USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0135 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -1.57 K(o=-1.6,f=-5!) USER MOD Single : A 24 SER OG : rot -7:sc= 0.99 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl 146:sc= -2.42! (180deg=-3.87!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot -91:sc= 0.554 USER MOD Single : A 38 HIS : no HD1:sc= -0.167 X(o=-0.17,f=-0.0056) USER MOD Single : A 42 ASN : amide:sc= -0.0381 X(o=-0.038,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.444 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 79:sc= 0.59 USER MOD Single : A 63 GLN : amide:sc= -0.316 K(o=-0.32,f=-2.1) USER MOD Single : A 65 THR OG1 : rot -150:sc= -0.0121 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -128:sc= -0.0223 (180deg=-1.09) USER MOD Single : A 78 SER OG : rot 160:sc= 0.604 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.238 K(o=-0.24,f=-2.3!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 21:sc= 0.00878 USER MOD Single : A 104 GLN : amide:sc= -2.76! C(o=-2.8!,f=-3.8!) USER MOD Single : A 110 GLN : amide:sc= -0.258 K(o=-0.26,f=-1.6!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl -143:sc= -0.247 (180deg=-1.46!) USER MOD Single : A 119 SER OG : rot -7:sc= 0.137! USER MOD Single : A 120 ASN : amide:sc= -2.93! C(o=-2.9!,f=-9.7!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 73:sc= 0.78 USER MOD Single : A 126 CYS SG : rot 180:sc= 0.0549 USER MOD Single : A 127 ASN : amide:sc= -0.0244 K(o=-0.024,f=-1.2) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.257 X(o=-0.26,f=-0.073) USER MOD Single : A 137 LYS NZ :NH3+ -157:sc= -1.51 (180deg=-3.14!) USER MOD Single : A 138 THR OG1 : rot 50:sc= 0.0655 USER MOD Single : A 144 MET CE :methyl -172:sc= 0 (180deg=-0.117) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= -0.0425 USER MOD Single : A 150 CYS SG : rot -127:sc= -0.512 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -7.029 -10.327 10.727 1.00 0.00 N ATOM 88 CA ASP A 9 -7.889 -9.151 10.779 1.00 0.00 C ATOM 89 C ASP A 9 -8.684 -9.002 9.485 1.00 0.00 C ATOM 90 O ASP A 9 -8.181 -9.287 8.399 1.00 0.00 O ATOM 91 CB ASP A 9 -7.053 -7.893 11.030 1.00 0.00 C ATOM 92 CG ASP A 9 -7.515 -7.129 12.256 1.00 0.00 C ATOM 93 OD1 ASP A 9 -8.456 -6.317 12.130 1.00 0.00 O ATOM 94 OD2 ASP A 9 -6.934 -7.342 13.341 1.00 0.00 O ATOM 0 HA ASP A 9 -8.592 -9.280 11.602 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -6.007 -8.173 11.152 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -7.109 -7.243 10.157 1.00 0.00 H new ATOM 99 N ILE A 10 -9.929 -8.554 9.609 1.00 0.00 N ATOM 100 CA ILE A 10 -10.793 -8.366 8.451 1.00 0.00 C ATOM 101 C ILE A 10 -11.985 -7.476 8.793 1.00 0.00 C ATOM 102 O ILE A 10 -12.698 -7.724 9.765 1.00 0.00 O ATOM 103 CB ILE A 10 -11.306 -9.717 7.909 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.124 -9.506 6.633 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.135 -10.434 8.965 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.332 -10.772 5.832 1.00 0.00 C ATOM 0 H ILE A 10 -10.362 -8.314 10.501 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.193 -7.880 7.681 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.446 -10.341 7.666 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.096 -9.090 6.899 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.622 -8.768 6.007 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.489 -11.385 8.566 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.521 -10.616 9.847 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.989 -9.815 9.239 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.920 -10.547 4.942 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.365 -11.178 5.535 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -12.862 -11.505 6.441 1.00 0.00 H new ATOM 118 N VAL A 11 -12.193 -6.439 7.987 1.00 0.00 N ATOM 119 CA VAL A 11 -13.297 -5.513 8.204 1.00 0.00 C ATOM 120 C VAL A 11 -14.218 -5.466 6.989 1.00 0.00 C ATOM 121 O VAL A 11 -13.980 -4.713 6.045 1.00 0.00 O ATOM 122 CB VAL A 11 -12.787 -4.090 8.504 1.00 0.00 C ATOM 123 CG1 VAL A 11 -13.942 -3.176 8.884 1.00 0.00 C ATOM 124 CG2 VAL A 11 -11.735 -4.118 9.603 1.00 0.00 C ATOM 0 H VAL A 11 -11.611 -6.220 7.178 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.854 -5.879 9.067 1.00 0.00 H new ATOM 0 HB VAL A 11 -12.323 -3.694 7.601 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -13.561 -2.176 9.092 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -14.655 -3.129 8.061 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -14.439 -3.567 9.772 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.388 -3.104 9.800 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.169 -4.536 10.511 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.894 -4.734 9.286 1.00 0.00 H new ATOM 134 N GLY A 12 -15.272 -6.274 7.021 1.00 0.00 N ATOM 135 CA GLY A 12 -16.214 -6.310 5.917 1.00 0.00 C ATOM 136 C GLY A 12 -15.650 -7.010 4.696 1.00 0.00 C ATOM 137 O GLY A 12 -15.940 -8.182 4.456 1.00 0.00 O ATOM 0 H GLY A 12 -15.491 -6.905 7.792 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -17.124 -6.819 6.236 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.496 -5.291 5.650 1.00 0.00 H new ATOM 141 N ILE A 13 -14.843 -6.290 3.923 1.00 0.00 N ATOM 142 CA ILE A 13 -14.238 -6.849 2.721 1.00 0.00 C ATOM 143 C ILE A 13 -12.797 -6.376 2.560 1.00 0.00 C ATOM 144 O ILE A 13 -12.301 -6.234 1.442 1.00 0.00 O ATOM 145 CB ILE A 13 -15.035 -6.468 1.459 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.130 -4.946 1.330 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.423 -7.088 1.502 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.384 -4.475 -0.085 1.00 0.00 C ATOM 0 H ILE A 13 -14.593 -5.318 4.108 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.252 -7.933 2.836 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.512 -6.857 0.585 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -15.931 -4.584 1.974 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.204 -4.500 1.692 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -16.974 -6.810 0.604 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.335 -8.173 1.552 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -16.956 -6.726 2.381 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.440 -3.387 -0.102 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.571 -4.807 -0.730 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -16.325 -4.892 -0.444 1.00 0.00 H new ATOM 160 N TRP A 14 -12.130 -6.132 3.684 1.00 0.00 N ATOM 161 CA TRP A 14 -10.746 -5.674 3.667 1.00 0.00 C ATOM 162 C TRP A 14 -9.904 -6.449 4.675 1.00 0.00 C ATOM 163 O TRP A 14 -9.978 -6.204 5.880 1.00 0.00 O ATOM 164 CB TRP A 14 -10.678 -4.177 3.974 1.00 0.00 C ATOM 165 CG TRP A 14 -11.386 -3.330 2.961 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.705 -2.981 2.962 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.812 -2.728 1.794 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.988 -2.197 1.869 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.842 -2.027 1.138 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.528 -2.711 1.244 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.626 -1.319 -0.041 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.315 -2.007 0.073 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.359 -1.320 -0.558 1.00 0.00 C ATOM 0 H TRP A 14 -12.526 -6.244 4.617 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.343 -5.852 2.670 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -11.113 -3.995 4.957 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.633 -3.871 4.026 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.423 -3.278 3.713 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.902 -1.806 1.640 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.717 -3.238 1.724 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.429 -0.788 -0.530 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.327 -1.987 -0.362 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.160 -0.780 -1.472 1.00 0.00 H new ATOM 184 N TRP A 15 -9.101 -7.383 4.175 1.00 0.00 N ATOM 185 CA TRP A 15 -8.245 -8.193 5.033 1.00 0.00 C ATOM 186 C TRP A 15 -6.796 -7.724 4.953 1.00 0.00 C ATOM 187 O TRP A 15 -6.287 -7.429 3.872 1.00 0.00 O ATOM 188 CB TRP A 15 -8.338 -9.668 4.636 1.00 0.00 C ATOM 189 CG TRP A 15 -8.129 -9.904 3.172 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.079 -9.865 2.192 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.893 -10.219 2.521 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.508 -10.135 0.971 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.167 -10.356 1.148 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.580 -10.397 2.967 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.177 -10.663 0.217 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.598 -10.702 2.043 1.00 0.00 C ATOM 197 CH2 TRP A 15 -4.902 -10.832 0.681 1.00 0.00 C ATOM 0 H TRP A 15 -9.026 -7.597 3.181 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.590 -8.078 6.061 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.596 -10.235 5.198 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.317 -10.053 4.922 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.126 -9.653 2.353 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.002 -10.166 0.079 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.337 -10.298 4.015 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.408 -10.764 -0.833 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.580 -10.842 2.376 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.113 -11.071 -0.017 1.00 0.00 H new ATOM 208 N THR A 16 -6.135 -7.658 6.106 1.00 0.00 N ATOM 209 CA THR A 16 -4.745 -7.224 6.165 1.00 0.00 C ATOM 210 C THR A 16 -3.832 -8.222 5.460 1.00 0.00 C ATOM 211 O THR A 16 -3.943 -9.432 5.664 1.00 0.00 O ATOM 212 CB THR A 16 -4.305 -7.053 7.621 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.361 -6.529 8.405 1.00 0.00 O ATOM 214 CG2 THR A 16 -3.113 -6.133 7.780 1.00 0.00 C ATOM 0 H THR A 16 -6.540 -7.900 7.010 1.00 0.00 H new ATOM 0 HA THR A 16 -4.668 -6.265 5.653 1.00 0.00 H new ATOM 0 HB THR A 16 -4.022 -8.050 7.958 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.061 -6.429 9.333 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.852 -6.055 8.835 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.266 -6.536 7.226 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.362 -5.145 7.394 1.00 0.00 H new ATOM 222 N VAL A 17 -2.932 -7.708 4.628 1.00 0.00 N ATOM 223 CA VAL A 17 -2.002 -8.553 3.891 1.00 0.00 C ATOM 224 C VAL A 17 -1.022 -9.247 4.833 1.00 0.00 C ATOM 225 O VAL A 17 -1.082 -9.065 6.049 1.00 0.00 O ATOM 226 CB VAL A 17 -1.207 -7.741 2.852 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.132 -7.205 1.771 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.450 -6.607 3.527 1.00 0.00 C ATOM 0 H VAL A 17 -2.828 -6.709 4.448 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.600 -9.304 3.375 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.480 -8.402 2.380 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.552 -6.634 1.046 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.624 -8.037 1.267 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.884 -6.559 2.223 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.106 -6.044 2.777 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.157 -5.945 4.028 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.244 -7.018 4.260 1.00 0.00 H new ATOM 238 N SER A 18 -0.124 -10.042 4.262 1.00 0.00 N ATOM 239 CA SER A 18 0.869 -10.762 5.051 1.00 0.00 C ATOM 240 C SER A 18 2.218 -10.785 4.339 1.00 0.00 C ATOM 241 O SER A 18 3.254 -10.502 4.942 1.00 0.00 O ATOM 242 CB SER A 18 0.398 -12.192 5.319 1.00 0.00 C ATOM 243 OG SER A 18 -0.288 -12.281 6.556 1.00 0.00 O ATOM 0 H SER A 18 -0.063 -10.204 3.257 1.00 0.00 H new ATOM 0 HA SER A 18 0.988 -10.241 6.001 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.258 -12.519 4.512 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.255 -12.865 5.326 1.00 0.00 H new ATOM 0 HG SER A 18 -0.580 -13.205 6.702 1.00 0.00 H new ATOM 249 N ASN A 19 2.198 -11.122 3.053 1.00 0.00 N ATOM 250 CA ASN A 19 3.421 -11.180 2.260 1.00 0.00 C ATOM 251 C ASN A 19 3.311 -10.295 1.023 1.00 0.00 C ATOM 252 O ASN A 19 2.263 -9.706 0.759 1.00 0.00 O ATOM 253 CB ASN A 19 3.715 -12.624 1.844 1.00 0.00 C ATOM 254 CG ASN A 19 2.492 -13.328 1.292 1.00 0.00 C ATOM 255 OD1 ASN A 19 1.493 -13.501 1.990 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.565 -13.743 0.032 1.00 0.00 N ATOM 0 H ASN A 19 1.350 -11.359 2.539 1.00 0.00 H new ATOM 0 HA ASN A 19 4.241 -10.811 2.876 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.504 -12.629 1.092 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.092 -13.177 2.704 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.773 -14.226 -0.393 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.413 -13.579 -0.511 1.00 0.00 H new ATOM 263 N PHE A 20 4.402 -10.207 0.267 1.00 0.00 N ATOM 264 CA PHE A 20 4.430 -9.393 -0.943 1.00 0.00 C ATOM 265 C PHE A 20 3.436 -9.917 -1.975 1.00 0.00 C ATOM 266 O PHE A 20 2.889 -9.151 -2.769 1.00 0.00 O ATOM 267 CB PHE A 20 5.840 -9.378 -1.537 1.00 0.00 C ATOM 268 CG PHE A 20 5.967 -8.521 -2.764 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.882 -7.141 -2.674 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.171 -9.096 -4.008 1.00 0.00 C ATOM 271 CE1 PHE A 20 5.999 -6.350 -3.803 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.288 -8.311 -5.139 1.00 0.00 C ATOM 273 CZ PHE A 20 6.203 -6.937 -5.036 1.00 0.00 C ATOM 0 H PHE A 20 5.277 -10.689 0.471 1.00 0.00 H new ATOM 0 HA PHE A 20 4.144 -8.376 -0.675 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.540 -9.022 -0.781 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.131 -10.399 -1.785 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.723 -6.678 -1.712 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.239 -10.170 -4.095 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.931 -5.275 -3.720 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.446 -8.772 -6.103 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.296 -6.322 -5.919 1.00 0.00 H new ATOM 283 N GLY A 21 3.207 -11.226 -1.959 1.00 0.00 N ATOM 284 CA GLY A 21 2.281 -11.829 -2.899 1.00 0.00 C ATOM 285 C GLY A 21 0.842 -11.438 -2.626 1.00 0.00 C ATOM 286 O GLY A 21 0.022 -11.380 -3.543 1.00 0.00 O ATOM 0 H GLY A 21 3.647 -11.880 -1.311 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.550 -11.530 -3.912 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.375 -12.914 -2.852 1.00 0.00 H new ATOM 290 N GLU A 22 0.533 -11.170 -1.362 1.00 0.00 N ATOM 291 CA GLU A 22 -0.818 -10.783 -0.969 1.00 0.00 C ATOM 292 C GLU A 22 -1.218 -9.465 -1.624 1.00 0.00 C ATOM 293 O GLU A 22 -2.391 -9.241 -1.926 1.00 0.00 O ATOM 294 CB GLU A 22 -0.915 -10.660 0.552 1.00 0.00 C ATOM 295 CG GLU A 22 -0.924 -11.999 1.271 1.00 0.00 C ATOM 296 CD GLU A 22 -2.282 -12.672 1.233 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.802 -12.896 0.119 1.00 0.00 O ATOM 298 OE2 GLU A 22 -2.825 -12.974 2.316 1.00 0.00 O ATOM 0 H GLU A 22 1.200 -11.214 -0.591 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.504 -11.560 -1.307 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.075 -10.068 0.915 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.823 -10.114 0.807 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.184 -12.657 0.815 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.624 -11.852 2.309 1.00 0.00 H new ATOM 305 N ILE A 23 -0.236 -8.596 -1.842 1.00 0.00 N ATOM 306 CA ILE A 23 -0.486 -7.300 -2.461 1.00 0.00 C ATOM 307 C ILE A 23 -0.725 -7.446 -3.961 1.00 0.00 C ATOM 308 O ILE A 23 0.207 -7.683 -4.727 1.00 0.00 O ATOM 309 CB ILE A 23 0.690 -6.330 -2.232 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.062 -6.284 -0.748 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.338 -4.939 -2.738 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.501 -5.892 -0.498 1.00 0.00 C ATOM 0 H ILE A 23 0.740 -8.766 -1.599 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.380 -6.891 -1.990 1.00 0.00 H new ATOM 0 HB ILE A 23 1.552 -6.692 -2.793 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.407 -5.576 -0.239 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.878 -7.263 -0.305 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.179 -4.267 -2.569 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.119 -4.985 -3.805 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.536 -4.568 -2.204 