOM 1207 CZ TYR A 83 -0.035 3.170 -12.429 1.00 0.00 C ATOM 1208 OH TYR A 83 -0.423 1.994 -13.027 1.00 0.00 O ATOM 0 H TYR A 83 -0.365 9.049 -10.693 1.00 0.00 H new ATOM 0 HA TYR A 83 -0.385 6.541 -9.117 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.341 7.595 -11.332 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.135 6.685 -10.061 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -1.180 6.268 -11.793 1.00 0.00 H new ATOM 0 HD2 TYR A 83 2.578 4.520 -10.799 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -1.872 4.170 -12.862 1.00 0.00 H new ATOM 0 HE2 TYR A 83 1.886 2.421 -11.867 1.00 0.00 H new ATOM 0 HH TYR A 83 0.300 1.336 -12.954 1.00 0.00 H new ATOM 1218 N LEU A 84 0.918 7.484 -7.241 1.00 0.00 N ATOM 1219 CA LEU A 84 1.583 8.070 -6.084 1.00 0.00 C ATOM 1220 C LEU A 84 3.088 8.164 -6.312 1.00 0.00 C ATOM 1221 O LEU A 84 3.699 7.251 -6.867 1.00 0.00 O ATOM 1222 CB LEU A 84 1.297 7.241 -4.830 1.00 0.00 C ATOM 1223 CG LEU A 84 -0.079 7.469 -4.202 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.246 6.615 -2.955 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.276 8.941 -3.874 1.00 0.00 C ATOM 0 H LEU A 84 0.482 6.579 -7.063 1.00 0.00 H new ATOM 0 HA LEU A 84 1.191 9.077 -5.943 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.394 6.185 -5.081 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.061 7.463 -4.085 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.841 7.172 -4.923 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.231 6.791 -2.523 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.149 5.562 -3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.522 6.879 -2.228 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.260 9.086 -3.428 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.492 9.263 -3.171 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.202 9.531 -4.788 1.00 0.00 H new ATOM 1237 N GLY A 85 3.679 9.274 -5.883 1.00 0.00 N ATOM 1238 CA GLY A 85 5.108 9.466 -6.052 1.00 0.00 C ATOM 1239 C GLY A 85 5.699 10.392 -5.007 1.00 0.00 C ATOM 1240 O GLY A 85 4.981 11.177 -4.386 1.00 0.00 O ATOM 0 H GLY A 85 3.195 10.044 -5.422 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.609 8.499 -6.001 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.301 9.873 -7.044 1.00 0.00 H new ATOM 1244 N ILE A 86 7.010 10.300 -4.812 1.00 0.00 N ATOM 1245 CA ILE A 86 7.697 11.136 -3.835 1.00 0.00 C ATOM 1246 C ILE A 86 8.549 12.198 -4.523 1.00 0.00 C ATOM 1247 O ILE A 86 9.053 11.985 -5.625 1.00 0.00 O ATOM 1248 CB ILE A 86 8.596 10.296 -2.909 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.489 9.367 -3.734 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.747 9.494 -1.933 1.00 0.00 C ATOM 1251 CD1 ILE A 86 10.865 9.165 -3.138 1.00 0.00 C ATOM 0 H ILE A 86 7.618 9.655 -5.317 1.00 0.00 H new ATOM 0 HA ILE A 86 6.926 11.622 -3.238 1.00 0.00 H new ATOM 0 HB ILE A 86 9.235 10.970 -2.338 1.00 0.00 H new ATOM 0 HG12 ILE A 86 8.999 8.398 -3.833 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.594 9.775 -4.739 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.396 8.905 -1.285 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.149 10.174 -1.326 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.087 8.827 -2.488 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.443 8.496 -3.775 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.374 10.126 -3.065 1.00 0.00 H new ATOM 0 HD13 ILE A 86 10.770 8.728 -2.144 1.00 0.00 H new ATOM 1263 N ASN A 87 8.706 13.341 -3.863 1.00 0.00 N ATOM 1264 CA ASN A 87 9.498 14.437 -4.410 1.00 0.00 C ATOM 1265 C ASN A 87 10.951 14.336 -3.956 1.00 0.00 C ATOM 1266 O ASN A 87 11.263 13.639 -2.990 1.00 0.00 O ATOM 1267 CB ASN A 87 8.909 15.783 -3.982 1.00 0.00 C ATOM 1268 CG ASN A 87 7.986 16.369 -5.033 1.00 0.00 C ATOM 1269 OD1 ASN A 87 7.617 15.698 -5.996 1.00 0.00 O ATOM 1270 ND2 ASN A 87 7.609 17.629 -4.852 1.00 0.00 N ATOM 0 H ASN A 87 8.295 13.532 -2.949 1.00 0.00 H new ATOM 0 HA ASN A 87 9.470 14.366 -5.497 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.359 15.656 -3.049 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.719 16.484 -3.782 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.989 18.078 -5.526 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.939 18.148 -4.039 1.00 0.00 H new ATOM 1277 N SER A 88 11.835 15.036 -4.659 1.00 0.00 N ATOM 1278 CA SER A 88 13.256 15.026 -4.327 1.00 0.00 C ATOM 1279 C SER A 88 13.511 15.743 -3.005 1.00 0.00 C ATOM 1280 O SER A 88 14.430 15.393 -2.265 1.00 0.00 O ATOM 1281 CB SER A 88 14.067 15.684 -5.444 1.00 0.00 C ATOM 1282 OG SER A 88 15.291 15.002 -5.656 1.00 0.00 O ATOM 0 H SER A 88 11.593 15.617 -5.462 1.00 0.00 H new ATOM 0 HA SER A 88 13.572 13.988 -4.223 1.00 0.00 H new ATOM 0 HB2 SER A 88 13.485 15.688 -6.366 1.00 0.00 H new ATOM 0 HB3 SER A 88 14.267 16.725 -5.188 1.00 0.00 H new ATOM 0 HG SER A 88 15.790 15.441 -6.376 1.00 0.00 H new ATOM 1288 N ASP A 89 12.693 16.751 -2.716 1.00 0.00 N ATOM 1289 CA ASP A 89 12.831 17.517 -1.483 1.00 0.00 C ATOM 1290 C ASP A 89 12.499 16.658 -0.268 1.00 0.00 C ATOM 1291 O ASP A 89 13.206 16.689 0.739 1.00 0.00 O ATOM 1292 CB ASP A 89 11.923 18.747 -1.518 1.00 0.00 C ATOM 1293 CG ASP A 89 12.626 19.970 -2.072 1.00 0.00 C ATOM 1294 OD1 ASP A 89 13.186 19.880 -3.184 1.00 0.00 O ATOM 1295 OD2 ASP A 89 12.619 21.018 -1.392 1.00 0.00 O ATOM 0 H ASP A 89 11.929 17.056 -3.319 1.00 0.00 H new ATOM 0 HA ASP A 89 13.868 17.843 -1.401 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.045 18.530 -2.126 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.567 18.961 -0.510 1.00 0.00 H new ATOM 1300 N GLY A 90 11.419 15.890 -0.370 1.00 0.00 N ATOM 1301 CA GLY A 90 11.012 15.032 0.727 1.00 0.00 C ATOM 1302 C GLY A 90 9.522 15.105 0.998 1.00 0.00 C ATOM 1303 O GLY A 90 9.101 15.271 2.143 1.00 0.00 O ATOM 0 H GLY A 90 10.818 15.847 -1.193 1.00 0.00 H new ATOM 0 HA2 GLY A 90 11.287 14.002 0.500 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.556 15.316 1.628 1.00 0.00 H new ATOM 1307 N LEU A 91 8.723 14.981 -0.056 1.00 0.00 N ATOM 1308 CA LEU A 91 7.273 15.032 0.074 1.00 0.00 C ATOM 1309 C LEU A 91 6.613 13.930 -0.749 1.00 0.00 C ATOM 1310 O LEU A 91 7.211 13.396 -1.683 1.00 0.00 O ATOM 1311 CB LEU A 91 6.749 16.401 -0.368 1.00 0.00 C ATOM 1312 CG LEU A 91 5.598 16.957 0.473 1.00 0.00 C ATOM 1313 CD1 LEU A 91 6.135 17.717 1.675 1.00 0.00 C ATOM 1314 CD2 LEU A 91 4.707 17.853 -0.372 1.00 0.00 C ATOM 0 H LEU A 91 9.056 14.844 -1.010 1.00 0.00 H new ATOM 0 HA LEU A 91 7.021 14.876 1.123 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.573 17.114 -0.344 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.420 16.330 -1.405 1.00 0.00 H new ATOM 0 HG LEU A 91 5.000 16.121 0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.302 18.105 2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.732 17.046 2.293 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.756 18.545 1.334 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.893 18.240 0.242 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.293 18.684 -0.763 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.294 17.278 -1.201 1.00 0.00 H new ATOM 1326 N VAL A 92 5.375 13.596 -0.397 1.00 0.00 N ATOM 1327 CA VAL A 92 4.634 12.557 -1.104 1.00 0.00 C ATOM 1328 C VAL A 92 3.497 13.156 -1.924 1.00 0.00 C ATOM 1329 O VAL A 92 2.454 13.524 -1.382 1.00 0.00 O ATOM 1330 CB VAL A 92 4.056 11.517 -0.127 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.451 10.346 -0.887 1.00 0.00 C ATOM 1332 CG2 VAL A 92 5.129 11.038 0.839 1.00 0.00 C ATOM 0 H VAL A 92 4.865 14.029 0.373 1.00 0.00 H new ATOM 0 HA VAL A 92 5.339 12.063 -1.772 1.00 0.00 H new ATOM 0 HB VAL A 92 3.264 