USER MOD reduce.3.24.130724 H: found=0, std=0, add=970, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 986 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.0449 K(o=-0.045,f=-1.4!) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 THR OG1 : rot -11:sc= 0.467 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 HIS : no HD1:sc= -0.164 X(o=-0.16,f=-0.06) USER MOD Single : A 24 TYR OH : rot -97:sc= 0.523 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 116:sc= 0.505 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 68 HIS : no HD1:sc= -0.231 X(o=-0.23,f=-0.00073) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl -163:sc= -0.222 (180deg=-0.794) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.00256 USER MOD Single : A 101 ASN : amide:sc= -0.477 X(o=-0.48,f=-0.28) USER MOD Single : A 103 HIS : no HD1:sc= -0.0364 X(o=-0.036,f=0) USER MOD Single : A 109 THR OG1 : rot 28:sc= 1.39 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 160:sc= -0.296 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 63:sc= 0.186 USER MOD Single : A 140 GLN :FLIP amide:sc= 0.885 F(o=-0.073,f=0.89) USER MOD Single : A 141 MET CE :methyl -178:sc= 0 (180deg=-0.00504) USER MOD Single : A 142 THR OG1 : rot 180:sc= -3.81! USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 152 ASN : amide:sc= -0.153 X(o=-0.15,f=0) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 57 N GLU A 5 5.292 -41.360 10.803 1.00 0.00 N ATOM 58 CA GLU A 5 4.127 -40.604 11.249 1.00 0.00 C ATOM 59 C GLU A 5 4.523 -39.191 11.669 1.00 0.00 C ATOM 60 O GLU A 5 3.761 -38.242 11.485 1.00 0.00 O ATOM 61 CB GLU A 5 3.439 -41.325 12.410 1.00 0.00 C ATOM 62 CG GLU A 5 2.126 -41.985 12.023 1.00 0.00 C ATOM 63 CD GLU A 5 1.273 -42.335 13.226 1.00 0.00 C ATOM 64 OE1 GLU A 5 0.152 -41.795 13.338 1.00 0.00 O ATOM 65 OE2 GLU A 5 1.725 -43.151 14.057 1.00 0.00 O ATOM 0 HA GLU A 5 3.430 -40.531 10.414 1.00 0.00 H new ATOM 0 HB2 GLU A 5 4.114 -42.083 12.807 1.00 0.00 H new ATOM 0 HB3 GLU A 5 3.254 -40.611 13.212 1.00 0.00 H new ATOM 0 HG2 GLU A 5 1.567 -41.317 11.368 1.00 0.00 H new ATOM 0 HG3 GLU A 5 2.333 -42.891 11.453 1.00 0.00 H new ATOM 73 N TRP A 6 5.719 -39.061 12.235 1.00 0.00 N ATOM 74 CA TRP A 6 6.215 -37.765 12.681 1.00 0.00 C ATOM 75 C TRP A 6 6.403 -36.818 11.501 1.00 0.00 C ATOM 76 O TRP A 6 6.018 -35.650 11.561 1.00 0.00 O ATOM 77 CB TRP A 6 7.537 -37.931 13.433 1.00 0.00 C ATOM 78 CG TRP A 6 7.677 -37.003 14.600 1.00 0.00 C ATOM 79 CD1 TRP A 6 7.526 -37.318 15.921 1.00 0.00 C ATOM 80 CD2 TRP A 6 7.996 -35.608 14.554 1.00 0.00 C ATOM 81 NE1 TRP A 6 7.732 -36.203 16.697 1.00 0.00 N ATOM 82 CE2 TRP A 6 8.023 -35.141 15.882 1.00 0.00 C ATOM 83 CE3 TRP A 6 8.264 -34.708 13.518 1.00 0.00 C ATOM 84 CZ2 TRP A 6 8.304 -33.815 16.200 1.00 0.00 C ATOM 85 CZ3 TRP A 6 8.544 -33.392 13.835 1.00 0.00 