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.694 -5.880 0.575 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.163 -6.613 -0.978 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.685 -4.900 -0.911 1.00 0.00 H new ATOM 324 N SER A 24 -1.981 -7.302 -4.370 1.00 0.00 N ATOM 325 CA SER A 24 -2.342 -7.417 -5.778 1.00 0.00 C ATOM 326 C SER A 24 -3.703 -6.781 -6.044 1.00 0.00 C ATOM 327 O SER A 24 -4.652 -6.980 -5.285 1.00 0.00 O ATOM 328 CB SER A 24 -2.363 -8.887 -6.202 1.00 0.00 C ATOM 329 OG SER A 24 -1.065 -9.453 -6.142 1.00 0.00 O ATOM 0 H SER A 24 -2.765 -7.106 -3.748 1.00 0.00 H new ATOM 0 HA SER A 24 -1.591 -6.887 -6.364 1.00 0.00 H new ATOM 0 HB2 SER A 24 -3.037 -9.446 -5.554 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.753 -8.971 -7.216 1.00 0.00 H new ATOM 0 HG SER A 24 -0.410 -8.750 -5.950 1.00 0.00 H new ATOM 335 N GLY A 25 -3.790 -6.015 -7.127 1.00 0.00 N ATOM 336 CA GLY A 25 -5.038 -5.362 -7.474 1.00 0.00 C ATOM 337 C GLY A 25 -5.335 -4.169 -6.586 1.00 0.00 C ATOM 338 O GLY A 25 -4.432 -3.413 -6.228 1.00 0.00 O ATOM 0 H GLY A 25 -3.019 -5.835 -7.770 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.997 -5.036 -8.513 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.854 -6.080 -7.397 1.00 0.00 H new ATOM 342 N THR A 26 -6.604 -4.002 -6.228 1.00 0.00 N ATOM 343 CA THR A 26 -7.018 -2.894 -5.375 1.00 0.00 C ATOM 344 C THR A 26 -6.548 -3.107 -3.940 1.00 0.00 C ATOM 345 O THR A 26 -6.611 -4.217 -3.414 1.00 0.00 O ATOM 346 CB THR A 26 -8.539 -2.738 -5.408 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.997 -2.562 -6.736 1.00 0.00 O ATOM 348 CG2 THR A 26 -9.038 -1.567 -4.590 1.00 0.00 C ATOM 0 H THR A 26 -7.363 -4.620 -6.515 1.00 0.00 H new ATOM 0 HA THR A 26 -6.558 -1.983 -5.757 1.00 0.00 H new ATOM 0 HB THR A 26 -8.933 -3.657 -4.974 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.972 -2.466 -6.736 1.00 0.00 H new ATOM 0 HG21 THR A 26 -10.125 -1.513 -4.656 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.744 -1.699 -3.549 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.605 -0.644 -4.975 1.00 0.00 H new ATOM 356 N ILE A 27 -6.076 -2.034 -3.311 1.00 0.00 N ATOM 357 CA ILE A 27 -5.596 -2.105 -1.938 1.00 0.00 C ATOM 358 C ILE A 27 -5.813 -0.782 -1.211 1.00 0.00 C ATOM 359 O ILE A 27 -6.322 0.180 -1.789 1.00 0.00 O ATOM 360 CB ILE A 27 -4.099 -2.465 -1.884 1.00 0.00 C ATOM 361 CG1 ILE A 27 -3.277 -1.455 -2.685 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.875 -3.875 -2.410 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.803 -1.469 -2.346 1.00 0.00 C ATOM 0 H ILE A 27 -6.017 -1.107 -3.732 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.170 -2.889 -1.443 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.770 -2.428 -0.846 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -3.399 -1.662 -3.748 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.673 -0.455 -2.508 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.813 -4.115 -2.366 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.433 -4.584 -1.799 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.218 -3.937 -3.443 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.283 -0.727 -2.953 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.670 -1.232 -1.290 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.392 -2.458 -2.550 1.00 0.00 H new ATOM 375 N ALA A 28 -5.426 -0.739 0.059 1.00 0.00 N ATOM 376 CA ALA A 28 -5.578 0.466 0.865 1.00 0.00 C ATOM 377 C ALA A 28 -4.549 0.509 1.988 1.00 0.00 C ATOM 378 O ALA A 28 -4.223 -0.517 2.586 1.00 0.00 O ATOM 379 CB ALA A 28 -6.987 0.544 1.434 1.00 0.00 C ATOM 0 H ALA A 28 -5.004 -1.526 0.553 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.409 1.329 0.221 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.088 1.448 2.034 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.708 0.568 0.617 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.176 -0.329 2.059 1.00 0.00 H new ATOM 385 N ILE A 29 -4.038 1.703 2.271 1.00 0.00 N ATOM 386 CA ILE A 29 -3.044 1.880 3.323 1.00 0.00 C ATOM 387 C ILE A 29 -3.621 2.668 4.495 1.00 0.00 C ATOM 388 O ILE A 29 -4.382 3.616 4.305 1.00 0.00 O ATOM 389 CB ILE A 29 -1.791 2.607 2.797 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.275 1.931 1.525 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.707 2.635 3.864 1.00 0.00 C ATOM 392 CD1 ILE A 29 -0.830 2.910 0.460 1.00 0.00 C ATOM 0 H ILE A 29 -4.296 2.562 1.786 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.760 0.884 3.662 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.063 3.634 2.554 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.439 1.281 1.782 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.060 1.294 1.117 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.171 3.152 3.477 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.077 3.159 4.745 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.437 1.614 4.135 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.476 2.362 -0.413 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.670 3.544 0.175 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.023 3.530 0.850 1.00 0.00 H new ATOM 404 N GLU A 30 -3.254 2.266 5.709 1.00 0.00 N ATOM 405 CA GLU A 30 -3.734 2.935 6.912 1.00 0.00 C ATOM 406 C GLU A 30 -2.568 3.381 7.788 1.00 0.00 C ATOM 407 O GLU A 30 -1.792 2.557 8.274 1.00 0.00 O ATOM 408 CB GLU A 30 -4.655 2.004 7.704 1.00 0.00 C ATOM 409 CG GLU A 30 -5.232 2.642 8.958 1.00 0.00 C ATOM 410 CD GLU A 30 -5.971 1.647 9.831 1.00 0.00 C ATOM 411 OE1 GLU A 30 -7.118 1.292 9.489 1.00 0.00 O ATOM 412 OE2 GLU A 30 -5.401 1.222 10.859 1.00 0.00 O ATOM 0 H GLU A 30 -2.627 1.481 5.884 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.295 3.819 6.608 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.474 1.682 7.060 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.099 1.109 7.984 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.426 3.096 9.534 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -5.912 3.445 8.673 1.00 0.00 H new ATOM 419 N MET A 31 -2.449 4.690 7.986 1.00 0.00 N ATOM 420 CA MET A 31 -1.376 5.245 8.804 1.00 0.00 C ATOM 421 C MET A 31 -1.812 5.369 10.261 1.00 0.00 C ATOM 422 O MET A 31 -1.104 4.934 11.169 1.00 0.00 O ATOM 423 CB MET A 31 -0.954 6.614 8.266 1.00 0.00 C ATOM 424 CG MET A 31 -0.237 6.547 6.928 1.00 0.00 C ATOM 425 SD MET A 31 -0.147 8.148 6.106 1.00 0.00 S ATOM 426 CE MET A 31 1.201 7.867 4.961 1.00 0.00 C ATOM 0 H MET A 31 -3.082 5.386 7.592 1.00 0.00 H new ATOM 0 HA MET A 31 -0.525 4.565 8.755 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.838 7.243 8.164 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.302 7.096 8.994 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.772 6.164 7.080 1.00 0.00 H new ATOM 0 HG3 MET A 31 -0.752 5.839 6.279 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.020 8.424 4.042 1.00 0.00 H new ATOM 0 HE2 MET A 31 2.136 8.202 5.410 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.269 6.803 4.733 1.00 0.00 H new ATOM 436 N ASP A 32 -2.979 5.967 10.476 1.00 0.00 N ATOM 437 CA ASP A 32 -3.507 6.149 11.822 1.00 0.00 C ATOM 438 C ASP A 32 -4.636 5.161 12.102 1.00 0.00 C ATOM 439 O ASP A 32 -5.055 4.415 11.216 1.00 0.00 O ATOM 440 CB ASP A 32 -4.009 7.583 12.007 1.00 0.00 C ATOM 441 CG ASP A 32 -3.585 8.176 13.336 1.00 0.00 C ATOM 442 OD1 ASP A 32 -2.386 8.083 13.673 1.00 0.00 O ATOM 443 OD2 ASP A 32 -4.453 8.735 14.040 1.00 0.00 O ATOM 0 H ASP A 32 -3.577 6.334 9.735 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.700 5.961 12.530 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.629 8.205 11.197 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.097 7.596 11.937 1.00 0.00 H new ATOM 448 N LYS A 33 -5.123 5.161 13.338 1.00 0.00 N ATOM 449 CA LYS A 33 -6.203 4.266 13.734 1.00 0.00 C ATOM 450 C LYS A 33 -7.551 4.789 13.248 1.00 0.00 C ATOM 451 O LYS A 33 -8.289 5.423 14.001 1.00 0.00 O ATOM 452 CB LYS A 33 -6.225 4.100 15.255 1.00 0.00 C ATOM 453 CG LYS A 33 -4.922 3.567 15.828 1.00 0.00 C ATOM 454 CD LYS A 33 -4.993 2.069 16.075 1.00 0.00 C ATOM 455 CE LYS A 33 -4.335 1.690 17.393 1.00 0.00 C ATOM 456 NZ LYS A 33 -5.319 1.632 18.509 1.00 0.00 N ATOM 0 H LYS A 33 -4.787 5.771 14.083 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.023 3.295 13.272 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.447 5.063 15.714 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -7.035 3.423 15.527 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.105 3.785 15.140 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.697 4.081 16.763 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -6.035 1.749 16.082 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.503 1.541 15.257 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -3.846 0.721 17.289 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -3.557 2.415 17.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -4.831 1.371 19.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.767 2.563 18.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.047 0.922 18.293 1.00 0.00 H new ATOM 470 N GLY A 34 -7.865 4.519 11.985 1.00 0.00 N ATOM 471 CA GLY A 34 -9.123 4.971 11.420 1.00 0.00 C ATOM 472 C GLY A 34 -8.928 5.944 10.273 1.00 0.00 C ATOM 473 O GLY A 34 -9.721 5.970 9.332 1.00 0.00 O ATOM 0 H GLY A 34 -7.271 3.995 11.343 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.690 4.109 11.069 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.717 5.448 12.200 1.00 0.00 H new ATOM 477 N ALA A 35 -7.872 6.746 10.353 1.00 0.00 N ATOM 478 CA ALA A 35 -7.578 7.726 9.313 1.00 0.00 C ATOM 479 C ALA A 35 -6.730 7.111 8.204 1.00 0.00 C ATOM 480 O ALA A 35 -5.746 6.422 8.472 1.00 0.00 O ATOM 481 CB ALA A 35 -6.872 8.933 9.912 1.00 0.00 C ATOM 0 H ALA A 35 -7.206 6.737 11.126 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.522 8.051 8.875 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.658 9.657 9.126 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.513 9.393 10.664 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.938 8.615 10.376 1.00 0.00 H new ATOM 487 N TYR A 36 -7.121 7.364 6.959 1.00 0.00 N ATOM 488 CA TYR A 36 -6.398 6.836 5.809 1.00 0.00 C ATOM 489 C TYR A 36 -5.807 7.966 4.972 1.00 0.00 C ATOM 490 O TYR A 36 -6.049 9.143 5.241 1.00 0.00 O ATOM 491 CB TYR A 36 -7.326 5.979 4.947 1.00 0.00 C ATOM 492 CG TYR A 36 -7.869 4.763 5.664 1.00 0.00 C ATOM 493 CD1 TYR A 36 -8.736 4.899 6.742 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.514 3.481 5.264 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.233 3.790 7.400 1.00 0.00 C ATOM 496 CE2 TYR A 36 -8.008 2.368 5.917 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.867 2.528 6.984 1.00 0.00 C ATOM 498 OH TYR A 36 -9.362 1.422 7.636 1.00 0.00 O ATOM 0 H TYR A 36 -7.935 7.931 6.721 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.581 6.216 6.178 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.160 6.592 4.606 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -6.785 5.655 4.058 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.026 5.886 7.070 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.841 3.352 4.429 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -9.905 3.912 8.236 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.723 1.378 5.593 1.00 0.00 H new ATOM 0 HH TYR A 36 -8.754 1.172 8.363 1.00 0.00 H new ATOM 508 N ILE A 37 -5.031 7.600 3.957 1.00 0.00 N ATOM 509 CA ILE A 37 -4.407 8.583 3.080 1.00 0.00 C ATOM 510 C ILE A 37 -5.398 9.106 2.047 1.00 0.00 C ATOM 511 O ILE A 37 -5.857 8.364 1.179 1.00 0.00 O ATOM 512 CB ILE A 37 -3.187 7.990 2.349 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.269 7.272 3.341 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.428 9.082 1.612 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.223 6.403 2.676 1.00 0.00 C ATOM 0 H ILE A 37 -4.820 6.630 3.722 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.077 9.407 3.713 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.539 7.263 1.617 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.770 8.014 3.965 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.875 6.654 4.003 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.569 8.647 1.101 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.086 9.552 0.881 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.084 9.831 2.325 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.608 5.925 3.439 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.714 5.638 2.074 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.592 7.019 2.035 1.00 0.00 H new ATOM 527 N HIS A 38 -5.725 10.391 2.146 1.00 0.00 N ATOM 528 CA HIS A 38 -6.663 11.015 1.220 1.00 0.00 C ATOM 529 C HIS A 38 -5.922 11.751 0.108 1.00 0.00 C ATOM 530 O HIS A 38 -4.757 12.116 0.261 1.00 0.00 O ATOM 531 CB HIS A 38 -7.579 11.986 1.966 1.00 0.00 C ATOM 532 CG HIS A 38 -8.870 12.257 1.256 1.00 0.00 C ATOM 533 ND1 HIS A 38 -10.008 11.497 1.415 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.191 13.231 0.368 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.964 12.020 0.635 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.519 13.075 -0.021 1.00 0.00 N ATOM 0 H HIS A 38 -5.354 11.020 2.858 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.268 10.228 0.770 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.796 11.581 2.955 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -7.051 12.928 2.116 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.523 14.004 0.018 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.968 11.629 0.554 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.040 13.656 -0.677 1.00 0.00 H new ATOM 544 N ALA A 39 -6.606 11.964 -1.012 1.00 0.00 N ATOM 545 CA ALA A 39 -6.013 12.656 -2.150 1.00 0.00 C ATOM 546 C ALA A 39 -6.772 13.940 -2.468 1.00 0.00 C ATOM 547 O ALA A 39 -7.984 14.023 -2.268 1.00 0.00 O ATOM 548 CB ALA A 39 -5.986 11.741 -3.366 1.00 0.00 C ATOM 0 H ALA A 39 -7.571 11.667 -1.155 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.990 12.926 -1.888 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.541 12.269 -4.209 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.394 10.854 -3.141 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.003 11.444 -3.620 1.00 0.00 H new ATOM 554 N LEU A 40 -6.050 14.940 -2.963 1.00 0.00 N ATOM 555 CA LEU A 40 -6.654 16.222 -3.309 1.00 0.00 C ATOM 556 C LEU A 40 -6.580 16.471 -4.811 1.00 0.00 C ATOM 557 O LEU A 40 -5.718 15.925 -5.500 1.00 0.00 O ATOM 558 CB LEU A 40 -5.956 17.357 -2.557 1.00 0.00 C ATOM 559 CG LEU A 40 -6.297 17.454 -1.069 1.00 0.00 C ATOM 560 CD1 LEU A 40 -5.262 18.297 -0.339 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.690 18.034 -0.879 1.00 0.00 C ATOM 0 H LEU A 40 -5.046 14.887 -3.134 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.703 16.192 -3.016 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.878 17.231 -2.660 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.214 18.302 -3.036 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.282 16.450 -0.645 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.520 18.355 0.718 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.278 17.840 -0.448 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.245 19.301 -0.764 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.916 18.096 0.185 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.732 19.031 -1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.422 17.391 -1.369 1.00 0.00 H new ATOM 573 N ASP A 41 -7.490 17.300 -5.314 1.00 0.00 N ATOM 574 CA ASP A 41 -7.527 17.621 -6.735 1.00 0.00 C ATOM 575 C ASP A 41 -6.481 18.675 -7.083 1.00 0.00 C ATOM 576 O ASP A 41 -5.937 18.684 -8.188 1.00 0.00 O ATOM 577 CB ASP A 41 -8.919 18.120 -7.130 1.00 0.00 C ATOM 578 CG ASP A 41 -10.006 17.110 -6.815 1.00 0.00 C ATOM 579 OD1 ASP A 41 -10.534 17.141 -5.683 1.00 0.00 O ATOM 580 OD2 ASP A 41 -10.328 16.289 -7.698 1.00 0.00 O ATOM 0 H ASP A 41 -8.211 17.761 -4.758 1.00 0.00 H new ATOM 0 HA ASP A 41 -7.301 16.712 -7.293 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -9.130 19.052 -6.606 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.933 18.344 -8.197 1.00 0.00 H new ATOM 585 N ASN A 42 -6.203 19.561 -6.132 1.00 0.00 N ATOM 586 CA ASN A 42 -5.221 20.621 -6.337 1.00 0.00 C ATOM 587 C ASN A 42 -3.848 20.037 -6.656 1.00 0.00 C ATOM 588 O ASN A 42 -3.050 20.651 -7.364 1.00 0.00 O ATOM 589 CB ASN A 42 -5.134 21.510 -5.096 1.00 0.00 C ATOM 590 CG ASN A 42 -4.411 22.815 -5.370 1.00 0.00 C ATOM 591 OD1 ASN A 42 -5.033 23.829 -5.684 1.00 0.00 O ATOM 592 ND2 ASN A 42 -3.088 22.794 -5.250 1.00 0.00 N ATOM 0 H ASN A 42 -6.643 19.566 -5.212 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.545 21.224 -7.185 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -6.140 21.724 -4.734 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.617 20.971 -4.302 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -2.547 23.642 -5.421 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.613 21.930 -4.987 1.00 0.00 H new ATOM 599 N GLY A 43 -3.580 18.846 -6.129 1.00 0.00 N ATOM 600 CA GLY A 43 -2.302 18.199 -6.369 1.00 0.00 C ATOM 601 C GLY A 43 -1.521 17.967 -5.091 1.00 0.00 C ATOM 602 O GLY A 43 -0.293 18.059 -5.080 1.00 0.00 O ATOM 0 H GLY A 43 -4.224 18.318 -5.541 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.470 17.244 -6.867 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.709 18.813 -7.047 1.00 0.00 H new ATOM 606 N LEU A 44 -2.234 17.666 -4.010 1.00 0.00 N ATOM 607 CA LEU A 44 -1.600 17.420 -2.720 1.00 0.00 C ATOM 608 C LEU A 44 -2.195 16.187 -2.047 1.00 0.00 C ATOM 609 O LEU A 44 -3.181 15.624 -2.524 1.00 0.00 O ATOM 610 CB LEU A 44 -1.759 18.639 -1.809 1.00 0.00 C ATOM 611 CG LEU A 44 -1.323 19.969 -2.427 1.00 0.00 C ATOM 612 CD1 LEU A 44 -2.251 21.092 -1.992 1.00 0.00 C ATOM 613 CD2 LEU A 44 0.115 20.287 -2.045 1.00 0.00 C ATOM 0 H LEU A 44 -3.251 17.587 -4.002 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.539 17.240 -2.894 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.805 18.719 -1.513 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -1.182 18.472 -0.899 1.00 0.00 H new ATOM 0 HG LEU A 44 -1.380 19.879 -3.512 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.924 22.029 -2.442 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -3.268 20.870 -2.315 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -2.227 21.183 -0.906 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.409 21.236 -2.493 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.196 20.357 -0.960 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.771 19.496 -2.408 1.00 0.00 H new ATOM 625 N PHE A 45 -1.592 15.774 -0.938 1.00 0.00 N ATOM 626 CA PHE A 45 -2.064 14.608 -0.201 1.00 0.00 C ATOM 627 C PHE A 45 -2.196 14.922 1.286 1.00 0.00 C ATOM 628 O PHE A 45 -1.216 15.266 1.948 1.00 0.00 O ATOM 629 CB PHE A 45 -1.109 13.430 -0.403 1.00 0.00 C ATOM 630 CG PHE A 45 -1.468 12.561 -1.575 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.030 12.880 -2.850 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.245 11.427 -1.400 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.358 12.082 -3.929 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.577 10.626 -2.476 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.133 10.954 -3.741 1.00 0.00 C ATOM 0 H PHE A 45 -0.776 16.229 -0.530 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.048 14.339 -0.586 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.098 13.812 -0.541 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.099 12.821 0.501 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.426 13.762 -3.002 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.595 11.166 -0.412 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.009 12.340 -4.918 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.183 9.745 -2.327 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.391 10.329 -4.583 1.00 0.00 H new ATOM 645 N THR A 46 -3.413 14.799 1.806 1.00 0.00 N ATOM 646 CA THR A 46 -3.674 15.069 3.215 1.00 0.00 C ATOM 647 C THR A 46 -4.278 13.847 3.900 1.00 0.00 C ATOM 648 O THR A 46 -4.554 12.835 3.255 1.00 0.00 O ATOM 649 CB THR A 46 -4.614 16.267 3.362 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.997 16.441 4.714 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.876 16.140 2.539 1.00 0.00 C ATOM 0 H THR A 46 -4.234 14.514 1.272 1.00 0.00 H new ATOM 0 HA THR A 46 -2.724 15.301 3.696 1.00 0.00 H new ATOM 0 HB THR A 46 -4.048 17.125 2.999 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.596 17.213 4.787 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.498 17.022 2.689 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.615 16.055 1.484 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.425 15.251 2.850 1.00 0.00 H new ATOM 659 N LEU A 47 -4.480 13.948 5.209 1.00 0.00 N ATOM 660 CA LEU A 47 -5.052 12.851 5.981 1.00 0.00 C ATOM 661 C LEU A 47 -6.575 12.920 5.983 1.00 0.00 C ATOM 662 O LEU A 47 -7.165 13.827 6.571 1.00 0.00 O ATOM 663 CB LEU A 47 -4.527 12.883 7.418 1.00 0.00 C ATOM 664 CG LEU A 47 -4.533 11.535 8.140 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.532 10.584 7.506 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.230 11.723 9.619 1.00 0.00 C ATOM 0 H LEU A 47 -4.256 14.778 5.758 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.750 11.915 5.511 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.507 13.268 7.407 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.128 13.588 7.992 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.527 11.098 8.045 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.551 9.631 8.034 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.793 10.425 6.460 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.532 11.013 7.569 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.238 10.754 10.118 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.248 12.182 9.734 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.986 12.368 10.066 1.00 0.00 H new ATOM 678 N GLY A 48 -7.209 11.957 5.322 1.00 0.00 N ATOM 679 CA GLY A 48 -8.657 11.928 5.262 1.00 0.00 C ATOM 680 C GLY A 48 -9.291 11.789 6.631 1.00 0.00 C ATOM 681 O GLY A 48 -8.645 11.340 7.578 1.00 0.00 O ATOM 0 H GLY A 48 -6.744 11.196 4.827 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -9.016 12.842 4.790 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.975 11.097 4.632 1.00 0.00 H new ATOM 685 N ALA A 49 -10.558 12.176 6.738 1.00 0.00 N ATOM 686 CA ALA A 49 -11.277 12.092 8.004 1.00 0.00 C ATOM 687 C ALA A 49 -11.563 10.639 8.377 1.00 0.00 C ATOM 688 O ALA A 49 -11.870 9.818 7.514 1.00 0.00 O ATOM 689 CB ALA A 49 -12.574 12.884 7.927 1.00 0.00 C ATOM 0 H ALA A 49 -11.107 12.550 5.964 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.647 12.523 8.782 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.101 12.813 8.879 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.350 13.929 7.714 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -13.202 12.478 7.134 1.00 0.00 H new ATOM 695 N PRO A 50 -11.466 10.301 9.676 1.00 0.00 N ATOM 696 CA PRO A 50 -11.717 8.939 10.157 1.00 0.00 C ATOM 697 C PRO A 50 -13.201 8.583 10.142 1.00 0.00 C ATOM 698 O PRO A 50 -14.060 9.462 10.208 1.00 0.00 O ATOM 699 CB PRO A 50 -11.189 8.970 11.591 1.00 0.00 C ATOM 700 CG PRO A 50 -11.331 10.390 12.013 1.00 0.00 C ATOM 701 CD PRO A 50 -11.106 11.217 10.776 1.00 0.00 C ATOM 0 HA PRO A 50 -11.239 8.188 9.528 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.761 8.305 12.238 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.150 8.645 11.638 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.320 10.575 12.431 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.606 10.641 12.787 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.729 12.111 10.773 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -10.071 11.549 10.699 1.00 0.00 H new ATOM 709 N HIS A 51 -13.493 7.289 10.058 1.00 0.00 N ATOM 710 CA HIS A 51 -14.872 6.818 10.036 1.00 0.00 C ATOM 711 C HIS A 51 -15.415 6.658 11.453 1.00 0.00 C ATOM 712 O HIS A 51 -14.653 6.623 12.420 1.00 0.00 O ATOM 713 CB HIS A 51 -14.967 5.488 9.288 1.00 0.00 C ATOM 714 CG HIS A 51 -14.239 5.483 7.980 1.00 0.00 C ATOM 715 ND1 HIS A 51 -14.802 6.015 6.845 1.00 0.00 N ATOM 716 CD2 HIS A 51 -13.006 5.006 7.682 1.00 0.00 C ATOM 717 CE1 HIS A 51 -13.907 5.851 5.887 1.00 0.00 C ATOM 718 NE2 HIS A 51 -12.803 5.243 6.347 1.00 0.00 N ATOM 0 H HIS A 51 -12.793 6.549 10.004 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.476 7.562 9.517 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -14.566 4.696 9.920 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -16.017 5.254 9.111 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.317 4.531 8.364 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.046 6.166 4.864 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -11.972 5.003 5.807 1.00 0.00 H new ATOM 726 N ARG A 52 -16.735 6.561 11.568 1.00 0.00 N ATOM 727 CA ARG A 52 -17.379 6.404 12.868 1.00 0.00 C ATOM 728 C ARG A 52 -17.658 4.934 13.164 1.00 0.00 C ATOM 729 O ARG A 52 -17.385 4.449 14.261 1.00 0.00 O ATOM 730 CB ARG A 52 -18.683 7.203 12.914 1.00 0.00 C ATOM 731 CG ARG A 52 -18.475 8.708 12.916 1.00 0.00 C ATOM 732 CD ARG A 52 -18.498 9.276 11.506 1.00 0.00 C ATOM 733 NE ARG A 52 -19.204 10.554 11.442 1.00 0.00 N ATOM 734 CZ ARG A 52 -19.665 11.090 10.315 1.00 0.00 C ATOM 735 NH1 ARG A 52 -19.498 10.464 9.157 1.00 0.00 N ATOM 736 NH2 ARG A 52 -20.296 12.257 10.346 1.00 0.00 N ATOM 0 H ARG A 52 -17.380 6.588 10.778 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.700 6.786 13.630 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -19.297 6.931 12.055 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.241 6.921 13.807 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -19.253 9.183 13.513 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -17.522 8.944 13.389 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -17.476 9.408 11.152 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -18.978 8.563 10.836 1.00 0.00 H new ATOM 0 HE ARG A 52 -19.352 11.065 12.312 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -19.014 9.567 9.128 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -19.854 10.880 8.296 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -20.427 12.742 11.233 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -20.650 12.669 9.482 1.00 0.00 H new ATOM 750 N GLU A 53 -18.203 4.230 12.177 1.00 0.00 N ATOM 751 CA GLU A 53 -18.518 2.815 12.332 1.00 0.00 C ATOM 752 C GLU A 53 -17.311 1.948 11.990 1.00 0.00 C ATOM 753 O GLU A 53 -16.517 2.289 11.112 1.00 0.00 O ATOM 754 CB GLU A 53 -19.707 2.437 11.442 1.00 0.00 C ATOM 755 CG GLU A 53 -20.958 2.073 12.223 1.00 0.00 C ATOM 756 CD GLU A 53 -21.023 0.598 12.569 1.00 0.00 C ATOM 757 OE1 GLU A 53 -20.205 0.147 13.398 1.00 0.00 O ATOM 758 OE2 GLU A 53 -21.891 -0.105 12.010 1.00 0.00 O ATOM 0 H GLU A 53 -18.435 4.616 11.262 1.00 0.00 H new ATOM 0 HA GLU A 53 -18.783 2.637 13.374 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -19.933 3.271 10.778 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -19.425 1.594 10.811 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -20.992 2.659 13.141 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -21.838 2.344 11.639 1.00 0.00 H new ATOM 765 N VAL A 54 -17.178 0.826 12.689 1.00 0.00 N ATOM 766 CA VAL A 54 -16.068 -0.090 12.460 1.00 0.00 C ATOM 767 C VAL A 54 -16.249 -0.856 11.154 1.00 0.00 C ATOM 768 O VAL A 54 -15.280 -1.134 10.446 1.00 0.00 O ATOM 769 CB VAL A 54 -15.921 -1.097 13.616 1.00 0.00 C ATOM 770 CG1 VAL A 54 -14.647 -1.912 13.458 1.00 0.00 C ATOM 771 CG2 VAL A 54 -15.941 -0.377 14.957 1.00 0.00 C ATOM 0 H VAL A 54 -17.826 0.529 13.419 1.00 0.00 H new ATOM 0 HA VAL A 54 -15.165 0.517 12.401 1.00 0.00 H new ATOM 0 HB VAL A 54 -16.768 -1.783 13.585 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -14.562 -2.617 14.284 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -14.680 -2.459 12.516 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -13.785 -1.244 13.460 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -15.836 -1.104 15.762 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -15.116 0.334 15.001 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -16.885 0.156 15.070 1.00 0.00 H new ATOM 781 N ASP A 55 -17.495 -1.194 10.840 1.00 0.00 N ATOM 782 CA ASP A 55 -17.803 -1.928 9.618 1.00 0.00 C ATOM 783 C ASP A 55 -18.005 -0.972 8.446 1.00 0.00 C ATOM 784 O ASP A 55 -19.103 -0.864 7.899 1.00 0.00 O ATOM 785 CB ASP A 55 -19.054 -2.786 9.817 1.00 0.00 C ATOM 786 CG ASP A 55 -19.202 -3.850 8.746 1.00 0.00 C ATOM 787 OD1 ASP A 55 -18.349 -4.762 8.694 1.00 0.00 O ATOM 788 OD2 ASP A 55 -20.168 -3.771 7.960 1.00 0.00 O ATOM 0 H ASP A 55 -18.308 -0.971 11.415 1.00 0.00 H new ATOM 0 HA ASP A 55 -16.959 -2.578 9.390 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -19.012 -3.263 10.796 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -19.935 -2.145 9.813 1.00 0.00 H new ATOM 793 N GLU A 56 -16.936 -0.279 8.065 1.00 0.00 N ATOM 794 CA GLU A 56 -16.995 0.668 6.958 1.00 0.00 C ATOM 795 C GLU A 56 -15.678 0.689 6.190 1.00 0.00 C ATOM 796 O GLU A 56 -14.609 0.863 6.776 1.00 0.00 O ATOM 797 CB GLU A 56 -17.322 2.071 7.477 1.00 0.00 C ATOM 798 CG GLU A 56 -18.328 2.819 6.618 1.00 0.00 C ATOM 799 CD GLU A 56 -18.821 4.093 7.274 1.00 0.00 C ATOM 800 OE1 GLU A 56 -18.091 5.105 7.231 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.938 4.079 7.834 1.00 0.00 O ATOM 0 H GLU A 56 -16.020 -0.356 8.506 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.785 0.347 6.278 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -17.711 1.992 8.492 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.402 2.652 7.533 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.871 3.062 5.659 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -19.178 2.169 6.411 1.00 0.00 H new ATOM 808 N GLY A 57 -15.762 0.511 4.875 1.00 0.00 N ATOM 809 CA GLY A 57 -14.569 0.514 4.049 1.00 0.00 C ATOM 810 C GLY A 57 -14.084 1.917 3.733 1.00 0.00 C ATOM 811 O GLY A 57 -14.812 2.888 3.939 1.00 0.00 O ATOM 0 H GLY A 57 -16.635 0.365 4.367 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.777 -0.035 4.559 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -14.774 -0.014 3.118 1.00 0.00 H new ATOM 815 N PRO A 58 -12.847 2.056 3.226 1.00 0.00 N ATOM 816 CA PRO A 58 -12.276 3.363 2.884 1.00 0.00 C ATOM 817 C PRO A 58 -12.993 4.017 1.709 1.00 0.00 C ATOM 818 O PRO A 58 -13.719 3.358 0.966 1.00 0.00 O ATOM 819 CB PRO A 58 -10.826 3.037 2.511 1.00 0.00 C ATOM 820 CG PRO A 58 -10.850 1.604 2.105 1.00 0.00 C ATOM 821 CD PRO A 58 -11.909 0.953 2.947 1.00 0.00 C ATOM 0 HA PRO A 58 -12.367 4.073 3.706 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.474 3.672 1.698 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.155 3.198 3.355 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.078 1.503 1.044 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -9.879 1.136 2.268 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.397 0.134 2.418 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.494 0.537 3.865 1.00 0.00 H new ATOM 829 N SER A 59 -12.785 5.320 1.547 1.00 0.00 N ATOM 830 CA SER A 59 -13.412 6.064 0.461 1.00 0.00 C ATOM 831 C SER A 59 -12.799 5.686 -0.885 1.00 0.00 C ATOM 832 O SER A 59 -11.723 5.091 -0.941 1.00 0.00 O ATOM 833 CB SER A 59 -13.266 7.570 0.696 1.00 0.00 C ATOM 834 OG SER A 59 -13.551 7.906 2.042 1.00 0.00 O ATOM 0 H SER A 59 -12.188 5.882 2.154 1.00 0.00 H new ATOM 0 HA SER A 59 -14.471 5.806 0.442 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.252 7.884 0.446 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.940 8.112 0.032 1.00 0.00 H new ATOM 0 HG SER A 59 -12.774 7.698 2.603 1.00 0.00 H new ATOM 840 N PRO A 60 -13.480 6.028 -1.993 1.00 0.00 N ATOM 841 CA PRO A 60 -12.997 5.723 -3.342 1.00 0.00 C ATOM 842 C PRO A 60 -11.583 6.246 -3.594 1.00 0.00 C ATOM 843 O PRO A 60 -10.731 5.518 -4.107 1.00 0.00 O ATOM 844 CB PRO A 60 -14.001 6.430 -4.257 1.00 0.00 C ATOM 845 CG PRO A 60 -15.235 6.569 -3.434 1.00 0.00 C ATOM 846 CD PRO A 60 -14.770 6.742 -2.016 1.00 0.00 C ATOM 0 HA PRO A 60 -12.933 4.648 -3.510 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.627 7.403 -4.577 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -14.191 5.849 -5.159 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -15.826 7.426 -3.758 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.870 5.689 -3.532 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -14.652 7.794 -1.757 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.478 6.316 -1.305 1.00 0.00 H new ATOM 854 N PRO A 61 -11.304 7.516 -3.242 1.00 0.00 N ATOM 855 CA PRO A 61 -9.980 8.110 -3.443 1.00 0.00 C ATOM 856 C PRO A 61 -8.954 7.606 -2.433 1.00 0.00 C ATOM 857 O PRO A 61 -7.751 7.623 -2.695 1.00 0.00 O ATOM 858 CB PRO A 61 -10.232 9.605 -3.250 1.00 0.00 C ATOM 859 CG PRO A 61 -11.393 9.673 -2.320 1.00 0.00 C ATOM 860 CD PRO A 61 -12.248 8.471 -2.623 1.00 0.00 C ATOM 0 HA PRO A 61 -9.563 7.855 -4.417 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.358 