11.991 0.452 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.048 9.622 -0.179 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.650 10.706 -1.533 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.221 9.870 -1.494 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.702 10.303 1.522 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.945 10.582 0.279 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.510 11.885 1.409 1.00 0.00 H new ATOM 1342 N VAL A 93 3.705 13.253 -3.233 1.00 0.00 N ATOM 1343 CA VAL A 93 2.697 13.807 -4.128 1.00 0.00 C ATOM 1344 C VAL A 93 2.454 12.889 -5.320 1.00 0.00 C ATOM 1345 O VAL A 93 3.395 12.344 -5.899 1.00 0.00 O ATOM 1346 CB VAL A 93 3.106 15.200 -4.643 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.053 16.223 -3.518 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.494 15.153 -5.265 1.00 0.00 C ATOM 0 H VAL A 93 4.563 12.955 -3.697 1.00 0.00 H new ATOM 0 HA VAL A 93 1.778 13.897 -3.549 1.00 0.00 H new ATOM 0 HB VAL A 93 2.397 15.504 -5.413 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.345 17.201 -3.901 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.039 16.277 -3.122 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.737 15.926 -2.723 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.766 16.146 -5.623 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.217 14.826 -4.517 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.495 14.453 -6.101 1.00 0.00 H new ATOM 1358 N GLY A 94 1.186 12.718 -5.682 1.00 0.00 N ATOM 1359 CA GLY A 94 0.844 11.862 -6.803 1.00 0.00 C ATOM 1360 C GLY A 94 0.510 12.648 -8.054 1.00 0.00 C ATOM 1361 O GLY A 94 -0.662 12.840 -8.380 1.00 0.00 O ATOM 0 H GLY A 94 0.390 13.157 -5.219 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.678 11.191 -7.011 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.007 11.238 -6.532 1.00 0.00 H new ATOM 1365 N ARG A 95 1.541 13.101 -8.760 1.00 0.00 N ATOM 1366 CA ARG A 95 1.354 13.869 -9.985 1.00 0.00 C ATOM 1367 C ARG A 95 2.441 13.539 -11.002 1.00 0.00 C ATOM 1368 O ARG A 95 3.405 14.289 -11.162 1.00 0.00 O ATOM 1369 CB ARG A 95 1.362 15.368 -9.682 1.00 0.00 C ATOM 1370 CG ARG A 95 0.165 15.832 -8.866 1.00 0.00 C ATOM 1371 CD ARG A 95 -0.516 17.033 -9.503 1.00 0.00 C ATOM 1372 NE ARG A 95 0.423 18.120 -9.766 1.00 0.00 N ATOM 1373 CZ ARG A 95 0.165 19.143 -10.579 1.00 0.00 C ATOM 1374 NH1 ARG A 95 -1.000 19.220 -11.209 1.00 0.00 N ATOM 1375 NH2 ARG A 95 1.074 20.090 -10.761 1.00 0.00 N ATOM 0 H ARG A 95 2.516 12.949 -8.504 1.00 0.00 H new ATOM 0 HA ARG A 95 0.387 13.598 -10.409 1.00 0.00 H new ATOM 0 HB2 ARG A 95 2.276 15.616 -9.143 1.00 0.00 H new ATOM 0 HB3 ARG A 95 1.386 15.920 -10.622 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -0.550 15.015 -8.772 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.489 16.089 -7.858 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -0.988 16.728 -10.437 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -1.309 17.390 -8.846 1.00 0.00 H new ATOM 0 HE ARG A 95 1.330 18.094 -9.300 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -1.703 18.494 -11.072 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -1.193 20.005 -11.831 1.00 0.00 H new ATOM 0 HH21 ARG A 95 1.971 20.035 -10.279 1.00 0.00 H new ATOM 0 HH22 ARG A 95 0.877 20.873 -11.384 1.00 0.00 H new ATOM 1389 N SER A 96 2.282 12.411 -11.687 1.00 0.00 N ATOM 1390 CA SER A 96 3.253 11.981 -12.686 1.00 0.00 C ATOM 1391 C SER A 96 2.561 11.331 -13.880 1.00 0.00 C ATOM 1392 O SER A 96 2.896 11.611 -15.031 1.00 0.00 O ATOM 1393 CB SER A 96 4.251 11.003 -12.066 1.00 0.00 C ATOM 1394 OG SER A 96 5.563 11.240 -12.544 1.00 0.00 O ATOM 0 H SER A 96 1.490 11.779 -11.568 1.00 0.00 H new ATOM 0 HA SER A 96 3.787 12.863 -13.039 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.233 11.100 -10.980 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.955 9.980 -12.299 1.00 0.00 H new ATOM 0 HG SER A 96 6.182 10.602 -12.131 1.00 0.00 H new ATOM 1400 N ASP A 97 1.595 10.460 -13.600 1.00 0.00 N ATOM 1401 CA ASP A 97 0.859 9.768 -14.652 1.00 0.00 C ATOM 1402 C ASP A 97 1.768 8.803 -15.404 1.00 0.00 C ATOM 1403 O ASP A 97 1.606 8.586 -16.605 1.00 0.00 O ATOM 1404 CB ASP A 97 0.244 10.776 -15.628 1.00 0.00 C ATOM 1405 CG ASP A 97 -0.754 10.133 -16.571 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -1.557 9.298 -16.105 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -0.733 10.465 -17.774 1.00 0.00 O ATOM 0 H ASP A 97 1.304 10.217 -12.653 1.00 0.00 H new ATOM 0 HA ASP A 97 0.058 9.196 -14.183 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.250 11.568 -15.065 1.00 0.00 H new ATOM 0 HB3 ASP A 97 1.038 11.246 -16.209 1.00 0.00 H new ATOM 1412 N ALA A 98 2.729 8.227 -14.688 1.00 0.00 N ATOM 1413 CA ALA A 98 3.668 7.285 -15.285 1.00 0.00 C ATOM 1414 C ALA A 98 4.468 6.555 -14.210 1.00 0.00 C ATOM 1415 O ALA A 98 4.852 7.145 -13.201 1.00 0.00 O ATOM 1416 CB ALA A 98 4.603 8.006 -16.243 1.00 0.00 C ATOM 0 H ALA A 98 2.877 8.397 -13.693 1.00 0.00 H new ATOM 0 HA ALA A 98 3.096 6.544 -15.844 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.298 7.290 -16.681 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.020 8.477 -17.035 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.162 8.769 -15.701 1.00 0.00 H new ATOM 1422 N ILE A 99 4.717 5.270 -14.435 1.00 0.00 N ATOM 1423 CA ILE A 99 5.471 4.460 -13.486 1.00 0.00 C ATOM 1424 C ILE A 99 6.941 4.864 -13.467 1.00 0.00 C ATOM 1425 O ILE A 99 7.723 4.438 -14.317 1.00 0.00 O ATOM 1426 CB ILE A 99 5.366 2.958 -13.818 1.00 0.00 C ATOM 1427 CG1 ILE A 99 3.902 2.551 -13.994 1.00 0.00 C ATOM 1428 CG2 ILE A 99 6.024 2.125 -12.727 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.678 1.581 -15.135 1.00 0.00 C ATOM 0 H ILE A 99 4.408 4.767 -15.267 1.00 0.00 H new ATOM 0 HA ILE A 99 5.035 4.637 -12.503 1.00 0.00 H new ATOM 0 HB ILE A 99 5.890 2.773 -14.756 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.545 2.100 -13.068 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.302 3.445 -14.165 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.941 1.067 -12.977 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.076 2.397 -12.646 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.526 2.313 -11.776 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.618 1.336 -15.201 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.004 2.037 -16.070 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.250 0.671 -14.956 1.00 0.00 H new ATOM 1441 N GLY A 100 7.311 5.689 -12.492 1.00 0.00 N ATOM 1442 CA GLY A 100 8.687 6.136 -12.380 1.00 0.00 C ATOM 1443 C GLY A 100 9.361 5.633 -11.117 1.00 0.00 C ATOM 1444 O GLY A 100 8.752 4.899 -10.338 1.00 0.00 O ATOM 0 H GLY A 100 6.682 6.056 -11.778 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.249 5.793 -13.249 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.714 7.226 -12.393 1.00 0.00 H new ATOM 1448 N PRO A 101 10.628 6.013 -10.884 1.00 0.00 N ATOM 1449 CA PRO A 101 11.376 5.586 -9.695 1.00 0.00 C ATOM 1450 C PRO A 101 10.770 6.133 -8.406 1.00 0.00 C ATOM 1451 O PRO A 101 10.636 5.412 -7.419 1.00 0.00 O ATOM 1452 CB PRO A 101 12.776 6.168 -9.917 1.00 0.00 C ATOM 1453 CG PRO A 101 12.577 7.292 -10.874 1.00 0.00 C ATOM 1454 CD PRO A 101 11.432 6.886 -11.757 1.00 0.00 C ATOM 0 HA PRO A 101 11.369 4.502 -9.579 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.211 6.518 -8.981 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.455 5.419 -10.323 1.00 0.00 H new ATOM 0 HG2 PRO A 101 12.353 8.219 -10.346 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.478 7.469 -11.461 1.00 0.00 H new ATOM 0 HD2 PRO A 101 10.861 7.749 -12.099 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.777 