C ATOM 86 CH2 TRP A 6 8.562 -32.957 15.166 1.00 0.00 C ATOM 0 H TRP A 6 6.361 -39.837 12.395 1.00 0.00 H new ATOM 0 HA TRP A 6 5.474 -37.334 13.355 1.00 0.00 H new ATOM 0 HB2 TRP A 6 7.620 -38.960 13.784 1.00 0.00 H new ATOM 0 HB3 TRP A 6 8.363 -37.762 12.742 1.00 0.00 H new ATOM 0 HD1 TRP A 6 7.281 -38.299 16.300 1.00 0.00 H new ATOM 0 HE1 TRP A 6 7.677 -36.171 17.715 1.00 0.00 H new ATOM 0 HE3 TRP A 6 8.252 -35.035 12.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 8.318 -33.476 17.225 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.752 -32.688 13.043 1.00 0.00 H new ATOM 0 HH2 TRP A 6 8.784 -31.922 15.381 1.00 0.00 H new ATOM 97 N MET A 7 6.999 -37.329 10.428 1.00 0.00 N ATOM 98 CA MET A 7 7.239 -36.528 9.233 1.00 0.00 C ATOM 99 C MET A 7 5.925 -36.038 8.634 1.00 0.00 C ATOM 100 O MET A 7 5.862 -34.953 8.055 1.00 0.00 O ATOM 101 CB MET A 7 8.012 -37.343 8.195 1.00 0.00 C ATOM 102 CG MET A 7 8.666 -36.493 7.119 1.00 0.00 C ATOM 103 SD MET A 7 9.861 -37.418 6.134 1.00 0.00 S ATOM 104 CE MET A 7 10.267 -36.212 4.872 1.00 0.00 C ATOM 0 H MET A 7 7.324 -38.293 10.362 1.00 0.00 H new ATOM 0 HA MET A 7 7.833 -35.660 9.521 1.00 0.00 H new ATOM 0 HB2 MET A 7 8.780 -37.927 8.702 1.00 0.00 H new ATOM 0 HB3 MET A 7 7.332 -38.053 7.723 1.00 0.00 H new ATOM 0 HG2 MET A 7 7.895 -36.088 6.463 1.00 0.00 H new ATOM 0 HG3 MET A 7 9.165 -35.644 7.586 1.00 0.00 H new ATOM 0 HE1 MET A 7 10.998 -36.637 4.184 1.00 0.00 H new ATOM 0 HE2 MET A 7 9.365 -35.943 4.322 1.00 0.00 H new ATOM 0 HE3 MET A 7 10.686 -35.321 5.341 1.00 0.00 H new ATOM 114 N THR A 8 4.877 -36.843 8.778 1.00 0.00 N ATOM 115 CA THR A 8 3.564 -36.491 8.252 1.00 0.00 C ATOM 116 C THR A 8 3.050 -35.203 8.889 1.00 0.00 C ATOM 117 O THR A 8 2.523 -34.326 8.203 1.00 0.00 O ATOM 118 CB THR A 8 2.569 -37.626 8.500 1.00 0.00 C ATOM 119 OG1 THR A 8 3.145 -38.877 8.166 1.00 0.00 O ATOM 120 CG2 THR A 8 1.288 -37.483 7.708 1.00 0.00 C ATOM 0 H THR A 8 4.912 -37.744 9.255 1.00 0.00 H new ATOM 0 HA THR A 8 3.663 -36.332 7.178 1.00 0.00 H new ATOM 0 HB THR A 8 2.327 -37.573 9.561 1.00 0.00 H new ATOM 0 HG1 THR A 8 2.495 -39.591 8.333 1.00 0.00 H new ATOM 0 HG21 THR A 8 0.627 -38.321 7.931 1.00 0.00 H new ATOM 0 HG22 THR A 8 0.795 -36.550 7.979 1.00 0.00 H new ATOM 0 HG23 THR A 8 1.518 -37.476 6.643 1.00 0.00 H new ATOM 128 N THR A 9 3.208 -35.095 10.203 1.00 0.00 N ATOM 129 CA THR A 9 2.762 -33.915 10.933 1.00 0.00 C ATOM 130 C THR A 9 3.680 -32.728 10.662 1.00 0.00 C ATOM 131 O THR A 9 3.238 -31.579 10.641 1.00 0.00 O ATOM 132 CB THR A 9 2.713 -34.204 12.434 1.00 0.00 C ATOM 133 OG1 THR A 9 2.012 -35.408 12.689 1.00 0.00 O ATOM 134 CG2 THR A 9 2.047 -33.107 13.235 1.00 0.00 C ATOM 0 H THR A 9 3.642 -35.811 10.785 1.00 0.00 H new ATOM 0 HA THR A 9 1.760 -33.663 10.586 1.00 0.00 H new ATOM 0 HB THR A 9 3.754 -34.278 