USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=26 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 Set 1.1: A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 73:sc= 0.476 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -2.02 K(o=-2,f=-6.1!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl 145:sc= -2.39! (180deg=-3.05!) USER MOD Single : A 33 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0184) USER MOD Single : A 36 TYR OH : rot -86:sc= 0.201 USER MOD Single : A 38 HIS : no HD1:sc= -0.0107 K(o=-0.011,f=-1.3) USER MOD Single : A 42 ASN : amide:sc= -0.0247 K(o=-0.025,f=-0.76) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.0232 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= -1.37 USER MOD Single : A 63 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 65:sc= 1.26 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -150:sc= 0.0144 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 87 ASN : amide:sc= -0.163 K(o=-0.16,f=-2.5!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 15:sc= 0.554 USER MOD Single : A 104 GLN : amide:sc= -1.6! C(o=-1.6!,f=-3.3!) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl -176:sc= -0.73 (180deg=-0.747) USER MOD Single : A 119 SER OG : rot 164:sc= 1.25 USER MOD Single : A 120 ASN : amide:sc= -0.721 X(o=-0.72,f=-1) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 15:sc= 0.0475 USER MOD Single : A 126 CYS SG : rot 80:sc= -0.559 USER MOD Single : A 127 ASN : amide:sc= -0.922 X(o=-0.92,f=-1.1) USER MOD Single : A 135 LYS NZ :NH3+ 144:sc= 1.14 (180deg=-0.132) USER MOD Single : A 136 ASN : amide:sc= -0.039 X(o=-0.039,f=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 46:sc= 0.189 USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= -2.78! USER MOD Single : A 150 CYS SG : rot -114:sc= 1.12 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -6.533 -9.961 9.745 1.00 0.00 N ATOM 88 CA ASP A 9 -7.633 -9.079 10.122 1.00 0.00 C ATOM 89 C ASP A 9 -8.409 -8.620 8.891 1.00 0.00 C ATOM 90 O ASP A 9 -7.856 -7.974 8.002 1.00 0.00 O ATOM 91 CB ASP A 9 -7.101 -7.864 10.885 1.00 0.00 C ATOM 92 CG ASP A 9 -6.701 -8.205 12.307 1.00 0.00 C ATOM 93 OD1 ASP A 9 -5.683 -8.906 12.486 1.00 0.00 O ATOM 94 OD2 ASP A 9 -7.406 -7.772 13.242 1.00 0.00 O ATOM 0 HA ASP A 9 -8.309 -9.639 10.768 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -6.240 -7.455 10.356 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -7.864 -7.086 10.902 1.00 0.00 H new ATOM 99 N ILE A 10 -9.693 -8.958 8.849 1.00 0.00 N ATOM 100 CA ILE A 10 -10.547 -8.581 7.728 1.00 0.00 C ATOM 101 C ILE A 10 -11.645 -7.621 8.174 1.00 0.00 C ATOM 102 O ILE A 10 -12.522 -7.985 8.958 1.00 0.00 O ATOM 103 CB ILE A 10 -11.191 -9.819 7.070 1.00 0.00 C ATOM 104 CG1 ILE A 10 -11.982 -9.410 5.825 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.089 -10.546 8.061 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.446 -10.584 4.991 1.00 0.00 C ATOM 0 H ILE A 10 -10.166 -9.492 9.578 1.00 0.00 H new ATOM 0 HA ILE A 10 -9.910 -8.083 6.996 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.397 -10.501 6.766 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -12.850 -8.827 6.132 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.362 -8.759 5.208 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.534 -11.416 7.578 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.498 -10.869 8.918 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.879 -9.874 8.397 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.999 -10.219 4.126 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.581 -11.155 4.654 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -13.092 -11.224 5.592 1.00 0.00 H new ATOM 118 N VAL A 11 -11.589 -6.391 7.672 1.00 0.00 N ATOM 119 CA VAL A 11 -12.578 -5.378 8.019 1.00 0.00 C ATOM 120 C VAL A 11 -13.564 -5.160 6.875 1.00 0.00 C ATOM 121 O VAL A 11 -13.255 -4.478 5.898 1.00 0.00 O ATOM 122 CB VAL A 11 -11.909 -4.035 8.369 1.00 0.00 C ATOM 123 CG1 VAL A 11 -12.939 -3.039 8.878 1.00 0.00 C ATOM 124 CG2 VAL A 11 -10.804 -4.239 9.395 1.00 0.00 C ATOM 0 H VAL A 11 -10.869 -6.073 7.024 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.115 -5.746 8.894 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.462 -3.628 7.462 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.446 -2.097 9.120 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.691 -2.868 8.108 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.419 -3.437 9.772 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.343 -3.279 9.629 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.226 -4.671 10.303 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.050 -4.914 8.989 1.00 0.00 H new ATOM 134 N GLY A 12 -14.751 -5.744 7.004 1.00 0.00 N ATOM 135 CA GLY A 12 -15.763 -5.602 5.975 1.00 0.00 C ATOM 136 C GLY A 12 -15.403 -6.342 4.701 1.00 0.00 C ATOM 137 O GLY A 12 -15.861 -7.462 4.476 1.00 0.00 O ATOM 0 H GLY A 12 -15.030 -6.313 7.803 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.715 -5.976 6.352 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -15.902 -4.545 5.750 1.00 0.00 H new ATOM 141 N ILE A 13 -14.579 -5.715 3.868 1.00 0.00 N ATOM 142 CA ILE A 13 -14.156 -6.320 2.611 1.00 0.00 C ATOM 143 C ILE A 13 -12.677 -6.060 2.346 1.00 0.00 C ATOM 144 O ILE A 13 -12.251 -5.950 1.197 1.00 0.00 O ATOM 145 CB ILE A 13 -14.980 -5.786 1.423 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.081 -4.261 1.484 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.366 -6.415 1.415 1.00 0.00 C ATOM 148 CD1 ILE A 13 -14.928 -3.590 0.137 1.00 0.00 C ATOM 0 H ILE A 13 -14.191 -4.788 4.041 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.323 -7.393 2.706 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.472 -6.059 0.498 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.046 -3.986 1.910 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.314 -3.881 2.159 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -16.936 -6.028 0.570 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.274 -7.497 1.325 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -16.882 -6.170 2.344 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.011 -2.510 0.257 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -13.952 -3.835 -0.283 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.711 -3.941 -0.535 1.00 0.00 H new ATOM 160 N TRP A 14 -11.898 -5.965 3.420 1.00 0.00 N ATOM 161 CA TRP A 14 -10.466 -5.718 3.306 1.00 0.00 C ATOM 162 C TRP A 14 -9.687 -6.575 4.299 1.00 0.00 C ATOM 163 O TRP A 14 -9.813 -6.407 5.512 1.00 0.00 O ATOM 164 CB TRP A 14 -10.161 -4.238 3.542 1.00 0.00 C ATOM 165 CG TRP A 14 -10.890 -3.324 2.604 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.144 -2.811 2.769 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.408 -2.818 1.355 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.472 -2.016 1.699 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.424 -2.003 0.817 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.219 -2.972 0.639 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.283 -1.346 -0.403 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.080 -2.319 -0.572 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.107 -1.515 -1.082 1.00 0.00 C ATOM 0 H TRP A 14 -12.235 -6.055 4.378 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.155 -5.988 2.297 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.424 -3.979 4.568 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.088 -4.074 3.437 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -12.784 -3.003 3.617 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.353 -1.516 1.580 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.422 -3.590 1.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.073 -0.726 -0.799 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.164 -2.431 -1.134 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -9.968 -1.018 -2.031 1.00 0.00 H new ATOM 184 N TRP A 15 -8.883 -7.495 3.776 1.00 0.00 N ATOM 185 CA TRP A 15 -8.084 -8.379 4.618 1.00 0.00 C ATOM 186 C TRP A 15 -6.625 -7.938 4.640 1.00 0.00 C ATOM 187 O TRP A 15 -6.032 -7.666 3.596 1.00 0.00 O ATOM 188 CB TRP A 15 -8.185 -9.821 4.119 1.00 0.00 C ATOM 189 CG TRP A 15 -7.918 -9.963 2.652 1.00 0.00 C ATOM 190 CD1 TRP A 15 -8.813 -9.796 1.636 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.669 -10.302 2.036 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.199 -10.010 0.425 1.00 0.00 N ATOM 193 CE2 TRP A 15 -6.883 -10.321 0.644 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.392 -10.589 2.525 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -5.867 -10.617 -0.261 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.385 -10.883 1.625 1.00 0.00 C ATOM 197 CH2 TRP A 15 -4.627 -10.894 0.245 1.00 0.00 C ATOM 0 H TRP A 15 -8.767 -7.648 2.774 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.476 -8.324 5.633 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.477 -10.439 4.671 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.181 -10.205 4.338 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.853 -9.534 1.765 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.650 -9.947 -0.488 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.195 -10.581 3.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.052 -10.627 -1.325 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.394 -11.108 1.992 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -3.818 -11.126 -0.432 1.00 0.00 H new ATOM 208 N THR A 16 -6.052 -7.868 5.837 1.00 0.00 N ATOM 209 CA THR A 16 -4.661 -7.459 5.996 1.00 0.00 C ATOM 210 C THR A 16 -3.717 -8.505 5.414 1.00 0.00 C ATOM 211 O THR A 16 -3.848 -9.697 5.688 1.00 0.00 O ATOM 212 CB THR A 16 -4.340 -7.233 7.475 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.323 -6.412 8.081 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.993 -6.584 7.703 1.00 0.00 C ATOM 0 H THR A 16 -6.529 -8.089 6.711 1.00 0.00 H new ATOM 0 HA THR A 16 -4.519 -6.525 5.453 1.00 0.00 H new ATOM 0 HB THR A 16 -4.325 -8.227 7.923 1.00 0.00 H new ATOM 0 HG1 THR A 16 -6.151 -6.924 8.197 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.829 -6.453 8.773 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.209 -7.219 7.291 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.969 -5.612 7.210 1.00 0.00 H new ATOM 222 N VAL A 17 -2.764 -8.050 4.606 1.00 0.00 N ATOM 223 CA VAL A 17 -1.798 -8.946 3.984 1.00 0.00 C ATOM 224 C VAL A 17 -0.718 -9.364 4.976 1.00 0.00 C ATOM 225 O VAL A 17 -0.589 -8.780 6.052 1.00 0.00 O ATOM 226 CB VAL A 17 -1.129 -8.290 2.761 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.109 -8.194 1.602 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.583 -6.917 3.122 1.00 0.00 C ATOM 0 H VAL A 17 -2.641 -7.066 4.367 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.350 -9.828 3.658 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.294 -8.917 2.449 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.618 -7.728 0.748 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.445 -9.193 1.326 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.967 -7.592 1.900 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.114 -6.470 2.245 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.399 -6.279 3.463 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.156 -7.017 3.917 1.00 0.00 H new ATOM 238 N SER A 18 0.057 -10.378 4.605 1.00 0.00 N ATOM 239 CA SER A 18 1.127 -10.876 5.462 1.00 0.00 C ATOM 240 C SER A 18 2.475 -10.789 4.754 1.00 0.00 C ATOM 241 O SER A 18 3.477 -10.395 5.351 1.00 0.00 O ATOM 242 CB SER A 18 0.848 -12.322 5.875 1.00 0.00 C ATOM 243 OG SER A 18 0.147 -12.375 7.107 1.00 0.00 O ATOM 0 H SER A 18 -0.036 -10.871 3.717 1.00 0.00 H new ATOM 0 HA SER A 18 1.164 -10.252 6.355 1.00 0.00 H new ATOM 0 HB2 SER A 18 0.265 -12.819 5.100 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.788 -12.866 5.964 1.00 0.00 H new ATOM 0 HG SER A 18 -0.021 -13.310 7.348 1.00 0.00 H new ATOM 249 N ASN A 19 2.493 -11.160 3.477 1.00 0.00 N ATOM 250 CA ASN A 19 3.717 -11.123 2.687 1.00 0.00 C ATOM 251 C ASN A 19 3.511 -10.333 1.398 1.00 0.00 C ATOM 252 O ASN A 19 2.416 -9.840 1.130 1.00 0.00 O ATOM 253 CB ASN A 19 4.181 -12.544 2.360 1.00 0.00 C ATOM 254 CG ASN A 19 3.056 -13.415 1.838 1.00 0.00 C ATOM 255 OD1 ASN A 19 2.067 -13.653 2.531 1.00 0.00 O ATOM 256 ND2 ASN A 19 3.201 -13.895 0.608 1.00 0.00 N ATOM 0 H ASN A 19 1.673 -11.490 2.968 1.00 0.00 H new ATOM 0 HA ASN A 19 4.485 -10.624 3.278 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.978 -12.501 1.617 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.604 -13.000 3.255 1.00 0.00 H new ATOM 0 HD21 ASN A 19 2.476 -14.486 0.203 1.00 0.00 H new ATOM 0 HD22 ASN A 19 4.038 -13.672 0.069 1.00 0.00 H new ATOM 263 N PHE A 20 4.571 -10.220 0.603 1.00 0.00 N ATOM 264 CA PHE A 20 4.505 -9.490 -0.658 1.00 0.00 C ATOM 265 C PHE A 20 3.640 -10.232 -1.672 1.00 0.00 C ATOM 266 O PHE A 20 2.945 -9.615 -2.479 1.00 0.00 O ATOM 267 CB PHE A 20 5.910 -9.283 -1.225 1.00 0.00 C ATOM 268 CG PHE A 20 5.940 -8.422 -2.456 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.726 -8.974 -3.709 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.184 -7.062 -2.360 1.00 0.00 C ATOM 271 CE1 PHE A 20 5.753 -8.186 -4.843 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.212 -6.268 -3.491 1.00 0.00 C ATOM 273 CZ PHE A 20 5.996 -6.831 -4.734 1.00 0.00 C ATOM 0 H PHE A 20 5.484 -10.624 0.810 1.00 0.00 H new ATOM 0 HA PHE A 20 4.052 -8.518 -0.463 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.539 -8.829 -0.459 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.345 -10.254 -1.460 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.536 -10.033 -3.800 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.354 -6.617 -1.391 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.584 -8.629 -5.813 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.403 -5.209 -3.403 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.017 -6.212 -5.619 1.00 0.00 H new ATOM 283 N GLY A 21 3.687 -11.560 -1.624 1.00 0.00 N ATOM 284 CA GLY A 21 2.903 -12.363 -2.542 1.00 0.00 C ATOM 285 C GLY A 21 1.413 -12.128 -2.393 1.00 0.00 C ATOM 286 O GLY A 21 0.654 -12.279 -3.350 1.00 0.00 O ATOM 0 H GLY A 21 4.254 -12.093 -0.965 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.203 -12.136 -3.565 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.120 -13.418 -2.373 1.00 0.00 H new ATOM 290 N GLU A 22 0.992 -11.759 -1.187 1.00 0.00 N ATOM 291 CA GLU A 22 -0.417 -11.503 -0.915 1.00 0.00 C ATOM 292 C GLU A 22 -0.832 -10.130 -1.436 1.00 0.00 C ATOM 293 O GLU A 22 -1.969 -9.937 -1.864 1.00 0.00 O ATOM 294 CB GLU A 22 -0.694 -11.596 0.587 1.00 0.00 C ATOM 295 CG GLU A 22 -0.372 -12.957 1.182 1.00 0.00 C ATOM 296 CD GLU A 22 -1.357 -14.028 0.753 1.00 0.00 C ATOM 297 OE1 GLU A 22 -1.493 -14.255 -0.468 1.00 0.00 O ATOM 298 OE2 GLU A 22 -1.992 -14.639 1.638 1.00 0.00 O ATOM 0 H GLU A 22 1.607 -11.631 -0.383 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.004 -12.261 -1.433 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.109 -10.835 1.104 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.744 -11.368 0.769 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.634 -13.252 0.882 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.372 -12.883 2.270 1.00 0.00 H new ATOM 305 N ILE A 23 0.098 -9.182 -1.396 1.00 0.00 N ATOM 306 CA ILE A 23 -0.171 -7.828 -1.864 1.00 0.00 C ATOM 307 C ILE A 23 -0.183 -7.765 -3.387 1.00 0.00 C ATOM 308 O ILE A 23 0.851 -7.934 -4.033 1.00 0.00 O ATOM 309 CB ILE A 23 0.874 -6.830 -1.328 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.050 -7.002 0.182 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.462 -5.404 -1.659 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.176 -6.173 0.757 1.00 0.00 C ATOM 0 H ILE A 23 1.044 -9.327 -1.044 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.155 -7.552 -1.484 1.00 0.00 H new ATOM 0 HB ILE A 23 1.830 -7.034 -1.811 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.119 -6.732 0.681 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.236 -8.054 0.401 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.210 -4.711 -1.274 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.383 -5.290 -2.740 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.503 -5.188 -1.200 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.243 -6.345 1.831 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.116 -6.459 0.285 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.982 -5.117 0.570 1.00 0.00 