6.359 -12.647 1.00 0.00 H new ATOM 1462 N ARG A 102 10.409 7.411 -8.425 1.00 0.00 N ATOM 1463 CA ARG A 102 9.818 8.054 -7.258 1.00 0.00 C ATOM 1464 C ARG A 102 8.489 7.401 -6.891 1.00 0.00 C ATOM 1465 O ARG A 102 8.100 7.376 -5.723 1.00 0.00 O ATOM 1466 CB ARG A 102 9.610 9.546 -7.523 1.00 0.00 C ATOM 1467 CG ARG A 102 10.897 10.294 -7.832 1.00 0.00 C ATOM 1468 CD ARG A 102 10.697 11.317 -8.939 1.00 0.00 C ATOM 1469 NE ARG A 102 10.521 10.685 -10.245 1.00 0.00 N ATOM 1470 CZ ARG A 102 10.001 11.301 -11.303 1.00 0.00 C ATOM 1471 NH1 ARG A 102 9.605 12.566 -11.215 1.00 0.00 N ATOM 1472 NH2 ARG A 102 9.876 10.652 -12.453 1.00 0.00 N ATOM 0 H ARG A 102 10.515 8.022 -9.235 1.00 0.00 H new ATOM 0 HA ARG A 102 10.505 7.933 -6.421 1.00 0.00 H new ATOM 0 HB2 ARG A 102 8.920 9.665 -8.359 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.137 9.999 -6.652 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.252 10.796 -6.932 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.670 9.584 -8.127 1.00 0.00 H new ATOM 0 HD2 ARG A 102 9.825 11.930 -8.713 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.557 11.986 -8.973 1.00 0.00 H new ATOM 0 HE ARG A 102 10.814 9.714 -10.351 1.00 0.00 H new ATOM 0 HH11 ARG A 102 9.699 13.070 -10.333 1.00 0.00 H new ATOM 0 HH12 ARG A 102 9.207 13.034 -12.029 1.00 0.00 H new ATOM 0 HH21 ARG A 102 10.179 9.681 -12.526 1.00 0.00 H new ATOM 0 HH22 ARG A 102 9.477 11.124 -13.264 1.00 0.00 H new ATOM 1486 N GLU A 103 7.797 6.874 -7.896 1.00 0.00 N ATOM 1487 CA GLU A 103 6.511 6.220 -7.680 1.00 0.00 C ATOM 1488 C GLU A 103 6.695 4.806 -7.134 1.00 0.00 C ATOM 1489 O GLU A 103 5.773 4.232 -6.557 1.00 0.00 O ATOM 1490 CB GLU A 103 5.715 6.174 -8.986 1.00 0.00 C ATOM 1491 CG GLU A 103 5.254 7.541 -9.465 1.00 0.00 C ATOM 1492 CD GLU A 103 6.387 8.373 -10.032 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.052 7.904 -10.980 1.00 0.00 O ATOM 1494 OE2 GLU A 103 6.611 9.494 -9.528 1.00 0.00 O ATOM 0 H GLU A 103 8.105 6.887 -8.868 1.00 0.00 H new ATOM 0 HA GLU A 103 5.959 6.802 -6.942 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.329 5.715 -9.760 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.844 5.533 -8.849 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.485 7.414 -10.227 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.795 8.077 -8.634 1.00 0.00 H new ATOM 1501 N GLN A 104 7.888 4.246 -7.322 1.00 0.00 N ATOM 1502 CA GLN A 104 8.182 2.899 -6.847 1.00 0.00 C ATOM 1503 C GLN A 104 8.213 2.849 -5.322 1.00 0.00 C ATOM 1504 O GLN A 104 8.578 3.825 -4.666 1.00 0.00 O ATOM 1505 CB GLN A 104 9.523 2.421 -7.409 1.00 0.00 C ATOM 1506 CG GLN A 104 9.467 2.047 -8.882 1.00 0.00 C ATOM 1507 CD GLN A 104 10.655 1.213 -9.317 1.00 0.00 C ATOM 1508 OE1 GLN A 104 10.927 0.155 -8.751 1.00 0.00 O ATOM 1509 NE2 GLN A 104 11.373 1.688 -10.329 1.00 0.00 N ATOM 0 H GLN A 104 8.664 4.704 -7.799 1.00 0.00 H new ATOM 0 HA GLN A 104 7.389 2.238 -7.197 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.266 3.206 -7.270 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.861 1.557 -6.836 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.548 1.494 -9.078 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.426 2.956 -9.483 1.00 0.00 H new ATOM 0 HE21 GLN A 104 11.112 2.570 -10.770 1.00 0.00 H new ATOM 0 HE22 GLN A 104 12.185 1.171 -10.665 1.00 0.00 H new ATOM 1518 N TRP A 105 7.830 1.704 -4.767 1.00 0.00 N ATOM 1519 CA TRP A 105 7.815 1.520 -3.319 1.00 0.00 C ATOM 1520 C TRP A 105 8.443 0.184 -2.937 1.00 0.00 C ATOM 1521 O TRP A 105 8.881 -0.576 -3.799 1.00 0.00 O ATOM 1522 CB TRP A 105 6.381 1.594 -2.788 1.00 0.00 C ATOM 1523 CG TRP A 105 5.698 2.891 -3.100 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.930 3.169 -4.194 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.720 4.085 -2.310 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.474 4.464 -4.134 1.00 0.00 N ATOM 1527 CE2 TRP A 105 4.944 5.047 -2.986 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.318 4.436 -1.096 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.753 6.334 -2.489 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.128 5.714 -0.604 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.351 6.649 -1.300 1.00 0.00 C ATOM 0 H TRP A 105 7.525 0.888 -5.298 1.00 0.00 H new ATOM 0 HA TRP A 105 8.402 2.321 -2.869 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.801 0.775 -3.213 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.393 1.449 -1.708 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.713 2.473 -4.990 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.882 4.917 -4.830 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.918 3.721 -0.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.154 7.057 -3.023 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.586 5.996 0.332 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.221 7.639 -0.889 1.00 0.00 H new ATOM 1542 N GLU A 106 8.484 -0.096 -1.638 1.00 0.00 N ATOM 1543 CA GLU A 106 9.061 -1.341 -1.144 1.00 0.00 C ATOM 1544 C GLU A 106 8.486 -1.706 0.224 1.00 0.00 C ATOM 1545 O GLU A 106 8.997 -1.270 1.255 1.00 0.00 O ATOM 1546 CB GLU A 106 10.584 -1.222 -1.054 1.00 0.00 C ATOM 1547 CG GLU A 106 11.317 -2.503 -1.418 1.00 0.00 C ATOM 1548 CD GLU A 106 12.558 -2.724 -0.576 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.193 -1.723 -0.181 1.00 0.00 O ATOM 1550 OE2 GLU A 106 12.895 -3.896 -0.310 1.00 0.00 O ATOM 0 H GLU A 106 8.125 0.521 -0.910 1.00 0.00 H new ATOM 0 HA GLU A 106 8.806 -2.133 -1.848 1.00 0.00 H new ATOM 0 HB2 GLU A 106 10.917 -0.422 -1.715 1.00 0.00 H new ATOM 0 HB3 GLU A 106 10.858 -0.932 -0.040 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.643 -3.351 -1.294 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.598 -2.470 -2.471 1.00 0.00 H new ATOM 1557 N PRO A 107 7.412 -2.514 0.252 1.00 0.00 N ATOM 1558 CA PRO A 107 6.773 -2.934 1.504 1.00 0.00 C ATOM 1559 C PRO A 107 7.650 -3.889 2.308 1.00 0.00 C ATOM 1560 O PRO A 107 7.952 -4.994 1.859 1.00 0.00 O ATOM 1561 CB PRO A 107 5.499 -3.641 1.037 1.00 0.00 C ATOM 1562 CG PRO A 107 5.811 -4.111 -0.341 1.00 0.00 C ATOM 1563 CD PRO A 107 6.736 -3.083 -0.930 1.00 0.00 C ATOM 0 HA PRO A 107 6.586 -2.090 2.169 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.246 -4.475 1.692 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.646 -2.963 1.040 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.282 -5.094 -0.321 1.00 0.00 H new ATOM 0 HG3 PRO A 107 4.903 -4.205 -0.936 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.448 -3.533 -1.622 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.189 -2.321 -1.485 1.00 0.00 H new ATOM 1571 N VAL A 108 8.055 -3.454 3.496 1.00 0.00 N ATOM 1572 CA VAL A 108 8.899 -4.271 4.361 1.00 0.00 C ATOM 1573 C VAL A 108 8.122 -4.769 5.575 1.00 0.00 C ATOM 1574 O VAL A 108 7.255 -4.070 6.100 1.00 0.00 O ATOM 1575 CB VAL A 108 10.133 -3.487 4.844 1.00 0.00 C ATOM 1576 CG1 VAL A 108 11.098 -4.407 5.576 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.822 -2.801 3.674 1.00 0.00 C ATOM 0 H VAL A 108 7.813 -2.541 3.882 1.00 0.00 H new ATOM 0 HA VAL A 108 9.228 -5.124 3.767 1.00 0.00 H new ATOM 0 HB VAL A 108 9.801 -2.718 5.542 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.964 -3.835 5.910 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.598 -4.846 6.440 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.425 -5.201 4.904 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.692 -2.252 4.035 1.00 0.00 H new ATOM 0 HG22 VAL A 108 11.141 -3.550 2.949 1.00 0.00 H new ATOM 0 HG23 VAL A 108 10.128 -2.109 3.198 1.00 0.00 H new ATOM 1587 N PHE A 109 8.439 -5.982 6.015 1.00 0.00 N ATOM 1588 CA PHE