12.748 1.00 0.00 H new ATOM 0 HG1 THR A 9 1.993 -35.577 13.654 1.00 0.00 H new ATOM 0 HG21 THR A 9 2.046 -33.377 14.291 1.00 0.00 H new ATOM 0 HG22 THR A 9 2.594 -32.174 13.099 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.020 -32.979 12.893 1.00 0.00 H new ATOM 142 N PHE A 10 4.962 -33.014 10.456 1.00 0.00 N ATOM 143 CA PHE A 10 5.944 -31.969 10.186 1.00 0.00 C ATOM 144 C PHE A 10 5.818 -31.462 8.753 1.00 0.00 C ATOM 145 O PHE A 10 6.083 -30.293 8.473 1.00 0.00 O ATOM 146 CB PHE A 10 7.359 -32.498 10.430 1.00 0.00 C ATOM 147 CG PHE A 10 8.425 -31.450 10.279 1.00 0.00 C ATOM 148 CD1 PHE A 10 8.726 -30.592 11.325 1.00 0.00 C ATOM 149 CD2 PHE A 10 9.126 -31.323 9.090 1.00 0.00 C ATOM 150 CE1 PHE A 10 9.707 -29.628 11.189 1.00 0.00 C ATOM 151 CE2 PHE A 10 10.107 -30.361 8.948 1.00 0.00 C ATOM 152 CZ PHE A 10 10.398 -29.512 9.998 1.00 0.00 C ATOM 0 H PHE A 10 5.345 -33.959 10.471 1.00 0.00 H new ATOM 0 HA PHE A 10 5.751 -31.138 10.864 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.413 -32.918 11.434 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.559 -33.312 9.733 1.00 0.00 H new ATOM 0 HD1 PHE A 10 8.188 -30.678 12.257 1.00 0.00 H new ATOM 0 HD2 PHE A 10 8.903 -31.984 8.265 1.00 0.00 H new ATOM 0 HE1 PHE A 10 9.933 -28.966 12.012 1.00 0.00 H new ATOM 0 HE2 PHE A 10 10.646 -30.273 8.016 1.00 0.00 H new ATOM 0 HZ PHE A 10 11.164 -28.759 9.888 1.00 0.00 H new ATOM 162 N ARG A 11 5.413 -32.349 7.850 1.00 0.00 N ATOM 163 CA ARG A 11 5.253 -31.990 6.445 1.00 0.00 C ATOM 164 C ARG A 11 4.165 -30.935 6.273 1.00 0.00 C ATOM 165 O ARG A 11 4.363 -29.931 5.588 1.00 0.00 O ATOM 166 CB ARG A 11 4.911 -33.230 5.617 1.00 0.00 C ATOM 167 CG ARG A 11 6.089 -34.171 5.416 1.00 0.00 C ATOM 168 CD ARG A 11 6.582 -34.151 3.976 1.00 0.00 C ATOM 169 NE ARG A 11 7.468 -33.018 3.717 1.00 0.00 N ATOM 170 CZ ARG A 11 8.296 -32.949 2.677 1.00 0.00 C ATOM 171 NH1 ARG A 11 8.354 -33.941 1.797 1.00 0.00 N ATOM 172 NH2 ARG A 11 9.068 -31.883 2.515 1.00 0.00 N ATOM 0 H ARG A 11 5.190 -33.321 8.065 1.00 0.00 H new ATOM 0 HA ARG A 11 6.197 -31.574 6.093 1.00 0.00 H new ATOM 0 HB2 ARG A 11 4.103 -33.773 6.107 1.00 0.00 H new ATOM 0 HB3 ARG A 11 4.538 -32.915 4.643 1.00 0.00 H new ATOM 0 HG2 ARG A 11 6.902 -33.885 6.084 1.00 0.00 H new ATOM 0 HG3 ARG A 11 5.796 -35.185 5.687 1.00 0.00 H new ATOM 0 HD2 ARG A 11 7.109 -35.080 3.760 1.00 0.00 H new ATOM 0 HD3 ARG A 11 5.728 -34.105 3.301 1.00 0.00 H new ATOM 0 HE ARG A 11 7.451 -32.235 4.371 1.00 0.00 H new ATOM 0 HH11 ARG A 11 7.762 -34.763 1.915 1.00 0.00 H new ATOM 0 HH12 ARG A 11 8.991 -33.881 1.002 1.00 0.00 H new ATOM 0 HH21 ARG A 11 9.027 -31.117 3.187 1.00 0.00 H new ATOM 0 HH22 ARG A 11 9.703 -31.829 1.718 1.00 0.00 H new ATOM 186 N GLU A 12 3.017 -31.169 6.900 1.00 0.00 N ATOM 187 CA GLU A 12 1.897 -30.238 6.816 1.00 0.00 C ATOM 