H new ATOM 324 N SER A 24 -1.359 -7.522 -3.955 1.00 0.00 N ATOM 325 CA SER A 24 -1.506 -7.437 -5.403 1.00 0.00 C ATOM 326 C SER A 24 -2.914 -6.988 -5.782 1.00 0.00 C ATOM 327 O SER A 24 -3.901 -7.616 -5.399 1.00 0.00 O ATOM 328 CB SER A 24 -1.199 -8.789 -6.048 1.00 0.00 C ATOM 329 OG SER A 24 -0.455 -8.628 -7.243 1.00 0.00 O ATOM 0 H SER A 24 -2.225 -7.380 -3.434 1.00 0.00 H new ATOM 0 HA SER A 24 -0.796 -6.697 -5.772 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.639 -9.410 -5.349 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.131 -9.312 -6.264 1.00 0.00 H new ATOM 0 HG SER A 24 -0.270 -9.507 -7.634 1.00 0.00 H new ATOM 335 N GLY A 25 -2.999 -5.896 -6.535 1.00 0.00 N ATOM 336 CA GLY A 25 -4.290 -5.382 -6.953 1.00 0.00 C ATOM 337 C GLY A 25 -4.752 -4.216 -6.101 1.00 0.00 C ATOM 338 O GLY A 25 -3.939 -3.538 -5.471 1.00 0.00 O ATOM 0 H GLY A 25 -2.197 -5.358 -6.863 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.232 -5.067 -7.995 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.030 -6.181 -6.902 1.00 0.00 H new ATOM 342 N THR A 26 -6.060 -3.981 -6.083 1.00 0.00 N ATOM 343 CA THR A 26 -6.629 -2.888 -5.303 1.00 0.00 C ATOM 344 C THR A 26 -6.388 -3.100 -3.812 1.00 0.00 C ATOM 345 O THR A 26 -6.938 -4.022 -3.209 1.00 0.00 O ATOM 346 CB THR A 26 -8.129 -2.765 -5.576 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.385 -2.744 -6.969 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.747 -1.520 -4.978 1.00 0.00 C ATOM 0 H THR A 26 -6.745 -4.532 -6.599 1.00 0.00 H new ATOM 0 HA THR A 26 -6.135 -1.965 -5.605 1.00 0.00 H new ATOM 0 HB THR A 26 -8.580 -3.638 -5.104 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.350 -2.667 -7.123 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.812 -1.495 -5.209 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.611 -1.529 -3.897 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.264 -0.637 -5.397 1.00 0.00 H new ATOM 356 N ILE A 27 -5.560 -2.242 -3.223 1.00 0.00 N ATOM 357 CA ILE A 27 -5.246 -2.337 -1.802 1.00 0.00 C ATOM 358 C ILE A 27 -5.480 -1.005 -1.098 1.00 0.00 C ATOM 359 O ILE A 27 -5.764 0.007 -1.740 1.00 0.00 O ATOM 360 CB ILE A 27 -3.785 -2.772 -1.578 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.827 -1.792 -2.257 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.567 -4.184 -2.102 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.536 -1.585 -1.497 1.00 0.00 C ATOM 0 H ILE A 27 -5.095 -1.474 -3.708 1.00 0.00 H new ATOM 0 HA ILE A 27 -5.911 -3.091 -1.380 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.580 -2.767 -0.507 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.596 -2.157 -3.258 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.327 -0.831 -2.376 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.530 -4.477 -1.937 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.227 -4.873 -1.576 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.787 -4.214 -3.169 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.905 -0.878 -2.037 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.757 -1.190 -0.505 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.014 -2.537 -1.401 1.00 0.00 H new ATOM 375 N ALA A 28 -5.360 -1.011 0.226 1.00 0.00 N ATOM 376 CA ALA A 28 -5.559 0.197 1.017 1.00 0.00 C ATOM 377 C ALA A 28 -4.395 0.423 1.976 1.00 0.00 C ATOM 378 O ALA A 28 -3.561 -0.461 2.174 1.00 0.00 O ATOM 379 CB ALA A 28 -6.870 0.114 1.785 1.00 0.00 C ATOM 0 H ALA A 28 -5.126 -1.839 0.773 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.603 1.046 0.335 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.006 1.023 2.372 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.697 0.008 1.083 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -6.847 -0.748 2.452 1.00 0.00 H new ATOM 385 N ILE A 29 -4.346 1.611 2.568 1.00 0.00 N ATOM 386 CA ILE A 29 -3.284 1.952 3.507 1.00 0.00 C ATOM 387 C ILE A 29 -3.820 2.793 4.661 1.00 0.00 C ATOM 388 O ILE A 29 -4.476 3.813 4.447 1.00 0.00 O ATOM 389 CB ILE A 29 -2.145 2.724 2.812 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.721 2.006 1.530 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.961 2.883 3.754 1.00 0.00 C ATOM 392 CD1 ILE A 29 -0.711 2.778 0.711 1.00 0.00 C ATOM 0 H ILE A 29 -5.028 2.353 2.415 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.892 1.012 3.896 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.508 3.717 2.546 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.300 1.035 1.789 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.604 1.818 0.919 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.165 3.430 3.249 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.273 3.434 4.641 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.595 1.899 4.048 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.456 2.209 -0.183 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.136 3.739 0.421 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.188 2.943 1.304 1.00 0.00 H new ATOM 404 N GLU A 30 -3.537 2.359 5.885 1.00 0.00 N ATOM 405 CA GLU A 30 -3.991 3.072 7.073 1.00 0.00 C ATOM 406 C GLU A 30 -2.810 3.496 7.938 1.00 0.00 C ATOM 407 O GLU A 30 -2.124 2.658 8.525 1.00 0.00 O ATOM 408 CB GLU A 30 -4.944 2.194 7.886 1.00 0.00 C ATOM 409 CG GLU A 30 -5.593 2.918 9.054 1.00 0.00 C ATOM 410 CD GLU A 30 -6.445 2.001 9.908 1.00 0.00 C ATOM 411 OE1 GLU A 30 -7.499 1.543 9.420 1.00 0.00 O ATOM 412 OE2 GLU A 30 -6.058 1.740 11.068 1.00 0.00 O ATOM 0 H GLU A 30 -2.995 1.517 6.080 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.520 3.968 6.748 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.724 1.813 7.227 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.396 1.331 8.264 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.817 3.368 9.673 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.210 3.732 8.674 1.00 0.00 H new ATOM 419 N MET A 31 -2.576 4.803 8.014 1.00 0.00 N ATOM 420 CA MET A 31 -1.477 5.339 8.808 1.00 0.00 C ATOM 421 C MET A 31 -1.920 5.601 10.243 1.00 0.00 C ATOM 422 O MET A 31 -1.312 5.104 11.192 1.00 0.00 O ATOM 423 CB MET A 31 -0.949 6.630 8.180 1.00 0.00 C ATOM 424 CG MET A 31 -0.383 6.439 6.781 1.00 0.00 C ATOM 425 SD MET A 31 -0.088 8.003 5.933 1.00 0.00 S ATOM 426 CE MET A 31 1.369 7.598 4.973 1.00 0.00 C ATOM 0 H MET A 31 -3.134 5.510 7.535 1.00 0.00 H new ATOM 0 HA MET A 31 -0.678 4.598 8.824 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.756 7.361 8.140 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.174 7.046 8.823 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.552 5.882 6.844 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.074 5.836 6.193 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.331 8.119 4.016 1.00 0.00 H new ATOM 0 HE2 MET A 31 2.261 7.906 5.518 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.403 6.522 4.800 1.00 0.00 H new ATOM 436 N ASP A 32 -2.982 6.385 10.396 1.00 0.00 N ATOM 437 CA ASP A 32 -3.507 6.713 11.717 1.00 0.00 C ATOM 438 C ASP A 32 -4.448 5.619 12.213 1.00 0.00 C ATOM 439 O ASP A 32 -4.692 4.632 11.519 1.00 0.00 O ATOM 440 CB ASP A 32 -4.236 8.058 11.678 1.00 0.00 C ATOM 441 CG ASP A 32 -3.531 9.120 12.499 1.00 0.00 C ATOM 442 OD1 ASP A 32 -2.297 9.253 12.367 1.00 0.00 O ATOM 443 OD2 ASP A 32 -4.215 9.821 13.275 1.00 0.00 O ATOM 0 H ASP A 32 -3.496 6.805 9.622 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.669 6.785 12.410 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -4.316 8.395 10.645 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.252 7.929 12.051 1.00 0.00 H new ATOM 448 N LYS A 33 -4.975 5.802 13.420 1.00 0.00 N ATOM 449 CA LYS A 33 -5.890 4.832 14.009 1.00 0.00 C ATOM 450 C LYS A 33 -7.287 4.971 13.417 1.00 0.00 C ATOM 451 O LYS A 33 -8.156 5.624 13.995 1.00 0.00 O ATOM 452 CB LYS A 33 -5.946 5.011 15.527 1.00 0.00 C ATOM 453 CG LYS A 33 -4.713 4.492 16.248 1.00 0.00 C ATOM 454 CD LYS A 33 -5.067 3.897 17.601 1.00 0.00 C ATOM 455 CE LYS A 33 -4.086 2.808 18.004 1.00 0.00 C ATOM 456 NZ LYS A 33 -2.702 3.335 18.155 1.00 0.00 N ATOM 0 H LYS A 33 -4.784 6.613 14.008 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.518 3.833 13.781 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.071 6.070 15.755 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.826 4.496 15.913 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.223 3.736 15.634 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.000 5.305 16.383 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.070 4.683 18.356 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.076 3.485 17.566 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.408 2.359 18.944 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.093 2.017 17.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.077 2.577 18.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.359 3.679 17.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.701 4.118 18.840 1.00 0.00 H new ATOM 470 N GLY A 34 -7.498 4.353 12.259 1.00 0.00 N ATOM 471 CA GLY A 34 -8.793 4.420 11.607 1.00 0.00 C ATOM 472 C GLY A 34 -8.791 5.344 10.406 1.00 0.00 C ATOM 473 O GLY A 34 -9.548 5.141 9.457 1.00 0.00 O ATOM 0 H GLY A 34 -6.795 3.807 11.761 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.089 3.420 11.291 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.540 4.762 12.324 1.00 0.00 H new ATOM 477 N ALA A 35 -7.939 6.363 10.446 1.00 0.00 N ATOM 478 CA ALA A 35 -7.842 7.321 9.352 1.00 0.00 C ATOM 479 C ALA A 35 -7.019 6.757 8.200 1.00 0.00 C ATOM 480 O ALA A 35 -6.081 5.989 8.411 1.00 0.00 O ATOM 481 CB ALA A 35 -7.235 8.626 9.847 1.00 0.00 C ATOM 0 H ALA A 35 -7.306 6.546 11.224 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.849 7.517 8.983 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -7.168 9.333 9.020 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.864 9.045 10.633 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.238 8.436 10.243 1.00 0.00 H new ATOM 487 N TYR A 36 -7.377 7.144 6.980 1.00 0.00 N ATOM 488 CA TYR A 36 -6.673 6.676 5.791 1.00 0.00 C ATOM 489 C TYR A 36 -6.064 7.846 5.025 1.00 0.00 C ATOM 490 O TYR A 36 -6.295 9.008 5.358 1.00 0.00 O ATOM 491 CB TYR A 36 -7.624 5.896 4.882 1.00 0.00 C ATOM 492 CG TYR A 36 -8.092 4.587 5.476 1.00 0.00 C ATOM 493 CD1 TYR A 36 -9.132 4.551 6.397 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.494 3.385 5.118 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.563 3.357 6.943 1.00 0.00 C ATOM 496 CE2 TYR A 36 -7.919 2.187 5.658 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.953 2.178 6.570 1.00 0.00 C ATOM 498 OH TYR A 36 -9.380 0.987 7.111 1.00 0.00 O ATOM 0 H TYR A 36 -8.151 7.781 6.789 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.867 6.016 6.113 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.493 6.516 4.661 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.125 5.697 3.933 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.612 5.473 6.691 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.683 3.388 4.405 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -10.373 3.347 7.658 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.444 1.262 5.367 1.00 0.00 H new ATOM 0 HH TYR A 36 -8.921 0.832 7.963 1.00 0.00 H new ATOM 508 N ILE A 37 -5.285 7.530 3.995 1.00 0.00 N ATOM 509 CA ILE A 37 -4.643 8.555 3.180 1.00 0.00 C ATOM 510 C ILE A 37 -5.635 9.184 2.208 1.00 0.00 C ATOM 511 O ILE A 37 -6.149 8.517 1.310 1.00 0.00 O ATOM 512 CB ILE A 37 -3.457 7.977 2.384 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.542 7.167 3.305 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.679 9.095 1.707 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.575 6.273 2.560 1.00 0.00 C ATOM 0 H ILE A 37 -5.083 6.573 3.705 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.274 9.319 3.864 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.846 7.312 1.613 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.978 7.852 3.937 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.155 6.555 3.966 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.844 8.671 1.149 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.336 9.634 1.024 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.298 9.782 2.462 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.958 5.729 3.275 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.133 5.564 1.948 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.937 6.881 1.919 1.00 0.00 H new ATOM 527 N HIS A 38 -5.900 10.473 2.393 1.00 0.00 N ATOM 528 CA HIS A 38 -6.831 11.193 1.532 1.00 0.00 C ATOM 529 C HIS A 38 -6.084 11.983 0.462 1.00 0.00 C ATOM 530 O HIS A 38 -5.212 12.795 0.770 1.00 0.00 O ATOM 531 CB HIS A 38 -7.701 12.137 2.364 1.00 0.00 C ATOM 532 CG HIS A 38 -9.119 12.217 1.891 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.953 11.128 1.777 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.850 13.292 1.500 1.00 0.00 C ATOM 535 CE1 HIS A 38 -11.138 11.563 1.329 1.00 0.00 C ATOM 536 NE2 HIS A 38 -11.129 12.869 1.144 1.00 0.00 N ATOM 0 H HIS A 38 -5.483 11.040 3.131 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.470 10.461 1.038 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.691 11.806 3.403 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -7.263 13.135 2.343 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -9.497 14.312 1.470 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.991 10.927 1.143 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.899 13.449 0.810 1.00 0.00 H new ATOM 544 N ALA A 39 -6.432 11.738 -0.798 1.00 0.00 N ATOM 545 CA ALA A 39 -5.794 12.426 -1.913 1.00 0.00 C ATOM 546 C ALA A 39 -6.492 13.748 -2.213 1.00 0.00 C ATOM 547 O ALA A 39 -7.704 13.875 -2.037 1.00 0.00 O ATOM 548 CB ALA A 39 -5.790 11.537 -3.148 1.00 0.00 C ATOM 0 H ALA A 39 -7.152 11.069 -1.071 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.764 12.644 -1.632 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.311 12.063 -3.973 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.241 10.620 -2.934 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.816 11.290 -3.422 1.00 0.00 H new ATOM 554 N LEU A 40 -5.719 14.731 -2.666 1.00 0.00 N ATOM 555 CA LEU A 40 -6.264 16.045 -2.990 1.00 0.00 C ATOM 556 C LEU A 40 -6.092 16.354 -4.474 1.00 0.00 C ATOM 557 O LEU A 40 -5.171 15.856 -5.120 1.00 0.00 O ATOM 558 CB LEU A 40 -5.580 17.124 -2.148 1.00 0.00 C ATOM 559 CG LEU A 40 -6.043 17.200 -0.693 1.00 0.00 C ATOM 560 CD1 LEU A 40 -5.131 18.113 0.110 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.484 17.682 -0.617 1.00 0.00 C ATOM 0 H LEU A 40 -4.714 14.642 -2.817 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.330 16.037 -2.761 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.505 16.947 -2.162 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.750 18.092 -2.618 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.992 16.200 -0.263 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.476 18.155 1.143 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.113 17.725 0.083 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.149 19.115 -0.319 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.797 17.730 0.426 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.560 18.673 -1.065 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.128 16.989 -1.158 1.00 0.00 H new ATOM 573 N ASP A 41 -6.986 17.181 -5.007 1.00 0.00 N ATOM 574 CA ASP A 41 -6.933 17.560 -6.415 1.00 0.00 C ATOM 575 C ASP A 41 -5.925 18.682 -6.643 1.00 0.00 C ATOM 576 O ASP A 41 -5.344 18.796 -7.722 1.00 0.00 O ATOM 577 CB ASP A 41 -8.318 17.996 -6.898 1.00 0.00 C ATOM 578 CG ASP A 41 -9.304 16.845 -6.940 1.00 0.00 C ATOM 579 OD1 ASP A 41 -8.970 15.799 -7.536 1.00 0.00 O ATOM 580 OD2 ASP A 41 -10.409 16.990 -6.378 1.00 0.00 O ATOM 0 H ASP A 41 -7.755 17.601 -4.486 1.00 0.00 H new ATOM 0 HA ASP A 41 -6.612 16.690 -6.987 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -8.701 18.775 -6.239 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.232 18.434 -7.893 1.00 0.00 H new ATOM 585 N ASN A 42 -5.722 19.507 -5.620 1.00 0.00 N ATOM 586 CA ASN A 42 -4.782 20.620 -5.710 1.00 0.00 C ATOM 587 C ASN A 42 -3.388 20.134 -6.098 1.00 0.00 C ATOM 588 O ASN A 42 -2.596 20.885 -6.668 1.00 0.00 O ATOM 589 CB ASN A 42 -4.720 21.369 -4.377 1.00 0.00 C ATOM 590 CG ASN A 42 -4.084 22.738 -4.511 1.00 0.00 C ATOM 591 OD1 ASN A 42 -4.291 23.436 -5.503 1.00 0.00 O ATOM 592 ND2 ASN A 42 -3.305 23.129 -3.509 1.00 0.00 N ATOM 0 H ASN A 42 -6.195 19.426 -4.720 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.137 21.297 -6.487 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.728 