A 109 7.773 -6.576 7.169 1.00 0.00 C ATOM 1589 C PHE A 109 8.776 -6.886 8.274 1.00 0.00 C ATOM 1590 O PHE A 109 9.803 -7.523 8.034 1.00 0.00 O ATOM 1591 CB PHE A 109 7.039 -7.854 6.758 1.00 0.00 C ATOM 1592 CG PHE A 109 6.044 -7.647 5.652 1.00 0.00 C ATOM 1593 CD1 PHE A 109 6.470 -7.457 4.347 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.684 -7.642 5.917 1.00 0.00 C ATOM 1595 CE1 PHE A 109 5.556 -7.267 3.327 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.766 -7.452 4.902 1.00 0.00 C ATOM 1597 CZ PHE A 109 4.203 -7.264 3.605 1.00 0.00 C ATOM 0 H PHE A 109 9.153 -6.573 5.590 1.00 0.00 H new ATOM 0 HA PHE A 109 7.049 -5.856 7.551 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.771 -8.598 6.443 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.524 -8.263 7.627 1.00 0.00 H new ATOM 0 HD1 PHE A 109 7.527 -7.457 4.124 1.00 0.00 H new ATOM 0 HD2 PHE A 109 4.337 -7.788 6.929 1.00 0.00 H new ATOM 0 HE1 PHE A 109 5.900 -7.121 2.314 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.709 -7.450 5.122 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.488 -7.115 2.810 1.00 0.00 H new ATOM 1607 N GLN A 110 8.474 -6.432 9.486 1.00 0.00 N ATOM 1608 CA GLN A 110 9.351 -6.661 10.629 1.00 0.00 C ATOM 1609 C GLN A 110 8.572 -7.249 11.802 1.00 0.00 C ATOM 1610 O GLN A 110 7.725 -6.581 12.395 1.00 0.00 O ATOM 1611 CB GLN A 110 10.027 -5.353 11.049 1.00 0.00 C ATOM 1612 CG GLN A 110 11.546 -5.416 11.012 1.00 0.00 C ATOM 1613 CD GLN A 110 12.133 -4.666 9.833 1.00 0.00 C ATOM 1614 OE1 GLN A 110 12.738 -3.605 9.995 1.00 0.00 O ATOM 1615 NE2 GLN A 110 11.957 -5.214 8.636 1.00 0.00 N ATOM 0 H GLN A 110 7.629 -5.903 9.702 1.00 0.00 H new ATOM 0 HA GLN A 110 10.117 -7.377 10.332 1.00 0.00 H new ATOM 0 HB2 GLN A 110 9.688 -4.551 10.393 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.706 -5.095 12.058 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.946 -5.001 11.937 1.00 0.00 H new ATOM 0 HG3 GLN A 110 11.862 -6.458 10.968 1.00 0.00 H new ATOM 0 HE21 GLN A 110 11.449 -6.094 8.548 1.00 0.00 H new ATOM 0 HE22 GLN A 110 12.329 -4.755 7.805 1.00 0.00 H new ATOM 1624 N ASP A 111 8.867 -8.502 12.133 1.00 0.00 N ATOM 1625 CA ASP A 111 8.196 -9.180 13.236 1.00 0.00 C ATOM 1626 C ASP A 111 6.691 -9.248 12.998 1.00 0.00 C ATOM 1627 O ASP A 111 5.898 -9.140 13.934 1.00 0.00 O ATOM 1628 CB ASP A 111 8.483 -8.460 14.555 1.00 0.00 C ATOM 1629 CG ASP A 111 9.949 -8.519 14.939 1.00 0.00 C ATOM 1630 OD1 ASP A 111 10.525 -9.627 14.914 1.00 0.00 O ATOM 1631 OD2 ASP A 111 10.521 -7.458 15.263 1.00 0.00 O ATOM 0 H ASP A 111 9.566 -9.068 11.653 1.00 0.00 H new ATOM 0 HA ASP A 111 8.583 -10.197 13.293 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.174 -7.418 14.472 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.884 -8.908 15.348 1.00 0.00 H new ATOM 1636 N GLY A 112 6.303 -9.428 11.740 1.00 0.00 N ATOM 1637 CA GLY A 112 4.895 -9.508 11.402 1.00 0.00 C ATOM 1638 C GLY A 112 4.336 -8.181 10.926 1.00 0.00 C ATOM 1639 O GLY A 112 3.450 -8.143 10.072 1.00 0.00 O ATOM 0 H GLY A 112 6.939 -9.520 10.948 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.753 -10.258 10.624 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.334 -9.843 12.274 1.00 0.00 H new ATOM 1643 N LYS A 113 4.855 -7.090 11.480 1.00 0.00 N ATOM 1644 CA LYS A 113 4.402 -5.755 11.109 1.00 0.00 C ATOM 1645 C LYS A 113 4.717 -5.460 9.645 1.00 0.00 C ATOM 1646 O LYS A 113 5.308 -6.287 8.949 1.00 0.00 O ATOM 1647 CB LYS A 113 5.061 -4.703 12.004 1.00 0.00 C ATOM 1648 CG LYS A 113 4.588 -4.752 13.448 1.00 0.00 C ATOM 1649 CD LYS A 113 3.302 -3.964 13.640 1.00 0.00 C ATOM 1650 CE LYS A 113 2.533 -4.441 14.862 1.00 0.00 C ATOM 1651 NZ LYS A 113 1.829 -5.728 14.610 1.00 0.00 N ATOM 0 H LYS A 113 5.590 -7.105 12.187 1.00 0.00 H new ATOM 0 HA LYS A 113 3.321 -5.715 11.246 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.142 -4.842 11.979 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.858 -3.712 11.597 1.00 0.00 H new ATOM 0 HG2 LYS A 113 4.429 -5.789 13.745 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.363 -4.350 14.100 1.00 0.00 H new ATOM 0 HD2 LYS A 113 3.536 -2.905 13.747 1.00 0.00 H new ATOM 0 HD3 LYS A 113 2.676 -4.065 12.753 1.00 0.00 H new ATOM 0 HE2 LYS A 113 3.221 -4.562 15.699 1.00 0.00 H new ATOM 0 HE3 LYS A 113 1.807 -3.682 15.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 1.211 -5.949 15.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 1.256 -5.647 13.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 2.528 -6.489 14.491 1.00 0.00 H new ATOM 1665 N MET A 114 4.322 -4.279 9.186 1.00 0.00 N ATOM 1666 CA MET A 114 4.562 -3.875 7.805 1.00 0.00 C ATOM 1667 C MET A 114 4.609 -2.356 7.681 1.00 0.00 C ATOM 1668 O MET A 114 3.977 -1.640 8.459 1.00 0.00 O ATOM 1669 CB MET A 114 3.475 -4.440 6.889 1.00 0.00 C ATOM 1670 CG MET A 114 2.064 -4.079 7.326 1.00 0.00 C ATOM 1671 SD MET A 114 0.808 -5.094 6.524 1.00 0.00 S ATOM 1672 CE MET A 114 0.646 -6.429 7.707 1.00 0.00 C ATOM 0 H MET A 114 3.834 -3.583 9.750 1.00 0.00 H new ATOM 0 HA MET A 114 5.529 -4.276 7.500 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.638 -4.073 5.876 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.569 -5.525 6.854 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.982 -4.193 8.407 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.875 -3.029 7.101 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.086 -7.248 7.256 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.636 -6.782 7.995 1.00 0.00 H new ATOM 0 HE3 MET A 114 0.117 -6.070 8.590 1.00 0.00 H new ATOM 1682 N ALA A 115 5.362 -1.870 6.700 1.00 0.00 N ATOM 1683 CA ALA A 115 5.492 -0.436 6.474 1.00 0.00 C ATOM 1684 C ALA A 115 5.827 -0.138 5.018 1.00 0.00 C ATOM 1685 O ALA A 115 6.576 -0.877 4.379 1.00 0.00 O ATOM 1686 CB ALA A 115 6.555 0.148 7.392 1.00 0.00 C ATOM 0 H ALA A 115 5.892 -2.449 6.048 1.00 0.00 H new ATOM 0 HA ALA A 115 4.534 0.031 6.702 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.642 1.220 7.213 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.273 -0.024 8.431 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.513 -0.332 7.191 1.00 0.00 H new ATOM 1692 N LEU A 116 5.267 0.949 4.497 1.00 0.00 N ATOM 1693 CA LEU A 116 5.507 1.344 3.114 1.00 0.00 C ATOM 1694 C LEU A 116 6.783 2.171 2.998 1.00 0.00 C ATOM 1695 O LEU A 116 6.860 3.288 3.511 1.00 0.00 O ATOM 1696 CB LEU A 116 4.317 2.141 2.575 1.00 0.00 C ATOM 1697 CG LEU A 116 4.235 2.230 1.050 1.00 0.00 C ATOM 1698 CD1 LEU A 116 3.470 1.043 0.488 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.582 3.538 0.628 1.00 0.00 C ATOM 0 H LEU A 116 4.644 1.572 5.012 1.00 0.00 H new ATOM 0 HA LEU A 116 5.628 0.438 2.519 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.398 1.689 2.947 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.362 3.152 2.981 1.00 0.00 H new ATOM 0 HG LEU A 116 5.248 2.206 0.647 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.421 1.123 -0.598 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.980 0.119 0.762 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.460 1.035 0.897 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.532 3.585 -0.460 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.575 3.591 1.041 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.172 4.376 1.000 1.00 0.00 H new ATOM 1711 N LEU A 117 7.783 1.617 2.319 1.00 0.00 N ATOM 1712 CA LEU A 117 9.056 2.303 2.135 1.00 0.00 C ATOM 1713 C LEU A 117 9.114 2.985 0.772 1.00 0.00 C ATOM 1714 O LEU A 117 8.815 2.372 -0.253 1.00 0.00 O ATOM 1715 CB LEU A 117 10.216 1.317 2.273 1.00 0.00 C ATOM 1716 CG LEU A 117 11.608 1.954 2.298 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.117 