10.103 -2.830 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.454 10.095 -4.198 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.061 9.662 -1.282 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -11.954 10.596 -2.465 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -12.697 8.061 -1.718 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.065 8.721 -3.299 1.00 0.00 H new ATOM 868 N GLU A 62 -9.436 7.156 -1.279 1.00 0.00 N ATOM 869 CA GLU A 62 -8.557 6.646 -0.232 1.00 0.00 C ATOM 870 C GLU A 62 -7.946 5.308 -0.640 1.00 0.00 C ATOM 871 O GLU A 62 -6.828 4.980 -0.245 1.00 0.00 O ATOM 872 CB GLU A 62 -9.329 6.488 1.079 1.00 0.00 C ATOM 873 CG GLU A 62 -9.291 7.727 1.959 1.00 0.00 C ATOM 874 CD GLU A 62 -10.193 7.607 3.172 1.00 0.00 C ATOM 875 OE1 GLU A 62 -11.118 6.769 3.144 1.00 0.00 O ATOM 876 OE2 GLU A 62 -9.974 8.352 4.150 1.00 0.00 O ATOM 0 H GLU A 62 -10.429 7.134 -1.045 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.751 7.365 -0.086 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.367 6.245 0.853 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.918 5.645 1.634 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.267 7.903 2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.591 8.595 1.372 1.00 0.00 H new ATOM 883 N GLN A 63 -8.688 4.542 -1.434 1.00 0.00 N ATOM 884 CA GLN A 63 -8.218 3.240 -1.895 1.00 0.00 C ATOM 885 C GLN A 63 -7.173 3.396 -2.993 1.00 0.00 C ATOM 886 O GLN A 63 -7.380 4.126 -3.963 1.00 0.00 O ATOM 887 CB GLN A 63 -9.393 2.405 -2.408 1.00 0.00 C ATOM 888 CG GLN A 63 -10.450 2.127 -1.352 1.00 0.00 C ATOM 889 CD GLN A 63 -11.726 1.557 -1.940 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.717 0.494 -2.561 1.00 0.00 O ATOM 891 NE2 GLN A 63 -12.833 2.264 -1.746 1.00 0.00 N ATOM 0 H GLN A 63 -9.616 4.800 -1.771 1.00 0.00 H new ATOM 0 HA GLN A 63 -7.757 2.728 -1.051 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -9.857 2.924 -3.247 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.015 1.457 -2.790 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.049 1.429 -0.617 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -10.680 3.051 -0.821 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -12.794 3.140 -1.225 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.722 1.931 -2.118 1.00 0.00 H new ATOM 900 N PHE A 64 -6.047 2.706 -2.834 1.00 0.00 N ATOM 901 CA PHE A 64 -4.968 2.768 -3.813 1.00 0.00 C ATOM 902 C PHE A 64 -4.848 1.451 -4.574 1.00 0.00 C ATOM 903 O PHE A 64 -5.173 0.386 -4.048 1.00 0.00 O ATOM 904 CB PHE A 64 -3.643 3.093 -3.123 1.00 0.00 C ATOM 905 CG PHE A 64 -3.650 4.409 -2.399 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.275 5.574 -3.048 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.034 4.480 -1.069 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.280 6.786 -2.383 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.042 5.689 -0.399 1.00 0.00 C ATOM 910 CZ PHE A 64 -3.664 6.843 -1.058 1.00 0.00 C ATOM 0 H PHE A 64 -5.859 2.098 -2.037 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.202 3.559 -4.525 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.407 2.299 -2.414 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.847 3.102 -3.868 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.975 5.535 -4.085 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.330 3.580 -0.550 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.984 7.687 -2.899 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.343 5.731 0.637 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.669 7.789 -0.537 1.00 0.00 H new ATOM 920 N THR A 65 -4.381 1.532 -5.816 1.00 0.00 N ATOM 921 CA THR A 65 -4.218 0.346 -6.650 1.00 0.00 C ATOM 922 C THR A 65 -2.779 -0.157 -6.606 1.00 0.00 C ATOM 923 O THR A 65 -1.838 0.607 -6.817 1.00 0.00 O ATOM 924 CB THR A 65 -4.619 0.654 -8.093 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.512 1.754 -8.142 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.289 -0.511 -8.790 1.00 0.00 C ATOM 0 H THR A 65 -4.109 2.406 -6.267 1.00 0.00 H new ATOM 0 HA THR A 65 -4.869 -0.436 -6.258 1.00 0.00 H new ATOM 0 HB THR A 65 -3.686 0.879 -8.610 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.109 1.657 -8.913 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.548 -0.225 -9.810 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.608 -1.362 -8.813 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.195 -0.786 -8.250 1.00 0.00 H new ATOM 934 N ALA A 66 -2.617 -1.448 -6.333 1.00 0.00 N ATOM 935 CA ALA A 66 -1.293 -2.054 -6.263 1.00 0.00 C ATOM 936 C ALA A 66 -0.886 -2.637 -7.612 1.00 0.00 C ATOM 937 O ALA A 66 -1.698 -3.251 -8.304 1.00 0.00 O ATOM 938 CB ALA A 66 -1.263 -3.131 -5.188 1.00 0.00 C ATOM 0 H ALA A 66 -3.386 -2.094 -6.157 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.576 -1.276 -6.002 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -0.269 -3.576 -5.146 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -1.503 -2.687 -4.222 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.996 -3.902 -5.425 1.00 0.00 H new ATOM 944 N VAL A 67 0.376 -2.439 -7.981 1.00 0.00 N ATOM 945 CA VAL A 67 0.889 -2.946 -9.247 1.00 0.00 C ATOM 946 C VAL A 67 2.273 -3.561 -9.076 1.00 0.00 C ATOM 947 O VAL A 67 3.238 -2.865 -8.759 1.00 0.00 O ATOM 948 CB VAL A 67 0.964 -1.831 -10.308 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.307 -2.413 -11.671 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.345 -1.057 -10.365 1.00 0.00 C ATOM 0 H VAL A 67 1.061 -1.931 -7.421 1.00 0.00 H new ATOM 0 HA VAL A 67 0.193 -3.715 -9.584 1.00 0.00 H new ATOM 0 HB VAL A 67 1.756 -1.138 -10.024 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.356 -1.611 -12.407 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.272 -2.917 -11.619 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.539 -3.129 -11.965 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.272 -0.274 -11.120 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.158 -1.736 -10.623 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.544 -0.606 -9.393 1.00 0.00 H new ATOM 960 N LYS A 68 2.364 -4.870 -9.290 1.00 0.00 N ATOM 961 CA LYS A 68 3.632 -5.579 -9.160 1.00 0.00 C ATOM 962 C LYS A 68 4.595 -5.169 -10.269 1.00 0.00 C ATOM 963 O LYS A 68 4.190 -4.966 -11.412 1.00 0.00 O ATOM 964 CB LYS A 68 3.401 -7.090 -9.202 1.00 0.00 C ATOM 965 CG LYS A 68 3.043 -7.689 -7.851 1.00 0.00 C ATOM 966 CD LYS A 68 3.288 -9.189 -7.825 1.00 0.00 C ATOM 967 CE LYS A 68 4.774 -9.514 -7.801 1.00 0.00 C ATOM 968 NZ LYS A 68 5.152 -10.465 -8.882 1.00 0.00 N ATOM 0 H LYS A 68 1.575 -5.461 -9.554 1.00 0.00 H new ATOM 0 HA LYS A 68 4.075 -5.314 -8.200 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.601 -7.307 -9.910 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.301 -7.576 -9.579 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.634 -7.209 -7.071 1.00 0.00 H new ATOM 0 HG3 LYS A 68 1.996 -7.486 -7.628 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.806 -9.622 -6.948 1.00 0.00 H new ATOM 0 HD3 LYS A 68 2.829 -9.648 -8.700 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.349 -8.594 -7.910 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.037 -9.941 -6.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.172 -10.661 -8.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.623 -11.353 -8.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 4.925 -10.047 -9.807 1.00 0.00 H new ATOM 982 N LEU A 69 5.874 -5.049 -9.922 1.00 0.00 N ATOM 983 CA LEU A 69 6.893 -4.664 -10.891 1.00 0.00 C ATOM 984 C LEU A 69 8.032 -5.679 -10.921 1.00 0.00 C ATOM 985 O LEU A 69 8.129 -6.488 -11.843 1.00 0.00 O ATOM 986 CB LEU A 69 7.437 -3.271 -10.563 1.00 0.00 C ATOM 987 CG LEU A 69 6.393 -2.154 -10.551 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.808 -1.045 -9.596 1.00 0.00 C ATOM 989 CD2 LEU A 69 6.187 -1.604 -11.955 1.00 0.00 C ATOM 0 H LEU A 69 6.227 -5.213 -8.979 1.00 0.00 H new ATOM 0 HA LEU A 69 6.430 -4.642 -11.878 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.919 -3.307 -9.586 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.208 -3.019 -11.290 1.00 0.00 H new ATOM 0 HG LEU A 69 5.447 -2.569 -10.202 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.053 -0.259 -9.601 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.904 -1.450 -8.588 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.765 -0.631 -9.913 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.441 -0.810 -11.929 1.00 0.00 H new ATOM 0 HD22 LEU A 69 7.129 -1.205 -12.331 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.843 -2.403 -12.612 1.00 0.00 H new ATOM 1001 N SER A 70 8.891 -5.632 -9.907 1.00 0.00 N ATOM 1002 CA SER A 70 10.023 -6.550 -9.820 1.00 0.00 C ATOM 1003 C SER A 70 10.847 -6.280 -8.565 1.00 0.00 C ATOM 1004 O SER A 70 10.785 -5.191 -7.994 1.00 0.00 O ATOM 1005 CB SER A 70 10.909 -6.423 -11.061 1.00 0.00 C ATOM 1006 OG SER A 70 11.110 -5.064 -11.408 1.00 0.00 O ATOM 0 H SER A 70 8.825 -4.969 -9.135 1.00 0.00 H new ATOM 0 HA SER A 70 9.630 -7.565 -9.765 1.00 0.00 H new ATOM 0 HB2 SER A 70 11.871 -6.900 -10.875 1.00 0.00 H new ATOM 0 HB3 SER A 70 10.448 -6.950 -11.896 1.00 0.00 H new ATOM 0 HG SER A 70 11.680 -5.010 -12.203 1.00 0.00 H new ATOM 1012 N ASP A 71 11.619 -7.276 -8.143 1.00 0.00 N ATOM 1013 CA ASP A 71 12.457 -7.145 -6.956 1.00 0.00 C ATOM 1014 C ASP A 71 11.617 -6.801 -5.729 1.00 0.00 C ATOM 1015 O ASP A 71 12.017 -5.986 -4.898 1.00 0.00 O ATOM 1016 CB ASP A 71 13.523 -6.070 -7.177 1.00 0.00 C ATOM 1017 CG ASP A 71 14.760 -6.615 -7.863 1.00 0.00 C ATOM 1018 OD1 ASP A 71 14.799 -6.607 -9.112 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.691 -7.050 -7.153 1.00 0.00 O ATOM 0 H ASP A 71 11.682 -8.183 -8.605 1.00 0.00 H new ATOM 0 HA ASP A 71 12.946 -8.103 -6.780 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.103 -5.264 -7.778 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.804 -5.638 -6.217 1.00 0.00 H new ATOM 1024 N SER A 72 10.450 -7.429 -5.623 1.00 0.00 N ATOM 1025 CA SER A 72 9.553 -7.191 -4.498 1.00 0.00 C ATOM 1026 C SER A 72 9.111 -5.731 -4.453 1.00 0.00 C ATOM 1027 O SER A 72 8.865 -5.179 -3.381 1.00 0.00 O ATOM 1028 CB SER A 72 10.240 -7.568 -3.183 1.00 0.00 C ATOM 1029 OG SER A 72 10.644 -8.926 -3.189 1.00 0.00 O ATOM 0 H SER A 72 10.104 -8.106 -6.302 1.00 0.00 H new ATOM 0 HA SER A 72 8.670 -7.815 -4.632 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.108 -6.928 -3.026 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.559 -7.392 -2.350 1.00 0.00 H new ATOM 0 HG SER A 72 11.082 -9.141 -2.339 1.00 0.00 H new ATOM 1035 N ARG A 73 9.012 -5.112 -5.625 1.00 0.00 N ATOM 1036 CA ARG A 73 8.598 -3.716 -5.719 1.00 0.00 C ATOM 1037 C ARG A 73 7.190 -3.605 -6.293 1.00 0.00 C ATOM 1038 O ARG A 73 6.815 -4.355 -7.194 1.00 0.00 O ATOM 1039 CB ARG A 73 9.581 -2.930 -6.589 1.00 0.00 C ATOM 1040 CG ARG A 73 11.024 -3.032 -6.122 1.00 0.00 C ATOM 1041 CD ARG A 73 11.242 -2.287 -4.815 1.00 0.00 C ATOM 1042 NE ARG A 73 11.165 -0.838 -4.992 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.159 -0.097 -5.480 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.303 -0.663 -5.840 1.00 0.00 N ATOM 1045 NH2 ARG A 73 12.006 1.214 -5.606 1.00 0.00 N ATOM 0 H ARG A 73 9.212 -5.554 -6.522 1.00 0.00 H new ATOM 0 HA ARG A 73 8.595 -3.294 -4.714 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.514 -3.291 -7.615 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.285 -1.881 -6.600 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.292 -4.081 -5.993 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.685 -2.626 -6.888 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.494 -2.604 -4.088 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.217 -2.551 -4.405 1.00 0.00 H new ATOM 0 HE ARG A 73 10.300 -0.367 -4.727 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.426 -1.671 -5.744 1.00 0.00 H new ATOM 0 HH12 ARG A 73 14.060 -0.090 -6.213 1.00 0.00 H new ATOM 0 HH21 ARG A 73 11.128 1.654 -5.329 1.00 0.00 H new ATOM 0 HH22 ARG A 73 12.766 1.783 -5.979 1.00 0.00 H new ATOM 1059 N ILE A 74 6.416 -2.662 -5.767 1.00 0.00 N ATOM 1060 CA ILE A 74 5.047 -2.452 -6.228 1.00 0.00 C ATOM 1061 C ILE A 74 4.767 -0.971 -6.456 1.00 0.00 C ATOM 1062 O ILE A 74 5.301 -0.112 -5.756 1.00 0.00 O ATOM 1063 CB ILE A 74 4.022 -3.007 -5.221 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.360 -2.540 -3.804 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.983 -4.527 -5.288 1.00 0.00 C ATOM 1066 CD1 ILE A 74 3.220 -2.708 -2.824 1.00 0.00 C ATOM 0 H ILE A 74 6.712 -2.031 -5.022 1.00 0.00 H new ATOM 0 HA ILE A 74 4.945 -2.989 -7.171 1.00 0.00 H new ATOM 0 HB ILE A 74 3.035 -2.625 -5.483 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.224 -3.098 -3.443 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.649 -1.490 -3.836 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.254 -4.904 -4.571 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.699 -4.840 -6.293 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.968 -4.927 -5.049 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.531 -2.356 -1.840 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.361 -2.128 -3.162 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.945 -3.761 -2.763 1.00 0.00 H new ATOM 1078 N ALA A 75 3.923 -0.679 -7.442 1.00 0.00 N ATOM 1079 CA ALA A 75 3.571 0.698 -7.763 1.00 0.00 C ATOM 1080 C ALA A 75 2.166 1.034 -7.274 1.00 0.00 C ATOM 1081 O ALA A 75 1.216 0.294 -7.531 1.00 0.00 O ATOM 1082 CB ALA A 75 3.681 0.935 -9.263 1.00 0.00 C ATOM 0 H ALA A 75 3.471 -1.378 -8.031 1.00 0.00 H new ATOM 0 HA ALA A 75 4.273 1.355 -7.250 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.415 1.968 -9.489 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.704 0.744 -9.587 1.00 0.00 H new ATOM 0 HB3 ALA A 75 3.003 0.263 -9.788 1.00 0.00 H new ATOM 1088 N LEU A 76 2.042 2.153 -6.569 1.00 0.00 N ATOM 1089 CA LEU A 76 0.753 2.587 -6.043 1.00 0.00 C ATOM 1090 C LEU A 76 0.062 3.539 -7.014 1.00 0.00 C ATOM 1091 O LEU A 76 0.710 4.165 -7.852 1.00 0.00 O ATOM 1092 CB LEU A 76 0.934 3.268 -4.686 1.00 0.00 C ATOM 1093 CG LEU A 76 1.621 2.415 -3.619 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.997 3.266 -2.416 1.00 0.00 C ATOM 1095 CD2 LEU A 76 0.720 1.263 -3.198 1.00 0.00 C ATOM 0 H LEU A 76 2.819 2.776 -6.348 1.00 0.00 H new ATOM 0 HA LEU A 76 0.125 1.705 -5.918 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.514 4.180 -4.829 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.046 3.568 -4.314 1.00 0.00 H new ATOM 0 HG LEU A 76 2.535 2.000 -4.045 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.485 2.642 -1.667 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.678 4.057 -2.729 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.098 3.710 -1.989 1.00 0.00 H new ATOM 0 HD21 LEU A 76 1.224 0.666 -2.438 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -0.210 1.659 -2.790 1.00 0.00 H new ATOM 0 HD23 LEU A 76 0.500 0.638 -4.064 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.257 3.644 -6.894 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.037 4.520 -7.759 1.00 0.00 C ATOM 1109 C LYS A 77 -3.152 5.205 -6.975 1.00 0.00 C ATOM 1110 O LYS A 77 -3.725 4.623 -6.055 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.631 3.727 -8.925 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.332 4.596 -9.956 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.043 3.754 -11.004 1.00 0.00 C ATOM 1114 CE LYS A 77 -5.529 3.634 -10.710 1.00 0.00 C ATOM 1115 NZ LYS A 77 -6.342 4.525 -11.584 1.00 0.00 N ATOM 0 H LYS A 77 -1.808 3.132 -6.205 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.370 5.286 -8.154 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.835 3.166 -9.415 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.340 2.998 -8.534 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.053 5.244 -9.458 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.604 5.245 -10.442 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.901 4.201 -11.988 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.597 2.760 -11.037 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -5.845 2.600 -10.851 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.714 3.884 -9.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.977 5.102 -10.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -5.711 5.149 -12.