21.478 -3.977 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.154 20.778 -3.657 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -2.850 24.041 -3.543 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -3.162 22.517 -2.706 1.00 0.00 H new ATOM 599 N GLY A 43 -3.094 18.876 -5.786 1.00 0.00 N ATOM 600 CA GLY A 43 -1.796 18.315 -6.110 1.00 0.00 C ATOM 601 C GLY A 43 -1.012 17.912 -4.876 1.00 0.00 C ATOM 602 O GLY A 43 0.217 17.980 -4.864 1.00 0.00 O ATOM 0 H GLY A 43 -3.732 18.235 -5.314 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.930 17.444 -6.751 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.221 19.045 -6.680 1.00 0.00 H new ATOM 606 N LEU A 44 -1.726 17.492 -3.836 1.00 0.00 N ATOM 607 CA LEU A 44 -1.090 17.077 -2.592 1.00 0.00 C ATOM 608 C LEU A 44 -1.839 15.905 -1.965 1.00 0.00 C ATOM 609 O LEU A 44 -2.841 15.436 -2.505 1.00 0.00 O ATOM 610 CB LEU A 44 -1.036 18.247 -1.607 1.00 0.00 C ATOM 611 CG LEU A 44 -0.163 19.424 -2.047 1.00 0.00 C ATOM 612 CD1 LEU A 44 -0.811 20.746 -1.663 1.00 0.00 C ATOM 613 CD2 LEU A 44 1.227 19.314 -1.437 1.00 0.00 C ATOM 0 H LEU A 44 -2.744 17.430 -3.831 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.074 16.757 -2.821 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.051 18.609 -1.441 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.668 17.879 -0.649 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.067 19.392 -3.132 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.174 21.570 -1.985 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.784 20.829 -2.147 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.939 20.788 -0.581 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.834 20.159 -1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.149 19.319 -0.350 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.695 18.385 -1.763 1.00 0.00 H new ATOM 625 N PHE A 45 -1.345 15.436 -0.824 1.00 0.00 N ATOM 626 CA PHE A 45 -1.969 14.318 -0.125 1.00 0.00 C ATOM 627 C PHE A 45 -2.063 14.595 1.371 1.00 0.00 C ATOM 628 O PHE A 45 -1.048 14.782 2.044 1.00 0.00 O ATOM 629 CB PHE A 45 -1.177 13.032 -0.368 1.00 0.00 C ATOM 630 CG PHE A 45 -1.553 12.328 -1.641 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.270 12.896 -2.873 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.193 11.098 -1.606 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.615 12.252 -4.045 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.540 10.450 -2.775 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.252 11.027 -3.996 1.00 0.00 C ATOM 0 H PHE A 45 -0.516 15.812 -0.364 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.979 14.195 -0.517 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.113 13.269 -0.394 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.332 12.355 0.472 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.774 13.854 -2.917 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.422 10.642 -0.654 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.387 12.705 -4.998 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.037 9.492 -2.734 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.524 10.522 -4.911 1.00 0.00 H new ATOM 645 N THR A 46 -3.287 14.621 1.888 1.00 0.00 N ATOM 646 CA THR A 46 -3.516 14.874 3.305 1.00 0.00 C ATOM 647 C THR A 46 -4.209 13.687 3.965 1.00 0.00 C ATOM 648 O THR A 46 -4.846 12.876 3.295 1.00 0.00 O ATOM 649 CB THR A 46 -4.358 16.139 3.489 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.558 16.412 4.864 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.719 16.051 2.834 1.00 0.00 C ATOM 0 H THR A 46 -4.137 14.470 1.345 1.00 0.00 H new ATOM 0 HA THR A 46 -2.547 15.018 3.784 1.00 0.00 H new ATOM 0 HB THR A 46 -3.792 16.936 3.007 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.097 17.225 4.961 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.264 16.980 3.002 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.598 15.890 1.763 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.277 15.220 3.265 1.00 0.00 H new ATOM 659 N LEU A 47 -4.080 13.593 5.284 1.00 0.00 N ATOM 660 CA LEU A 47 -4.694 12.504 6.036 1.00 0.00 C ATOM 661 C LEU A 47 -6.196 12.723 6.184 1.00 0.00 C ATOM 662 O LEU A 47 -6.636 13.739 6.722 1.00 0.00 O ATOM 663 CB LEU A 47 -4.045 12.380 7.417 1.00 0.00 C ATOM 664 CG LEU A 47 -4.372 11.091 8.171 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.735 9.894 7.481 1.00 0.00 C ATOM 666 CD2 LEU A 47 -3.903 11.186 9.616 1.00 0.00 C ATOM 0 H LEU A 47 -3.556 14.257 5.854 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.534 11.579 5.483 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.963 12.451 7.301 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.357 13.229 8.026 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.453 10.954 8.168 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.978 8.985 8.031 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.117 9.815 6.463 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.653 10.023 7.454 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.144 10.260 10.138 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.825 11.346 9.639 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.404 12.020 10.107 1.00 0.00 H new ATOM 678 N GLY A 48 -6.979 11.763 5.704 1.00 0.00 N ATOM 679 CA GLY A 48 -8.423 11.869 5.793 1.00 0.00 C ATOM 680 C GLY A 48 -8.940 11.576 7.188 1.00 0.00 C ATOM 681 O GLY A 48 -8.197 11.100 8.046 1.00 0.00 O ATOM 0 H GLY A 48 -6.639 10.913 5.255 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.730 12.873 5.498 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.880 11.176 5.086 1.00 0.00 H new ATOM 685 N ALA A 49 -10.218 11.861 7.415 1.00 0.00 N ATOM 686 CA ALA A 49 -10.833 11.626 8.716 1.00 0.00 C ATOM 687 C ALA A 49 -11.168 10.148 8.905 1.00 0.00 C ATOM 688 O ALA A 49 -11.570 9.469 7.959 1.00 0.00 O ATOM 689 CB ALA A 49 -12.084 12.477 8.869 1.00 0.00 C ATOM 0 H ALA A 49 -10.847 12.255 6.716 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.117 11.911 9.487 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.533 12.292 9.845 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.819 13.531 8.786 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.797 12.219 8.086 1.00 0.00 H new ATOM 695 N PRO A 50 -11.007 9.627 10.134 1.00 0.00 N ATOM 696 CA PRO A 50 -11.295 8.222 10.439 1.00 0.00 C ATOM 697 C PRO A 50 -12.792 7.938 10.501 1.00 0.00 C ATOM 698 O PRO A 50 -13.612 8.853 10.423 1.00 0.00 O ATOM 699 CB PRO A 50 -10.657 8.024 11.813 1.00 0.00 C ATOM 700 CG PRO A 50 -10.699 9.374 12.444 1.00 0.00 C ATOM 701 CD PRO A 50 -10.532 10.364 11.322 1.00 0.00 C ATOM 0 HA PRO A 50 -10.910 7.549 9.673 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.208 7.293 12.404 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -9.634 7.658 11.726 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -11.643 9.531 12.965 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -9.905 9.484 13.182 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.118 11.267 11.494 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.493 10.674 11.212 1.00 0.00 H new ATOM 709 N HIS A 51 -13.142 6.664 10.640 1.00 0.00 N ATOM 710 CA HIS A 51 -14.541 6.257 10.713 1.00 0.00 C ATOM 711 C HIS A 51 -14.901 5.796 12.122 1.00 0.00 C ATOM 712 O HIS A 51 -14.079 5.202 12.820 1.00 0.00 O ATOM 713 CB HIS A 51 -14.822 5.138 9.710 1.00 0.00 C ATOM 714 CG HIS A 51 -14.357 5.447 8.321 1.00 0.00 C ATOM 715 ND1 HIS A 51 -14.985 6.394 7.550 1.00 0.00 N ATOM 716 CD2 HIS A 51 -13.330 4.913 7.616 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.334 6.417 6.401 1.00 0.00 C ATOM 718 NE2 HIS A 51 -13.322 5.535 6.394 1.00 0.00 N ATOM 0 H HIS A 51 -12.476 5.894 10.704 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.158 7.121 10.464 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -14.336 4.224 10.052 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.894 4.940 9.690 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.649 4.145 7.952 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.584 7.063 5.573 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.672 5.361 5.627 1.00 0.00 H new ATOM 726 N ARG A 52 -16.134 6.074 12.533 1.00 0.00 N ATOM 727 CA ARG A 52 -16.601 5.686 13.859 1.00 0.00 C ATOM 728 C ARG A 52 -16.868 4.187 13.926 1.00 0.00 C ATOM 729 O ARG A 52 -16.404 3.503 14.838 1.00 0.00 O ATOM 730 CB ARG A 52 -17.871 6.459 14.220 1.00 0.00 C ATOM 731 CG ARG A 52 -18.255 6.346 15.687 1.00 0.00 C ATOM 732 CD ARG A 52 -17.318 7.151 16.573 1.00 0.00 C ATOM 733 NE ARG A 52 -18.006 7.703 17.737 1.00 0.00 N ATOM 734 CZ ARG A 52 -17.380 8.183 18.810 1.00 0.00 C ATOM 735 NH1 ARG A 52 -16.054 8.180 18.870 1.00 0.00 N ATOM 736 NH2 ARG A 52 -18.082 8.667 19.825 1.00 0.00 N ATOM 0 H ARG A 52 -16.827 6.566 11.968 1.00 0.00 H new ATOM 0 HA ARG A 52 -15.818 5.928 14.578 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -17.730 7.510 13.970 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -18.695 6.093 13.608 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -19.278 6.697 15.824 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.234 5.299 15.990 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -16.497 6.515 16.905 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -16.878 7.962 15.993 1.00 0.00 H new ATOM 0 HE ARG A 52 -19.026 7.722 17.728 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -15.509 7.809 18.092 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -15.580 8.549 19.694 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -19.101 8.672 19.784 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -17.603 9.035 20.647 1.00 0.00 H new ATOM 750 N GLU A 53 -17.620 3.681 12.954 1.00 0.00 N ATOM 751 CA GLU A 53 -17.950 2.261 12.902 1.00 0.00 C ATOM 752 C GLU A 53 -16.745 1.439 12.457 1.00 0.00 C ATOM 753 O GLU A 53 -15.865 1.937 11.754 1.00 0.00 O ATOM 754 CB GLU A 53 -19.124 2.022 11.951 1.00 0.00 C ATOM 755 CG GLU A 53 -20.478 2.336 12.566 1.00 0.00 C ATOM 756 CD GLU A 53 -21.573 1.415 12.065 1.00 0.00 C ATOM 757 OE1 GLU A 53 -21.513 1.008 10.886 1.00 0.00 O ATOM 758 OE2 GLU A 53 -22.490 1.100 12.852 1.00 0.00 O ATOM 0 H GLU A 53 -18.013 4.233 12.191 1.00 0.00 H new ATOM 0 HA GLU A 53 -18.234 1.943 13.905 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.989 2.634 11.059 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -19.113 0.981 11.628 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -20.408 2.255 13.651 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.745 3.368 12.340 1.00 0.00 H new ATOM 765 N VAL A 54 -16.710 0.176 12.871 1.00 0.00 N ATOM 766 CA VAL A 54 -15.614 -0.716 12.514 1.00 0.00 C ATOM 767 C VAL A 54 -15.718 -1.159 11.060 1.00 0.00 C ATOM 768 O VAL A 54 -14.860 -0.835 10.238 1.00 0.00 O ATOM 769 CB VAL A 54 -15.586 -1.961 13.419 1.00 0.00 C ATOM 770 CG1 VAL A 54 -14.327 -2.777 13.167 1.00 0.00 C ATOM 771 CG2 VAL A 54 -15.689 -1.562 14.882 1.00 0.00 C ATOM 0 H VAL A 54 -17.429 -0.252 13.454 1.00 0.00 H new ATOM 0 HA VAL A 54 -14.690 -0.155 12.654 1.00 0.00 H new ATOM 0 HB VAL A 54 -16.448 -2.583 13.176 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -14.325 -3.653 13.816 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -14.303 -3.097 12.125 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -13.449 -2.167 13.379 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -15.668 -2.456 15.505 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -14.850 -0.917 15.143 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -16.624 -1.026 15.048 1.00 0.00 H new ATOM 781 N ASP A 55 -16.774 -1.903 10.746 1.00 0.00 N ATOM 782 CA ASP A 55 -16.990 -2.391 9.389 1.00 0.00 C ATOM 783 C ASP A 55 -17.332 -1.242 8.446 1.00 0.00 C ATOM 784 O ASP A 55 -18.503 -0.974 8.178 1.00 0.00 O ATOM 785 CB ASP A 55 -18.111 -3.432 9.371 1.00 0.00 C ATOM 786 CG ASP A 55 -17.587 -4.847 9.524 1.00 0.00 C ATOM 787 OD1 ASP A 55 -16.565 -5.174 8.885 1.00 0.00 O ATOM 788 OD2 ASP A 55 -18.200 -5.628 10.282 1.00 0.00 O ATOM 0 H ASP A 55 -17.494 -2.181 11.413 1.00 0.00 H new ATOM 0 HA ASP A 55 -16.066 -2.857 9.046 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -18.814 -3.219 10.176 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -18.664 -3.351 8.435 1.00 0.00 H new ATOM 793 N GLU A 56 -16.303 -0.567 7.946 1.00 0.00 N ATOM 794 CA GLU A 56 -16.494 0.553 7.032 1.00 0.00 C ATOM 795 C GLU A 56 -15.368 0.618 6.005 1.00 0.00 C ATOM 796 O GLU A 56 -14.195 0.733 6.362 1.00 0.00 O ATOM 797 CB GLU A 56 -16.565 1.868 7.813 1.00 0.00 C ATOM 798 CG GLU A 56 -17.939 2.156 8.395 1.00 0.00 C ATOM 799 CD GLU A 56 -18.644 3.299 7.689 1.00 0.00 C ATOM 800 OE1 GLU A 56 -18.758 3.249 6.447 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.082 4.243 8.380 1.00 0.00 O ATOM 0 H GLU A 56 -15.327 -0.776 8.158 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.434 0.401 6.502 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -15.835 1.840 8.622 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.279 2.688 7.154 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -18.553 1.258 8.328 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.838 2.395 9.454 1.00 0.00 H new ATOM 808 N GLY A 57 -15.733 0.543 4.730 1.00 0.00 N ATOM 809 CA GLY A 57 -14.742 0.596 3.671 1.00 0.00 C ATOM 810 C GLY A 57 -14.256 2.007 3.400 1.00 0.00 C ATOM 811 O GLY A 57 -14.955 2.974 3.702 1.00 0.00 O ATOM 0 H GLY A 57 -16.697 0.446 4.411 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.893 -0.032 3.941 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.168 0.180 2.758 1.00 0.00 H new ATOM 815 N PRO A 58 -13.049 2.159 2.826 1.00 0.00 N ATOM 816 CA PRO A 58 -12.482 3.476 2.520 1.00 0.00 C ATOM 817 C PRO A 58 -13.214 4.171 1.377 1.00 0.00 C ATOM 818 O PRO A 58 -13.962 3.540 0.629 1.00 0.00 O ATOM 819 CB PRO A 58 -11.041 3.158 2.117 1.00 0.00 C ATOM 820 CG PRO A 58 -11.088 1.755 1.619 1.00 0.00 C ATOM 821 CD PRO A 58 -12.146 1.061 2.432 1.00 0.00 C ATOM 0 HA PRO A 58 -12.561 4.160 3.365 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.686 3.841 1.345 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.362 3.255 2.964 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.331 1.726 0.557 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.121 1.266 1.738 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.667 0.302 1.849 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.720 0.559 3.301 1.00 0.00 H new ATOM 829 N SER A 59 -12.993 5.474 1.246 1.00 0.00 N ATOM 830 CA SER A 59 -13.629 6.259 0.194 1.00 0.00 C ATOM 831 C SER A 59 -12.995 5.965 -1.164 1.00 0.00 C ATOM 832 O SER A 59 -11.885 5.438 -1.238 1.00 0.00 O ATOM 833 CB SER A 59 -13.523 7.752 0.511 1.00 0.00 C ATOM 834 OG SER A 59 -14.735 8.425 0.218 1.00 0.00 O ATOM 0 H SER A 59 -12.377 6.010 1.857 1.00 0.00 H new ATOM 0 HA SER A 59 -14.681 5.979 0.149 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.275 7.886 1.564 1.00 0.00 H new ATOM 0 HB3 SER A 59 -12.710 8.192 -0.067 1.00 0.00 H new ATOM 0 HG SER A 59 -14.640 9.377 0.431 1.00 0.00 H new ATOM 840 N PRO A 60 -13.695 6.303 -2.262 1.00 0.00 N ATOM 841 CA PRO A 60 -13.193 6.072 -3.620 1.00 0.00 C ATOM 842 C PRO A 60 -11.775 6.607 -3.824 1.00 0.00 C ATOM 843 O PRO A 60 -10.906 5.891 -4.322 1.00 0.00 O ATOM 844 CB PRO A 60 -14.189 6.826 -4.503 1.00 0.00 C ATOM 845 CG PRO A 60 -15.448 6.863 -3.708 1.00 0.00 C ATOM 846 CD PRO A 60 -15.028 6.936 -2.266 1.00 0.00 C ATOM 0 HA PRO A 60 -13.123 5.009 -3.849 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.835 7.831 -4.730 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -14.337 6.318 -5.456 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -16.056 7.725 -3.981 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -16.052 5.975 -3.894 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -14.984 7.966 -1.913 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.726 6.406 -1.618 1.00 0.00 H new ATOM 854 N PRO A 61 -11.513 7.874 -3.446 1.00 0.00 N ATOM 855 CA PRO A 61 -10.183 8.476 -3.602 1.00 0.00 C ATOM 856 C PRO A 61 -9.145 7.828 -2.689 1.00 0.00 C ATOM 857 O PRO A 61 -7.950 7.849 -2.981 1.00 0.00 O ATOM 858 CB PRO A 61 -10.400 9.939 -3.211 1.00 0.00 C ATOM 859 CG PRO A 61 -11.599 9.925 -2.330 1.00 0.00 C ATOM 860 CD PRO A 61 -12.475 8.816 -2.840 1.00 0.00 C ATOM 0 HA PRO A 61 -9.796 8.348 -4.613 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.531 10.342 -2.690 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.562 10.563 -4.090 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.318 9.753 -1.291 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.120 