2.072 3.727 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.581 1.145 1.451 1.00 0.00 C ATOM 0 H LEU A 117 7.735 0.694 1.887 1.00 0.00 H new ATOM 0 HA LEU A 117 9.143 3.066 2.908 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.079 0.744 3.190 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.172 0.609 1.445 1.00 0.00 H new ATOM 0 HG LEU A 117 11.534 2.956 1.876 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.108 2.527 3.724 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.434 2.693 4.306 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.175 1.080 4.176 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.565 1.613 1.481 1.00 0.00 H new ATOM 0 HD22 LEU A 117 12.649 0.131 1.844 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.226 1.112 0.421 1.00 0.00 H new ATOM 1730 N ALA A 118 9.501 4.256 0.768 1.00 0.00 N ATOM 1731 CA ALA A 118 9.600 5.020 -0.469 1.00 0.00 C ATOM 1732 C ALA A 118 10.929 4.760 -1.169 1.00 0.00 C ATOM 1733 O ALA A 118 11.833 4.150 -0.598 1.00 0.00 O ATOM 1734 CB ALA A 118 9.430 6.505 -0.187 1.00 0.00 C ATOM 0 H ALA A 118 9.751 4.778 1.608 1.00 0.00 H new ATOM 0 HA ALA A 118 8.800 4.695 -1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.506 7.064 -1.120 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.452 6.680 0.262 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.209 6.837 0.499 1.00 0.00 H new ATOM 1740 N SER A 119 11.041 5.229 -2.407 1.00 0.00 N ATOM 1741 CA SER A 119 12.261 5.048 -3.185 1.00 0.00 C ATOM 1742 C SER A 119 13.412 5.872 -2.609 1.00 0.00 C ATOM 1743 O SER A 119 14.566 5.696 -3.000 1.00 0.00 O ATOM 1744 CB SER A 119 12.022 5.437 -4.645 1.00 0.00 C ATOM 1745 OG SER A 119 13.218 5.349 -5.400 1.00 0.00 O ATOM 0 H SER A 119 10.302 5.737 -2.893 1.00 0.00 H new ATOM 0 HA SER A 119 12.536 3.995 -3.134 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.266 4.783 -5.079 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.631 6.453 -4.694 1.00 0.00 H new ATOM 0 HG SER A 119 13.986 5.314 -4.793 1.00 0.00 H new ATOM 1751 N ASN A 120 13.096 6.773 -1.681 1.00 0.00 N ATOM 1752 CA ASN A 120 14.111 7.618 -1.061 1.00 0.00 C ATOM 1753 C ASN A 120 14.607 7.016 0.253 1.00 0.00 C ATOM 1754 O ASN A 120 15.133 7.726 1.110 1.00 0.00 O ATOM 1755 CB ASN A 120 13.551 9.020 -0.813 1.00 0.00 C ATOM 1756 CG ASN A 120 14.614 9.992 -0.339 1.00 0.00 C ATOM 1757 OD1 ASN A 120 15.681 10.106 -0.943 1.00 0.00 O ATOM 1758 ND2 ASN A 120 14.327 10.700 0.747 1.00 0.00 N ATOM 0 H ASN A 120 12.147 6.936 -1.343 1.00 0.00 H new ATOM 0 HA ASN A 120 14.956 7.683 -1.746 1.00 0.00 H new ATOM 0 HB2 ASN A 120 13.102 9.397 -1.732 1.00 0.00 H new ATOM 0 HB3 ASN A 120 12.756 8.964 -0.069 1.00 0.00 H new ATOM 0 HD21 ASN A 120 15.003 11.371 1.112 1.00 0.00 H new ATOM 0 HD22 ASN A 120 13.430 10.573 1.216 1.00 0.00 H new ATOM 1765 N SER A 121 14.440 5.704 0.404 1.00 0.00 N ATOM 1766 CA SER A 121 14.876 5.013 1.614 1.00 0.00 C ATOM 1767 C SER A 121 14.262 5.642 2.861 1.00 0.00 C ATOM 1768 O SER A 121 14.907 5.724 3.907 1.00 0.00 O ATOM 1769 CB SER A 121 16.402 5.036 1.716 1.00 0.00 C ATOM 1770 OG SER A 121 17.001 4.625 0.499 1.00 0.00 O ATOM 0 H SER A 121 14.007 5.100 -0.295 1.00 0.00 H new ATOM 0 HA SER A 121 14.536 3.979 1.551 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.738 6.042 1.969 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.726 4.380 2.524 1.00 0.00 H new ATOM 0 HG SER A 121 17.976 4.650 0.590 1.00 0.00 H new ATOM 1776 N CYS A 122 13.015 6.086 2.746 1.00 0.00 N ATOM 1777 CA CYS A 122 12.319 6.707 3.866 1.00 0.00 C ATOM 1778 C CYS A 122 10.869 6.238 3.935 1.00 0.00 C ATOM 1779 O CYS A 122 10.148 6.268 2.937 1.00 0.00 O ATOM 1780 CB CYS A 122 12.369 8.230 3.744 1.00 0.00 C ATOM 1781 SG CYS A 122 13.853 8.980 4.455 1.00 0.00 S ATOM 0 H CYS A 122 12.466 6.027 1.888 1.00 0.00 H new ATOM 0 HA CYS A 122 12.823 6.406 4.785 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.307 8.501 2.690 1.00 0.00 H new ATOM 0 HB3 CYS A 122 11.491 8.652 4.234 1.00 0.00 H new ATOM 0 HG CYS A 122 13.804 10.270 4.301 1.00 0.00 H new ATOM 1787 N PHE A 123 10.448 5.806 5.119 1.00 0.00 N ATOM 1788 CA PHE A 123 9.083 5.331 5.317 1.00 0.00 C ATOM 1789 C PHE A 123 8.088 6.483 5.214 1.00 0.00 C ATOM 1790 O PHE A 123 8.453 7.648 5.375 1.00 0.00 O ATOM 1791 CB PHE A 123 8.951 4.649 6.680 1.00 0.00 C ATOM 1792 CG PHE A 123 9.777 3.401 6.809 1.00 0.00 C ATOM 1793 CD1 PHE A 123 11.110 3.470 7.183 1.00 0.00 C ATOM 1794 CD2 PHE A 123 9.221 2.157 6.555 1.00 0.00 C ATOM 1795 CE1 PHE A 123 11.871 2.323 7.304 1.00 0.00 C ATOM 1796 CE2 PHE A 123 9.978 1.007 6.674 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.305 1.090 7.048 1.00 0.00 C ATOM 0 H PHE A 123 11.031 5.775 5.955 1.00 0.00 H new ATOM 0 HA PHE A 123 8.858 4.608 4.533 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.246 5.352 7.459 1.00 0.00 H new ATOM 0 HB3 PHE A 123 7.904 4.401 6.853 1.00 0.00 H new ATOM 0 HD1 PHE A 123 11.559 4.432 7.382 1.00 0.00 H new ATOM 0 HD2 PHE A 123 8.184 2.086 6.261 1.00 0.00 H new ATOM 0 HE1 PHE A 123 12.908 2.391 7.599 1.00 0.00 H new ATOM 0 HE2 PHE A 123 9.532 0.044 6.475 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.899 0.192 7.140 1.00 0.00 H new ATOM 1807 N ILE A 124 6.830 6.151 4.945 1.00 0.00 N ATOM 1808 CA ILE A 124 5.783 7.158 4.819 1.00 0.00 C ATOM 1809 C ILE A 124 5.331 7.655 6.189 1.00 0.00 C ATOM 1810 O ILE A 124 5.475 6.957 7.192 1.00 0.00 O ATOM 1811 CB ILE A 124 4.563 6.609 4.056 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.005 5.373 4.762 1.00 0.00 C ATOM 1813 CG2 ILE A 124 4.940 6.282 2.620 1.00 0.00 C ATOM 1814 CD1 ILE A 124 2.682 4.901 4.197 1.00 0.00 C ATOM 0 H ILE A 124 6.511 5.192 4.810 1.00 0.00 H new ATOM 0 HA ILE A 124 6.209 7.988 4.256 1.00 0.00 H new ATOM 0 HB ILE A 124 3.788 7.375 4.042 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.732 4.564 4.689 1.00 0.00 H new ATOM 0 HG13 ILE A 124 3.880 5.595 5.822 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.067 5.895 2.094 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.293 7.185 2.122 1.00 0.00 H new ATOM 0 HG23 ILE A 124 5.730 5.531 2.613 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.345 4.021 4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 124 1.941 5.694 4.294 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.806 4.647 3.144 1.00 0.00 H new ATOM 1826 N ARG A 125 4.784 8.866 6.221 1.00 0.00 N ATOM 1827 CA ARG A 125 4.310 9.458 7.468 1.00 0.00 C ATOM 1828 C ARG A 125 3.263 10.534 7.195 1.00 0.00 C ATOM 1829 O ARG A 125 3.378 11.297 6.235 1.00 0.00 O ATOM 1830 CB ARG A 125 5.482 10.056 8.249 1.00 0.00 C ATOM 1831 CG ARG A 125 5.337 9.925 9.758 1.00 0.00 C ATOM 1832 CD ARG A 125 5.099 11.274 10.417 1.00 0.00 C ATOM 1833 NE ARG A 125 4.243 11.164 11.596 1.00 0.00 N ATOM 1834 CZ ARG A 125 4.163 12.096 12.543 1.00 0.00 C ATOM 1835 NH1 ARG A 125 4.882 13.208 12.453 1.00 0.00 N ATOM 1836 NH2 ARG A 125 3.360 11.915 13.583 1.00 0.00 N ATOM 0 H ARG A 125 4.658 9.456 5.399 1.00 0.00 H new ATOM 0 HA ARG A 125 3.849 8.671 8.064 1.00 0.00 H new ATOM 0 HB2 ARG A 125 6.404 9.566 7.937 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.579 11.111 7.992 1.00 0.00 H new ATOM 0 HG2 ARG A 125 4.508 9.256 9.988 1.00 0.00 H new ATOM 0 HG3 ARG A 125 6.237 9.471 10.172 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.055 11.711 10.703 1.00 0.00 H new ATOM 0 HD3 ARG A 125 4.640 11.953 9.698 1.00 0.00 H new ATOM 0 HE ARG A 125 3.674 10.324 11.699 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.500 13.352 11.655 1.00 0.00 H new ATOM 0 HH12 ARG A 125 4.816 13.918 13.182 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.805 11.062 13.656 1.00 0.00 H new ATOM 0 HH22 ARG A 125 3.298 