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.906 3.947 -12.240 1.00 0.00 H new ATOM 1129 N SER A 78 -3.453 6.446 -7.345 1.00 0.00 N ATOM 1130 CA SER A 78 -4.500 7.209 -6.676 1.00 0.00 C ATOM 1131 C SER A 78 -5.874 6.857 -7.236 1.00 0.00 C ATOM 1132 O SER A 78 -5.998 6.435 -8.385 1.00 0.00 O ATOM 1133 CB SER A 78 -4.244 8.710 -6.831 1.00 0.00 C ATOM 1134 OG SER A 78 -4.574 9.152 -8.136 1.00 0.00 O ATOM 0 H SER A 78 -2.987 6.944 -8.104 1.00 0.00 H new ATOM 0 HA SER A 78 -4.482 6.950 -5.617 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.833 9.260 -6.098 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.196 8.926 -6.625 1.00 0.00 H new ATOM 0 HG SER A 78 -4.713 10.122 -8.127 1.00 0.00 H new ATOM 1140 N GLY A 79 -6.904 7.033 -6.415 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.255 6.729 -6.846 1.00 0.00 C ATOM 1142 C GLY A 79 -8.679 7.548 -8.050 1.00 0.00 C ATOM 1143 O GLY A 79 -9.504 7.108 -8.850 1.00 0.00 O ATOM 0 H GLY A 79 -6.827 7.381 -5.459 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.325 5.669 -7.089 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.946 6.914 -6.023 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.111 8.742 -8.179 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.433 9.626 -9.293 1.00 0.00 C ATOM 1149 C TYR A 80 -7.799 9.125 -10.587 1.00 0.00 C ATOM 1150 O TYR A 80 -8.468 9.006 -11.612 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.957 11.050 -8.997 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.761 11.747 -7.923 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -8.504 11.517 -6.577 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -9.777 12.635 -8.254 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -9.236 12.153 -5.592 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -10.514 13.273 -7.275 1.00 0.00 C ATOM 1157 CZ TYR A 80 -10.239 13.029 -5.946 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.970 13.664 -4.968 1.00 0.00 O ATOM 0 H TYR A 80 -7.425 9.120 -7.526 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.516 9.631 -9.418 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.911 11.018 -8.693 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -8.005 11.638 -9.914 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -7.719 10.830 -6.296 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -9.994 12.830 -9.294 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -9.023 11.964 -4.550 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -11.301 13.959 -7.549 1.00 0.00 H new ATOM 0 HH TYR A 80 -11.637 14.248 -5.385 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.504 8.833 -10.529 1.00 0.00 N ATOM 1169 CA GLY A 81 -5.800 8.348 -11.702 1.00 0.00 C ATOM 1170 C GLY A 81 -4.396 8.909 -11.811 1.00 0.00 C ATOM 1171 O GLY A 81 -4.023 9.470 -12.841 1.00 0.00 O ATOM 0 H GLY A 81 -5.929 8.923 -9.691 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.751 7.260 -11.668 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.364 8.614 -12.596 1.00 0.00 H new ATOM 1175 N LYS A 82 -3.616 8.757 -10.746 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.244 9.252 -10.726 1.00 0.00 C ATOM 1177 C LYS A 82 -1.356 8.359 -9.867 1.00 0.00 C ATOM 1178 O LYS A 82 -1.741 7.955 -8.769 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.206 10.688 -10.200 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.464 11.734 -11.272 1.00 0.00 C ATOM 1181 CD LYS A 82 -2.937 13.046 -10.667 1.00 0.00 C ATOM 1182 CE LYS A 82 -3.886 13.780 -11.601 1.00 0.00 C ATOM 1183 NZ LYS A 82 -5.308 13.432 -11.332 1.00 0.00 N ATOM 0 H LYS A 82 -3.910 8.295 -9.885 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.863 9.237 -11.747 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -2.950 10.797 -9.411 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.232 10.875 -9.748 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.552 11.904 -11.844 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.214 11.363 -11.971 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.437 12.851 -9.718 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.077 13.679 -10.450 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.748 14.855 -11.488 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.641 13.534 -12.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.923 13.953 -11.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.446 12.410 -11.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.549 13.690 -10.354 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.166 8.054 -10.373 1.00 0.00 N ATOM 1198 CA TYR A 83 0.778 7.207 -9.652 1.00 0.00 C ATOM 1199 C TYR A 83 1.399 7.959 -8.479 1.00 0.00 C ATOM 1200 O TYR A 83 1.940 9.052 -8.646 1.00 0.00 O ATOM 1201 CB TYR A 83 1.876 6.714 -10.596 1.00 0.00 C ATOM 1202 CG TYR A 83 1.432 5.589 -11.505 1.00 0.00 C ATOM 1203 CD1 TYR A 83 1.283 4.296 -11.018 1.00 0.00 C ATOM 1204 CD2 TYR A 83 1.163 5.821 -12.848 1.00 0.00 C ATOM 1205 CE1 TYR A 83 0.877 3.266 -11.846 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.757 4.796 -13.681 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.615 3.520 -13.175 1.00 0.00 C ATOM 1208 OH TYR A 83 0.212 2.497 -14.001 1.00 0.00 O ATOM 0 H TYR A 83 0.168 8.381 -11.280 1.00 0.00 H new ATOM 0 HA TYR A 83 0.232 6.349 -9.261 1.00 0.00 H new ATOM 0 HB2 TYR A 83 2.221 7.549 -11.206 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.728 6.378 -10.005 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.487 4.093 -9.977 1.00 0.00 H new ATOM 0 HD2 TYR A 83 1.273 6.818 -13.247 1.00 0.00 H new ATOM 0 HE1 TYR A 83 0.766 2.266 -11.453 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.552 4.993 -14.723 1.00 0.00 H new ATOM 0 HH TYR A 83 0.068 2.845 -14.906 1.00 0.00 H new ATOM 1218 N LEU A 84 1.317 7.366 -7.293 1.00 0.00 N ATOM 1219 CA LEU A 84 1.871 7.978 -6.091 1.00 0.00 C ATOM 1220 C LEU A 84 3.385 8.122 -6.202 1.00 0.00 C ATOM 1221 O LEU A 84 4.117 7.133 -6.172 1.00 0.00 O ATOM 1222 CB LEU A 84 1.515 7.145 -4.858 1.00 0.00 C ATOM 1223 CG LEU A 84 0.031 7.137 -4.488 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.249 6.094 -3.415 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.408 8.518 -4.023 1.00 0.00 C ATOM 0 H LEU A 84 0.872 6.461 -7.138 1.00 0.00 H new ATOM 0 HA LEU A 84 1.436 8.972 -5.987 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.837 6.118 -5.027 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.084 7.521 -4.008 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.544 6.874 -5.376 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.310 6.104 -3.166 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.027 5.107 -3.786 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.335 6.323 -2.524 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.466 8.495 -3.764 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.174 8.809 -3.149 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.246 9.240 -4.823 1.00 0.00 H new ATOM 1237 N GLY A 85 3.848 9.362 -6.331 1.00 0.00 N ATOM 1238 CA GLY A 85 5.272 9.614 -6.443 1.00 0.00 C ATOM 1239 C GLY A 85 5.794 10.504 -5.332 1.00 0.00 C ATOM 1240 O GLY A 85 5.055 11.320 -4.783 1.00 0.00 O ATOM 0 H GLY A 85 3.262 10.196 -6.360 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.808 8.665 -6.426 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.480 10.080 -7.406 1.00 0.00 H new ATOM 1244 N ILE A 86 7.071 10.344 -4.999 1.00 0.00 N ATOM 1245 CA ILE A 86 7.690 11.139 -3.945 1.00 0.00 C ATOM 1246 C ILE A 86 8.391 12.364 -4.521 1.00 0.00 C ATOM 1247 O ILE A 86 8.817 12.363 -5.676 1.00 0.00 O ATOM 1248 CB ILE A 86 8.711 10.310 -3.142 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.790 9.749 -4.070 1.00 0.00 C ATOM 1250 CG2 ILE A 86 8.009 9.184 -2.396 1.00 0.00 C ATOM 1251 CD1 ILE A 86 10.998 9.211 -3.334 1.00 0.00 C ATOM 0 H ILE A 86 7.696 9.672 -5.443 1.00 0.00 H new ATOM 0 HA ILE A 86 6.889 11.460 -3.280 1.00 0.00 H new ATOM 0 HB ILE A 86 9.190 10.961 -2.411 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.359 8.952 -4.676 1.00 0.00 H new ATOM 0 HG13 ILE A 86 10.111 10.533 -4.756 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.743 8.607 -1.833 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.275 9.605 -1.709 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.506 8.532 -3.110 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.722 8.829 -4.054 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.454 10.010 -2.749 1.00 0.00 H new ATOM 0 HD13 ILE A 86 10.689 8.405 -2.668 1.00 0.00 H new ATOM 1263 N ASN A 87 8.506 13.409 -3.709 1.00 0.00 N ATOM 1264 CA ASN A 87 9.157 14.642 -4.138 1.00 0.00 C ATOM 1265 C ASN A 87 10.635 14.639 -3.760 1.00 0.00 C ATOM 1266 O ASN A 87 11.129 13.684 -3.159 1.00 0.00 O ATOM 1267 CB ASN A 87 8.462 15.854 -3.513 1.00 0.00 C ATOM 1268 CG ASN A 87 7.380 16.425 -4.409 1.00 0.00 C ATOM 1269 OD1 ASN A 87 7.370 16.190 -5.618 1.00 0.00 O ATOM 1270 ND2 ASN A 87 6.461 17.182 -3.819 1.00 0.00 N ATOM 0 H ASN A 87 8.157 13.427 -2.751 1.00 0.00 H new ATOM 0 HA ASN A 87 9.079 14.705 -5.223 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.024 15.566 -2.557 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.202 16.626 -3.304 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.709 17.594 -4.371 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.508 17.351 -2.814 1.00 0.00 H new ATOM 1277 N SER A 88 11.334 15.711 -4.117 1.00 0.00 N ATOM 1278 CA SER A 88 12.756 15.830 -3.816 1.00 0.00 C ATOM 1279 C SER A 88 12.975 16.162 -2.343 1.00 0.00 C ATOM 1280 O SER A 88 13.914 15.669 -1.719 1.00 0.00 O ATOM 1281 CB SER A 88 13.396 16.906 -4.694 1.00 0.00 C ATOM 1282 OG SER A 88 12.909 16.837 -6.023 1.00 0.00 O ATOM 0 H SER A 88 10.940 16.509 -4.615 1.00 0.00 H new ATOM 0 HA SER A 88 13.228 14.870 -4.027 1.00 0.00 H new ATOM 0 HB2 SER A 88 13.187 17.891 -4.278 1.00 0.00 H new ATOM 0 HB3 SER A 88 14.479 16.783 -4.694 1.00 0.00 H new ATOM 0 HG SER A 88 13.332 17.536 -6.563 1.00 0.00 H new ATOM 1288 N ASP A 89 12.103 17.002 -1.796 1.00 0.00 N ATOM 1289 CA ASP A 89 12.201 17.401 -0.396 1.00 0.00 C ATOM 1290 C ASP A 89 11.858 16.236 0.527 1.00 0.00 C ATOM 1291 O ASP A 89 12.512 16.027 1.548 1.00 0.00 O ATOM 1292 CB ASP A 89 11.269 18.581 -0.114 1.00 0.00 C ATOM 1293 CG ASP A 89 11.794 19.882 -0.690 1.00 0.00 C ATOM 1294 OD1 ASP A 89 11.892 19.985 -1.931 1.00 0.00 O ATOM 1295 OD2 ASP A 89 12.108 20.797 0.100 1.00 0.00 O ATOM 0 H ASP A 89 11.321 17.420 -2.300 1.00 0.00 H new ATOM 0 HA ASP A 89 13.230 17.705 -0.202 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.285 18.372 -0.534 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.140 18.689 0.963 1.00 0.00 H new ATOM 1300 N GLY A 90 10.827 15.482 0.161 1.00 0.00 N ATOM 1301 CA GLY A 90 10.414 14.348 0.968 1.00 0.00 C ATOM 1302 C GLY A 90 8.923 14.340 1.237 1.00 0.00 C ATOM 1303 O GLY A 90 8.489 14.080 2.359 1.00 0.00 O ATOM 0 H GLY A 90 10.270 15.635 -0.680 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.693 13.424 0.461 1.00 0.00 H new ATOM 0 HA3 GLY A 90 10.951 14.366 1.916 1.00 0.00 H new ATOM 1307 N LEU A 91 8.135 14.625 0.205 1.00 0.00 N ATOM 1308 CA LEU A 91 6.683 14.651 0.335 1.00 0.00 C ATOM 1309 C LEU A 91 6.028 13.751 -0.708 1.00 0.00 C ATOM 1310 O LEU A 91 6.340 13.833 -1.896 1.00 0.00 O ATOM 1311 CB LEU A 91 6.162 16.082 0.190 1.00 0.00 C ATOM 1312 CG LEU A 91 4.690 16.274 0.562 1.00 0.00 C ATOM 1313 CD1 LEU A 91 4.557 16.682 2.021 1.00 0.00 C ATOM 1314 CD2 LEU A 91 4.043 17.312 -0.343 1.00 0.00 C ATOM 0 H LEU A 91 8.478 14.841 -0.731 1.00 0.00 H new ATOM 0 HA LEU A 91 6.425 14.277 1.326 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.768 16.738 0.815 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.305 16.402 -0.842 1.00 0.00 H new ATOM 0 HG LEU A 91 4.173 15.325 0.422 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.503 16.814 2.267 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.984 15.906 2.656 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.088 17.619 2.187 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.997 17.436 -0.064 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.563 18.264 -0.234 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.106 16.981 -1.380 1.00 0.00 H new ATOM 1326 N VAL A 92 5.119 12.895 -0.256 1.00 0.00 N ATOM 1327 CA VAL A 92 4.419 11.980 -1.151 1.00 0.00 C ATOM 1328 C VAL A 92 3.303 12.697 -1.904 1.00 0.00 C ATOM 1329 O VAL A 92 2.374 13.229 -1.297 1.00 0.00 O ATOM 1330 CB VAL A 92 3.821 10.787 -0.382 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.232 9.768 -1.345 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.873 10.142 0.509 1.00 0.00 C ATOM 0 H VAL A 92 4.849 12.815 0.724 1.00 0.00 H new ATOM 0 HA VAL A 92 5.156 11.609 -1.863 1.00 0.00 H new ATOM 0 HB VAL A 92 3.017 11.158 0.254 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.815 8.933 -0.781 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.444 10.237 -1.935 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.014 9.402 -2.010 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.431 9.301 1.044 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.701 9.787 -0.104 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.241 10.875 1.227 1.00 0.00 H new ATOM 1342 N VAL A 93 3.403 12.707 -3.230 1.00 0.00 N ATOM 1343 CA VAL A 93 2.402 13.358 -4.065 1.00 0.00 C ATOM 1344 C VAL A 93 1.968 12.452 -5.212 1.00 0.00 C ATOM 1345 O VAL A 93 2.457 11.330 -5.348 1.00 0.00 O ATOM 1346 CB VAL A 93 2.931 14.683 -4.646 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.040 15.739 -3.558 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.273 14.468 -5.329 1.00 0.00 C ATOM 0 H VAL A 93 4.167 12.272 -3.748 1.00 0.00 H new ATOM 0 HA VAL A 93 1.544 13.566 -3.425 1.00 0.00 H new ATOM 0 HB VAL A 93 2.222 15.039 -5.394 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.415 16.667 -3.988 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.057 15.913 -3.120 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.726 15.395 -2.784 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.631 15.415 -5.733 1.00 0.00 H new ATOM 0 HG22 VAL A 93 4.993 14.087 -4.605 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.158 13.748 -6.139 1.00 0.00 H new ATOM 1358 N GLY A 94 1.048 12.944 -6.035 1.00 0.00 N ATOM 1359 CA GLY A 94 0.565 12.164 -7.159 1.00 0.00 C ATOM 1360 C GLY A 94 0.176 13.031 -8.341 1.00 0.00 C ATOM 1361 O GLY A 94 -0.993 13.380 -8.505 1.00 0.00 O ATOM 0 H GLY A 94 0.628 13.869 -5.944 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.338 11.460 -7.467 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.297 11.575 -6.845 1.00 0.00 H new ATOM 1365 N ARG A 95 1.158 13.379 -9.166 1.00 0.00 N ATOM 1366 CA ARG A 95 0.913 14.211 -10.338 1.00 0.00 C ATOM 1367 C ARG A 95 1.661 13.671 -11.553 1.00 0.00 C ATOM 1368 O ARG A 95 2.080 14.432 -12.424 1.00 0.00 O ATOM 1369 CB ARG A 95 1.337 15.655 -10.063 1.00 0.00 C ATOM 1370 CG ARG A 95 0.714 16.243 -8.807 1.00 0.00 C ATOM 1371 CD ARG A 95 0.014 17.562 -9.093 1.00 0.00 C ATOM 1372 NE ARG A 95 0.865 18.484 -9.840 1.00 0.00 N ATOM 1373 CZ ARG A 95 0.585 19.775 -10.015 1.00 0.00 C ATOM 1374 NH1 ARG A 95 -0.519 20.297 -9.498 1.00 0.00 N ATOM 1375 NH2 ARG A 95 1.414 20.544 -10.709 1.00 0.00 N ATOM 0 H ARG A 95 2.131 13.098 -9.044 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.156 14.189 -10.552 1.00 0.00 H new ATOM 0 HB2 ARG A 95 2.423 15.695 -9.973 1.00 0.00 H new ATOM 0 HB3 ARG A 95 1.065 16.274 -10.918 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -0.001 15.534 -8.389 1.00 0.00 H new ATOM 0 HG3 ARG A 95 1.487 16.397 -8.054 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -0.899 17.373 -9.658 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -0.284 18.025 -8.152 1.00 0.00 H new ATOM 0 HE ARG A 95 1.724 18.119 -10.252 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -1.159 19.710 -8.963 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -0.728 21.286 -9.635 1.00 0.00 H new ATOM 0 HH21 ARG A 95 2.265 20.147 -11.108 1.00 0.00 H new ATOM 0 HH22 ARG A 95 1.201 21.532 -10.844 1.00 0.00 H new ATOM 1389 N SER A 96 1.824 12.354 -11.604 1.00 0.00 N ATOM 1390 CA SER A 96 2.521 11.711 -12.712 1.00 0.00 C ATOM 1391 C SER A 96 1.856 10.390 -13.083 1.00 0.00 C ATOM 1392 O SER A 96 1.583 9.558 -12.218 1.00 0.00 O ATOM 1393 CB SER A 96 3.988 11.474 -12.348 1.00 0.00 C ATOM 1394 OG SER A 96 4.771 12.627 -12.602 1.00 0.00 O ATOM 0 H SER A 96 1.483 11.710 -10.890 1.00 0.00 H new ATOM 0 HA SER A 96 2.470 12.375 -13.575 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.065 11.203 -11.295 1.00 0.00 H new ATOM 0 HB3 SER A 96 4.377 10.633 -12.922 1.00 0.00 H new ATOM 0 HG SER A 96 4.191 13.417 -12.630 1.00 0.00 H new ATOM 1400 N ASP A 97 1.600 10.205 -14.373 1.00 0.00 N ATOM 1401 CA ASP A 97 0.966 8.984 -14.860 1.00 0.00 C ATOM 1402 C ASP A 97 