188 C GLU A 12 2.157 -28.996 7.664 1.00 0.00 C ATOM 189 O GLU A 12 1.706 -27.901 7.330 1.00 0.00 O ATOM 190 CB GLU A 12 0.605 -30.919 7.271 1.00 0.00 C ATOM 191 CG GLU A 12 0.624 -31.345 8.730 1.00 0.00 C ATOM 192 CD GLU A 12 -0.158 -30.401 9.623 1.00 0.00 C ATOM 193 OE1 GLU A 12 0.068 -29.177 9.534 1.00 0.00 O ATOM 194 OE2 GLU A 12 -0.997 -30.888 10.410 1.00 0.00 O ATOM 0 H GLU A 12 2.838 -31.995 7.472 1.00 0.00 H new ATOM 0 HA GLU A 12 1.790 -29.930 5.776 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -0.231 -30.238 7.111 1.00 0.00 H new ATOM 0 HB3 GLU A 12 0.427 -31.795 6.647 1.00 0.00 H new ATOM 0 HG2 GLU A 12 0.209 -32.349 8.817 1.00 0.00 H new ATOM 0 HG3 GLU A 12 1.656 -31.396 9.077 1.00 0.00 H new ATOM 202 N ASN A 13 2.885 -29.176 8.760 1.00 0.00 N ATOM 203 CA ASN A 13 3.204 -28.070 9.655 1.00 0.00 C ATOM 204 C ASN A 13 4.117 -27.059 8.968 1.00 0.00 C ATOM 205 O ASN A 13 3.807 -25.870 8.902 1.00 0.00 O ATOM 206 CB ASN A 13 3.871 -28.591 10.929 1.00 0.00 C ATOM 207 CG ASN A 13 3.938 -27.540 12.019 1.00 0.00 C ATOM 208 OD1 ASN A 13 3.493 -26.408 11.833 1.00 0.00 O ATOM 209 ND2 ASN A 13 4.495 -27.911 13.166 1.00 0.00 N ATOM 0 H ASN A 13 3.265 -30.077 9.050 1.00 0.00 H new ATOM 0 HA ASN A 13 2.272 -27.571 9.919 1.00 0.00 H new ATOM 0 HB2 ASN A 13 3.320 -29.457 11.296 1.00 0.00 H new ATOM 0 HB3 ASN A 13 4.879 -28.932 10.694 1.00 0.00 H new ATOM 0 HD21 ASN A 13 4.567 -27.247 13.937 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.851 -28.860 13.276 1.00 0.00 H new ATOM 216 N ILE A 14 5.245 -27.542 8.454 1.00 0.00 N ATOM 217 CA ILE A 14 6.203 -26.682 7.772 1.00 0.00 C ATOM 218 C ILE A 14 5.567 -26.007 6.560 1.00 0.00 C ATOM 219 O ILE A 14 5.802 -24.827 6.300 1.00 0.00 O ATOM 220 CB ILE A 14 7.446 -27.476 7.319 1.00 0.00 C ATOM 221 CG1 ILE A 14 8.494 -26.533 6.722 1.00 0.00 C ATOM 222 CG2 ILE A 14 7.055 -28.551 6.315 1.00 0.00 C ATOM 223 CD1 ILE A 14 9.609 -26.184 7.684 1.00 0.00 C ATOM 0 H ILE A 14 5.516 -28.524 8.498 1.00 0.00 H new ATOM 0 HA ILE A 14 6.513 -25.919 8.486 1.00 0.00 H new ATOM 0 HB ILE A 14 7.882 -27.965 8.190 1.00 0.00 H new ATOM 0 HG12 ILE A 14 8.923 -26.995 5.833 1.00 0.00 H new ATOM 0 HG13 ILE A 14 8.003 -25.615 6.398 1.00 0.00 H new ATOM 0 HG21 ILE A 14 7.944 -29.101 6.006 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.345 -29.238 6.775 1.00 0.00 H new ATOM 0 HG23 ILE A 14 6.596 -28.085 5.443 1.00 0.00 H new ATOM 0 HD11 ILE A 14 10.315 -25.513 7.195 1.00 0.00 H new ATOM 0 HD12 ILE A 14 9.191 -25.693 8.563 1.00 0.00 H new ATOM 0 HD13 ILE A 14 10.125 -27.094 7.988 1.00 0.00 H new ATOM 235 N ALA A 15 4.761 -26.764 5.822 1.00 0.00 N ATOM 236 CA ALA A 15 4.092 -26.240 4.638 1.00 0.00 C ATOM 237 C ALA A 15 3.122 -25.122 5.006 1.00 0.00 C ATOM 238 O ALA A 15 2.923 -24.181 4.237 1.00 0.00 O ATOM 239 CB ALA A 15 3.360 -27.356 3.908 