10.882 -2.365 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.042 8.349 -2.035 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.198 9.178 -3.571 1.00 0.00 H new ATOM 868 N GLU A 62 -9.611 7.251 -1.587 1.00 0.00 N ATOM 869 CA GLU A 62 -8.721 6.595 -0.634 1.00 0.00 C ATOM 870 C GLU A 62 -8.286 5.228 -1.151 1.00 0.00 C ATOM 871 O GLU A 62 -7.179 4.770 -0.871 1.00 0.00 O ATOM 872 CB GLU A 62 -9.413 6.443 0.722 1.00 0.00 C ATOM 873 CG GLU A 62 -9.614 7.761 1.453 1.00 0.00 C ATOM 874 CD GLU A 62 -10.586 7.642 2.612 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.888 6.500 3.020 1.00 0.00 O ATOM 876 OE2 GLU A 62 -11.044 8.691 3.113 1.00 0.00 O ATOM 0 H GLU A 62 -10.598 7.224 -1.331 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.835 7.218 -0.514 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.383 5.967 0.575 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.822 5.775 1.349 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.653 8.117 1.824 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.981 8.510 0.751 1.00 0.00 H new ATOM 883 N GLN A 63 -9.165 4.581 -1.909 1.00 0.00 N ATOM 884 CA GLN A 63 -8.873 3.265 -2.467 1.00 0.00 C ATOM 885 C GLN A 63 -7.751 3.348 -3.497 1.00 0.00 C ATOM 886 O GLN A 63 -7.918 3.939 -4.565 1.00 0.00 O ATOM 887 CB GLN A 63 -10.128 2.671 -3.109 1.00 0.00 C ATOM 888 CG GLN A 63 -11.200 2.282 -2.104 1.00 0.00 C ATOM 889 CD GLN A 63 -12.334 1.497 -2.735 1.00 0.00 C ATOM 890 OE1 GLN A 63 -12.276 1.138 -3.911 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.373 1.228 -1.954 1.00 0.00 N ATOM 0 H GLN A 63 -10.086 4.946 -2.151 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.548 2.616 -1.654 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.544 3.394 -3.810 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.848 1.791 -3.688 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.749 1.687 -1.310 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -11.601 3.183 -1.639 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.378 1.546 -0.985 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.166 0.704 -2.323 1.00 0.00 H new ATOM 900 N PHE A 64 -6.610 2.750 -3.172 1.00 0.00 N ATOM 901 CA PHE A 64 -5.461 2.756 -4.070 1.00 0.00 C ATOM 902 C PHE A 64 -5.365 1.442 -4.839 1.00 0.00 C ATOM 903 O PHE A 64 -6.163 0.528 -4.627 1.00 0.00 O ATOM 904 CB PHE A 64 -4.172 2.994 -3.282 1.00 0.00 C ATOM 905 CG PHE A 64 -4.104 4.351 -2.640 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.673 5.453 -3.360 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.472 4.523 -1.315 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.609 6.701 -2.772 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.410 5.770 -0.722 1.00 0.00 C ATOM 910 CZ PHE A 64 -3.978 6.861 -1.451 1.00 0.00 C ATOM 0 H PHE A 64 -6.456 2.255 -2.294 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.596 3.567 -4.786 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.082 2.230 -2.509 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.319 2.874 -3.950 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.383 5.335 -4.394 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.811 3.674 -0.740 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.270 7.551 -3.345 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.699 5.891 0.311 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.929 7.836 -0.989 1.00 0.00 H new ATOM 920 N THR A 65 -4.386 1.355 -5.733 1.00 0.00 N ATOM 921 CA THR A 65 -4.187 0.152 -6.533 1.00 0.00 C ATOM 922 C THR A 65 -2.705 -0.186 -6.650 1.00 0.00 C ATOM 923 O THR A 65 -1.919 0.596 -7.185 1.00 0.00 O ATOM 924 CB THR A 65 -4.790 0.337 -7.926 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.947 1.152 -7.868 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.181 -0.967 -8.587 1.00 0.00 C ATOM 0 H THR A 65 -3.718 2.103 -5.922 1.00 0.00 H new ATOM 0 HA THR A 65 -4.691 -0.675 -6.032 1.00 0.00 H new ATOM 0 HB THR A 65 -4.005 0.806 -8.520 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.317 1.260 -8.769 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.602 -0.764 -9.572 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.300 -1.600 -8.692 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.923 -1.478 -7.974 1.00 0.00 H new ATOM 934 N ALA A 66 -2.328 -1.356 -6.146 1.00 0.00 N ATOM 935 CA ALA A 66 -0.940 -1.799 -6.194 1.00 0.00 C ATOM 936 C ALA A 66 -0.675 -2.639 -7.438 1.00 0.00 C ATOM 937 O ALA A 66 -1.459 -3.524 -7.780 1.00 0.00 O ATOM 938 CB ALA A 66 -0.594 -2.587 -4.940 1.00 0.00 C ATOM 0 H ALA A 66 -2.965 -2.015 -5.699 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.304 -0.915 -6.242 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.445 -2.912 -4.989 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.736 -1.956 -4.063 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.243 -3.459 -4.868 1.00 0.00 H new ATOM 944 N VAL A 67 0.434 -2.355 -8.112 1.00 0.00 N ATOM 945 CA VAL A 67 0.802 -3.084 -9.320 1.00 0.00 C ATOM 946 C VAL A 67 2.229 -3.616 -9.228 1.00 0.00 C ATOM 947 O VAL A 67 3.170 -2.856 -8.997 1.00 0.00 O ATOM 948 CB VAL A 67 0.675 -2.198 -10.574 1.00 0.00 C ATOM 949 CG1 VAL A 67 0.910 -3.016 -11.835 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.686 -1.520 -10.617 1.00 0.00 C ATOM 0 H VAL A 67 1.094 -1.625 -7.842 1.00 0.00 H new ATOM 0 HA VAL A 67 0.110 -3.921 -9.406 1.00 0.00 H new ATOM 0 HB VAL A 67 1.440 -1.423 -10.524 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.816 -2.372 -12.709 1.00 0.00 H new ATOM 0 HG12 VAL A 67 1.911 -3.447 -11.808 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.172 -3.816 -11.893 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.755 -0.899 -11.510 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.469 -2.278 -10.640 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.810 -0.897 -9.731 1.00 0.00 H new ATOM 960 N LYS A 68 2.381 -4.923 -9.412 1.00 0.00 N ATOM 961 CA LYS A 68 3.694 -5.555 -9.352 1.00 0.00 C ATOM 962 C LYS A 68 4.597 -5.037 -10.466 1.00 0.00 C ATOM 963 O LYS A 68 4.119 -4.616 -11.520 1.00 0.00 O ATOM 964 CB LYS A 68 3.556 -7.075 -9.457 1.00 0.00 C ATOM 965 CG LYS A 68 3.061 -7.730 -8.178 1.00 0.00 C ATOM 966 CD LYS A 68 3.262 -9.237 -8.213 1.00 0.00 C ATOM 967 CE LYS A 68 4.708 -9.617 -7.932 1.00 0.00 C ATOM 968 NZ LYS A 68 5.305 -10.396 -9.052 1.00 0.00 N ATOM 0 H LYS A 68 1.612 -5.565 -9.604 1.00 0.00 H new ATOM 0 HA LYS A 68 4.148 -5.304 -8.394 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.868 -7.314 -10.268 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.523 -7.502 -9.723 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.592 -7.310 -7.323 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.004 -7.506 -8.038 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.612 -9.708 -7.476 1.00 0.00 H new ATOM 0 HD3 LYS A 68 2.968 -9.621 -9.190 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.295 -8.714 -7.765 1.00 0.00 H new ATOM 0 HE3 LYS A 68 4.758 -10.204 -7.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.291 -10.635 -8.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.761 -11.270 -9.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.281 -9.827 -9.922 1.00 0.00 H new ATOM 982 N LEU A 69 5.904 -5.072 -10.229 1.00 0.00 N ATOM 983 CA LEU A 69 6.871 -4.606 -11.215 1.00 0.00 C ATOM 984 C LEU A 69 8.097 -5.514 -11.249 1.00 0.00 C ATOM 985 O LEU A 69 8.277 -6.294 -12.184 1.00 0.00 O ATOM 986 CB LEU A 69 7.291 -3.166 -10.908 1.00 0.00 C ATOM 987 CG LEU A 69 6.142 -2.160 -10.834 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.528 -0.972 -9.967 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.749 -1.697 -12.229 1.00 0.00 C ATOM 0 H LEU A 69 6.317 -5.418 -9.363 1.00 0.00 H new ATOM 0 HA LEU A 69 6.396 -4.636 -12.195 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.826 -3.154 -9.959 1.00 0.00 H new ATOM 0 HB3 LEU A 69 7.993 -2.837 -11.674 1.00 0.00 H new ATOM 0 HG LEU A 69 5.282 -2.652 -10.379 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.698 -0.267 -9.926 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.761 -1.317 -8.960 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.402 -0.479 -10.393 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.930 -0.981 -12.158 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.605 -1.222 -12.709 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.431 -2.555 -12.821 1.00 0.00 H new ATOM 1001 N SER A 70 8.939 -5.409 -10.224 1.00 0.00 N ATOM 1002 CA SER A 70 10.147 -6.222 -10.138 1.00 0.00 C ATOM 1003 C SER A 70 10.928 -5.901 -8.868 1.00 0.00 C ATOM 1004 O SER A 70 10.823 -4.801 -8.325 1.00 0.00 O ATOM 1005 CB SER A 70 11.031 -5.994 -11.366 1.00 0.00 C ATOM 1006 OG SER A 70 10.756 -6.948 -12.377 1.00 0.00 O ATOM 0 H SER A 70 8.806 -4.768 -9.442 1.00 0.00 H new ATOM 0 HA SER A 70 9.848 -7.270 -10.105 1.00 0.00 H new ATOM 0 HB2 SER A 70 10.866 -4.989 -11.755 1.00 0.00 H new ATOM 0 HB3 SER A 70 12.081 -6.056 -11.079 1.00 0.00 H new ATOM 0 HG SER A 70 9.839 -6.827 -12.700 1.00 0.00 H new ATOM 1012 N ASP A 71 11.714 -6.866 -8.402 1.00 0.00 N ATOM 1013 CA ASP A 71 12.516 -6.685 -7.197 1.00 0.00 C ATOM 1014 C ASP A 71 11.628 -6.438 -5.980 1.00 0.00 C ATOM 1015 O ASP A 71 11.994 -5.688 -5.075 1.00 0.00 O ATOM 1016 CB ASP A 71 13.490 -5.520 -7.376 1.00 0.00 C ATOM 1017 CG ASP A 71 14.294 -5.631 -8.657 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.120 -6.563 -8.761 1.00 0.00 O ATOM 1019 OD2 ASP A 71 14.097 -4.788 -9.557 1.00 0.00 O ATOM 0 H ASP A 71 11.813 -7.782 -8.840 1.00 0.00 H new ATOM 0 HA ASP A 71 13.082 -7.601 -7.030 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.934 -4.582 -7.379 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.170 -5.485 -6.525 1.00 0.00 H new ATOM 1024 N SER A 72 10.461 -7.074 -5.967 1.00 0.00 N ATOM 1025 CA SER A 72 9.522 -6.923 -4.861 1.00 0.00 C ATOM 1026 C SER A 72 9.076 -5.472 -4.717 1.00 0.00 C ATOM 1027 O SER A 72 8.926 -4.965 -3.606 1.00 0.00 O ATOM 1028 CB SER A 72 10.157 -7.407 -3.556 1.00 0.00 C ATOM 1029 OG SER A 72 10.164 -8.823 -3.485 1.00 0.00 O ATOM 0 H SER A 72 10.143 -7.698 -6.709 1.00 0.00 H new ATOM 0 HA SER A 72 8.644 -7.532 -5.078 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.178 -7.031 -3.484 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.607 -7.000 -2.708 1.00 0.00 H new ATOM 0 HG SER A 72 10.577 -9.106 -2.642 1.00 0.00 H new ATOM 1035 N ARG A 73 8.866 -4.808 -5.850 1.00 0.00 N ATOM 1036 CA ARG A 73 8.437 -3.414 -5.850 1.00 0.00 C ATOM 1037 C ARG A 73 7.051 -3.274 -6.472 1.00 0.00 C ATOM 1038 O ARG A 73 6.778 -3.828 -7.536 1.00 0.00 O ATOM 1039 CB ARG A 73 9.442 -2.551 -6.616 1.00 0.00 C ATOM 1040 CG ARG A 73 10.882 -2.752 -6.171 1.00 0.00 C ATOM 1041 CD ARG A 73 11.046 -2.515 -4.677 1.00 0.00 C ATOM 1042 NE ARG A 73 12.075 -1.517 -4.392 1.00 0.00 N ATOM 1043 CZ ARG A 73 11.881 -0.204 -4.481 1.00 0.00 C ATOM 1044 NH1 ARG A 73 10.697 0.277 -4.841 1.00 0.00 N ATOM 1045 NH2 ARG A 73 12.873 0.633 -4.207 1.00 0.00 N ATOM 0 H ARG A 73 8.986 -5.213 -6.779 1.00 0.00 H new ATOM 0 HA ARG A 73 8.389 -3.072 -4.816 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.365 -2.776 -7.680 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.175 -1.501 -6.492 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.201 -3.765 -6.416 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.532 -2.071 -6.721 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.096 -2.187 -4.255 1.00 0.00 H new ATOM 0 HD3 ARG A 73 11.305 -3.454 -4.187 1.00 0.00 H new ATOM 0 HE ARG A 73 12.997 -1.847 -4.108 1.00 0.00 H new ATOM 0 HH11 ARG A 73 9.930 -0.361 -5.051 1.00 0.00 H new ATOM 0 HH12 ARG A 73 10.555 1.285 -4.907 1.00 0.00 H new ATOM 0 HH21 ARG A 73 13.784 0.270 -3.928 1.00 0.00 H new ATOM 0 HH22 ARG A 73 12.724 1.640 -4.275 1.00 0.00 H new ATOM 1059 N ILE A 74 6.181 -2.527 -5.800 1.00 0.00 N ATOM 1060 CA ILE A 74 4.823 -2.314 -6.287 1.00 0.00 C ATOM 1061 C ILE A 74 4.515 -0.826 -6.419 1.00 0.00 C ATOM 1062 O ILE A 74 4.903 -0.023 -5.570 1.00 0.00 O ATOM 1063 CB ILE A 74 3.782 -2.960 -5.353 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.005 -2.507 -3.910 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.850 -4.477 -5.455 1.00 0.00 C ATOM 1066 CD1 ILE A 74 2.722 -2.299 -3.137 1.00 0.00 C ATOM 0 H ILE A 74 6.392 -2.060 -4.918 1.00 0.00 H new ATOM 0 HA ILE A 74 4.761 -2.785 -7.268 1.00 0.00 H new ATOM 0 HB ILE A 74 2.788 -2.637 -5.663 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.614 -3.250 -3.395 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.573 -1.576 -3.913 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.109 -4.920 -4.790 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.645 -4.782 -6.481 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.845 -4.817 -5.167 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.957 -1.978 -2.122 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.121 -1.535 -3.629 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.163 -3.234 -3.102 1.00 0.00 H new ATOM 1078 N ALA A 75 3.815 -0.465 -7.490 1.00 0.00 N ATOM 1079 CA ALA A 75 3.453 0.926 -7.733 1.00 0.00 C ATOM 1080 C ALA A 75 2.065 1.237 -7.185 1.00 0.00 C ATOM 1081 O ALA A 75 1.099 0.535 -7.481 1.00 0.00 O ATOM 1082 CB ALA A 75 3.517 1.233 -9.222 1.00 0.00 C ATOM 0 H ALA A 75 3.487 -1.117 -8.203 1.00 0.00 H new ATOM 0 HA ALA A 75 4.170 1.560 -7.210 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.245 2.275 -9.391 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.530 1.059 -9.586 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.823 0.585 -9.757 1.00 0.00 H new ATOM 1088 N LEU A 76 1.974 2.294 -6.385 1.00 0.00 N ATOM 1089 CA LEU A 76 0.703 2.699 -5.795 1.00 0.00 C ATOM 1090 C LEU A 76 -0.040 3.665 -6.711 1.00 0.00 C ATOM 1091 O LEU A 76 0.537 4.634 -7.206 1.00 0.00 O ATOM 1092 CB LEU A 76 0.935 3.349 -4.430 1.00 0.00 C ATOM 1093 CG LEU A 76 1.067 2.371 -3.260 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.718 3.052 -2.068 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.296 1.813 -2.879 1.00 0.00 C ATOM 0 H LEU A 76 2.765 2.886 -6.130 1.00 0.00 H new ATOM 0 HA LEU A 76 0.091 1.806 -5.666 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.840 3.954 -4.482 1.00 0.00 H new ATOM 0 HB3 LEU A 76 0.109 4.029 -4.223 1.00 0.00 H new ATOM 0 HG LEU A 76 1.704 1.543 -3.571 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.804 2.342 -1.245 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.711 3.405 -2.348 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.107 3.899 -1.754 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.185 1.119 -2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -0.955 2.630 -2.586 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.726 1.289 -3.733 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.322 3.396 -6.931 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.146 4.243 -7.787 1.00 0.00 C ATOM 1109 C LYS A 77 -3.313 4.835 -7.003 1.00 0.00 C ATOM 1110 O LYS A 77 -3.994 4.131 -6.258 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.672 3.441 -8.979 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.274 4.307 -10.074 1.00 0.00 C ATOM 1113 CD LYS A 77 -3.120 3.662 -11.442 1.00 0.00 C ATOM 1114 CE LYS A 77 -2.807 4.695 -12.513 1.00 0.00 C ATOM 1115 NZ LYS A 77 -3.078 4.175 -13.882 1.00 0.00 N ATOM 0 H LYS A 77 -1.814 2.598 -6.529 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.525 5.060 -8.154 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.856 2.853 -9.399 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.426 2.736 -8.628 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.331 4.475 -9.867 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.790 5.284 -10.074 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.323 2.919 -11.408 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.037 3.134 -11.702 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -3.404 5.590 -12.340 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -1.761 4.991 -12.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.852 4.909 -14.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.489 3.336 -14.