2.001 8.034 -15.455 1.00 0.00 C ATOM 1403 O ASP A 97 1.709 7.290 -16.391 1.00 0.00 O ATOM 1404 CB ASP A 97 -0.098 9.319 -15.907 1.00 0.00 C ATOM 1405 CG ASP A 97 -1.405 9.764 -15.281 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -1.366 10.619 -14.370 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -2.467 9.259 -15.700 1.00 0.00 O ATOM 0 H ASP A 97 1.821 10.884 -15.101 1.00 0.00 H new ATOM 0 HA ASP A 97 0.489 8.489 -14.014 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.275 10.107 -16.561 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.277 8.444 -16.532 1.00 0.00 H new ATOM 1412 N ALA A 98 3.211 8.065 -14.905 1.00 0.00 N ATOM 1413 CA ALA A 98 4.289 7.207 -15.382 1.00 0.00 C ATOM 1414 C ALA A 98 4.911 6.419 -14.235 1.00 0.00 C ATOM 1415 O ALA A 98 4.919 6.871 -13.090 1.00 0.00 O ATOM 1416 CB ALA A 98 5.349 8.036 -16.090 1.00 0.00 C ATOM 0 H ALA A 98 3.469 8.675 -14.129 1.00 0.00 H new ATOM 0 HA ALA A 98 3.867 6.495 -16.091 1.00 0.00 H new ATOM 0 HB1 ALA A 98 6.148 7.382 -16.441 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.901 8.550 -16.940 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.759 8.771 -15.397 1.00 0.00 H new ATOM 1422 N ILE A 99 5.433 5.238 -14.550 1.00 0.00 N ATOM 1423 CA ILE A 99 6.058 4.387 -13.545 1.00 0.00 C ATOM 1424 C ILE A 99 7.550 4.679 -13.429 1.00 0.00 C ATOM 1425 O ILE A 99 8.368 4.066 -14.114 1.00 0.00 O ATOM 1426 CB ILE A 99 5.864 2.893 -13.873 1.00 0.00 C ATOM 1427 CG1 ILE A 99 4.394 2.605 -14.185 1.00 0.00 C ATOM 1428 CG2 ILE A 99 6.346 2.030 -12.716 1.00 0.00 C ATOM 1429 CD1 ILE A 99 4.124 1.157 -14.531 1.00 0.00 C ATOM 0 H ILE A 99 5.435 4.849 -15.493 1.00 0.00 H new ATOM 0 HA ILE A 99 5.571 4.610 -12.596 1.00 0.00 H new ATOM 0 HB ILE A 99 6.457 2.648 -14.754 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.786 2.884 -13.324 1.00 0.00 H new ATOM 0 HG13 ILE A 99 4.077 3.234 -15.017 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.203 0.978 -12.962 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.404 2.220 -12.537 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.777 2.273 -11.819 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.063 1.025 -14.741 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.705 0.879 -15.410 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.410 0.523 -13.692 1.00 0.00 H new ATOM 1441 N GLY A 100 7.897 5.620 -12.557 1.00 0.00 N ATOM 1442 CA GLY A 100 9.291 5.978 -12.369 1.00 0.00 C ATOM 1443 C GLY A 100 9.862 5.425 -11.075 1.00 0.00 C ATOM 1444 O GLY A 100 9.115 4.962 -10.213 1.00 0.00 O ATOM 0 H GLY A 100 7.239 6.141 -11.978 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.876 5.604 -13.210 1.00 0.00 H new ATOM 0 HA3 GLY A 100 9.388 7.064 -12.371 1.00 0.00 H new ATOM 1448 N PRO A 101 11.196 5.461 -10.910 1.00 0.00 N ATOM 1449 CA PRO A 101 11.855 4.955 -9.702 1.00 0.00 C ATOM 1450 C PRO A 101 11.257 5.540 -8.427 1.00 0.00 C ATOM 1451 O PRO A 101 10.880 4.806 -7.513 1.00 0.00 O ATOM 1452 CB PRO A 101 13.305 5.413 -9.871 1.00 0.00 C ATOM 1453 CG PRO A 101 13.491 5.551 -11.342 1.00 0.00 C ATOM 1454 CD PRO A 101 12.162 5.996 -11.887 1.00 0.00 C ATOM 0 HA PRO A 101 11.744 3.876 -9.599 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.483 6.359 -9.359 1.00 0.00 H new ATOM 0 HB3 PRO A 101 14.001 4.687 -9.451 1.00 0.00 H new ATOM 0 HG2 PRO A 101 14.270 6.279 -11.570 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.798 4.605 -11.787 1.00 0.00 H new ATOM 0 HD2 PRO A 101 12.101 7.082 -11.960 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.984 5.599 -12.887 1.00 0.00 H new ATOM 1462 N ARG A 102 11.175 6.865 -8.372 1.00 0.00 N ATOM 1463 CA ARG A 102 10.623 7.549 -7.208 1.00 0.00 C ATOM 1464 C ARG A 102 9.180 7.122 -6.956 1.00 0.00 C ATOM 1465 O ARG A 102 8.721 7.094 -5.815 1.00 0.00 O ATOM 1466 CB ARG A 102 10.692 9.065 -7.401 1.00 0.00 C ATOM 1467 CG ARG A 102 12.083 9.571 -7.749 1.00 0.00 C ATOM 1468 CD ARG A 102 12.385 10.894 -7.062 1.00 0.00 C ATOM 1469 NE ARG A 102 12.994 11.858 -7.975 1.00 0.00 N ATOM 1470 CZ ARG A 102 13.669 12.934 -7.577 1.00 0.00 C ATOM 1471 NH1 ARG A 102 13.825 13.186 -6.283 1.00 0.00 N ATOM 1472 NH2 ARG A 102 14.190 13.759 -8.474 1.00 0.00 N ATOM 0 H ARG A 102 11.484 7.487 -9.120 1.00 0.00 H new ATOM 0 HA ARG A 102 11.220 7.272 -6.339 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.001 9.354 -8.193 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.354 9.555 -6.488 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.825 8.829 -7.454 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.167 9.694 -8.829 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.463 11.311 -6.657 1.00 0.00 H new ATOM 0 HD3 ARG A 102 13.054 10.720 -6.219 1.00 0.00 H new ATOM 0 HE ARG A 102 12.896 11.697 -8.977 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.427 12.554 -5.589 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.343 14.012 -5.983 1.00 0.00 H new ATOM 0 HH21 ARG A 102 14.074 13.569 -9.469 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.707 14.583 -8.169 1.00 0.00 H new ATOM 1486 N GLU A 103 8.472 6.788 -8.029 1.00 0.00 N ATOM 1487 CA GLU A 103 7.081 6.362 -7.925 1.00 0.00 C ATOM 1488 C GLU A 103 6.983 4.948 -7.360 1.00 0.00 C ATOM 1489 O GLU A 103 6.001 4.596 -6.708 1.00 0.00 O ATOM 1490 CB GLU A 103 6.402 6.426 -9.295 1.00 0.00 C ATOM 1491 CG GLU A 103 5.619 7.708 -9.526 1.00 0.00 C ATOM 1492 CD GLU A 103 6.492 8.843 -10.025 1.00 0.00 C ATOM 1493 OE1 GLU A 103 6.712 8.927 -11.252 1.00 0.00 O ATOM 1494 OE2 GLU A 103 6.957 9.647 -9.190 1.00 0.00 O ATOM 0 H GLU A 103 8.838 6.804 -8.981 1.00 0.00 H new ATOM 0 HA GLU A 103 6.570 7.041 -7.242 1.00 0.00 H new ATOM 0 HB2 GLU A 103 7.160 6.328 -10.072 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.729 5.575 -9.398 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.826 7.520 -10.250 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.137 8.008 -8.595 1.00 0.00 H new ATOM 1501 N GLN A 104 8.009 4.141 -7.615 1.00 0.00 N ATOM 1502 CA GLN A 104 8.037 2.766 -7.131 1.00 0.00 C ATOM 1503 C GLN A 104 8.082 2.725 -5.607 1.00 0.00 C ATOM 1504 O GLN A 104 8.349 3.735 -4.956 1.00 0.00 O ATOM 1505 CB GLN A 104 9.245 2.025 -7.709 1.00 0.00 C ATOM 1506 CG GLN A 104 9.355 2.127 -9.221 1.00 0.00 C ATOM 1507 CD GLN A 104 9.762 0.816 -9.866 1.00 0.00 C ATOM 1508 OE1 GLN A 104 9.238 0.437 -10.914 1.00 0.00 O ATOM 1509 NE2 GLN A 104 10.700 0.114 -9.241 1.00 0.00 N ATOM 0 H GLN A 104 8.831 4.416 -8.153 1.00 0.00 H new ATOM 0 HA GLN A 104 7.123 2.272 -7.462 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.154 2.424 -7.259 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.185 0.974 -7.428 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.397 2.447 -9.630 1.00 0.00 H new ATOM 0 HG3 GLN A 104 10.084 2.896 -9.478 1.00 0.00 H new ATOM 0 HE21 GLN A 104 11.108 0.465 -8.375 1.00 0.00 H new ATOM 0 HE22 GLN A 104 11.013 -0.777 -9.627 1.00 0.00 H new ATOM 1518 N TRP A 105 7.820 1.550 -5.044 1.00 0.00 N ATOM 1519 CA TRP A 105 7.832 1.376 -3.596 1.00 0.00 C ATOM 1520 C TRP A 105 8.391 0.009 -3.218 1.00 0.00 C ATOM 1521 O TRP A 105 8.279 -0.952 -3.979 1.00 0.00 O ATOM 1522 CB TRP A 105 6.420 1.537 -3.031 1.00 0.00 C ATOM 1523 CG TRP A 105 5.784 2.848 -3.383 1.00 0.00 C ATOM 1524 CD1 TRP A 105 5.031 3.122 -4.488 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.848 4.062 -2.627 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.622 4.434 -4.465 1.00 0.00 N ATOM 1527 CE2 TRP A 105 5.110 5.031 -3.332 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.455 4.424 -1.421 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.965 6.338 -2.872 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.311 5.721 -0.965 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.570 6.664 -1.689 1.00 0.00 C ATOM 0 H TRP A 105 7.597 0.704 -5.568 1.00 0.00 H new ATOM 0 HA TRP A 105 8.477 2.143 -3.167 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.793 0.726 -3.403 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.457 1.439 -1.946 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.792 2.412 -5.266 1.00 0.00 H new ATOM 0 HE1 TRP A 105 4.049 4.889 -5.175 1.00 0.00 H new ATOM 0 HE3 TRP A 105 7.026 3.703 -0.855 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.396 7.067 -3.429 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.777 6.012 -0.035 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.474 7.669 -1.305 1.00 0.00 H new ATOM 1542 N GLU A 106 8.996 -0.072 -2.037 1.00 0.00 N ATOM 1543 CA GLU A 106 9.575 -1.322 -1.558 1.00 0.00 C ATOM 1544 C GLU A 106 8.959 -1.732 -0.222 1.00 0.00 C ATOM 1545 O GLU A 106 9.465 -1.371 0.840 1.00 0.00 O ATOM 1546 CB GLU A 106 11.091 -1.182 -1.410 1.00 0.00 C ATOM 1547 CG GLU A 106 11.830 -2.509 -1.432 1.00 0.00 C ATOM 1548 CD GLU A 106 13.029 -2.524 -0.503 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.006 -1.789 0.507 1.00 0.00 O ATOM 1550 OE2 GLU A 106 13.990 -3.269 -0.786 1.00 0.00 O ATOM 0 H GLU A 106 9.098 0.713 -1.394 1.00 0.00 H new ATOM 0 HA GLU A 106 9.357 -2.098 -2.292 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.469 -0.552 -2.215 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.310 -0.669 -0.474 1.00 0.00 H new ATOM 0 HG2 GLU A 106 11.144 -3.307 -1.147 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.160 -2.720 -2.449 1.00 0.00 H new ATOM 1557 N PRO A 107 7.853 -2.496 -0.257 1.00 0.00 N ATOM 1558 CA PRO A 107 7.171 -2.955 0.957 1.00 0.00 C ATOM 1559 C PRO A 107 8.112 -3.694 1.902 1.00 0.00 C ATOM 1560 O PRO A 107 9.104 -4.282 1.471 1.00 0.00 O ATOM 1561 CB PRO A 107 6.091 -3.903 0.428 1.00 0.00 C ATOM 1562 CG PRO A 107 5.857 -3.470 -0.977 1.00 0.00 C ATOM 1563 CD PRO A 107 7.183 -2.972 -1.481 1.00 0.00 C ATOM 0 HA PRO A 107 6.774 -2.123 1.539 1.00 0.00 H new ATOM 0 HB2 PRO A 107 6.420 -4.941 0.472 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.179 -3.833 1.020 1.00 0.00 H new ATOM 0 HG2 PRO A 107 5.494 -4.298 -1.586 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.102 -2.685 -1.023 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.751 -3.764 -1.969 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.061 -2.171 -2.211 1.00 0.00 H new ATOM 1571 N VAL A 108 7.795 -3.660 3.192 1.00 0.00 N ATOM 1572 CA VAL A 108 8.613 -4.328 4.196 1.00 0.00 C ATOM 1573 C VAL A 108 7.746 -5.075 5.204 1.00 0.00 C ATOM 1574 O VAL A 108 6.652 -4.627 5.549 1.00 0.00 O ATOM 1575 CB VAL A 108 9.508 -3.326 4.950 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.492 -4.059 5.849 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.240 -2.422 3.969 1.00 0.00 C ATOM 0 H VAL A 108 6.978 -3.177 3.566 1.00 0.00 H new ATOM 0 HA VAL A 108 9.245 -5.040 3.665 1.00 0.00 H new ATOM 0 HB VAL A 108 8.874 -2.702 5.580 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.115 -3.334 6.373 1.00 0.00 H new ATOM 0 HG12 VAL A 108 9.944 -4.659 6.575 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.123 -4.710 5.243 1.00 0.00 H new ATOM 0 HG21 VAL A 108 10.867 -1.721 4.519 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.863 -3.028 3.311 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.514 -1.869 3.373 1.00 0.00 H new ATOM 1587 N PHE A 109 8.240 -6.217 5.670 1.00 0.00 N ATOM 1588 CA PHE A 109 7.510 -7.027 6.638 1.00 0.00 C ATOM 1589 C PHE A 109 8.467 -7.707 7.611 1.00 0.00 C ATOM 1590 O PHE A 109 9.438 -8.344 7.199 1.00 0.00 O ATOM 1591 CB PHE A 109 6.663 -8.078 5.918 1.00 0.00 C ATOM 1592 CG PHE A 109 5.792 -7.507 4.835 1.00 0.00 C ATOM 1593 CD1 PHE A 109 6.290 -7.316 3.556 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.476 -7.160 5.096 1.00 0.00 C ATOM 1595 CE1 PHE A 109 5.492 -6.791 2.558 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.674 -6.635 4.102 1.00 0.00 C ATOM 1597 CZ PHE A 109 4.182 -6.449 2.831 1.00 0.00 C ATOM 0 H PHE A 109 9.143 -6.602 5.393 1.00 0.00 H new ATOM 0 HA PHE A 109 6.853 -6.367 7.205 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.323 -8.830 5.484 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.034 -8.588 6.648 1.00 0.00 H new ATOM 0 HD1 PHE A 109 7.314 -7.581 3.337 1.00 0.00 H new ATOM 0 HD2 PHE A 109 4.073 -7.302 6.088 1.00 0.00 H new ATOM 0 HE1 PHE A 109 5.892 -6.648 1.565 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.650 -6.370 4.318 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.556 -6.037 2.053 1.00 0.00 H new ATOM 1607 N GLN A 110 8.188 -7.570 8.902 1.00 0.00 N ATOM 1608 CA GLN A 110 9.025 -8.170 9.934 1.00 0.00 C ATOM 1609 C GLN A 110 8.194 -8.547 11.157 1.00 0.00 C ATOM 1610 O GLN A 110 7.622 -7.684 11.821 1.00 0.00 O ATOM 1611 CB GLN A 110 10.143 -7.208 10.338 1.00 0.00 C ATOM 1612 CG GLN A 110 11.475 -7.895 10.595 1.00 0.00 C ATOM 1613 CD GLN A 110 11.796 -8.011 12.073 1.00 0.00 C ATOM 1614 OE1 GLN A 110 11.394 -7.168 12.874 1.00 0.00 O ATOM 1615 NE2 GLN A 110 12.523 -9.059 12.439 1.00 0.00 N ATOM 0 H GLN A 110 7.388 -7.048 9.259 1.00 0.00 H new ATOM 0 HA GLN A 110 9.468 -9.078 9.525 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.273 -6.465 9.551 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.841 -6.671 11.237 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.458 -8.891 10.152 1.00 0.00 H new ATOM 0 HG3 GLN A 110 12.269 -7.338 10.097 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.834 -9.733 11.740 1.00 0.00 H new ATOM 0 HE22 GLN A 110 12.770 -9.191 13.420 1.00 0.00 H new ATOM 1624 N ASP A 111 8.135 -9.843 11.449 1.00 0.00 N ATOM 1625 CA ASP A 111 7.375 -10.334 12.593 1.00 0.00 C ATOM 1626 C ASP A 111 5.899 -9.976 12.459 1.00 0.00 C ATOM 1627 O ASP A 111 5.220 -9.715 13.452 1.00 0.00 O ATOM 1628 CB ASP A 111 7.937 -9.755 13.892 1.00 0.00 C ATOM 1629 CG ASP A 111 9.303 -10.318 14.232 1.00 0.00 C ATOM 1630 OD1 ASP A 111 10.037 -10.703 13.298 1.00 0.00 O ATOM 1631 OD2 ASP A 111 9.639 -10.374 15.433 1.00 0.00 O ATOM 0 H ASP A 111 8.604 -10.571 10.910 1.00 0.00 H new ATOM 0 HA ASP A 111 7.466 -11.420 12.619 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.006 -8.671 13.804 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.247 -9.965 14.709 1.00 0.00 H new ATOM 1636 N GLY A 112 5.407 -9.966 11.224 1.00 0.00 N ATOM 1637 CA GLY A 112 4.014 -9.638 10.983 1.00 0.00 C ATOM 1638 C GLY A 112 3.814 -8.177 10.632 1.00 0.00 C ATOM 1639 O GLY A 112 3.002 -7.844 9.768 1.00 0.00 O ATOM 0 H GLY A 112 5.948 -10.179 10.386 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.633 -10.259 10.172 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.429 -9.879 11.870 1.00 0.00 H new ATOM 1643 N LYS A 113 4.556 -7.302 11.303 1.00 0.00 N ATOM 1644 CA LYS A 113 4.456 -5.868 11.058 1.00 0.00 C ATOM 1645 C LYS A 113 4.845 -5.534 9.621 1.00 0.00 C ATOM 1646 O LYS A 113 5.187 -6.419 8.837 1.00 0.00 O ATOM 1647 CB LYS A 113 5.351 -5.101 12.032 1.00 0.00 C ATOM 1648 CG LYS A 113 5.059 -5.402 13.493 1.00 0.00 C ATOM 1649 CD LYS A 113 6.304 -5.870 14.230 1.00 0.00 C ATOM 1650 CE LYS A 113 6.296 -5.419 15.682 1.00 0.00 C ATOM 1651 NZ LYS A 113 5.486 -6.327 16.540 1.00 0.00 N ATOM 0 H LYS A 113 5.233 -7.561 12.021 1.00 0.00 H new ATOM 0 HA LYS A 113 3.420 -5.568 11.214 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.393 -5.342 11.821 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.230 -4.032 11.859 1.00 0.00 H new ATOM 0 HG2 LYS A 113 4.664 -4.509 13.977 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.287 -6.169 13.559 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.367 -6.957 14.186 1.00 0.00 H new ATOM 0 HD3 LYS A 113 7.191 -5.479 13.732 1.00 0.00 H new ATOM 0 HE2 LYS A 113 7.319 -5.382 16.057 1.00 0.00 H new ATOM 0 HE3 LYS A 113 5.897 -4.407 15.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 5.506 -5.986 17.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.504 -6.343 16.