12.628 14.309 1.00 0.00 H new ATOM 1850 N CYS A 126 2.244 10.590 8.046 1.00 0.00 N ATOM 1851 CA CYS A 126 1.178 11.573 7.897 1.00 0.00 C ATOM 1852 C CYS A 126 1.319 12.688 8.929 1.00 0.00 C ATOM 1853 O CYS A 126 1.266 12.443 10.135 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.189 10.900 8.042 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.367 9.905 9.540 1.00 0.00 S ATOM 0 H CYS A 126 2.134 9.966 8.846 1.00 0.00 H new ATOM 0 HA CYS A 126 1.257 12.010 6.902 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.963 11.668 8.035 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.363 10.264 7.174 1.00 0.00 H new ATOM 0 HG CYS A 126 0.223 10.504 10.532 1.00 0.00 H new ATOM 1861 N ASN A 127 1.498 13.913 8.448 1.00 0.00 N ATOM 1862 CA ASN A 127 1.649 15.066 9.328 1.00 0.00 C ATOM 1863 C ASN A 127 0.296 15.517 9.872 1.00 0.00 C ATOM 1864 O ASN A 127 -0.751 15.067 9.408 1.00 0.00 O ATOM 1865 CB ASN A 127 2.322 16.220 8.582 1.00 0.00 C ATOM 1866 CG ASN A 127 3.835 16.116 8.602 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.406 15.363 9.391 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.492 16.875 7.732 1.00 0.00 N ATOM 0 H ASN A 127 1.542 14.133 7.453 1.00 0.00 H new ATOM 0 HA ASN A 127 2.278 14.770 10.168 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.975 16.233 7.549 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.019 17.166 9.032 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.511 16.848 7.700 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.977 17.485 7.096 1.00 0.00 H new ATOM 1875 N GLU A 128 0.328 16.407 10.858 1.00 0.00 N ATOM 1876 CA GLU A 128 -0.894 16.919 11.466 1.00 0.00 C ATOM 1877 C GLU A 128 -1.541 17.980 10.581 1.00 0.00 C ATOM 1878 O GLU A 128 -2.763 18.036 10.453 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.596 17.504 12.848 1.00 0.00 C ATOM 1880 CG GLU A 128 -0.658 16.480 13.969 1.00 0.00 C ATOM 1881 CD GLU A 128 -0.275 17.063 15.314 1.00 0.00 C ATOM 1882 OE1 GLU A 128 0.679 17.869 15.362 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -0.929 16.715 16.320 1.00 0.00 O ATOM 0 H GLU A 128 1.187 16.789 11.253 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.591 16.088 11.573 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.395 17.957 12.835 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.308 18.302 13.057 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.667 16.072 14.028 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.008 15.650 13.734 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.710 18.821 9.973 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.200 19.881 9.100 1.00 0.00 C ATOM 1892 C ALA A 129 -1.885 19.305 7.865 1.00 0.00 C ATOM 1893 O ALA A 129 -2.805 19.910 7.315 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.056 20.798 8.691 1.00 0.00 C ATOM 0 H ALA A 129 0.305 18.789 10.069 1.00 0.00 H new ATOM 0 HA ALA A 129 -1.938 20.461 9.654 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.436 21.585 8.039 1.00 0.00 H new ATOM 0 HB2 ALA A 129 0.387 21.246 9.580 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.701 20.221 8.160 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.431 18.133 7.434 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.011 17.495 6.268 1.00 0.00 C ATOM 1902 C GLY A 130 -1.015 17.340 5.136 1.00 0.00 C ATOM 1903 O GLY A 130 -1.379 17.431 3.962 1.00 0.00 O ATOM 0 H GLY A 130 -0.671 17.613 7.872 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.394 16.514 6.548 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.861 18.082 5.922 1.00 0.00 H new ATOM 1907 N ASP A 131 0.245 17.107 5.486 1.00 0.00 N ATOM 1908 CA ASP A 131 1.299 16.939 4.491 1.00 0.00 C ATOM 1909 C ASP A 131 2.023 15.612 4.683 1.00 0.00 C ATOM 1910 O ASP A 131 2.887 15.485 5.552 1.00 0.00 O ATOM 1911 CB ASP A 131 2.297 18.096 4.575 1.00 0.00 C ATOM 1912 CG ASP A 131 1.736 19.387 4.013 1.00 0.00 C ATOM 1913 OD1 ASP A 131 1.695 19.525 2.772 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.338 20.259 4.813 1.00 0.00 O ATOM 0 H ASP A 131 0.562 17.030 6.452 1.00 0.00 H new ATOM 0 HA ASP A 131 0.836 16.939 3.504 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.583 18.250 5.615 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.203 17.830 4.031 1.00 0.00 H new ATOM 1919 N ILE A 132 1.668 14.625 3.868 1.00 0.00 N ATOM 1920 CA ILE A 132 2.286 13.307 3.948 1.00 0.00 C ATOM 1921 C ILE A 132 3.734 13.351 3.472 1.00 0.00 C ATOM 1922 O ILE A 132 4.001 13.506 2.281 1.00 0.00 O ATOM 1923 CB ILE A 132 1.513 12.271 3.111 1.00 0.00 C ATOM 1924 CG1 ILE A 132 0.021 12.322 3.445 1.00 0.00 C ATOM 1925 CG2 ILE A 132 2.067 10.874 3.350 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.281 12.041 4.901 1.00 0.00 C ATOM 0 H ILE A 132 0.955 14.713 3.144 1.00 0.00 H new ATOM 0 HA ILE A 132 2.259 13.008 4.996 1.00 0.00 H new ATOM 0 HB ILE A 132 1.638 12.514 2.056 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -0.368 13.306 3.185 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.507 11.597 2.826 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.509 10.154 2.751 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.119 10.846 3.065 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.970 10.620 4.406 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.357 12.094 5.066 1.00 0.00 H new ATOM 0 HD12 ILE A 132 0.078 11.045 5.161 1.00 0.00 H new ATOM 0 HD13 ILE A 132 0.219 12.781 5.526 1.00 0.00 H new ATOM 1938 N GLU A 133 4.665 13.214 4.410 1.00 0.00 N ATOM 1939 CA GLU A 133 6.087 13.238 4.087 1.00 0.00 C ATOM 1940 C GLU A 133 6.762 11.937 4.509 1.00 0.00 C ATOM 1941 O GLU A 133 6.297 11.252 5.420 1.00 0.00 O ATOM 1942 CB GLU A 133 6.767 14.425 4.771 1.00 0.00 C ATOM 1943 CG GLU A 133 6.386 14.585 6.234 1.00 0.00 C ATOM 1944 CD GLU A 133 7.470 15.263 7.048 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.623 14.784 7.018 1.00 0.00 O ATOM 1946 OE2 GLU A 133 7.166 16.274 7.716 1.00 0.00 O ATOM 0 H GLU A 133 4.460 13.085 5.401 1.00 0.00 H new ATOM 0 HA GLU A 133 6.187 13.345 3.007 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.848 14.306 4.697 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.509 15.339 4.235 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.467 15.166 6.305 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.177 13.604 6.660 1.00 0.00 H new ATOM 1953 N ALA A 134 7.863 11.605 3.842 1.00 0.00 N ATOM 1954 CA ALA A 134 8.603 10.386 4.149 1.00 0.00 C ATOM 1955 C ALA A 134 9.556 10.604 5.319 1.00 0.00 C ATOM 1956 O ALA A 134 10.547 11.325 5.199 1.00 0.00 O ATOM 1957 CB ALA A 134 9.368 9.913 2.922 1.00 0.00 C ATOM 0 H ALA A 134 8.262 12.162 3.086 1.00 0.00 H new ATOM 0 HA ALA A 134 7.887 9.616 4.437 1.00 0.00 H new ATOM 0 HB1 ALA A 134 9.916 9.003 3.164 1.00 0.00 H new ATOM 0 HB2 ALA A 134 8.667 9.710 2.112 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.069 10.687 2.610 1.00 0.00 H new ATOM 1963 N LYS A 135 9.250 9.976 6.449 1.00 0.00 N ATOM 1964 CA LYS A 135 10.081 10.100 7.641 1.00 0.00 C ATOM 1965 C LYS A 135 11.380 9.317 7.482 1.00 0.00 C ATOM 1966 O LYS A 135 11.570 8.602 6.498 1.00 0.00 O ATOM 1967 CB LYS A 135 9.320 9.604 8.872 1.00 0.00 C ATOM 1968 CG LYS A 135 9.669 10.355 10.148 1.00 0.00 C ATOM 1969 CD LYS A 135 8.490 11.165 10.662 1.00 0.00 C ATOM 1970 CE LYS A 135 8.943 12.474 11.287 1.00 0.00 C ATOM 1971 NZ LYS A 135 9.081 13.556 10.272 1.00 0.00 N ATOM 0 H LYS A 135 8.433 9.376 6.565 1.00 0.00 H new ATOM 0 HA LYS A 135 10.327 11.153 7.775 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.250 9.695 8.688 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.530 8.544 9.015 1.00 0.00 H new ATOM 0 HG2 LYS A 135 9.985 9.646 10.913 1.00 0.00 H new ATOM 0 HG3 LYS A 135 10.513 11.019 9.961 1.00 0.00 H new ATOM 0 HD2 LYS A 135 7.803 11.371 9.841 1.00 0.00 H new ATOM 0 HD3 LYS A 135 7.939 10.580 11.399 1.00 0.00 H new ATOM 0 HE2 LYS A 135 8.226 12.780 12.049 1.00 0.00 H new ATOM 0 HE3 LYS A 135 9.898 12.325 11.