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.082 3.917 -13.963 1.00 0.00 H new ATOM 1129 N SER A 78 -3.537 6.133 -7.177 1.00 0.00 N ATOM 1130 CA SER A 78 -4.622 6.820 -6.486 1.00 0.00 C ATOM 1131 C SER A 78 -5.955 6.581 -7.189 1.00 0.00 C ATOM 1132 O SER A 78 -6.001 6.382 -8.403 1.00 0.00 O ATOM 1133 CB SER A 78 -4.336 8.321 -6.410 1.00 0.00 C ATOM 1134 OG SER A 78 -3.978 8.838 -7.681 1.00 0.00 O ATOM 0 H SER A 78 -2.982 6.730 -7.790 1.00 0.00 H new ATOM 0 HA SER A 78 -4.687 6.416 -5.476 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.217 8.844 -6.036 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.531 8.505 -5.699 1.00 0.00 H new ATOM 0 HG SER A 78 -3.370 9.598 -7.566 1.00 0.00 H new ATOM 1140 N GLY A 79 -7.035 6.600 -6.416 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.355 6.383 -6.981 1.00 0.00 C ATOM 1142 C GLY A 79 -8.708 7.408 -8.041 1.00 0.00 C ATOM 1143 O GLY A 79 -9.448 7.110 -8.979 1.00 0.00 O ATOM 0 H GLY A 79 -7.021 6.762 -5.409 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.401 5.385 -7.416 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.098 6.418 -6.184 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.179 8.617 -7.892 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.444 9.690 -8.843 1.00 0.00 C ATOM 1149 C TYR A 80 -7.954 9.314 -10.239 1.00 0.00 C ATOM 1150 O TYR A 80 -8.528 9.735 -11.243 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.772 10.985 -8.384 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.502 11.682 -7.259 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.853 11.988 -7.366 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -7.840 12.036 -6.090 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.523 12.626 -6.339 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -8.504 12.673 -5.059 1.00 0.00 C ATOM 1157 CZ TYR A 80 -9.845 12.967 -5.189 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.509 13.601 -4.165 1.00 0.00 O ATOM 0 H TYR A 80 -7.564 8.879 -7.122 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.522 9.845 -8.886 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.755 10.762 -8.062 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.696 11.665 -9.232 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -10.388 11.723 -8.266 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -6.789 11.810 -5.985 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.574 12.856 -6.438 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -7.975 12.939 -4.156 1.00 0.00 H new ATOM 0 HH TYR A 80 -9.887 13.770 -3.427 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.890 8.518 -10.293 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.341 8.098 -11.569 1.00 0.00 C ATOM 1170 C GLY A 81 -4.934 8.615 -11.796 1.00 0.00 C ATOM 1171 O GLY A 81 -4.615 9.113 -12.876 1.00 0.00 O ATOM 0 H GLY A 81 -6.399 8.157 -9.476 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.336 7.009 -11.618 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.988 8.450 -12.372 1.00 0.00 H new ATOM 1175 N LYS A 82 -4.090 8.495 -10.777 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.709 8.955 -10.871 1.00 0.00 C ATOM 1177 C LYS A 82 -1.781 8.062 -10.053 1.00 0.00 C ATOM 1178 O LYS A 82 -2.233 7.283 -9.214 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.598 10.403 -10.389 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.962 11.427 -11.451 1.00 0.00 C ATOM 1181 CD LYS A 82 -2.858 12.846 -10.914 1.00 0.00 C ATOM 1182 CE LYS A 82 -3.805 13.787 -11.641 1.00 0.00 C ATOM 1183 NZ LYS A 82 -3.141 14.468 -12.786 1.00 0.00 N ATOM 0 H LYS A 82 -4.337 8.084 -9.877 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.405 8.903 -11.917 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.249 10.541 -9.525 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.578 10.588 -10.052 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.301 11.312 -12.310 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.977 11.243 -11.803 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.086 12.850 -9.848 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -1.834 13.203 -11.022 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.667 13.226 -12.003 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.181 14.535 -10.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.820 15.101 -13.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -2.333 15.024 -12.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.805 13.756 -13.466 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.481 8.181 -10.304 1.00 0.00 N ATOM 1198 CA TYR A 83 0.511 7.385 -9.590 1.00 0.00 C ATOM 1199 C TYR A 83 1.114 8.178 -8.436 1.00 0.00 C ATOM 1200 O TYR A 83 1.393 9.370 -8.566 1.00 0.00 O ATOM 1201 CB TYR A 83 1.618 6.935 -10.546 1.00 0.00 C ATOM 1202 CG TYR A 83 1.254 5.717 -11.364 1.00 0.00 C ATOM 1203 CD1 TYR A 83 1.233 4.451 -10.790 1.00 0.00 C ATOM 1204 CD2 TYR A 83 0.932 5.831 -12.710 1.00 0.00 C ATOM 1205 CE1 TYR A 83 0.900 3.336 -11.535 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.599 4.721 -13.462 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.585 3.476 -12.870 1.00 0.00 C ATOM 1208 OH TYR A 83 0.253 2.368 -13.614 1.00 0.00 O ATOM 0 H TYR A 83 -0.090 8.820 -10.996 1.00 0.00 H new ATOM 0 HA TYR A 83 0.011 6.506 -9.183 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.860 7.756 -11.221 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.518 6.720 -9.970 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.481 4.337 -9.745 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.942 6.805 -13.177 1.00 0.00 H new ATOM 0 HE1 TYR A 83 0.887 2.360 -11.074 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.351 4.828 -14.508 1.00 0.00 H new ATOM 0 HH TYR A 83 0.057 2.639 -14.535 1.00 0.00 H new ATOM 1218 N LEU A 84 1.312 7.509 -7.305 1.00 0.00 N ATOM 1219 CA LEU A 84 1.881 8.152 -6.127 1.00 0.00 C ATOM 1220 C LEU A 84 3.397 8.272 -6.251 1.00 0.00 C ATOM 1221 O LEU A 84 4.118 7.278 -6.166 1.00 0.00 O ATOM 1222 CB LEU A 84 1.523 7.363 -4.865 1.00 0.00 C ATOM 1223 CG LEU A 84 0.028 7.121 -4.657 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.214 6.377 -3.352 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.733 8.437 -4.671 1.00 0.00 C ATOM 0 H LEU A 84 1.087 6.522 -7.180 1.00 0.00 H new ATOM 0 HA LEU A 84 1.459 9.154 -6.053 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.030 6.399 -4.901 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.914 7.896 -3.998 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.339 6.505 -5.478 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.283 6.213 -3.220 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.300 5.416 -3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.168 6.968 -2.520 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.795 8.245 -4.522 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.364 9.079 -3.871 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.586 8.932 -5.631 1.00 0.00 H new ATOM 1237 N GLY A 85 3.874 9.496 -6.455 1.00 0.00 N ATOM 1238 CA GLY A 85 5.301 9.724 -6.589 1.00 0.00 C ATOM 1239 C GLY A 85 5.857 10.594 -5.480 1.00 0.00 C ATOM 1240 O GLY A 85 5.142 11.420 -4.913 1.00 0.00 O ATOM 0 H GLY A 85 3.297 10.334 -6.530 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.820 8.766 -6.589 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.501 10.195 -7.551 1.00 0.00 H new ATOM 1244 N ILE A 86 7.136 10.409 -5.170 1.00 0.00 N ATOM 1245 CA ILE A 86 7.788 11.184 -4.121 1.00 0.00 C ATOM 1246 C ILE A 86 8.563 12.361 -4.706 1.00 0.00 C ATOM 1247 O ILE A 86 9.263 12.218 -5.708 1.00 0.00 O ATOM 1248 CB ILE A 86 8.752 10.312 -3.293 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.682 9.523 -4.217 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.970 9.371 -2.389 1.00 0.00 C ATOM 1251 CD1 ILE A 86 10.923 9.003 -3.523 1.00 0.00 C ATOM 0 H ILE A 86 7.741 9.729 -5.630 1.00 0.00 H new ATOM 0 HA ILE A 86 6.998 11.559 -3.470 1.00 0.00 H new ATOM 0 HB ILE A 86 9.361 10.963 -2.666 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.133 8.682 -4.641 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.981 10.160 -5.049 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.664 8.762 -1.810 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.346 9.953 -1.711 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.339 8.723 -2.997 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.536 8.454 -4.237 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.494 9.841 -3.123 1.00 0.00 H new ATOM 0 HD13 ILE A 86 10.633 8.340 -2.708 1.00 0.00 H new ATOM 1263 N ASN A 87 8.430 13.522 -4.075 1.00 0.00 N ATOM 1264 CA ASN A 87 9.117 14.724 -4.534 1.00 0.00 C ATOM 1265 C ASN A 87 10.587 14.700 -4.124 1.00 0.00 C ATOM 1266 O ASN A 87 11.031 13.795 -3.419 1.00 0.00 O ATOM 1267 CB ASN A 87 8.437 15.972 -3.967 1.00 0.00 C ATOM 1268 CG ASN A 87 8.350 17.094 -4.984 1.00 0.00 C ATOM 1269 OD1 ASN A 87 8.983 17.042 -6.038 1.00 0.00 O ATOM 1270 ND2 ASN A 87 7.565 18.118 -4.669 1.00 0.00 N ATOM 0 H ASN A 87 7.853 13.657 -3.245 1.00 0.00 H new ATOM 0 HA ASN A 87 9.063 14.752 -5.622 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.434 15.714 -3.628 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.989 16.319 -3.094 1.00 0.00 H new ATOM 0 HD21 ASN A 87 7.469 18.904 -5.312 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.059 18.119 -3.784 1.00 0.00 H new ATOM 1277 N SER A 88 11.337 15.702 -4.571 1.00 0.00 N ATOM 1278 CA SER A 88 12.756 15.796 -4.252 1.00 0.00 C ATOM 1279 C SER A 88 12.960 16.251 -2.811 1.00 0.00 C ATOM 1280 O SER A 88 13.848 15.760 -2.114 1.00 0.00 O ATOM 1281 CB SER A 88 13.452 16.767 -5.208 1.00 0.00 C ATOM 1282 OG SER A 88 12.935 18.079 -5.069 1.00 0.00 O ATOM 0 H SER A 88 10.985 16.460 -5.155 1.00 0.00 H new ATOM 0 HA SER A 88 13.195 14.805 -4.368 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.524 16.772 -5.009 1.00 0.00 H new ATOM 0 HB3 SER A 88 13.320 16.428 -6.235 1.00 0.00 H new ATOM 0 HG SER A 88 13.398 18.680 -5.689 1.00 0.00 H new ATOM 1288 N ASP A 89 12.131 17.190 -2.370 1.00 0.00 N ATOM 1289 CA ASP A 89 12.219 17.712 -1.011 1.00 0.00 C ATOM 1290 C ASP A 89 11.877 16.630 0.011 1.00 0.00 C ATOM 1291 O ASP A 89 12.363 16.654 1.141 1.00 0.00 O ATOM 1292 CB ASP A 89 11.281 18.910 -0.840 1.00 0.00 C ATOM 1293 CG ASP A 89 12.029 20.186 -0.504 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.993 20.517 -1.226 1.00 0.00 O ATOM 1295 OD2 ASP A 89 11.650 20.853 0.483 1.00 0.00 O ATOM 0 H ASP A 89 11.390 17.606 -2.934 1.00 0.00 H new ATOM 0 HA ASP A 89 13.245 18.037 -0.838 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.712 19.057 -1.758 1.00 0.00 H new ATOM 0 HB3 ASP A 89 10.562 18.695 -0.050 1.00 0.00 H new ATOM 1300 N GLY A 90 11.036 15.683 -0.395 1.00 0.00 N ATOM 1301 CA GLY A 90 10.645 14.607 0.496 1.00 0.00 C ATOM 1302 C GLY A 90 9.165 14.635 0.826 1.00 0.00 C ATOM 1303 O GLY A 90 8.755 14.206 1.904 1.00 0.00 O ATOM 0 H GLY A 90 10.619 15.642 -1.325 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.893 13.650 0.036 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.221 14.676 1.419 1.00 0.00 H new ATOM 1307 N LEU A 91 8.362 15.143 -0.103 1.00 0.00 N ATOM 1308 CA LEU A 91 6.919 15.225 0.094 1.00 0.00 C ATOM 1309 C LEU A 91 6.184 14.318 -0.886 1.00 0.00 C ATOM 1310 O LEU A 91 6.239 14.524 -2.099 1.00 0.00 O ATOM 1311 CB LEU A 91 6.441 16.669 -0.073 1.00 0.00 C ATOM 1312 CG LEU A 91 5.150 17.013 0.671 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.459 17.523 2.070 1.00 0.00 C ATOM 1314 CD2 LEU A 91 4.345 18.043 -0.108 1.00 0.00 C ATOM 0 H LEU A 91 8.686 15.504 -1.000 1.00 0.00 H new ATOM 0 HA LEU A 91 6.697 14.891 1.107 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.230 17.339 0.270 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.294 16.867 -1.135 1.00 0.00 H new ATOM 0 HG LEU A 91 4.553 16.106 0.761 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.528 17.763 2.584 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.994 16.754 2.628 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.077 18.418 2.003 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.430 18.276 0.436 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.936 18.951 -0.230 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.092 17.641 -1.089 1.00 0.00 H new ATOM 1326 N VAL A 92 5.498 13.312 -0.354 1.00 0.00 N ATOM 1327 CA VAL A 92 4.752 12.373 -1.182 1.00 0.00 C ATOM 1328 C VAL A 92 3.542 13.044 -1.822 1.00 0.00 C ATOM 1329 O VAL A 92 2.673 13.572 -1.129 1.00 0.00 O ATOM 1330 CB VAL A 92 4.276 11.157 -0.364 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.680 10.098 -1.278 1.00 0.00 C ATOM 1332 CG2 VAL A 92 5.422 10.582 0.454 1.00 0.00 C ATOM 0 H VAL A 92 5.444 13.126 0.647 1.00 0.00 H new ATOM 0 HA VAL A 92 5.432 12.033 -1.963 1.00 0.00 H new ATOM 0 HB VAL A 92 3.499 11.488 0.325 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.350 9.247 -0.682 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.829 10.518 -1.815 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.434 9.769 -1.994 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.067 9.724 1.025 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.223 10.267 -0.214 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.798 11.343 1.138 1.00 0.00 H new ATOM 1342 N VAL A 93 3.493 13.020 -3.150 1.00 0.00 N ATOM 1343 CA VAL A 93 2.390 13.626 -3.886 1.00 0.00 C ATOM 1344 C VAL A 93 1.949 12.738 -5.044 1.00 0.00 C ATOM 1345 O VAL A 93 2.507 11.663 -5.262 1.00 0.00 O ATOM 1346 CB VAL A 93 2.775 15.013 -4.434 1.00 0.00 C ATOM 1347 CG1 VAL A 93 2.961 16.005 -3.297 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.034 14.921 -5.283 1.00 0.00 C ATOM 0 H VAL A 93 4.205 12.587 -3.738 1.00 0.00 H new ATOM 0 HA VAL A 93 1.564 13.738 -3.183 1.00 0.00 H new ATOM 0 HB VAL A 93 1.963 15.371 -5.067 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.233 16.979 -3.705 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.031 16.093 -2.735 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.753 15.655 -2.635 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.291 15.910 -5.662 1.00 0.00 H new ATOM 0 HG22 VAL A 93 4.855 14.540 -4.676 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.859 14.246 -6.121 1.00 0.00 H new ATOM 1358 N GLY A 94 0.946 13.196 -5.785 1.00 0.00 N ATOM 1359 CA GLY A 94 0.447 12.431 -6.913 1.00 0.00 C ATOM 1360 C GLY A 94 0.311 13.269 -8.168 1.00 0.00 C ATOM 1361 O GLY A 94 -0.639 14.041 -8.308 1.00 0.00 O ATOM 0 H GLY A 94 0.469 14.083 -5.625 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.121 11.597 -7.108 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.523 12.004 -6.658 1.00 0.00 H new ATOM 1365 N ARG A 95 1.261 13.119 -9.084 1.00 0.00 N ATOM 1366 CA ARG A 95 1.245 13.869 -10.335 1.00 0.00 C ATOM 1367 C ARG A 95 2.340 13.381 -11.278 1.00 0.00 C ATOM 1368 O ARG A 95 3.417 13.971 -11.354 1.00 0.00 O ATOM 1369 CB ARG A 95 1.421 15.364 -10.061 1.00 0.00 C ATOM 1370 CG ARG A 95 2.519 15.672 -9.054 1.00 0.00 C ATOM 1371 CD ARG A 95 3.092 17.066 -9.264 1.00 0.00 C ATOM 1372 NE ARG A 95 3.217 17.800 -8.008 1.00 0.00 N ATOM 1373 CZ ARG A 95 3.367 19.121 -7.934 1.00 0.00 C ATOM 1374 NH1 ARG A 95 3.411 19.855 -9.038 1.00 0.00 N ATOM 1375 NH2 ARG A 95 3.473 19.711 -6.750 1.00 0.00 N ATOM 0 H ARG A 95 2.053 12.484 -8.984 1.00 0.00 H new ATOM 0 HA ARG A 95 0.280 13.705 -10.814 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.646 15.873 -10.998 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.479 15.771 -9.695 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.121 15.590 -8.043 1.00 0.00 H new ATOM 0 HG3 ARG A 95 3.315 14.933 -9.144 1.00 0.00 H new ATOM 0 HD2 ARG A 95 4.071 16.988 -9.738 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.451 17.623 -9.947 1.00 0.00 H new ATOM 0 HE ARG A 95 3.188 17.270 -7.137 1.00 0.00 H new ATOM 0 HH11 ARG A 95 3.330 19.408 -9.951 1.00 0.00 H new ATOM 0 HH12 ARG A 95 3.526 20.866 -8.974 1.00 0.00 H new ATOM 0 HH21 ARG A 95 3.440 19.153 -5.897 1.00 0.00 H new ATOM 0 HH22 ARG A 95 3.588 20.723 -6.693 1.00 0.00 H new ATOM 1389 N SER A 96 2.057 12.297 -11.993 1.00 0.00 N ATOM 1390 CA SER A 96 3.018 11.727 -12.931 1.00 0.00 C ATOM 1391 C SER A 96 2.308 10.949 -14.034 1.00 0.00 C ATOM 1392 O SER A 96 2.629 11.092 -15.213 1.00 0.00 O ATOM 1393 CB SER A 96 3.998 10.811 -12.195 1.00 0.00 C ATOM 1394 OG SER A 96 5.011 11.561 -11.547 1.00 0.00 O ATOM 0 H SER A 96 1.170 11.796 -11.941 1.00 0.00 H new ATOM 0 HA SER A 96 3.571 12.547 -13.389 1.00 0.00 H new ATOM 0 HB2 SER A 96 3.459 10.212 -11.461 1.00 0.00 H new ATOM 0 HB3 SER A 96 4.452 10.116 -12.902 1.00 0.00 H new ATOM 0 HG SER A 96 4.741 12.502 -11.499 1.00 0.00 H new ATOM 1400 N ASP A 97 1.341 10.126 -13.642 1.00 0.00 N ATOM 1401 CA ASP A 97 0.585 9.324 -14.598 1.00 0.00 C ATOM 1402 C ASP A 97 1.497 8.345 -15.328 1.00 0.00 C ATOM 1403 O ASP A 97 1.296 8.053 -16.507 1.00 0.00 O ATOM 1404 CB ASP A 97 -0.125 10.229 -15.609 1.00 0.00 C ATOM 1405 CG ASP A 97 -1.156 9.481 -16.431 