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 5.882 -7.288 16.500 1.00 0.00 H new ATOM 1665 N MET A 114 4.790 -4.249 9.283 1.00 0.00 N ATOM 1666 CA MET A 114 5.136 -3.797 7.941 1.00 0.00 C ATOM 1667 C MET A 114 5.240 -2.276 7.888 1.00 0.00 C ATOM 1668 O MET A 114 4.631 -1.575 8.697 1.00 0.00 O ATOM 1669 CB MET A 114 4.096 -4.284 6.930 1.00 0.00 C ATOM 1670 CG MET A 114 2.663 -4.006 7.352 1.00 0.00 C ATOM 1671 SD MET A 114 1.455 -4.703 6.209 1.00 0.00 S ATOM 1672 CE MET A 114 0.353 -5.537 7.348 1.00 0.00 C ATOM 0 H MET A 114 4.509 -3.504 9.920 1.00 0.00 H new ATOM 0 HA MET A 114 6.107 -4.219 7.683 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.283 -3.804 5.969 1.00 0.00 H new ATOM 0 HB3 MET A 114 4.221 -5.356 6.781 1.00 0.00 H new ATOM 0 HG2 MET A 114 2.495 -4.417 8.347 1.00 0.00 H new ATOM 0 HG3 MET A 114 2.511 -2.929 7.422 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.007 -6.470 6.903 1.00 0.00 H new ATOM 0 HE2 MET A 114 0.883 -5.752 8.276 1.00 0.00 H new ATOM 0 HE3 MET A 114 -0.503 -4.897 7.560 1.00 0.00 H new ATOM 1682 N ALA A 115 6.011 -1.773 6.931 1.00 0.00 N ATOM 1683 CA ALA A 115 6.194 -0.336 6.773 1.00 0.00 C ATOM 1684 C ALA A 115 6.579 0.014 5.340 1.00 0.00 C ATOM 1685 O ALA A 115 7.574 -0.487 4.814 1.00 0.00 O ATOM 1686 CB ALA A 115 7.248 0.173 7.744 1.00 0.00 C ATOM 0 H ALA A 115 6.520 -2.340 6.252 1.00 0.00 H new ATOM 0 HA ALA A 115 5.245 0.152 6.996 1.00 0.00 H new ATOM 0 HB1 ALA A 115 7.374 1.248 7.614 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.931 -0.034 8.766 1.00 0.00 H new ATOM 0 HB3 ALA A 115 8.195 -0.329 7.549 1.00 0.00 H new ATOM 1692 N LEU A 116 5.787 0.878 4.712 1.00 0.00 N ATOM 1693 CA LEU A 116 6.046 1.294 3.339 1.00 0.00 C ATOM 1694 C LEU A 116 7.276 2.195 3.266 1.00 0.00 C ATOM 1695 O LEU A 116 7.290 3.289 3.829 1.00 0.00 O ATOM 1696 CB LEU A 116 4.830 2.025 2.767 1.00 0.00 C ATOM 1697 CG LEU A 116 4.775 2.096 1.241 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.458 0.729 0.654 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.747 3.124 0.793 1.00 0.00 C ATOM 0 H LEU A 116 4.961 1.303 5.133 1.00 0.00 H new ATOM 0 HA LEU A 116 6.236 0.400 2.745 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.927 1.531 3.125 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.816 3.040 3.163 1.00 0.00 H new ATOM 0 HG LEU A 116 5.753 2.407 0.874 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.423 0.799 -0.433 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.231 0.019 0.947 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.492 0.388 1.027 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.721 3.162 -0.296 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.764 2.843 1.170 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.019 4.105 1.184 1.00 0.00 H new ATOM 1711 N LEU A 117 8.306 1.725 2.570 1.00 0.00 N ATOM 1712 CA LEU A 117 9.540 2.488 2.424 1.00 0.00 C ATOM 1713 C LEU A 117 9.584 3.198 1.075 1.00 0.00 C ATOM 1714 O LEU A 117 9.569 2.558 0.024 1.00 0.00 O ATOM 1715 CB LEU A 117 10.754 1.567 2.567 1.00 0.00 C ATOM 1716 CG LEU A 117 12.110 2.274 2.538 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.550 2.642 3.947 1.00 0.00 C ATOM 1718 CD2 LEU A 117 13.155 1.397 1.865 1.00 0.00 C ATOM 0 H LEU A 117 8.311 0.820 2.099 1.00 0.00 H new ATOM 0 HA LEU A 117 9.568 3.240 3.212 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.667 1.019 3.505 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.728 0.830 1.764 1.00 0.00 H new ATOM 0 HG LEU A 117 12.007 3.192 1.959 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.517 3.144 3.907 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.813 3.308 4.396 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.636 1.738 4.549 1.00 0.00 H new ATOM 0 HD21 LEU A 117 14.113 1.916 1.854 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.255 0.462 2.417 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.846 1.183 0.842 1.00 0.00 H new ATOM 1730 N ALA A 118 9.637 4.526 1.113 1.00 0.00 N ATOM 1731 CA ALA A 118 9.683 5.324 -0.106 1.00 0.00 C ATOM 1732 C ALA A 118 10.926 5.002 -0.929 1.00 0.00 C ATOM 1733 O ALA A 118 11.851 4.350 -0.445 1.00 0.00 O ATOM 1734 CB ALA A 118 9.640 6.806 0.232 1.00 0.00 C ATOM 0 H ALA A 118 9.649 5.071 1.975 1.00 0.00 H new ATOM 0 HA ALA A 118 8.809 5.074 -0.707 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.675 7.390 -0.688 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.718 7.030 0.769 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.496 7.062 0.857 1.00 0.00 H new ATOM 1740 N SER A 119 10.940 5.465 -2.174 1.00 0.00 N ATOM 1741 CA SER A 119 12.071 5.228 -3.065 1.00 0.00 C ATOM 1742 C SER A 119 13.309 6.001 -2.610 1.00 0.00 C ATOM 1743 O SER A 119 14.412 5.758 -3.097 1.00 0.00 O ATOM 1744 CB SER A 119 11.708 5.626 -4.497 1.00 0.00 C ATOM 1745 OG SER A 119 12.867 5.730 -5.307 1.00 0.00 O ATOM 0 H SER A 119 10.182 6.006 -2.589 1.00 0.00 H new ATOM 0 HA SER A 119 12.303 4.164 -3.033 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.029 4.887 -4.922 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.179 6.579 -4.490 1.00 0.00 H new ATOM 0 HG SER A 119 13.666 5.636 -4.748 1.00 0.00 H new ATOM 1751 N ASN A 120 13.122 6.931 -1.676 1.00 0.00 N ATOM 1752 CA ASN A 120 14.229 7.732 -1.165 1.00 0.00 C ATOM 1753 C ASN A 120 14.796 7.133 0.120 1.00 0.00 C ATOM 1754 O ASN A 120 15.378 7.843 0.940 1.00 0.00 O ATOM 1755 CB ASN A 120 13.770 9.168 -0.911 1.00 0.00 C ATOM 1756 CG ASN A 120 12.548 9.235 -0.015 1.00 0.00 C ATOM 1757 OD1 ASN A 120 12.238 8.284 0.704 1.00 0.00 O ATOM 1758 ND2 ASN A 120 11.847 10.362 -0.053 1.00 0.00 N ATOM 0 H ASN A 120 12.216 7.147 -1.259 1.00 0.00 H new ATOM 0 HA ASN A 120 15.017 7.734 -1.918 1.00 0.00 H new ATOM 0 HB2 ASN A 120 14.584 9.731 -0.454 1.00 0.00 H new ATOM 0 HB3 ASN A 120 13.546 9.649 -1.863 1.00 0.00 H new ATOM 0 HD21 ASN A 120 11.015 10.465 0.528 1.00 0.00 H new ATOM 0 HD22 ASN A 120 12.140 11.125 -0.664 1.00 0.00 H new ATOM 1765 N SER A 121 14.625 5.824 0.290 1.00 0.00 N ATOM 1766 CA SER A 121 15.124 5.135 1.475 1.00 0.00 C ATOM 1767 C SER A 121 14.570 5.768 2.750 1.00 0.00 C ATOM 1768 O SER A 121 15.289 5.933 3.735 1.00 0.00 O ATOM 1769 CB SER A 121 16.653 5.162 1.501 1.00 0.00 C ATOM 1770 OG SER A 121 17.175 3.962 2.045 1.00 0.00 O ATOM 0 H SER A 121 14.145 5.221 -0.378 1.00 0.00 H new ATOM 0 HA SER A 121 14.786 4.100 1.430 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.035 5.303 0.490 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.995 6.012 2.092 1.00 0.00 H new ATOM 0 HG SER A 121 18.154 4.004 2.049 1.00 0.00 H new ATOM 1776 N CYS A 122 13.290 6.119 2.723 1.00 0.00 N ATOM 1777 CA CYS A 122 12.641 6.732 3.875 1.00 0.00 C ATOM 1778 C CYS A 122 11.210 6.227 4.028 1.00 0.00 C ATOM 1779 O CYS A 122 10.499 6.039 3.042 1.00 0.00 O ATOM 1780 CB CYS A 122 12.644 8.256 3.737 1.00 0.00 C ATOM 1781 SG CYS A 122 14.276 8.964 3.410 1.00 0.00 S ATOM 0 H CYS A 122 12.681 5.989 1.915 1.00 0.00 H new ATOM 0 HA CYS A 122 13.202 6.453 4.767 1.00 0.00 H new ATOM 0 HB2 CYS A 122 11.969 8.538 2.929 1.00 0.00 H new ATOM 0 HB3 CYS A 122 12.247 8.694 4.653 1.00 0.00 H new ATOM 0 HG CYS A 122 14.628 8.697 2.187 1.00 0.00 H new ATOM 1787 N PHE A 123 10.796 6.009 5.273 1.00 0.00 N ATOM 1788 CA PHE A 123 9.451 5.525 5.555 1.00 0.00 C ATOM 1789 C PHE A 123 8.434 6.658 5.465 1.00 0.00 C ATOM 1790 O PHE A 123 8.639 7.736 6.024 1.00 0.00 O ATOM 1791 CB PHE A 123 9.396 4.886 6.944 1.00 0.00 C ATOM 1792 CG PHE A 123 10.198 3.619 7.052 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.792 2.470 6.393 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.355 3.580 7.812 1.00 0.00 C ATOM 1795 CE1 PHE A 123 10.527 1.304 6.491 1.00 0.00 C ATOM 1796 CE2 PHE A 123 12.094 2.417 7.912 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.680 1.276 7.251 1.00 0.00 C ATOM 0 H PHE A 123 11.373 6.160 6.101 1.00 0.00 H new ATOM 0 HA PHE A 123 9.199 4.774 4.806 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.762 5.602 7.680 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.357 4.672 7.196 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.892 2.486 5.797 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.683 4.468 8.332 1.00 0.00 H new ATOM 0 HE1 PHE A 123 10.200 0.414 5.973 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.995 2.399 8.507 1.00 0.00 H new ATOM 0 HZ PHE A 123 12.256 0.366 7.328 1.00 0.00 H new ATOM 1807 N ILE A 124 7.338 6.408 4.757 1.00 0.00 N ATOM 1808 CA ILE A 124 6.289 7.407 4.592 1.00 0.00 C ATOM 1809 C ILE A 124 5.503 7.595 5.884 1.00 0.00 C ATOM 1810 O ILE A 124 5.497 6.723 6.752 1.00 0.00 O ATOM 1811 CB ILE A 124 5.315 7.018 3.463 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.825 5.579 3.652 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.984 7.184 2.106 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.319 5.455 3.699 1.00 0.00 C ATOM 0 H ILE A 124 7.153 5.521 4.288 1.00 0.00 H new ATOM 0 HA ILE A 124 6.782 8.343 4.329 1.00 0.00 H new ATOM 0 HB ILE A 124 4.451 7.682 3.504 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.207 4.964 2.837 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.243 5.180 4.576 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.284 6.905 1.319 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.285 8.223 1.973 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.863 6.542 2.053 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.044 4.409 3.835 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.931 6.043 4.531 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.894 5.824 2.765 1.00 0.00 H new ATOM 1826 N ARG A 125 4.840 8.741 6.005 1.00 0.00 N ATOM 1827 CA ARG A 125 4.048 9.045 7.191 1.00 0.00 C ATOM 1828 C ARG A 125 3.205 10.297 6.975 1.00 0.00 C ATOM 1829 O ARG A 125 3.455 11.075 6.055 1.00 0.00 O ATOM 1830 CB ARG A 125 4.961 9.233 8.404 1.00 0.00 C ATOM 1831 CG ARG A 125 4.209 9.358 9.719 1.00 0.00 C ATOM 1832 CD ARG A 125 5.127 9.128 10.908 1.00 0.00 C ATOM 1833 NE ARG A 125 4.458 9.403 12.178 1.00 0.00 N ATOM 1834 CZ ARG A 125 4.258 10.628 12.661 1.00 0.00 C ATOM 1835 NH1 ARG A 125 4.673 11.691 11.983 1.00 0.00 N ATOM 1836 NH2 ARG A 125 3.643 10.789 13.824 1.00 0.00 N ATOM 0 H ARG A 125 4.836 9.474 5.296 1.00 0.00 H new ATOM 0 HA ARG A 125 3.378 8.205 7.376 1.00 0.00 H new ATOM 0 HB2 ARG A 125 5.647 8.388 8.466 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.568 10.126 8.256 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.760 10.349 9.790 1.00 0.00 H new ATOM 0 HG3 ARG A 125 3.393 8.636 9.743 1.00 0.00 H new ATOM 0 HD2 ARG A 125 5.479 8.097 10.900 1.00 0.00 H new ATOM 0 HD3 ARG A 125 6.006 9.766 10.816 1.00 0.00 H new ATOM 0 HE ARG A 125 4.125 8.610 12.727 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.147 11.572 11.088 1.00 0.00 H new ATOM 0 HH12 ARG A 125 4.517 12.627 12.357 1.00 0.00 H new ATOM 0 HH21 ARG A 125 3.323 9.975 14.349 1.00 0.00 H new ATOM 0 HH22 ARG A 125 3.490 11.727 14.194 1.00 0.00 H new ATOM 1850 N CYS A 126 2.205 10.486 7.829 1.00 0.00 N ATOM 1851 CA CYS A 126 1.324 11.644 7.732 1.00 0.00 C ATOM 1852 C CYS A 126 1.736 12.725 8.725 1.00 0.00 C ATOM 1853 O CYS A 126 2.698 12.560 9.475 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.127 11.229 7.982 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.383 10.342 9.536 1.00 0.00 S ATOM 0 H CYS A 126 1.984 9.852 8.597 1.00 0.00 H new ATOM 0 HA CYS A 126 1.409 12.051 6.725 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.755 12.120 7.977 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.461 10.599 7.157 1.00 0.00 H new ATOM 0 HG CYS A 126 -1.640 10.036 9.659 1.00 0.00 H new ATOM 1861 N ASN A 127 0.999 13.833 8.725 1.00 0.00 N ATOM 1862 CA ASN A 127 1.288 14.942 9.626 1.00 0.00 C ATOM 1863 C ASN A 127 0.038 15.357 10.395 1.00 0.00 C ATOM 1864 O ASN A 127 -1.034 14.779 10.217 1.00 0.00 O ATOM 1865 CB ASN A 127 1.841 16.134 8.840 1.00 0.00 C ATOM 1866 CG ASN A 127 3.156 16.637 9.402 1.00 0.00 C ATOM 1867 OD1 ASN A 127 3.345 16.694 10.617 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.075 17.006 8.517 1.00 0.00 N ATOM 0 H ASN A 127 0.199 13.985 8.111 1.00 0.00 H new ATOM 0 HA ASN A 127 2.039 14.611 10.343 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.981 15.845 7.798 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.111 16.943 8.851 1.00 0.00 H new ATOM 0 HD21 ASN A 127 4.980 17.353 8.836 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.876 16.942 7.519 1.00 0.00 H new ATOM 1875 N GLU A 128 0.183 16.362 11.252 1.00 0.00 N ATOM 1876 CA GLU A 128 -0.933 16.855 12.049 1.00 0.00 C ATOM 1877 C GLU A 128 -1.775 17.848 11.253 1.00 0.00 C ATOM 1878 O GLU A 128 -3.004 17.795 11.279 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.420 17.515 13.332 1.00 0.00 C ATOM 1880 CG GLU A 128 -0.388 16.577 14.527 1.00 0.00 C ATOM 1881 CD GLU A 128 -0.360 17.319 15.849 1.00 0.00 C ATOM 1882 OE1 GLU A 128 0.606 18.074 16.087 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -1.306 17.147 16.646 1.00 0.00 O ATOM 0 H GLU A 128 1.064 16.851 11.412 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.561 16.004 12.313 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.584 17.900 13.156 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.053 18.370 13.569 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.262 15.927 14.498 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.489 15.934 14.456 1.00 0.00 H new ATOM 1890 N ALA A 129 -1.104 18.751 10.547 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.789 19.755 9.743 1.00 0.00 C ATOM 1892 C ALA A 129 -2.437 19.126 8.514 1.00 0.00 C ATOM 1893 O ALA A 129 -3.488 19.574 8.057 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.819 20.850 9.327 1.00 0.00 C ATOM 0 H ALA A 129 -0.086 18.808 10.515 1.00 0.00 H new ATOM 0 HA ALA A 129 -2.578 20.196 10.353 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -1.345 21.593 8.727 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -0.406 21.327 10.216 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -0.010 20.416 8.740 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.802 18.086 7.984 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.332 17.411 6.813 1.00 0.00 C ATOM 1902 C GLY A 130 -1.360 17.421 5.650 1.00 0.00 C ATOM 1903 O GLY A 130 -1.683 17.908 4.566 1.00 0.00 O ATOM 0 H GLY A 130 -0.930 17.698 8.344 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.575 16.380 7.070 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -3.262 17.892 6.510 1.00 0.00 H new ATOM 1907 N ASP A 131 -0.166 16.883 5.874 1.00 0.00 N ATOM 1908 CA ASP A 131 0.857 16.832 4.836 1.00 0.00 C ATOM 1909 C ASP A 131 1.592 15.496 4.860 1.00 0.00 C ATOM 1910 O ASP A 131 2.466 15.272 5.698 1.00 0.00 O ATOM 1911 CB ASP A 131 1.853 17.978 5.017 1.00 0.00 C ATOM 1912 CG ASP A 131 1.263 19.322 4.640 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.492 19.880 5.449 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.571 19.818 3.536 1.00 0.00 O ATOM 0 H ASP A 131 0.117 16.476 6.765 1.00 0.00 H new ATOM 0 HA ASP A 131 0.364 16.937 3.870 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.183 18.008 6.055 1.00 0.00 H new ATOM 0 HB3 ASP A 131 2.736 17.788 4.407 1.00 0.00 H new ATOM 1919 N ILE A 132 1.231 14.611 3.937 1.00 0.00 N ATOM 1920 CA ILE A 132 1.857 13.297 3.852 1.00 0.00 C ATOM 1921 C ILE A 132 3.301 13.407 3.374 1.00 0.00 C ATOM 1922 O ILE A 132 3.559 13.696 2.205 1.00 0.00 O ATOM 1923 CB ILE A 132 1.083 12.365 2.899 1.00 0.00 C ATOM 1924 CG1 ILE A 132 -0.408 12.379 3.237 1.00 0.00 C ATOM 1925 CG2 ILE A 132 1.637 10.951 2.975 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.708 11.980 4.666 1.00 0.00 C ATOM 0 H ILE A 132 0.508 14.780 3.237 1.00 0.00 H new ATOM 0 HA ILE A 132 1.839 12.873 4.856 1.00 0.00 H new ATOM 0 HB ILE A 132 1.208 12.728 1.879 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -0.804 13.379 3.057 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.932 11.702 2.562 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.080 10.305 2.296 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.689 10.956 2.689 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.540 10.576 3.994 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.784 12.012 4.834 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -0.343 10.969 4.846 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.213 12.671 5.348 1.00 0.00 H new ATOM 1938 N GLU A 133 4.240 13.175 4.286 1.00 0.00 N ATOM 1939 CA GLU A 133 5.659 13.248 3.956 1.00 0.00 C ATOM 1940 C GLU A 133 6.411 12.047 4.521 1.00 0.00 C ATOM 1941 O GLU A 133 5.868 11.279 5.316 1.00 0.00 O ATOM 1942 CB GLU A 133 6.264 14.543 4.499 1.00 0.00 C ATOM 1943 CG GLU A 133 6.213 14.650 6.014 1.00 0.00 C ATOM 1944 CD GLU A 133 7.316 15.528 6.574 1.00 0.00 C ATOM 1945 OE1 GLU A 133 7.166 16.768 6.532 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.329 14.977 7.054 1.00 0.00 O ATOM 0 H GLU A 133 4.044 12.935 5.258 1.00 0.00 H new ATOM 0 HA GLU A 133 5.755 13.237 2.870 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.302 14.614 4.173 1.00 0.00 H new ATOM 0 HB3 GLU A 133 5.735 15.391 4.065 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.246 15.053 6.314 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.292 13.653 6.448 1.00 0.00 H new ATOM 1953 N ALA A 134 7.664 11.891 4.105 1.00 0.00 N ATOM 1954 CA ALA A 134 8.490 10.782 4.569 1.00 0.00 C ATOM 1955 C ALA A 134 9.274 11.169 5.819 1.00 0.00 C ATOM 1956 O ALA A 134 9.677 12.321 5.979 1.00 0.00 O ATOM 1957 CB ALA A 134 9.439 10.336 3.467 1.00 0.00 C ATOM 0 H ALA A 134 8.129 12.518 3.448 1.00 0.00 H new ATOM 0 HA ALA A 134 7.832 9.952 4.826 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.050 9.508 3.826 1.00 0.00 H new ATOM 0 HB2 ALA A 134 8.863 10.013 2.600 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.085 11.167 3.184 1.00 0.00 H new ATOM 1963 N LYS A 135 9.485 10.199 6.702 1.00 0.00 N ATOM 1964 CA LYS A 135 10.220 10.437 7.939 1.00 0.00 C ATOM 1965 C LYS A 135 11.621 9.838 7.862 1.00 0.00 C ATOM 1966 O LYS A 135 11.999 9.248 6.850 1.00 0.00 O ATOM 1967 CB LYS A 135 9.460 9.847 9.130 1.00 0.00 C ATOM 1968 CG LYS A 135 9.291 10.820 10.285 1.00 0.00 C ATOM 1969 CD LYS A 135 7.946 11.528 10.224 1.00 0.00 C ATOM 1970 CE LYS A 135 8.046 12.846 9.472 1.00 0.00 C ATOM 1971 NZ LYS A 135 8.206 14.002 10.396 1.00 0.00 N ATOM 0 H LYS A 135 9.157 9.240 6.584 1.00 0.00 H new ATOM 0 HA LYS A 135 10.314 11.514 8.077 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.476 9.518 8.796 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.988 8.962 9.485 1.00 0.00 H new ATOM 0 HG2 LYS A 135 9.379 10.284 11.230 1.00 0.00 H new ATOM 0 HG3 LYS A 135 10.093 11.558 10.261 1.00 0.00 H new ATOM 0 HD2 LYS A 135 7.216 10.883 9.735 1.00 0.00 H new ATOM 0 HD3 LYS A 135 7.583 11.711 11.235 1.00 0.00 H new ATOM 0 HE2 LYS A 135 8.893 12.809 8.786 1.00 0.00 H new ATOM 0 HE3 LYS A 135 7.151 12.987 8.