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 9.392 14.432 10.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 9.784 13.275 9.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 8.164 13.717 9.809 1.00 0.00 H new ATOM 1985 N ASN A 136 12.272 9.455 8.458 1.00 0.00 N ATOM 1986 CA ASN A 136 13.554 8.760 8.426 1.00 0.00 C ATOM 1987 C ASN A 136 13.353 7.249 8.391 1.00 0.00 C ATOM 1988 O ASN A 136 12.224 6.761 8.454 1.00 0.00 O ATOM 1989 CB ASN A 136 14.398 9.147 9.642 1.00 0.00 C ATOM 1990 CG ASN A 136 15.859 9.351 9.290 1.00 0.00 C ATOM 1991 OD1 ASN A 136 16.192 10.125 8.393 1.00 0.00 O ATOM 1992 ND2 ASN A 136 16.740 8.652 9.997 1.00 0.00 N ATOM 0 H ASN A 136 12.131 10.042 9.280 1.00 0.00 H new ATOM 0 HA ASN A 136 14.079 9.059 7.519 1.00 0.00 H new ATOM 0 HB2 ASN A 136 14.001 10.063 10.080 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.315 8.369 10.401 1.00 0.00 H new ATOM 0 HD21 ASN A 136 17.737 8.746 9.805 1.00 0.00 H new ATOM 0 HD22 ASN A 136 16.419 8.022 10.732 1.00 0.00 H new ATOM 1999 N LYS A 137 14.454 6.512 8.292 1.00 0.00 N ATOM 2000 CA LYS A 137 14.399 5.056 8.249 1.00 0.00 C ATOM 2001 C LYS A 137 13.839 4.493 9.553 1.00 0.00 C ATOM 2002 O LYS A 137 13.219 3.431 9.565 1.00 0.00 O ATOM 2003 CB LYS A 137 15.791 4.479 7.987 1.00 0.00 C ATOM 2004 CG LYS A 137 16.223 4.572 6.533 1.00 0.00 C ATOM 2005 CD LYS A 137 17.714 4.321 6.379 1.00 0.00 C ATOM 2006 CE LYS A 137 18.259 4.963 5.113 1.00 0.00 C ATOM 2007 NZ LYS A 137 19.350 4.154 4.505 1.00 0.00 N ATOM 0 H LYS A 137 15.396 6.900 8.240 1.00 0.00 H new ATOM 0 HA LYS A 137 13.735 4.767 7.435 1.00 0.00 H new ATOM 0 HB2 LYS A 137 16.516 5.005 8.607 1.00 0.00 H new ATOM 0 HB3 LYS A 137 15.806 3.434 8.296 1.00 0.00 H new ATOM 0 HG2 LYS A 137 15.667 3.846 5.940 1.00 0.00 H new ATOM 0 HG3 LYS A 137 15.977 5.559 6.141 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.242 4.718 7.246 1.00 0.00 H new ATOM 0 HD3 LYS A 137 17.903 3.248 6.354 1.00 0.00 H new ATOM 0 HE2 LYS A 137 17.451 5.084 4.391 1.00 0.00 H new ATOM 0 HE3 LYS A 137 18.632 5.961 5.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 19.694 4.626 3.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 20.132 4.059 5.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 18.988 3.210 4.261 1.00 0.00 H new ATOM 2021 N THR A 138 14.064 5.213 10.648 1.00 0.00 N ATOM 2022 CA THR A 138 13.584 4.786 11.957 1.00 0.00 C ATOM 2023 C THR A 138 12.070 4.604 11.950 1.00 0.00 C ATOM 2024 O THR A 138 11.317 5.575 12.034 1.00 0.00 O ATOM 2025 CB THR A 138 13.982 5.805 13.027 1.00 0.00 C ATOM 2026 OG1 THR A 138 13.825 7.126 12.541 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.413 5.653 13.495 1.00 0.00 C ATOM 0 H THR A 138 14.576 6.095 10.654 1.00 0.00 H new ATOM 0 HA THR A 138 14.045 3.826 12.189 1.00 0.00 H new ATOM 0 HB THR A 138 13.320 5.613 13.871 1.00 0.00 H new ATOM 0 HG1 THR A 138 12.938 7.222 12.135 1.00 0.00 H new ATOM 0 HG21 THR A 138 15.630 6.406 14.253 1.00 0.00 H new ATOM 0 HG22 THR A 138 15.553 4.659 13.920 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.088 5.784 12.649 1.00 0.00 H new ATOM 2035 N ALA A 139 11.629 3.354 11.847 1.00 0.00 N ATOM 2036 CA ALA A 139 10.204 3.045 11.829 1.00 0.00 C ATOM 2037 C ALA A 139 9.579 3.250 13.204 1.00 0.00 C ATOM 2038 O ALA A 139 9.734 2.417 14.097 1.00 0.00 O ATOM 2039 CB ALA A 139 9.980 1.618 11.353 1.00 0.00 C ATOM 0 H ALA A 139 12.238 2.539 11.775 1.00 0.00 H new ATOM 0 HA ALA A 139 9.718 3.729 11.133 1.00 0.00 H new ATOM 0 HB1 ALA A 139 8.912 1.401 11.344 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.382 1.503 10.346 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.486 0.926 12.027 1.00 0.00 H new ATOM 2045 N GLY A 140 8.874 4.365 13.369 1.00 0.00 N ATOM 2046 CA GLY A 140 8.236 4.658 14.638 1.00 0.00 C ATOM 2047 C GLY A 140 6.844 4.066 14.739 1.00 0.00 C ATOM 2048 O GLY A 140 6.369 3.417 13.806 1.00 0.00 O ATOM 0 H GLY A 140 8.734 5.071 12.646 1.00 0.00 H new ATOM 0 HA2 GLY A 140 8.852 4.269 15.449 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.178 5.738 14.771 1.00 0.00 H new ATOM 2052 N GLU A 141 6.189 4.289 15.874 1.00 0.00 N ATOM 2053 CA GLU A 141 4.843 3.772 16.093 1.00 0.00 C ATOM 2054 C GLU A 141 3.855 4.393 15.111 1.00 0.00 C ATOM 2055 O GLU A 141 2.961 3.716 14.604 1.00 0.00 O ATOM 2056 CB GLU A 141 4.396 4.051 17.530 1.00 0.00 C ATOM 2057 CG GLU A 141 4.749 2.938 18.503 1.00 0.00 C ATOM 2058 CD GLU A 141 4.985 3.448 19.911 1.00 0.00 C ATOM 2059 OE1 GLU A 141 5.751 4.422 20.069 1.00 0.00 O ATOM 2060 OE2 GLU A 141 4.404 2.873 20.855 1.00 0.00 O ATOM 0 H GLU A 141 6.568 4.824 16.655 1.00 0.00 H new ATOM 0 HA GLU A 141 4.862 2.695 15.928 1.00 0.00 H new ATOM 0 HB2 GLU A 141 4.855 4.979 17.871 1.00 0.00 H new ATOM 0 HB3 GLU A 141 3.317 4.205 17.543 1.00 0.00 H new ATOM 0 HG2 GLU A 141 3.944 2.203 18.517 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.644 2.424 18.152 1.00 0.00 H new ATOM 2067 N GLU A 142 4.023 5.684 14.847 1.00 0.00 N ATOM 2068 CA GLU A 142 3.145 6.397 13.925 1.00 0.00 C ATOM 2069 C GLU A 142 3.395 5.957 12.487 1.00 0.00 C ATOM 2070 O GLU A 142 2.463 5.846 11.690 1.00 0.00 O ATOM 2071 CB GLU A 142 3.355 7.907 14.053 1.00 0.00 C ATOM 2072 CG GLU A 142 2.766 8.497 15.324 1.00 0.00 C ATOM 2073 CD GLU A 142 1.312 8.896 15.163 1.00 0.00 C ATOM 2074 OE1 GLU A 142 0.483 8.010 14.865 1.00 0.00 O ATOM 2075 OE2 GLU A 142 1.003 10.094 15.331 1.00 0.00 O ATOM 0 H GLU A 142 4.759 6.259 15.258 1.00 0.00 H new ATOM 0 HA GLU A 142 2.114 6.157 14.185 1.00 0.00 H new ATOM 0 HB2 GLU A 142 4.423 8.121 14.024 1.00 0.00 H new ATOM 0 HB3 GLU A 142 2.908 8.402 13.191 1.00 0.00 H new ATOM 0 HG2 GLU A 142 2.852 7.770 16.131 1.00 0.00 H new ATOM 0 HG3 GLU A 142 3.348 9.370 15.618 1.00 0.00 H new ATOM 2082 N GLU A 143 4.659 5.705 12.161 1.00 0.00 N ATOM 2083 CA GLU A 143 5.032 5.276 10.818 1.00 0.00 C ATOM 2084 C GLU A 143 4.407 3.924 10.482 1.00 0.00 C ATOM 2085 O GLU A 143 4.169 3.613 9.315 1.00 0.00 O ATOM 2086 CB GLU A 143 6.554 5.192 10.690 1.00 0.00 C ATOM 2087 CG GLU A 143 7.201 6.497 10.257 1.00 0.00 C ATOM 2088 CD GLU A 143 7.795 7.267 11.420 1.00 0.00 C ATOM 2089 OE1 GLU A 143 8.877 6.871 11.904 1.00 0.00 O ATOM 2090 OE2 GLU A 143 7.180 8.266 11.847 1.00 0.00 O ATOM 0 H GLU A 143 5.442 5.791 12.809 1.00 0.00 H new ATOM 0 HA GLU A 143 4.655 6.015 10.112 1.00 0.00 H new ATOM 0 HB2 GLU A 143 6.975 4.888 11.649 1.00 0.00 H new ATOM 0 HB3 GLU A 143 6.807 4.414 9.970 1.00 0.00 H new ATOM 0 HG2 GLU A 143 7.984 6.286 9.528 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.458 7.118 9.756 1.00 0.00 H new ATOM 2097 N MET A 144 4.142 3.126 11.513 1.00 0.00 N ATOM 2098 CA MET A 144 3.545 1.808 11.325 1.00 0.00 C ATOM 2099 C MET A 144 2.225 1.908 10.568 1.00 0.00 C ATOM 2100 O MET A 144 1.395 2.771 10.857 1.00 0.00 O ATOM 2101 CB MET A 144 3.319 1.131 12.678 1.00 0.00 C ATOM 2102 CG MET A 144 4.598 0.623 13.325 1.00 0.00 C ATOM 2103 SD MET A 144 5.133 -0.962 12.655 1.00 0.00 S ATOM 2104 CE MET A 144 6.910 -0.741 12.639 1.00 0.00 C ATOM 0 H MET A 144 4.331 3.369 12.485 1.00 0.00 H new ATOM 0 HA MET A 144 4.236 1.206 10.734 1.00 0.00 H new ATOM 0 HB2 MET A 144 2.836 1.838 13.353 1.00 0.00 H new ATOM 0 HB3 MET A 144 2.631 0.296 12.547 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.389 1.359 13.183 1.00 0.00 H new ATOM 0 HG3 MET A 144 4.443 0.525 14.399 1.00 0.00 H new ATOM 0 HE1 MET A 144 7.397 -1.713 12.561 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.192 -0.125 11.785 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.224 -0.250 13.560 1.00 0.00 H new ATOM 2114 N ILE A 145 2.036 1.020 9.598 1.00 0.00 N ATOM 2115 CA ILE A 145 0.816 1.008 8.798 1.00 0.00 C ATOM 2116 C ILE A 145 0.286 -0.410 8.627 1.00 0.00 C ATOM 2117 O ILE A 145 0.872 -1.369 9.131 1.00 0.00 O ATOM 2118 CB ILE A 145 1.051 1.628 7.407 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.217 0.929 6.701 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.314 3.122 7.530 1.00 0.00 C ATOM 2121 CD1 ILE A 145 1.918 0.562 5.264 1.00 0.00 C ATOM 0 H ILE A 145 2.712 0.299 9.346 1.00 0.00 H new ATOM 0 HA ILE A 145 0.079 1.606 9.334 1.00 0.00 H new ATOM 0 HB ILE A 145 0.153 1.487 6.806 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.091 1.580 6.727 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.476 0.025 7.252 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.478 3.545 6.539 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.454 3.606 7.994 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.198 3.286 8.146 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.787 0.071 4.826 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.064 -0.114 5.231 1.00 0.00 H new ATOM 0 HD13 ILE A 145 1.688 1.465 4.698 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.826 -0.538 7.912 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.437 -1.841 7.673 1.00 0.00 C ATOM 2135 C LYS A 146 -2.057 -1.905 6.281 1.00 0.00 C ATOM 2136 O LYS A 146 -3.229 -1.576 6.096 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.502 -2.129 8.732 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.000 -1.972 10.158 1.00 0.00 C ATOM 2139 CD LYS A 146 -2.862 -2.748 11.141 1.00 0.00 C ATOM 2140 CE LYS A 146 -3.967 -1.881 11.720 1.00 0.00 C ATOM 2141 NZ LYS A 146 -4.609 -2.516 12.904 1.00 0.00 N ATOM 0 H LYS A 146 -1.323 0.245 7.487 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.656 -2.598 7.737 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.347 -1.458 8.577 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -2.872 -3.145 8.596 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -0.969 -2.321 10.222 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -1.997 -0.916 10.430 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -3.300 -3.611 10.639 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -2.239 -3.132 11.949 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -3.556 -0.913 12.006 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -4.721 -1.695 10.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -5.357 -1.893 13.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -5.023 -3.429 12.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -3.895 -2.671 13.645 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.262 -2.329 5.304 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.731 -2.435 3.928 1.00 0.00 C ATOM 2157 C ILE A 147 -2.795 -3.521 3.796 1.00 0.00 C ATOM 2158 O ILE A 147 -2.488 -4.713 3.842 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.573 -2.743 2.959 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.575 -1.754 3.168 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.060 -2.700 1.518 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.944 -2.360 2.944 1.00 0.00 C ATOM 0 H ILE A 147 -0.289 -2.605 5.440 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.164 -1.470 3.665 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.204 -3.747 3.167 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.445 -0.910 2.490 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.523 -1.359 4.183 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.230 -2.920 0.847 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -1.846 -3.442 1.377 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.453 -1.708 1.296 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.709 -1.602 3.110 1.00 0.00 H new ATOM 0 HD12 ILE A 147 2.095 -3.185 3.640 1.00 0.00 H new ATOM 0 HD13 ILE A 147 2.015 -2.730 1.921 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.044 -3.101 3.630 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.153 -4.038 3.491 1.00 0.00 C ATOM 2176 C ARG A 148 -5.309 -4.485 2.041 1.00 0.00 C ATOM 2177 O ARG A 148 -4.632 -3.976 1.147 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.453 -3.398 3.980 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.693 -3.571 5.472 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.741 -2.598 5.987 1.00 0.00 C ATOM 2181 NE ARG A 148 -7.153 -1.549 6.818 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.814 -1.719 8.095 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -7.001 -2.891 8.689 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.285 -0.713 8.778 1.00 0.00 N ATOM 0 H ARG A 148 -4.314 -2.118 3.588 1.00 0.00 H new ATOM 0 HA ARG A 148 -4.934 -4.914 4.102 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.435 -2.334 3.744 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.290 -3.832 3.433 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -7.014 -4.593 5.673 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.758 -3.419 6.011 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -8.260 -2.144 5.143 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.488 -3.142 6.565 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.993 -0.634 6.396 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.406 -3.668 8.167 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -6.739 -3.015 9.667 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -6.138 0.189 8.326 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -6.025 -0.841 9.756 1.00 0.00 H new ATOM 2198 N SER A 149 -6.205 -5.439 1.814 1.00 0.00 N ATOM 2199 CA SER A 149 -6.450 -5.956 0.472 1.00 0.00 C ATOM 2200 C SER A 149 -7.882 -6.462 0.336 1.00 0.00 C ATOM 2201 O SER A 149 -8.371 -7.208 1.185 1.00 0.00 O ATOM 2202 CB SER A 149 -5.467 -7.082 0.149 1.00 0.00 C ATOM 2203 OG SER A 149 -5.457 -7.368 -1.239 1.00 0.00 O ATOM 0 H SER A 149 -6.774 -5.870 2.542 1.00 0.00 H new ATOM 0 HA SER A 149 -6.303 -5.140 -0.236 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.465 -6.798 0.472 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.740 -7.978 0.706 1.00 0.00 H new ATOM 0 HG SER A 149 -4.819 -8.090 -1.420 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.550 -6.051 -0.737 1.00 0.00 N ATOM 2210 CA CYS A 150 -9.928 -6.463 -0.984 1.00 0.00 C ATOM 2211 C CYS A 150 -9.991 -7.501 -2.100 1.00 0.00 C ATOM 2212 O CYS A 150 -10.967 -7.564 -2.847 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.786 -5.251 -1.350 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.104 -4.238 -2.683 1.00 0.00 S ATOM 0 H CYS A 150 -8.160 -5.433 -1.449 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.318 -6.912 -0.071 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.778 -5.596 -1.642 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.913 -4.629 -0.464 1.00 0.00 H new ATOM 0 HG CYS A 150 -9.806 -3.059 -2.223 1.00 0.00 H new ATOM 2220 N ALA A 151 -8.945 -8.313 -2.206 1.00 0.00 N ATOM 2221 CA ALA A 151 -8.883 -9.349 -3.230 1.00 0.00 C ATOM 2222 C ALA A 151 -9.421 -10.675 -2.703 1.00 0.00 C ATOM 2223 O ALA A 151 -9.720 -10.809 -1.517 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.454 -9.517 -3.724 1.00 0.00 C ATOM 0 H ALA A 151 -8.129 -8.274 -1.596 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.511 -9.038 -4.065 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.422 -10.294 -4.488 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.103 -8.576 -4.148 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -6.812 -9.802 -2.890 1.00 0.00 H new