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -2.165 9.029 -15.849 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -0.954 9.347 -17.656 1.00 0.00 O ATOM 0 H ASP A 97 1.062 9.997 -12.669 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.162 8.754 -14.045 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.611 11.048 -15.080 1.00 0.00 H new ATOM 0 HB3 ASP A 97 0.614 10.674 -16.276 1.00 0.00 H new ATOM 1412 N ALA A 98 2.500 7.838 -14.618 1.00 0.00 N ATOM 1413 CA ALA A 98 3.444 6.890 -15.197 1.00 0.00 C ATOM 1414 C ALA A 98 4.250 6.186 -14.111 1.00 0.00 C ATOM 1415 O ALA A 98 4.525 6.761 -13.057 1.00 0.00 O ATOM 1416 CB ALA A 98 4.373 7.600 -16.171 1.00 0.00 C ATOM 0 H ALA A 98 2.680 8.068 -13.641 1.00 0.00 H new ATOM 0 HA ALA A 98 2.876 6.134 -15.739 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.073 6.881 -16.596 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.786 8.051 -16.971 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.927 8.377 -15.645 1.00 0.00 H new ATOM 1422 N ILE A 99 4.626 4.938 -14.375 1.00 0.00 N ATOM 1423 CA ILE A 99 5.402 4.157 -13.419 1.00 0.00 C ATOM 1424 C ILE A 99 6.861 4.597 -13.404 1.00 0.00 C ATOM 1425 O ILE A 99 7.704 4.013 -14.085 1.00 0.00 O ATOM 1426 CB ILE A 99 5.335 2.652 -13.738 1.00 0.00 C ATOM 1427 CG1 ILE A 99 3.883 2.216 -13.945 1.00 0.00 C ATOM 1428 CG2 ILE A 99 5.982 1.843 -12.624 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.747 0.848 -14.577 1.00 0.00 C ATOM 0 H ILE A 99 4.406 4.447 -15.242 1.00 0.00 H new ATOM 0 HA ILE A 99 4.963 4.333 -12.437 1.00 0.00 H new ATOM 0 HB ILE A 99 5.886 2.468 -14.660 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.372 2.215 -12.982 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.378 2.950 -14.573 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.926 0.782 -12.865 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.026 2.137 -12.520 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.458 2.030 -11.687 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.691 0.604 -14.694 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.229 0.849 -15.555 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.223 0.103 -13.939 1.00 0.00 H new ATOM 1441 N GLY A 100 7.153 5.633 -12.623 1.00 0.00 N ATOM 1442 CA GLY A 100 8.511 6.134 -12.534 1.00 0.00 C ATOM 1443 C GLY A 100 9.257 5.580 -11.334 1.00 0.00 C ATOM 1444 O GLY A 100 8.646 5.005 -10.433 1.00 0.00 O ATOM 0 H GLY A 100 6.473 6.134 -12.051 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.051 5.875 -13.445 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.490 7.222 -12.474 1.00 0.00 H new ATOM 1448 N PRO A 101 10.591 5.737 -11.294 1.00 0.00 N ATOM 1449 CA PRO A 101 11.412 5.241 -10.184 1.00 0.00 C ATOM 1450 C PRO A 101 10.897 5.709 -8.828 1.00 0.00 C ATOM 1451 O PRO A 101 10.945 4.970 -7.845 1.00 0.00 O ATOM 1452 CB PRO A 101 12.792 5.837 -10.467 1.00 0.00 C ATOM 1453 CG PRO A 101 12.814 6.062 -11.939 1.00 0.00 C ATOM 1454 CD PRO A 101 11.403 6.408 -12.326 1.00 0.00 C ATOM 0 HA PRO A 101 11.407 4.152 -10.129 1.00 0.00 H new ATOM 0 HB2 PRO A 101 12.940 6.769 -9.922 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.587 5.158 -10.159 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.499 6.868 -12.200 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.156 5.170 -12.465 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.240 7.486 -12.328 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.161 6.047 -13.326 1.00 0.00 H new ATOM 1462 N ARG A 102 10.404 6.942 -8.781 1.00 0.00 N ATOM 1463 CA ARG A 102 9.880 7.510 -7.544 1.00 0.00 C ATOM 1464 C ARG A 102 8.520 6.911 -7.203 1.00 0.00 C ATOM 1465 O ARG A 102 8.166 6.773 -6.033 1.00 0.00 O ATOM 1466 CB ARG A 102 9.764 9.031 -7.665 1.00 0.00 C ATOM 1467 CG ARG A 102 11.103 9.731 -7.833 1.00 0.00 C ATOM 1468 CD ARG A 102 10.927 11.222 -8.081 1.00 0.00 C ATOM 1469 NE ARG A 102 11.904 12.019 -7.343 1.00 0.00 N ATOM 1470 CZ ARG A 102 13.164 12.193 -7.733 1.00 0.00 C ATOM 1471 NH1 ARG A 102 13.604 11.630 -8.851 1.00 0.00 N ATOM 1472 NH2 ARG A 102 13.987 12.934 -7.002 1.00 0.00 N ATOM 0 H ARG A 102 10.356 7.567 -9.585 1.00 0.00 H new ATOM 0 HA ARG A 102 10.575 7.268 -6.740 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.128 9.272 -8.517 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.268 9.421 -6.776 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.709 9.579 -6.940 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.646 9.284 -8.666 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.024 11.426 -9.147 1.00 0.00 H new ATOM 0 HD3 ARG A 102 9.920 11.522 -7.789 1.00 0.00 H new ATOM 0 HE ARG A 102 11.603 12.468 -6.478 1.00 0.00 H new ATOM 0 HH11 ARG A 102 12.975 11.060 -9.417 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.571 11.767 -9.145 1.00 0.00 H new ATOM 0 HH21 ARG A 102 13.653 13.369 -6.142 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.953 13.068 -7.300 1.00 0.00 H new ATOM 1486 N GLU A 103 7.759 6.558 -8.234 1.00 0.00 N ATOM 1487 CA GLU A 103 6.435 5.974 -8.045 1.00 0.00 C ATOM 1488 C GLU A 103 6.530 4.543 -7.516 1.00 0.00 C ATOM 1489 O GLU A 103 5.532 3.967 -7.084 1.00 0.00 O ATOM 1490 CB GLU A 103 5.657 5.991 -9.361 1.00 0.00 C ATOM 1491 CG GLU A 103 5.165 7.373 -9.759 1.00 0.00 C ATOM 1492 CD GLU A 103 6.257 8.221 -10.384 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.163 8.661 -9.645 1.00 0.00 O ATOM 1494 OE2 GLU A 103 6.204 8.445 -11.611 1.00 0.00 O ATOM 0 H GLU A 103 8.036 6.666 -9.210 1.00 0.00 H new ATOM 0 HA GLU A 103 5.907 6.576 -7.306 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.293 5.598 -10.154 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.802 5.320 -9.277 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.340 7.272 -10.464 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.772 7.883 -8.879 1.00 0.00 H new ATOM 1501 N GLN A 104 7.731 3.971 -7.553 1.00 0.00 N ATOM 1502 CA GLN A 104 7.943 2.609 -7.077 1.00 0.00 C ATOM 1503 C GLN A 104 7.920 2.552 -5.553 1.00 0.00 C ATOM 1504 O GLN A 104 8.274 3.519 -4.879 1.00 0.00 O ATOM 1505 CB GLN A 104 9.275 2.066 -7.599 1.00 0.00 C ATOM 1506 CG GLN A 104 9.314 1.899 -9.109 1.00 0.00 C ATOM 1507 CD GLN A 104 10.728 1.836 -9.653 1.00 0.00 C ATOM 1508 OE1 GLN A 104 11.699 1.948 -8.903 1.00 0.00 O ATOM 1509 NE2 GLN A 104 10.852 1.658 -10.963 1.00 0.00 N ATOM 0 H GLN A 104 8.570 4.430 -7.907 1.00 0.00 H new ATOM 0 HA GLN A 104 7.131 1.989 -7.456 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.076 2.740 -7.296 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.474 1.102 -7.130 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.782 0.988 -9.384 1.00 0.00 H new ATOM 0 HG3 GLN A 104 8.786 2.730 -9.576 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.020 1.570 -11.547 1.00 0.00 H new ATOM 0 HE22 GLN A 104 11.779 1.609 -11.386 1.00 0.00 H new ATOM 1518 N TRP A 105 7.504 1.408 -5.017 1.00 0.00 N ATOM 1519 CA TRP A 105 7.437 1.219 -3.572 1.00 0.00 C ATOM 1520 C TRP A 105 7.891 -0.185 -3.190 1.00 0.00 C ATOM 1521 O TRP A 105 7.722 -1.133 -3.955 1.00 0.00 O ATOM 1522 CB TRP A 105 6.012 1.461 -3.070 1.00 0.00 C ATOM 1523 CG TRP A 105 5.480 2.816 -3.423 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.822 3.166 -4.566 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.561 4.004 -2.627 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.489 4.498 -4.530 1.00 0.00 N ATOM 1527 CE2 TRP A 105 4.933 5.035 -3.350 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.105 4.297 -1.373 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.832 6.335 -2.860 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.005 5.587 -0.888 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.373 6.592 -1.630 1.00 0.00 C ATOM 0 H TRP A 105 7.208 0.598 -5.562 1.00 0.00 H new ATOM 0 HA TRP A 105 8.106 1.940 -3.103 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.353 0.700 -3.488 1.00 0.00 H new ATOM 0 HB3 TRP A 105 5.991 1.341 -1.987 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.596 2.494 -5.380 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.992 5.005 -5.262 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.595 3.529 -0.793 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.344 7.112 -3.430 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.421 5.824 0.080 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.311 7.591 -1.223 1.00 0.00 H new ATOM 1542 N GLU A 106 8.473 -0.312 -2.001 1.00 0.00 N ATOM 1543 CA GLU A 106 8.955 -1.603 -1.521 1.00 0.00 C ATOM 1544 C GLU A 106 8.403 -1.913 -0.130 1.00 0.00 C ATOM 1545 O GLU A 106 8.941 -1.449 0.874 1.00 0.00 O ATOM 1546 CB GLU A 106 10.484 -1.618 -1.486 1.00 0.00 C ATOM 1547 CG GLU A 106 11.074 -3.003 -1.278 1.00 0.00 C ATOM 1548 CD GLU A 106 12.191 -3.013 -0.251 1.00 0.00 C ATOM 1549 OE1 GLU A 106 11.998 -2.435 0.840 1.00 0.00 O ATOM 1550 OE2 GLU A 106 13.256 -3.598 -0.537 1.00 0.00 O ATOM 0 H GLU A 106 8.622 0.462 -1.353 1.00 0.00 H new ATOM 0 HA GLU A 106 8.603 -2.370 -2.211 1.00 0.00 H new ATOM 0 HB2 GLU A 106 10.865 -1.207 -2.421 1.00 0.00 H new ATOM 0 HB3 GLU A 106 10.827 -0.962 -0.686 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.286 -3.685 -0.959 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.455 -3.378 -2.228 1.00 0.00 H new ATOM 1557 N PRO A 107 7.319 -2.707 -0.052 1.00 0.00 N ATOM 1558 CA PRO A 107 6.705 -3.075 1.228 1.00 0.00 C ATOM 1559 C PRO A 107 7.719 -3.661 2.204 1.00 0.00 C ATOM 1560 O PRO A 107 8.724 -4.243 1.796 1.00 0.00 O ATOM 1561 CB PRO A 107 5.668 -4.131 0.837 1.00 0.00 C ATOM 1562 CG PRO A 107 5.345 -3.837 -0.587 1.00 0.00 C ATOM 1563 CD PRO A 107 6.613 -3.309 -1.198 1.00 0.00 C ATOM 0 HA PRO A 107 6.279 -2.212 1.740 1.00 0.00 H new ATOM 0 HB2 PRO A 107 6.067 -5.139 0.952 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.780 -4.066 1.466 1.00 0.00 H new ATOM 0 HG2 PRO A 107 5.007 -4.735 -1.104 1.00 0.00 H new ATOM 0 HG3 PRO A 107 4.541 -3.105 -0.662 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.199 -4.105 -1.658 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.408 -2.573 -1.976 1.00 0.00 H new ATOM 1571 N VAL A 108 7.453 -3.501 3.496 1.00 0.00 N ATOM 1572 CA VAL A 108 8.347 -4.013 4.528 1.00 0.00 C ATOM 1573 C VAL A 108 7.565 -4.684 5.653 1.00 0.00 C ATOM 1574 O VAL A 108 6.398 -4.370 5.886 1.00 0.00 O ATOM 1575 CB VAL A 108 9.218 -2.891 5.124 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.278 -3.471 6.048 1.00 0.00 C ATOM 1577 CG2 VAL A 108 9.857 -2.068 4.017 1.00 0.00 C ATOM 0 H VAL A 108 6.627 -3.021 3.853 1.00 0.00 H new ATOM 0 HA VAL A 108 8.992 -4.749 4.048 1.00 0.00 H new ATOM 0 HB VAL A 108 8.579 -2.233 5.712 1.00 0.00 H new ATOM 0 HG11 VAL A 108 10.883 -2.663 6.459 1.00 0.00 H new ATOM 0 HG12 VAL A 108 9.795 -4.013 6.861 1.00 0.00 H new ATOM 0 HG13 VAL A 108 10.916 -4.153 5.486 1.00 0.00 H new ATOM 0 HG21 VAL A 108 10.469 -1.280 4.456 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.483 -2.712 3.400 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.078 -1.621 3.400 1.00 0.00 H new ATOM 1587 N PHE A 109 8.218 -5.610 6.348 1.00 0.00 N ATOM 1588 CA PHE A 109 7.588 -6.327 7.450 1.00 0.00 C ATOM 1589 C PHE A 109 8.597 -6.609 8.559 1.00 0.00 C ATOM 1590 O PHE A 109 9.624 -7.247 8.329 1.00 0.00 O ATOM 1591 CB PHE A 109 6.980 -7.639 6.953 1.00 0.00 C ATOM 1592 CG PHE A 109 6.043 -7.466 5.791 1.00 0.00 C ATOM 1593 CD1 PHE A 109 6.534 -7.257 4.513 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.671 -7.513 5.979 1.00 0.00 C ATOM 1595 CE1 PHE A 109 5.675 -7.098 3.442 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.806 -7.355 4.912 1.00 0.00 C ATOM 1597 CZ PHE A 109 4.309 -7.147 3.642 1.00 0.00 C ATOM 0 H PHE A 109 9.184 -5.881 6.167 1.00 0.00 H new ATOM 0 HA PHE A 109 6.794 -5.698 7.854 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.784 -8.315 6.663 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.444 -8.115 7.774 1.00 0.00 H new ATOM 0 HD1 PHE A 109 7.601 -7.218 4.351 1.00 0.00 H new ATOM 0 HD2 PHE A 109 4.273 -7.675 6.970 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.071 -6.936 2.450 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.738 -7.394 5.071 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.635 -7.023 2.807 1.00 0.00 H new ATOM 1607 N GLN A 110 8.298 -6.130 9.762 1.00 0.00 N ATOM 1608 CA GLN A 110 9.180 -6.333 10.905 1.00 0.00 C ATOM 1609 C GLN A 110 8.377 -6.526 12.187 1.00 0.00 C ATOM 1610 O GLN A 110 7.441 -5.775 12.465 1.00 0.00 O ATOM 1611 CB GLN A 110 10.130 -5.143 11.059 1.00 0.00 C ATOM 1612 CG GLN A 110 11.508 -5.529 11.571 1.00 0.00 C ATOM 1613 CD GLN A 110 12.548 -5.575 10.468 1.00 0.00 C ATOM 1614 OE1 GLN A 110 12.727 -6.599 9.811 1.00 0.00 O ATOM 1615 NE2 GLN A 110 13.240 -4.460 10.261 1.00 0.00 N ATOM 0 H GLN A 110 7.452 -5.599 9.970 1.00 0.00 H new ATOM 0 HA GLN A 110 9.764 -7.236 10.725 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.236 -4.646 10.095 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.686 -4.420 11.744 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.822 -4.815 12.332 1.00 0.00 H new ATOM 0 HG3 GLN A 110 11.452 -6.505 12.054 1.00 0.00 H new ATOM 0 HE21 GLN A 110 13.058 -3.634 10.830 1.00 0.00 H new ATOM 0 HE22 GLN A 110 13.953 -4.430 9.533 1.00 0.00 H new ATOM 1624 N ASP A 111 8.750 -7.537 12.966 1.00 0.00 N ATOM 1625 CA ASP A 111 8.065 -7.829 14.221 1.00 0.00 C ATOM 1626 C ASP A 111 6.582 -8.100 13.986 1.00 0.00 C ATOM 1627 O ASP A 111 5.754 -7.880 14.871 1.00 0.00 O ATOM 1628 CB ASP A 111 8.235 -6.668 15.201 1.00 0.00 C ATOM 1629 CG ASP A 111 9.500 -6.790 16.029 1.00 0.00 C ATOM 1630 OD1 ASP A 111 10.593 -6.523 15.486 1.00 0.00 O ATOM 1631 OD2 ASP A 111 9.397 -7.151 17.220 1.00 0.00 O ATOM 0 H ASP A 111 9.522 -8.167 12.751 1.00 0.00 H new ATOM 0 HA ASP A 111 8.514 -8.726 14.649 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.256 -5.729 14.648 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.372 -6.628 15.865 1.00 0.00 H new ATOM 1636 N GLY A 112 6.252 -8.579 12.791 1.00 0.00 N ATOM 1637 CA GLY A 112 4.868 -8.871 12.466 1.00 0.00 C ATOM 1638 C GLY A 112 4.186 -7.728 11.741 1.00 0.00 C ATOM 1639 O GLY A 112 3.323 -7.949 10.892 1.00 0.00 O ATOM 0 H GLY A 112 6.918 -8.770 12.042 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.825 -9.767 11.846 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.322 -9.092 13.383 1.00 0.00 H new ATOM 1643 N LYS A 113 4.571 -6.501 12.077 1.00 0.00 N ATOM 1644 CA LYS A 113 3.989 -5.318 11.453 1.00 0.00 C ATOM 1645 C LYS A 113 4.568 -5.098 10.060 1.00 0.00 C ATOM 1646 O LYS A 113 5.413 -5.865 9.599 1.00 0.00 O ATOM 1647 CB LYS A 113 4.235 -4.084 12.322 1.00 0.00 C ATOM 1648 CG LYS A 113 3.323 -4.002 13.535 1.00 0.00 C ATOM 1649 CD LYS A 113 4.054 -3.452 14.748 1.00 0.00 C ATOM 1650 CE LYS A 113 3.097 -3.164 15.893 1.00 0.00 C ATOM 1651 NZ LYS A 113 3.817 -2.946 17.179 1.00 0.00 N ATOM 0 H LYS A 113 5.284 -6.300 12.778 1.00 0.00 H new ATOM 0 HA LYS A 113 2.915 -5.478 11.359 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.272 -4.087 12.657 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.099 -3.189 11.715 1.00 0.00 H new ATOM 0 HG2 LYS A 113 2.468 -3.366 13.306 1.00 0.00 H new ATOM 0 HG3 LYS A 113 2.931 -4.993 13.764 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.809 -4.168 15.075 1.00 0.00 H new ATOM 0 HD3 LYS A 113 4.580 -2.538 14.473 1.00 0.00 H new ATOM 0 HE2 LYS A 113 2.503 -2.282 15.656 1.00 0.00 H new ATOM 0 HE3 LYS A 113 2.402 -3.996 16.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 3.128 -2.753 17.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.364 -3.797 17.