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 8.270 14.881 9.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 7.386 14.053 11.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 9.074 13.881 10.957 1.00 0.00 H new ATOM 1985 N ASN A 136 12.386 9.995 8.937 1.00 0.00 N ATOM 1986 CA ASN A 136 13.746 9.469 8.991 1.00 0.00 C ATOM 1987 C ASN A 136 13.753 7.956 8.793 1.00 0.00 C ATOM 1988 O ASN A 136 12.721 7.297 8.929 1.00 0.00 O ATOM 1989 CB ASN A 136 14.400 9.825 10.328 1.00 0.00 C ATOM 1990 CG ASN A 136 15.371 10.982 10.205 1.00 0.00 C ATOM 1991 OD1 ASN A 136 15.287 11.960 10.950 1.00 0.00 O ATOM 1992 ND2 ASN A 136 16.300 10.878 9.262 1.00 0.00 N ATOM 0 H ASN A 136 12.088 10.482 9.782 1.00 0.00 H new ATOM 0 HA ASN A 136 14.318 9.925 8.183 1.00 0.00 H new ATOM 0 HB2 ASN A 136 13.626 10.079 11.052 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.926 8.953 10.716 1.00 0.00 H new ATOM 0 HD21 ASN A 136 16.981 11.626 9.132 1.00 0.00 H new ATOM 0 HD22 ASN A 136 16.333 10.050 8.667 1.00 0.00 H new ATOM 1999 N LYS A 137 14.921 7.412 8.471 1.00 0.00 N ATOM 2000 CA LYS A 137 15.063 5.976 8.253 1.00 0.00 C ATOM 2001 C LYS A 137 14.677 5.195 9.506 1.00 0.00 C ATOM 2002 O LYS A 137 14.185 4.070 9.421 1.00 0.00 O ATOM 2003 CB LYS A 137 16.499 5.640 7.847 1.00 0.00 C ATOM 2004 CG LYS A 137 16.689 5.496 6.346 1.00 0.00 C ATOM 2005 CD LYS A 137 18.154 5.598 5.958 1.00 0.00 C ATOM 2006 CE LYS A 137 18.871 4.268 6.133 1.00 0.00 C ATOM 2007 NZ LYS A 137 18.803 3.782 7.539 1.00 0.00 N ATOM 0 H LYS A 137 15.784 7.943 8.355 1.00 0.00 H new ATOM 0 HA LYS A 137 14.389 5.687 7.446 1.00 0.00 H new ATOM 0 HB2 LYS A 137 17.164 6.421 8.216 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.797 4.711 8.333 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.291 4.536 6.018 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.120 6.270 5.830 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.235 5.922 4.921 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.641 6.358 6.569 1.00 0.00 H new ATOM 0 HE2 LYS A 137 18.426 3.526 5.470 1.00 0.00 H new ATOM 0 HE3 LYS A 137 19.914 4.376 5.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 19.587 3.123 7.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 18.876 4.590 8.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 17.898 3.293 7.694 1.00 0.00 H new ATOM 2021 N THR A 138 14.904 5.800 10.668 1.00 0.00 N ATOM 2022 CA THR A 138 14.581 5.161 11.938 1.00 0.00 C ATOM 2023 C THR A 138 13.092 4.838 12.021 1.00 0.00 C ATOM 2024 O THR A 138 12.249 5.733 11.965 1.00 0.00 O ATOM 2025 CB THR A 138 14.985 6.064 13.105 1.00 0.00 C ATOM 2026 OG1 THR A 138 14.991 7.423 12.708 1.00 0.00 O ATOM 2027 CG2 THR A 138 16.355 5.743 13.662 1.00 0.00 C ATOM 0 H THR A 138 15.310 6.731 10.756 1.00 0.00 H new ATOM 0 HA THR A 138 15.141 4.228 12.000 1.00 0.00 H new ATOM 0 HB THR A 138 14.242 5.883 13.882 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.146 7.637 12.261 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.580 6.419 14.486 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.369 4.714 14.022 1.00 0.00 H new ATOM 0 HG23 THR A 138 17.104 5.864 12.879 1.00 0.00 H new ATOM 2035 N ALA A 139 12.777 3.555 12.156 1.00 0.00 N ATOM 2036 CA ALA A 139 11.391 3.115 12.247 1.00 0.00 C ATOM 2037 C ALA A 139 10.873 3.225 13.677 1.00 0.00 C ATOM 2038 O ALA A 139 11.653 3.262 14.629 1.00 0.00 O ATOM 2039 CB ALA A 139 11.257 1.685 11.744 1.00 0.00 C ATOM 0 H ALA A 139 13.463 2.802 12.205 1.00 0.00 H new ATOM 0 HA ALA A 139 10.786 3.768 11.618 1.00 0.00 H new ATOM 0 HB1 ALA A 139 10.216 1.369 11.818 1.00 0.00 H new ATOM 0 HB2 ALA A 139 11.579 1.633 10.704 1.00 0.00 H new ATOM 0 HB3 ALA A 139 11.880 1.026 12.350 1.00 0.00 H new ATOM 2045 N GLY A 140 9.553 3.276 13.820 1.00 0.00 N ATOM 2046 CA GLY A 140 8.954 3.380 15.137 1.00 0.00 C ATOM 2047 C GLY A 140 7.524 2.876 15.166 1.00 0.00 C ATOM 2048 O GLY A 140 6.992 2.438 14.145 1.00 0.00 O ATOM 0 H GLY A 140 8.888 3.247 13.047 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.551 2.811 15.850 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.976 4.420 15.461 1.00 0.00 H new ATOM 2052 N GLU A 141 6.900 2.938 16.338 1.00 0.00 N ATOM 2053 CA GLU A 141 5.524 2.483 16.495 1.00 0.00 C ATOM 2054 C GLU A 141 4.569 3.343 15.672 1.00 0.00 C ATOM 2055 O GLU A 141 3.678 2.827 14.998 1.00 0.00 O ATOM 2056 CB GLU A 141 5.119 2.519 17.971 1.00 0.00 C ATOM 2057 CG GLU A 141 4.291 1.319 18.403 1.00 0.00 C ATOM 2058 CD GLU A 141 3.123 1.706 19.290 1.00 0.00 C ATOM 2059 OE1 GLU A 141 2.120 2.225 18.757 1.00 0.00 O ATOM 2060 OE2 GLU A 141 3.212 1.488 20.517 1.00 0.00 O ATOM 0 H GLU A 141 7.325 3.299 17.192 1.00 0.00 H new ATOM 0 HA GLU A 141 5.463 1.457 16.133 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.018 2.570 18.585 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.551 3.430 18.161 1.00 0.00 H new ATOM 0 HG2 GLU A 141 3.916 0.804 17.519 1.00 0.00 H new ATOM 0 HG3 GLU A 141 4.929 0.614 18.936 1.00 0.00 H new ATOM 2067 N GLU A 142 4.763 4.656 15.731 1.00 0.00 N ATOM 2068 CA GLU A 142 3.919 5.587 14.991 1.00 0.00 C ATOM 2069 C GLU A 142 4.212 5.517 13.496 1.00 0.00 C ATOM 2070 O GLU A 142 3.307 5.629 12.669 1.00 0.00 O ATOM 2071 CB GLU A 142 4.132 7.015 15.498 1.00 0.00 C ATOM 2072 CG GLU A 142 3.993 7.152 17.006 1.00 0.00 C ATOM 2073 CD GLU A 142 2.715 7.859 17.412 1.00 0.00 C ATOM 2074 OE1 GLU A 142 1.778 7.912 16.588 1.00 0.00 O ATOM 2075 OE2 GLU A 142 2.651 8.360 18.555 1.00 0.00 O ATOM 0 H GLU A 142 5.497 5.099 16.283 1.00 0.00 H new ATOM 0 HA GLU A 142 2.879 5.303 15.153 1.00 0.00 H new ATOM 0 HB2 GLU A 142 5.125 7.353 15.201 1.00 0.00 H new ATOM 0 HB3 GLU A 142 3.412 7.675 15.014 1.00 0.00 H new ATOM 0 HG2 GLU A 142 4.016 6.162 17.461 1.00 0.00 H new ATOM 0 HG3 GLU A 142 4.848 7.703 17.397 1.00 0.00 H new ATOM 2082 N GLU A 143 5.484 5.332 13.156 1.00 0.00 N ATOM 2083 CA GLU A 143 5.898 5.247 11.760 1.00 0.00 C ATOM 2084 C GLU A 143 5.285 4.025 11.083 1.00 0.00 C ATOM 2085 O GLU A 143 5.048 4.026 9.876 1.00 0.00 O ATOM 2086 CB GLU A 143 7.424 5.191 11.662 1.00 0.00 C ATOM 2087 CG GLU A 143 8.067 6.546 11.413 1.00 0.00 C ATOM 2088 CD GLU A 143 8.074 7.424 12.648 1.00 0.00 C ATOM 2089 OE1 GLU A 143 8.157 6.875 13.767 1.00 0.00 O ATOM 2090 OE2 GLU A 143 7.997 8.661 12.497 1.00 0.00 O ATOM 0 H GLU A 143 6.246 5.238 13.828 1.00 0.00 H new ATOM 0 HA GLU A 143 5.541 6.139 11.246 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.824 4.772 12.585 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.704 4.512 10.857 1.00 0.00 H new ATOM 0 HG2 GLU A 143 9.091 6.400 11.070 1.00 0.00 H new ATOM 0 HG3 GLU A 143 7.532 7.056 10.612 1.00 0.00 H new ATOM 2097 N MET A 144 5.033 2.981 11.869 1.00 0.00 N ATOM 2098 CA MET A 144 4.450 1.752 11.344 1.00 0.00 C ATOM 2099 C MET A 144 3.103 2.027 10.681 1.00 0.00 C ATOM 2100 O MET A 144 2.455 3.034 10.963 1.00 0.00 O ATOM 2101 CB MET A 144 4.278 0.725 12.465 1.00 0.00 C ATOM 2102 CG MET A 144 5.569 0.022 12.849 1.00 0.00 C ATOM 2103 SD MET A 144 5.889 -1.439 11.842 1.00 0.00 S ATOM 2104 CE MET A 144 7.600 -1.169 11.389 1.00 0.00 C ATOM 0 H MET A 144 5.224 2.963 12.871 1.00 0.00 H new ATOM 0 HA MET A 144 5.129 1.350 10.592 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.870 1.224 13.344 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.547 -0.021 12.154 1.00 0.00 H new ATOM 0 HG2 MET A 144 6.402 0.718 12.747 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.522 -0.268 13.899 1.00 0.00 H new ATOM 0 HE1 MET A 144 7.903 -1.912 10.651 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.711 -0.171 10.966 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.229 -1.260 12.274 1.00 0.00 H new ATOM 2114 N ILE A 145 2.690 1.124 9.797 1.00 0.00 N ATOM 2115 CA ILE A 145 1.421 1.268 9.094 1.00 0.00 C ATOM 2116 C ILE A 145 0.720 -0.077 8.943 1.00 0.00 C ATOM 2117 O ILE A 145 1.279 -1.121 9.278 1.00 0.00 O ATOM 2118 CB ILE A 145 1.621 1.889 7.698 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.596 1.046 6.876 1.00 0.00 C ATOM 2120 CG2 ILE A 145 2.122 3.321 7.821 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.390 1.169 5.381 1.00 0.00 C ATOM 0 H ILE A 145 3.216 0.285 9.551 1.00 0.00 H new ATOM 0 HA ILE A 145 0.800 1.932 9.695 1.00 0.00 H new ATOM 0 HB ILE A 145 0.661 1.905 7.183 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.616 1.344 7.120 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.492 -0.000 7.164 1.00 0.00 H new ATOM 0 HG21 ILE A 145 2.258 3.745 6.826 1.00 0.00 H new ATOM 0 HG22 ILE A 145 1.393 3.915 8.372 1.00 0.00 H new ATOM 0 HG23 ILE A 145 3.074 3.329 8.352 1.00 0.00 H new ATOM 0 HD11 ILE A 145 3.116 0.544 4.861 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.382 0.844 5.125 1.00 0.00 H new ATOM 0 HD13 ILE A 145 2.524 2.208 5.080 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.509 -0.044 8.437 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.289 -1.261 8.241 1.00 0.00 C ATOM 2135 C LYS A 146 -1.975 -1.255 6.880 1.00 0.00 C ATOM 2136 O LYS A 146 -2.836 -0.416 6.612 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.331 -1.407 9.352 1.00 0.00 C ATOM 2138 CG LYS A 146 -1.734 -1.751 10.707 1.00 0.00 C ATOM 2139 CD LYS A 146 -2.050 -3.182 11.112 1.00 0.00 C ATOM 2140 CE LYS A 146 -0.885 -4.116 10.821 1.00 0.00 C ATOM 2141 NZ LYS A 146 -0.547 -4.966 11.996 1.00 0.00 N ATOM 0 H LYS A 146 -0.986 0.812 8.155 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.607 -2.110 8.278 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -2.891 -0.476 9.437 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.043 -2.183 9.071 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -0.653 -1.612 10.675 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -2.121 -1.065 11.460 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -2.288 -3.216 12.175 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -2.935 -3.525 10.576 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -1.134 -4.753 9.972 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -0.012 -3.529 10.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 0.252 -5.588 11.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -0.285 -4.360 12.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -1.371 -5.545 12.254 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.589 -2.194 6.023 1.00 0.00 N ATOM 2156 CA ILE A 147 -2.168 -2.296 4.689 1.00 0.00 C ATOM 2157 C ILE A 147 -3.225 -3.392 4.631 1.00 0.00 C ATOM 2158 O ILE A 147 -3.119 -4.408 5.318 1.00 0.00 O ATOM 2159 CB ILE A 147 -1.087 -2.584 3.628 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.091 -1.623 3.795 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.676 -2.472 2.230 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.321 -2.035 3.017 1.00 0.00 C ATOM 0 H ILE A 147 -0.878 -2.895 6.229 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.633 -1.335 4.472 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.723 -3.602 3.767 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.215 -0.627 3.475 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.346 -1.554 4.852 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.901 -2.678 1.491 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.486 -3.193 2.117 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -2.064 -1.465 2.078 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.116 -1.308 3.182 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.652 -3.018 3.353 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.082 -2.076 1.954 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.245 -3.180 3.806 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.324 -4.151 3.658 1.00 0.00 C ATOM 2176 C ARG A 148 -5.723 -4.303 2.194 1.00 0.00 C ATOM 2177 O ARG A 148 -5.612 -3.362 1.408 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.537 -3.727 4.487 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.216 -3.474 5.950 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.277 -2.609 6.613 1.00 0.00 C ATOM 2181 NE ARG A 148 -6.765 -1.925 7.797 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.619 -2.509 8.985 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -6.943 -3.786 9.150 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.146 -1.815 10.011 1.00 0.00 N ATOM 0 H ARG A 148 -4.347 -2.345 3.230 1.00 0.00 H new ATOM 0 HA ARG A 148 -4.964 -5.114 4.020 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.963 -2.821 4.055 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.301 -4.502 4.420 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.140 -4.425 6.476 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.245 -2.986 6.031 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.642 -1.872 5.898 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.128 -3.230 6.893 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.504 -0.943 7.709 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.306 -4.326 8.364 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -6.829 -4.227 10.062 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -5.894 -0.834 9.890 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -6.034 -2.262 10.921 1.00 0.00 H new ATOM 2198 N SER A 149 -6.188 -5.495 1.833 1.00 0.00 N ATOM 2199 CA SER A 149 -6.605 -5.771 0.463 1.00 0.00 C ATOM 2200 C SER A 149 -8.078 -6.164 0.412 1.00 0.00 C ATOM 2201 O SER A 149 -8.652 -6.591 1.414 1.00 0.00 O ATOM 2202 CB SER A 149 -5.748 -6.887 -0.137 1.00 0.00 C ATOM 2203 OG SER A 149 -6.130 -7.161 -1.474 1.00 0.00 O ATOM 0 H SER A 149 -6.285 -6.285 2.471 1.00 0.00 H new ATOM 0 HA SER A 149 -6.469 -4.862 -0.122 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.697 -6.599 -0.108 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.848 -7.790 0.465 1.00 0.00 H new ATOM 0 HG SER A 149 -5.566 -7.877 -1.835 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.684 -6.015 -0.762 1.00 0.00 N ATOM 2210 CA CYS A 150 -10.091 -6.354 -0.944 1.00 0.00 C ATOM 2211 C CYS A 150 -10.262 -7.405 -2.037 1.00 0.00 C ATOM 2212 O CYS A 150 -11.237 -7.381 -2.787 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.897 -5.102 -1.294 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.241 -4.171 -2.699 1.00 0.00 S ATOM 0 H CYS A 150 -8.223 -5.662 -1.601 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.463 -6.768 -0.007 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.924 -5.394 -1.513 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.930 -4.449 -0.422 1.00 0.00 H new ATOM 0 HG CYS A 150 -10.076 -2.928 -2.357 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.307 -8.324 -2.120 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.350 -9.383 -3.120 1.00 0.00 C ATOM 2222 C ALA A 151 -10.446 -10.395 -2.801 1.00 0.00 C ATOM 2223 O ALA A 151 -11.103 -10.307 -1.764 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.999 -10.076 -3.215 1.00 0.00 C ATOM 0 H ALA A 151 -8.493 -8.357 -1.506 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.580 -8.929 -4.084 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -8.047 -10.865 -3.966 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.237 -9.350 -3.499 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.744 -10.510 -2.248 1.00 0.00 H new