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 4.462 -2.136 17.083 1.00 0.00 H new ATOM 1665 N MET A 114 4.108 -4.044 9.394 1.00 0.00 N ATOM 1666 CA MET A 114 4.581 -3.721 8.053 1.00 0.00 C ATOM 1667 C MET A 114 4.586 -2.213 7.825 1.00 0.00 C ATOM 1668 O MET A 114 3.681 -1.506 8.268 1.00 0.00 O ATOM 1669 CB MET A 114 3.704 -4.405 7.002 1.00 0.00 C ATOM 1670 CG MET A 114 2.237 -4.022 7.092 1.00 0.00 C ATOM 1671 SD MET A 114 1.229 -4.836 5.838 1.00 0.00 S ATOM 1672 CE MET A 114 0.014 -5.662 6.863 1.00 0.00 C ATOM 0 H MET A 114 3.408 -3.399 9.761 1.00 0.00 H new ATOM 0 HA MET A 114 5.603 -4.087 7.958 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.077 -4.152 6.009 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.796 -5.486 7.111 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.858 -4.280 8.081 1.00 0.00 H new ATOM 0 HG3 MET A 114 2.140 -2.942 6.985 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.640 -6.268 6.236 1.00 0.00 H new ATOM 0 HE2 MET A 114 0.521 -6.303 7.584 1.00 0.00 H new ATOM 0 HE3 MET A 114 -0.580 -4.918 7.394 1.00 0.00 H new ATOM 1682 N ALA A 115 5.610 -1.728 7.132 1.00 0.00 N ATOM 1683 CA ALA A 115 5.733 -0.304 6.843 1.00 0.00 C ATOM 1684 C ALA A 115 6.215 -0.072 5.416 1.00 0.00 C ATOM 1685 O ALA A 115 7.316 -0.482 5.048 1.00 0.00 O ATOM 1686 CB ALA A 115 6.680 0.354 7.836 1.00 0.00 C ATOM 0 H ALA A 115 6.368 -2.300 6.760 1.00 0.00 H new ATOM 0 HA ALA A 115 4.746 0.149 6.942 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.763 1.417 7.610 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.292 0.228 8.847 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.663 -0.111 7.764 1.00 0.00 H new ATOM 1692 N LEU A 116 5.383 0.586 4.616 1.00 0.00 N ATOM 1693 CA LEU A 116 5.725 0.872 3.227 1.00 0.00 C ATOM 1694 C LEU A 116 6.988 1.722 3.141 1.00 0.00 C ATOM 1695 O LEU A 116 7.135 2.708 3.864 1.00 0.00 O ATOM 1696 CB LEU A 116 4.566 1.586 2.531 1.00 0.00 C ATOM 1697 CG LEU A 116 4.379 1.229 1.054 1.00 0.00 C ATOM 1698 CD1 LEU A 116 3.296 0.174 0.893 1.00 0.00 C ATOM 1699 CD2 LEU A 116 4.040 2.472 0.243 1.00 0.00 C ATOM 0 H LEU A 116 4.468 0.931 4.905 1.00 0.00 H new ATOM 0 HA LEU A 116 5.913 -0.076 2.723 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.644 1.355 3.065 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.721 2.662 2.612 1.00 0.00 H new ATOM 0 HG LEU A 116 5.316 0.819 0.678 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.177 -0.067 -0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.579 -0.725 1.441 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.354 0.557 1.286 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.911 2.199 -0.804 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.117 2.912 0.620 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.850 3.196 0.332 1.00 0.00 H new ATOM 1711 N LEU A 117 7.897 1.334 2.253 1.00 0.00 N ATOM 1712 CA LEU A 117 9.148 2.061 2.071 1.00 0.00 C ATOM 1713 C LEU A 117 9.176 2.764 0.718 1.00 0.00 C ATOM 1714 O LEU A 117 9.020 2.130 -0.326 1.00 0.00 O ATOM 1715 CB LEU A 117 10.338 1.108 2.190 1.00 0.00 C ATOM 1716 CG LEU A 117 11.693 1.788 2.397 1.00 0.00 C ATOM 1717 CD1 LEU A 117 11.985 1.951 3.881 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.797 0.991 1.718 1.00 0.00 C ATOM 0 H LEU A 117 7.791 0.520 1.648 1.00 0.00 H new ATOM 0 HA LEU A 117 9.218 2.816 2.854 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.158 0.429 3.023 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.388 0.499 1.287 1.00 0.00 H new ATOM 0 HG LEU A 117 11.656 2.779 1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.952 2.436 4.010 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.208 2.563 4.340 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.004 0.971 4.358 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.754 1.488 1.875 1.00 0.00 H new ATOM 0 HD22 LEU A 117 12.835 -0.012 2.143 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.593 0.925 0.649 1.00 0.00 H new ATOM 1730 N ALA A 118 9.378 4.077 0.744 1.00 0.00 N ATOM 1731 CA ALA A 118 9.428 4.866 -0.482 1.00 0.00 C ATOM 1732 C ALA A 118 10.685 4.553 -1.285 1.00 0.00 C ATOM 1733 O ALA A 118 11.607 3.904 -0.789 1.00 0.00 O ATOM 1734 CB ALA A 118 9.363 6.351 -0.156 1.00 0.00 C ATOM 0 H ALA A 118 9.510 4.617 1.599 1.00 0.00 H new ATOM 0 HA ALA A 118 8.564 4.601 -1.092 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.401 6.928 -1.080 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.433 6.568 0.369 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.208 6.622 0.476 1.00 0.00 H new ATOM 1740 N SER A 119 10.717 5.021 -2.528 1.00 0.00 N ATOM 1741 CA SER A 119 11.862 4.793 -3.402 1.00 0.00 C ATOM 1742 C SER A 119 13.099 5.533 -2.896 1.00 0.00 C ATOM 1743 O SER A 119 14.214 5.275 -3.351 1.00 0.00 O ATOM 1744 CB SER A 119 11.537 5.239 -4.828 1.00 0.00 C ATOM 1745 OG SER A 119 12.537 4.815 -5.737 1.00 0.00 O ATOM 0 H SER A 119 9.963 5.561 -2.953 1.00 0.00 H new ATOM 0 HA SER A 119 12.077 3.724 -3.400 1.00 0.00 H new ATOM 0 HB2 SER A 119 10.572 4.831 -5.129 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.448 6.325 -4.861 1.00 0.00 H new ATOM 0 HG SER A 119 12.195 4.880 -6.653 1.00 0.00 H new ATOM 1751 N ASN A 120 12.900 6.453 -1.954 1.00 0.00 N ATOM 1752 CA ASN A 120 14.005 7.225 -1.395 1.00 0.00 C ATOM 1753 C ASN A 120 14.545 6.576 -0.121 1.00 0.00 C ATOM 1754 O ASN A 120 15.188 7.237 0.695 1.00 0.00 O ATOM 1755 CB ASN A 120 13.553 8.656 -1.100 1.00 0.00 C ATOM 1756 CG ASN A 120 14.702 9.552 -0.679 1.00 0.00 C ATOM 1757 OD1 ASN A 120 15.787 9.504 -1.260 1.00 0.00 O ATOM 1758 ND2 ASN A 120 14.469 10.376 0.336 1.00 0.00 N ATOM 0 H ASN A 120 11.986 6.681 -1.563 1.00 0.00 H new ATOM 0 HA ASN A 120 14.807 7.246 -2.133 1.00 0.00 H new ATOM 0 HB2 ASN A 120 13.077 9.074 -1.987 1.00 0.00 H new ATOM 0 HB3 ASN A 120 12.800 8.641 -0.312 1.00 0.00 H new ATOM 0 HD21 ASN A 120 15.204 11.003 0.663 1.00 0.00 H new ATOM 0 HD22 ASN A 120 13.555 10.382 0.788 1.00 0.00 H new ATOM 1765 N SER A 121 14.282 5.283 0.046 1.00 0.00 N ATOM 1766 CA SER A 121 14.747 4.553 1.221 1.00 0.00 C ATOM 1767 C SER A 121 14.279 5.226 2.507 1.00 0.00 C ATOM 1768 O SER A 121 14.999 5.248 3.505 1.00 0.00 O ATOM 1769 CB SER A 121 16.273 4.450 1.212 1.00 0.00 C ATOM 1770 OG SER A 121 16.748 4.018 -0.051 1.00 0.00 O ATOM 0 H SER A 121 13.750 4.720 -0.617 1.00 0.00 H new ATOM 0 HA SER A 121 14.320 3.551 1.184 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.707 5.420 1.455 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.598 3.753 1.984 1.00 0.00 H new ATOM 0 HG SER A 121 17.726 3.962 -0.031 1.00 0.00 H new ATOM 1776 N CYS A 122 13.069 5.775 2.477 1.00 0.00 N ATOM 1777 CA CYS A 122 12.508 6.448 3.643 1.00 0.00 C ATOM 1778 C CYS A 122 11.022 6.135 3.790 1.00 0.00 C ATOM 1779 O CYS A 122 10.245 6.306 2.851 1.00 0.00 O ATOM 1780 CB CYS A 122 12.713 7.960 3.533 1.00 0.00 C ATOM 1781 SG CYS A 122 14.395 8.507 3.909 1.00 0.00 S ATOM 0 H CYS A 122 12.459 5.767 1.660 1.00 0.00 H new ATOM 0 HA CYS A 122 13.028 6.081 4.528 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.457 8.278 2.522 1.00 0.00 H new ATOM 0 HB3 CYS A 122 12.020 8.460 4.210 1.00 0.00 H new ATOM 0 HG CYS A 122 15.198 7.485 3.890 1.00 0.00 H new ATOM 1787 N PHE A 123 10.635 5.672 4.975 1.00 0.00 N ATOM 1788 CA PHE A 123 9.242 5.335 5.245 1.00 0.00 C ATOM 1789 C PHE A 123 8.369 6.584 5.238 1.00 0.00 C ATOM 1790 O PHE A 123 8.824 7.674 5.583 1.00 0.00 O ATOM 1791 CB PHE A 123 9.122 4.621 6.593 1.00 0.00 C ATOM 1792 CG PHE A 123 9.904 3.341 6.667 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.341 2.145 6.251 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.202 3.334 7.151 1.00 0.00 C ATOM 1795 CE1 PHE A 123 10.057 0.965 6.316 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.924 2.157 7.220 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.351 0.972 6.801 1.00 0.00 C ATOM 0 H PHE A 123 11.266 5.522 5.762 1.00 0.00 H new ATOM 0 HA PHE A 123 8.895 4.668 4.456 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.463 5.292 7.382 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.071 4.407 6.789 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.330 2.135 5.871 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.655 4.258 7.478 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.607 0.040 5.989 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.935 2.164 7.601 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.914 0.052 6.852 1.00 0.00 H new ATOM 1807 N ILE A 124 7.110 6.418 4.842 1.00 0.00 N ATOM 1808 CA ILE A 124 6.173 7.533 4.791 1.00 0.00 C ATOM 1809 C ILE A 124 5.441 7.699 6.119 1.00 0.00 C ATOM 1810 O ILE A 124 5.137 6.717 6.797 1.00 0.00 O ATOM 1811 CB ILE A 124 5.136 7.344 3.667 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.369 6.035 3.866 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.819 7.363 2.308 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.193 5.876 2.926 1.00 0.00 C ATOM 0 H ILE A 124 6.717 5.523 4.552 1.00 0.00 H new ATOM 0 HA ILE A 124 6.760 8.429 4.588 1.00 0.00 H new ATOM 0 HB ILE A 124 4.425 8.169 3.706 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.052 5.198 3.725 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.011 5.985 4.894 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.074 7.228 1.524 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.324 8.319 2.168 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.549 6.556 2.257 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.696 4.926 3.123 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.489 6.694 3.082 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.546 5.894 1.895 1.00 0.00 H new ATOM 1826 N ARG A 125 5.162 8.945 6.483 1.00 0.00 N ATOM 1827 CA ARG A 125 4.467 9.240 7.730 1.00 0.00 C ATOM 1828 C ARG A 125 3.621 10.502 7.596 1.00 0.00 C ATOM 1829 O ARG A 125 4.110 11.547 7.164 1.00 0.00 O ATOM 1830 CB ARG A 125 5.471 9.405 8.872 1.00 0.00 C ATOM 1831 CG ARG A 125 4.824 9.464 10.246 1.00 0.00 C ATOM 1832 CD ARG A 125 5.543 10.444 11.159 1.00 0.00 C ATOM 1833 NE ARG A 125 4.858 10.602 12.440 1.00 0.00 N ATOM 1834 CZ ARG A 125 5.056 11.628 13.264 1.00 0.00 C ATOM 1835 NH1 ARG A 125 5.915 12.588 12.947 1.00 0.00 N ATOM 1836 NH2 ARG A 125 4.390 11.695 14.410 1.00 0.00 N ATOM 0 H ARG A 125 5.407 9.768 5.932 1.00 0.00 H new ATOM 0 HA ARG A 125 3.806 8.403 7.955 1.00 0.00 H new ATOM 0 HB2 ARG A 125 6.177 8.575 8.847 1.00 0.00 H new ATOM 0 HB3 ARG A 125 6.046 10.317 8.711 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.779 9.759 10.145 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.833 8.472 10.697 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.562 10.097 11.333 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.616 11.413 10.665 1.00 0.00 H new ATOM 0 HE ARG A 125 4.189 9.884 12.719 1.00 0.00 H new ATOM 0 HH11 ARG A 125 6.429 12.543 12.067 1.00 0.00 H new ATOM 0 HH12 ARG A 125 6.062 13.372 13.583 1.00 0.00 H new ATOM 0 HH21 ARG A 125 3.727 10.961 14.658 1.00 0.00 H new ATOM 0 HH22 ARG A 125 4.541 12.481 15.042 1.00 0.00 H new ATOM 1850 N CYS A 126 2.349 10.399 7.968 1.00 0.00 N ATOM 1851 CA CYS A 126 1.435 11.533 7.888 1.00 0.00 C ATOM 1852 C CYS A 126 1.639 12.479 9.067 1.00 0.00 C ATOM 1853 O CYS A 126 2.110 12.072 10.130 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.014 11.045 7.856 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.461 9.968 9.239 1.00 0.00 S ATOM 0 H CYS A 126 1.928 9.542 8.328 1.00 0.00 H new ATOM 0 HA CYS A 126 1.649 12.076 6.968 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.677 11.910 7.854 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.185 10.509 6.922 1.00 0.00 H new ATOM 0 HG CYS A 126 -0.708 10.692 10.290 1.00 0.00 H new ATOM 1861 N ASN A 127 1.282 13.745 8.871 1.00 0.00 N ATOM 1862 CA ASN A 127 1.425 14.750 9.918 1.00 0.00 C ATOM 1863 C ASN A 127 0.060 15.213 10.417 1.00 0.00 C ATOM 1864 O ASN A 127 -0.964 14.947 9.790 1.00 0.00 O ATOM 1865 CB ASN A 127 2.223 15.947 9.398 1.00 0.00 C ATOM 1866 CG ASN A 127 3.690 15.622 9.200 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.292 14.902 9.997 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.275 16.153 8.133 1.00 0.00 N ATOM 0 H ASN A 127 0.892 14.098 7.997 1.00 0.00 H new ATOM 0 HA ASN A 127 1.962 14.297 10.751 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.797 16.281 8.452 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.129 16.775 10.100 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.261 15.970 7.948 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.738 16.744 7.498 1.00 0.00 H new ATOM 1875 N GLU A 128 0.054 15.909 11.550 1.00 0.00 N ATOM 1876 CA GLU A 128 -1.184 16.410 12.132 1.00 0.00 C ATOM 1877 C GLU A 128 -1.709 17.607 11.346 1.00 0.00 C ATOM 1878 O GLU A 128 -2.919 17.807 11.233 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.964 16.802 13.595 1.00 0.00 C ATOM 1880 CG GLU A 128 0.196 17.766 13.798 1.00 0.00 C ATOM 1881 CD GLU A 128 -0.242 19.088 14.396 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -1.262 19.106 15.116 1.00 0.00 O ATOM 1883 OE2 GLU A 128 0.436 20.106 14.145 1.00 0.00 O ATOM 0 H GLU A 128 0.893 16.138 12.082 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.926 15.613 12.085 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -1.876 17.257 13.982 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -0.784 15.901 14.181 1.00 0.00 H new ATOM 0 HG2 GLU A 128 0.937 17.304 14.450 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.684 17.948 12.840 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.790 18.400 10.803 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.160 19.577 10.026 1.00 0.00 C ATOM 1892 C ALA A 129 -1.862 19.182 8.731 1.00 0.00 C ATOM 1893 O ALA A 129 -2.699 19.923 8.216 1.00 0.00 O ATOM 1894 CB ALA A 129 0.072 20.417 9.725 1.00 0.00 C ATOM 0 H ALA A 129 0.215 18.249 10.887 1.00 0.00 H new ATOM 0 HA ALA A 129 -1.856 20.170 10.619 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.218 21.293 9.144 1.00 0.00 H new ATOM 0 HB2 ALA A 129 0.531 20.737 10.660 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.786 19.824 9.154 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.515 18.010 8.209 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.121 17.536 6.979 1.00 0.00 C ATOM 1902 C GLY A 130 -1.126 17.443 5.839 1.00 0.00 C ATOM 1903 O GLY A 130 -1.492 17.583 4.673 1.00 0.00 O ATOM 0 H GLY A 130 -0.824 17.380 8.616 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.564 16.555 7.151 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.932 18.207 6.695 1.00 0.00 H new ATOM 1907 N ASP A 131 0.138 17.206 6.178 1.00 0.00 N ATOM 1908 CA ASP A 131 1.190 17.094 5.175 1.00 0.00 C ATOM 1909 C ASP A 131 1.916 15.757 5.295 1.00 0.00 C ATOM 1910 O ASP A 131 2.557 15.477 6.309 1.00 0.00 O ATOM 1911 CB ASP A 131 2.187 18.244 5.320 1.00 0.00 C ATOM 1912 CG ASP A 131 1.524 19.603 5.204 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.731 19.954 6.103 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.798 20.314 4.215 1.00 0.00 O ATOM 0 H ASP A 131 0.458 17.088 7.139 1.00 0.00 H new ATOM 0 HA ASP A 131 0.726 17.148 4.190 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.687 18.168 6.286 1.00 0.00 H new ATOM 0 HB3 ASP A 131 2.957 18.152 4.554 1.00 0.00 H new ATOM 1919 N ILE A 132 1.810 14.936 4.256 1.00 0.00 N ATOM 1920 CA ILE A 132 2.455 13.629 4.246 1.00 0.00 C ATOM 1921 C ILE A 132 3.827 13.698 3.583 1.00 0.00 C ATOM 1922 O ILE A 132 3.954 14.133 2.439 1.00 0.00 O ATOM 1923 CB ILE A 132 1.596 12.583 3.512 1.00 0.00 C ATOM 1924 CG1 ILE A 132 0.153 12.629 4.020 1.00 0.00 C ATOM 1925 CG2 ILE A 132 2.184 11.192 3.692 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.760 11.635 3.337 1.00 0.00 C ATOM 0 H ILE A 132 1.283 15.153 3.410 1.00 0.00 H new ATOM 0 HA ILE A 132 2.571 13.327 5.287 1.00 0.00 H new ATOM 0 HB ILE A 132 1.594 12.819 2.448 1.00 0.00 H new ATOM 0 HG12 ILE A 132 0.148 12.437 5.093 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.243 13.634 3.874 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.565 10.465 3.167 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.195 11.169 3.285 1.00 0.00 H new ATOM 0 HG23 ILE A 132 2.214 10.944 4.753 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.766 11.724 3.747 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -0.785 11.840 2.267 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.388 10.624 3.505 1.00 0.00 H new ATOM 1938 N GLU A 133 4.852 13.266 4.312 1.00 0.00 N ATOM 1939 CA GLU A 133 6.216 13.278 3.795 1.00 0.00 C ATOM 1940 C GLU A 133 6.935 11.976 4.132 1.00 0.00 C ATOM 1941 O GLU A 133 6.365 11.086 4.762 1.00 0.00 O ATOM 1942 CB GLU A 133 6.990 14.466 4.368 1.00 0.00 C ATOM 1943 CG GLU A 133 7.027 14.491 5.888 1.00 0.00 C ATOM 1944 CD GLU A 133 8.439 14.541 6.439 1.00 0.00 C ATOM 1945 OE1 GLU A 133 9.267 15.295 5.883 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.718 13.826 7.423 1.00 0.00 O ATOM 0 H GLU A 133 4.764 12.904 5.261 1.00 0.00 H new ATOM 0 HA GLU A 133 6.167 13.375 2.710 1.00 0.00 H new ATOM 0 HB2 GLU A 133 8.011 14.441 3.988 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.539 15.391 4.008 1.00 0.00 H new ATOM 0 HG2 GLU A 133 6.471 15.357 6.247 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.522 13.606 6.274 1.00 0.00 H new ATOM 1953 N ALA A 134 8.190 11.872 3.707 1.00 0.00 N ATOM 1954 CA ALA A 134 8.987 10.678 3.964 1.00 0.00 C ATOM 1955 C ALA A 134 9.821 10.834 5.230 1.00 0.00 C ATOM 1956 O ALA A 134 10.812 11.563 5.247 1.00 0.00 O ATOM 1957 CB ALA A 134 9.884 10.376 2.773 1.00 0.00 C ATOM 0 H ALA A 134 8.677 12.600 3.183 1.00 0.00 H new ATOM 0 HA ALA A 134 8.304 9.842 4.113 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.473 9.482 2.979 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.270 10.210 1.888 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.552 11.219 2.598 1.00 0.00 H new ATOM 1963 N LYS A 135 9.412 10.145 6.291 1.00 0.00 N ATOM 1964 CA LYS A 135 10.122 10.206 7.562 1.00 0.00 C ATOM 1965 C LYS A 135 11.493 9.547 7.451 1.00 0.00 C ATOM 1966 O LYS A 135 11.806 8.909 6.446 1.00 0.00 O ATOM 1967 CB LYS A 135 9.302 9.525 8.660 1.00 0.00 C ATOM 1968 CG LYS A 135 9.280 10.296 9.971 1.00 0.00 C ATOM 1969 CD LYS A 135 8.432 11.555 9.865 1.00 0.00 C ATOM 1970 CE LYS A 135 9.286 12.811 9.935 1.00 0.00 C ATOM 1971 NZ LYS A 135 8.455 14.044 9.998 1.00 0.00 N ATOM 0 H LYS A 135 8.592 9.538 6.295 1.00 0.00 H new ATOM 0 HA LYS A 135 10.264 11.255 7.822 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.279 9.393 8.309 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.708 8.530 8.840 1.00 0.00 H new ATOM 0 HG2 LYS A 135 8.888 9.658 10.763 1.00 0.00 H new ATOM 0 HG3 LYS A 135 10.298 10.565 10.253 1.00 0.00 H new ATOM 0 HD2 LYS A 135 7.877 11.543 8.927 1.00 0.00 H new ATOM 0 HD3 LYS A 135 7.697 11.568 10.670 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.931 12.763 10.812 1.00 0.00 H new ATOM 0 HE3 LYS A 135 9.937 12.856 9.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 8.917 14.743 10.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 8.349 14.441 9.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 7.517 13.811 10.382 1.00 0.00 H new ATOM 1985 N ASN A 136 12.308 9.706 8.489 1.00 0.00 N ATOM 1986 CA ASN A 136 13.645 9.125 8.505 1.00 0.00 C ATOM 1987 C ASN A 136 13.582 7.609 8.354 1.00 0.00 C ATOM 1988 O ASN A 136 12.502 7.018 8.376 1.00 0.00 O ATOM 1989 CB ASN A 136 14.368 9.490 9.804 1.00 0.00 C ATOM 1990 CG ASN A 136 14.729 10.961 9.870 1.00 0.00 C ATOM 1991 OD1 ASN A 136 14.297 11.679 10.772 1.00 0.00 O ATOM 1992 ND2 ASN A 136 15.527 11.418 8.912 1.00 0.00 N ATOM 0 H ASN A 136 12.066 10.232 9.329 1.00 0.00 H new ATOM 0 HA ASN A 136 14.201 9.533 7.661 1.00 0.00 H new ATOM 0 HB2 ASN A 136 13.734 9.236 10.653 1.00 0.00 H new ATOM 0 HB3 ASN A 136 15.275 8.892 9.893 1.00 0.00 H new ATOM 0 HD21 ASN A 136 15.805 12.399 8.905 1.00 0.00 H new ATOM 0 HD22 ASN A 136 15.862 10.788 8.183 1.00 0.00 H new ATOM 1999 N LYS A 137 14.745 6.985 8.200 1.00 0.00 N ATOM 2000 CA LYS A 137 14.820 5.536 8.045 1.00 0.00 C ATOM 2001 C LYS A 137 14.241 4.827 9.264 1.00 0.00 C ATOM 2002 O LYS A 137 13.539 3.824 9.136 1.00 0.00 O ATOM 2003 CB LYS A 137 16.270 5.101 7.827 1.00 0.00 C ATOM 2004 CG LYS A 137 16.906 5.705 6.586 1.00 0.00 C ATOM 2005 CD LYS A 137 17.992 4.804 6.021 1.00 0.00 C ATOM 2006 CE LYS A 137 18.557 5.360 4.724 1.00 0.00 C ATOM 2007 NZ LYS A 137 19.851 4.719 4.363 1.00 0.00 N ATOM 0 H LYS A 137 15.648 7.459 8.179 1.00 0.00 H new ATOM 0 HA LYS A 137 14.229 5.258 7.172 1.00 0.00 H new ATOM 0 HB2 LYS A 137 16.860 5.381 8.700 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.307 4.014 7.752 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.140 5.872 5.828 1.00 0.00 H new ATOM 0 HG3 LYS A 137 17.331 6.679 6.831 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.794 4.696 6.752 1.00 0.00 H new ATOM 0 HD3 LYS A 137 17.585 3.808 5.845 1.00 0.00 H new ATOM 0 HE2 LYS A 137 17.838 5.206 3.919 1.00 0.00 H new ATOM 0 HE3 LYS A 137 18.700 6.436 4.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 20.203 5.125 3.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 20.545 4.888 5.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 19.710 3.695 4.244 1.00 0.00 H new ATOM 2021 N THR A 138 14.540 5.353 10.447 1.00 0.00 N ATOM 2022 CA THR A 138 14.047 4.768 11.690 1.00 0.00 C ATOM 2023 C THR A 138 12.533 4.916 11.797 1.00 0.00 C ATOM 2024 O THR A 138 12.026 5.990 12.120 1.00 0.00 O ATOM 2025 CB THR A 138 14.723 5.431 12.891 1.00 0.00 C ATOM 2026 OG1 THR A 138 14.720 6.840 12.756 1.00 0.00 O ATOM 2027 CG2 THR A 138 16.158 4.992 13.088 1.00 0.00 C ATOM 0 H THR A 138 15.121 6.182 10.572 1.00 0.00 H new ATOM 0 HA THR A 138 14.290 3.705 11.686 1.00 0.00 H new ATOM 0 HB THR A 138 14.141 5.117 13.758 1.00 0.00 H new ATOM 0 HG1 THR A 138 13.831 7.140 12.472 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.578 5.500 13.956 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.190 3.914 13.247 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.741 5.245 12.202 1.00 0.00 H new ATOM 2035 N ALA A 139 11.817 3.830 11.525 1.00 0.00 N ATOM 2036 CA ALA A 139 10.361 3.838 11.591 1.00 0.00 C ATOM 2037 C ALA A 139 9.875 3.617 13.020 1.00 0.00 C ATOM 2038 O ALA A 139 9.946 2.507 13.546 1.00 0.00 O ATOM 2039 CB ALA A 139 9.785 2.776 10.668 1.00 0.00 C ATOM 0 H ALA A 139 12.222 2.933 11.257 1.00 0.00 H new ATOM 0 HA ALA A 139 10.013 4.817 11.263 1.00 0.00 H new ATOM 0 HB1 ALA A 139 8.697 2.794 10.728 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.096 2.978 9.643 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.149 1.794 10.971 1.00 0.00 H new ATOM 2045 N GLY A 140 9.381 4.683 13.642 1.00 0.00 N ATOM 2046 CA GLY A 140 8.890 4.586 15.004 1.00 0.00 C ATOM 2047 C GLY A 140 7.665 3.700 15.118 1.00 0.00 C ATOM 2048 O GLY A 140 7.158 3.199 14.115 1.00 0.00 O ATOM 0 H GLY A 140 9.312 5.612 13.227 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.680 4.193 15.644 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.649 5.583 15.372 1.00 0.00 H new ATOM 2052 N GLU A 141 7.189 3.506 16.344 1.00 0.00 N ATOM 2053 CA GLU A 141 6.016 2.674 16.585 1.00 0.00 C ATOM 2054 C GLU A 141 4.795 3.231 15.858 1.00 0.00 C ATOM 2055 O GLU A 141 4.001 2.479 15.294 1.00 0.00 O ATOM 2056 CB GLU A 141 5.733 2.580 18.086 1.00 0.00 C ATOM 2057 CG GLU A 141 5.291 1.197 18.535 1.00 0.00 C ATOM 2058 CD GLU A 141 4.518 1.227 19.840 1.00 0.00 C ATOM 2059 OE1 GLU A 141 5.124 1.560 20.881 1.00 0.00 O ATOM 2060 OE2 GLU A 141 3.308 0.919 19.820 1.00 0.00 O ATOM 0 H GLU A 141 7.597 3.913 17.185 1.00 0.00 H new ATOM 0 HA GLU A 141 6.222 1.676 16.198 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.631 2.862 18.635 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.960 3.302 18.348 1.00 0.00 H new ATOM 0 HG2 GLU A 141 4.670 0.748 17.759 1.00 0.00 H new ATOM 0 HG3 GLU A 141 6.167 0.559 18.651 1.00 0.00 H new ATOM 2067 N GLU A 142 4.655 4.552 15.876 1.00 0.00 N ATOM 2068 CA GLU A 142 3.532 5.210 15.218 1.00 0.00 C ATOM 2069 C GLU A 142 3.681 5.154 13.701 1.00 0.00 C ATOM 2070 O GLU A 142 2.691 5.107 12.971 1.00 0.00 O ATOM 2071 CB GLU A 142 3.425 6.665 15.678 1.00 0.00 C ATOM 2072 CG GLU A 142 3.256 6.817 17.182 1.00 0.00 C ATOM 2073 CD GLU A 142 1.901 7.384 17.564 1.00 0.00 C ATOM 2074 OE1 GLU A 142 0.955 7.251 16.760 1.00 0.00 O ATOM 2075 OE2 GLU A 142 1.790 7.960 18.665 1.00 0.00 O ATOM 0 H GLU A 142 5.305 5.188 16.339 1.00 0.00 H new ATOM 0 HA GLU A 142 2.620 4.681 15.495 1.00 0.00 H new ATOM 0 HB2 GLU A 142 4.320 7.203 15.365 1.00 0.00 H new ATOM 0 HB3 GLU A 142 2.579 7.135 15.176 1.00 0.00 H new ATOM 0 HG2 GLU A 142 3.386 5.845 17.658 1.00 0.00 H new ATOM 0 HG3 GLU A 142 4.040 7.469 17.568 1.00 0.00 H new ATOM 2082 N GLU A 143 4.925 5.159 13.234 1.00 0.00 N ATOM 2083 CA GLU A 143 5.205 5.109 11.804 1.00 0.00 C ATOM 2084 C GLU A 143 4.622 3.845 11.175 1.00 0.00 C ATOM 2085 O GLU A 143 4.334 3.814 9.979 1.00 0.00 O ATOM 2086 CB GLU A 143 6.715 5.170 11.558 1.00 0.00 C ATOM 2087 CG GLU A 143 7.150 6.374 10.738 1.00 0.00 C ATOM 2088 CD GLU A 143 7.236 6.071 9.256 1.00 0.00 C ATOM 2089 OE1 GLU A 143 6.391 5.297 8.759 1.00 0.00 O ATOM 2090 OE2 GLU A 143 8.148 6.608 8.591 1.00 0.00 O ATOM 0 H GLU A 143 5.755 5.197 13.825 1.00 0.00 H new ATOM 0 HA GLU A 143 4.732 5.972 11.336 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.231 5.189 12.518 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.028 4.260 11.046 1.00 0.00 H new ATOM 0 HG2 GLU A 143 6.446 7.191 10.898 1.00 0.00 H new ATOM 0 HG3 GLU A 143 8.122 6.717 11.092 1.00 0.00 H new ATOM 2097 N MET A 144 4.453 2.806 11.988 1.00 0.00 N ATOM 2098 CA MET A 144 3.905 1.541 11.508 1.00 0.00 C ATOM 2099 C MET A 144 2.549 1.750 10.840 1.00 0.00 C ATOM 2100 O MET A 144 1.769 2.610 11.251 1.00 0.00 O ATOM 2101 CB MET A 144 3.767 0.550 12.666 1.00 0.00 C ATOM 2102 CG MET A 144 5.097 0.135 13.273 1.00 0.00 C ATOM 2103 SD MET A 144 6.066 -0.914 12.173 1.00 0.00 S ATOM 2104 CE MET A 144 7.437 0.173 11.788 1.00 0.00 C ATOM 0 H MET A 144 4.687 2.815 12.981 1.00 0.00 H new ATOM 0 HA MET A 144 4.594 1.134 10.768 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.146 0.996 13.443 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.245 -0.339 12.312 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.673 1.027 13.519 1.00 0.00 H new ATOM 0 HG3 MET A 144 4.915 -0.395 14.208 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.126 -0.335 11.114 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.061 1.077 11.309 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.959 0.440 12.707 1.00 0.00 H new ATOM 2114 N ILE A 145 2.276 0.960 9.807 1.00 0.00 N ATOM 2115 CA ILE A 145 1.016 1.060 9.081 1.00 0.00 C ATOM 2116 C ILE A 145 0.392 -0.317 8.872 1.00 0.00 C ATOM 2117 O ILE A 145 0.987 -1.338 9.215 1.00 0.00 O ATOM 2118 CB ILE A 145 1.210 1.737 7.711 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.220 0.955 6.869 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.664 3.177 7.892 1.00 0.00 C ATOM 2121 CD1 ILE A 145 1.863 0.895 5.399 1.00 0.00 C ATOM 0 H ILE A 145 2.911 0.244 9.454 1.00 0.00 H new ATOM 0 HA ILE A 145 0.348 1.671 9.688 1.00 0.00 H new ATOM 0 HB ILE A 145 0.255 1.741 7.186 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.203 1.413 6.978 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.296 -0.060 7.258 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.797 3.642 6.915 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.912 3.727 8.457 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.610 3.195 8.434 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.622 0.326 4.863 1.00 0.00 H new ATOM 0 HD12 ILE A 145 0.894 0.410 5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 145 1.815 1.906 4.995 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.810 -0.335 8.307 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.516 -1.587 8.051 1.00 0.00 C ATOM 2135 C LYS A 146 -2.061 -1.623 6.627 1.00 0.00 C ATOM 2136 O LYS A 146 -3.000 -0.901 6.293 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.660 -1.766 9.051 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.190 -2.045 10.470 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.104 -3.036 11.174 1.00 0.00 C ATOM 2140 CE LYS A 146 -4.083 -2.330 12.099 1.00 0.00 C ATOM 2141 NZ LYS A 146 -3.432 -1.889 13.364 1.00 0.00 N ATOM 0 H LYS A 146 -1.316 0.502 8.017 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.806 -2.406 8.171 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.275 -0.866 9.051 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.296 -2.587 8.720 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.174 -2.438 10.447 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -2.159 -1.113 11.034 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -3.655 -3.615 10.433 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -2.504 -3.742 11.748 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -4.506 -1.465 11.588 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -4.911 -3.000 12.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -4.132 -1.412 13.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -3.050 -2.717 13.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -2.658 -1.230 13.145 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.464 -2.467 5.792 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.891 -2.597 4.404 1.00 0.00 C ATOM 2157 C ILE A 147 -2.942 -3.691 4.251 1.00 0.00 C ATOM 2158 O ILE A 147 -2.691 -4.856 4.561 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.701 -2.913 3.477 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.458 -1.953 3.753 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.129 -2.830 2.020 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.768 -2.396 3.140 1.00 0.00 C ATOM 0 H ILE A 147 -0.684 -3.071 6.052 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.323 -1.639 4.116 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.362 -3.929 3.679 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.201 -0.966 3.368 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.586 -1.851 4.831 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.278 -3.056 1.377 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -1.926 -3.550 1.833 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.491 -1.825 1.804 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.545 -1.668 3.376 1.00 0.00 H new ATOM 0 HD12 ILE A 147 2.048 -3.369 3.543 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.657 -2.470 2.058 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.121 -3.308 3.772 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.212 -4.256 3.578 1.00 0.00 C ATOM 2176 C ARG A 148 -5.534 -4.418 2.096 1.00 0.00 C ATOM 2177 O ARG A 148 -5.224 -3.547 1.284 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.459 -3.790 4.333 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.185 -3.398 5.776 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.250 -2.453 6.309 1.00 0.00 C ATOM 2181 NE ARG A 148 -6.774 -1.683 7.455 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.705 -2.163 8.695 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -7.080 -3.410 8.954 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.258 -1.395 9.679 1.00 0.00 N ATOM 0 H ARG A 148 -4.345 -2.348 3.511 1.00 0.00 H new ATOM 0 HA ARG A 148 -4.896 -5.222 3.971 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.893 -2.938 3.810 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.203 -4.587 4.317 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.148 -4.293 6.397 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.207 -2.922 5.845 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.559 -1.771 5.517 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.131 -3.026 6.598 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.477 -0.720 7.296 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.423 -4.006 8.201 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -7.025 -3.772 9.906 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -5.967 -0.437 9.486 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -6.205 -1.763 10.629 1.00 0.00 H new ATOM 2198 N SER A 149 -6.157 -5.541 1.750 1.00 0.00 N ATOM 2199 CA SER A 149 -6.520 -5.817 0.365 1.00 0.00 C ATOM 2200 C SER A 149 -7.957 -6.320 0.267 1.00 0.00 C ATOM 2201 O SER A 149 -8.450 -6.999 1.169 1.00 0.00 O ATOM 2202 CB SER A 149 -5.566 -6.849 -0.239 1.00 0.00 C ATOM 2203 OG SER A 149 -5.286 -6.552 -1.597 1.00 0.00 O ATOM 0 H SER A 149 -6.420 -6.273 2.409 1.00 0.00 H new ATOM 0 HA SER A 149 -6.441 -4.886 -0.196 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.637 -6.868 0.331 1.00 0.00 H new ATOM 0 HB3 SER A 149 -6.006 -7.843 -0.164 1.00 0.00 H new ATOM 0 HG SER A 149 -4.673 -7.225 -1.959 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.624 -5.981 -0.831 1.00 0.00 N ATOM 2210 CA CYS A 150 -10.005 -6.398 -1.047 1.00 0.00 C ATOM 2211 C CYS A 150 -10.091 -7.439 -2.158 1.00 0.00 C ATOM 2212 O CYS A 150 -11.054 -7.465 -2.924 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.875 -5.190 -1.396 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.328 -4.285 -2.862 1.00 0.00 S ATOM 0 H CYS A 150 -8.231 -5.418 -1.585 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.372 -6.847 -0.124 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.900 -5.527 -1.552 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.889 -4.508 -0.546 1.00 0.00 H new ATOM 0 HG CYS A 150 -9.935 -3.095 -2.516 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.077 -8.295 -2.241 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.036 -9.337 -3.258 1.00 0.00 C ATOM 2222 C ALA A 151 -9.839 -10.560 -2.825 1.00 0.00 C ATOM 2223 O ALA A 151 -10.165 -10.715 -1.648 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.597 -9.726 -3.556 1.00 0.00 C ATOM 0 H ALA A 151 -8.272 -8.286 -1.614 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.490 -8.941 -4.167 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.581 -10.506 -4.318 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.052 -8.854 -3.918 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.125 -10.098 -2.647 1.00 0.00 H new