1.00 0.00 C ATOM 0 H ALA A 15 4.556 -27.743 6.024 1.00 0.00 H new ATOM 0 HA ALA A 15 4.852 -25.824 3.976 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.865 -26.950 3.026 1.00 0.00 H new ATOM 0 HB2 ALA A 15 4.074 -28.121 3.604 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.616 -27.797 4.571 1.00 0.00 H new ATOM 245 N GLN A 16 2.522 -25.230 6.186 1.00 0.00 N ATOM 246 CA GLN A 16 1.572 -24.228 6.656 1.00 0.00 C ATOM 247 C GLN A 16 2.285 -22.930 7.017 1.00 0.00 C ATOM 248 O GLN A 16 1.931 -21.858 6.525 1.00 0.00 O ATOM 249 CB GLN A 16 0.802 -24.755 7.868 1.00 0.00 C ATOM 250 CG GLN A 16 -0.412 -23.914 8.230 1.00 0.00 C ATOM 251 CD GLN A 16 -0.953 -24.236 9.609 1.00 0.00 C ATOM 252 OE1 GLN A 16 -1.047 -23.363 10.472 1.00 0.00 O ATOM 253 NE2 GLN A 16 -1.313 -25.496 9.825 1.00 0.00 N ATOM 0 H GLN A 16 2.676 -26.002 6.835 1.00 0.00 H new ATOM 0 HA GLN A 16 0.869 -24.022 5.849 1.00 0.00 H new ATOM 0 HB2 GLN A 16 0.479 -25.776 7.667 1.00 0.00 H new ATOM 0 HB3 GLN A 16 1.474 -24.796 8.725 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -0.144 -22.858 8.186 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -1.195 -24.075 7.489 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.218 -26.188 9.082 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -1.684 -25.772 10.734 1.00 0.00 H new ATOM 262 N THR A 17 3.293 -23.032 7.877 1.00 0.00 N ATOM 263 CA THR A 17 4.058 -21.865 8.305 1.00 0.00 C ATOM 264 C THR A 17 4.635 -21.118 7.105 1.00 0.00 C ATOM 265 O THR A 17 4.853 -19.908 7.163 1.00 0.00 O ATOM 266 CB THR A 17 5.186 -22.287 9.247 1.00 0.00 C ATOM 267 OG1 THR A 17 6.053 -23.210 8.610 1.00 0.00 O ATOM 268 CG2 THR A 17 4.691 -22.929 10.524 1.00 0.00 C ATOM 0 H THR A 17 3.600 -23.912 8.292 1.00 0.00 H new ATOM 0 HA THR A 17 3.381 -21.194 8.835 1.00 0.00 H new ATOM 0 HB THR A 17 5.709 -21.365 9.502 1.00 0.00 H new ATOM 0 HG1 THR A 17 5.650 -23.511 7.769 1.00 0.00 H new ATOM 0 HG21 THR A 17 5.542 -23.204 11.147 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.059 -22.224 11.064 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.114 -23.822 10.283 1.00 0.00 H new ATOM 276 N TRP A 18 4.878 -21.847 6.020 1.00 0.00 N ATOM 277 CA TRP A 18 5.429 -21.250 4.809 1.00 0.00 C ATOM 278 C TRP A 18 4.316 -20.741 3.897 1.00 0.00 C ATOM 279 O TRP A 18 4.498 -19.769 3.164 1.00 0.00 O ATOM 280 CB TRP A 18 6.291 -22.270 4.061 1.00 0.00 C ATOM 281 CG TRP A 18 7.574 -21.695 3.541 1.00 0.00 C ATOM 282 CD1 TRP A 18 8.529 -21.037 4.262 1.00 0.00 C ATOM 283 CD2 TRP A 18 8.042 -21.725 2.188 1.00 0.00 C ATOM 284 NE1 TRP A 18 9.561 -20.657 3.440 1.00 0.00 N ATOM 285 CE2 TRP A 18 9.287 -21.068 2.162 1.00 0.00 C ATOM 286 CE3 TRP A 18 7.529 -22.244 0.995 1.00 0.00 C ATOM 287 CZ2 TRP A 18 10.024 -20.916 0.991 1.00 0.00 C ATOM 288 CZ3 TRP A 18 8.263 -22.094 -0.167 1.00 0.00 C ATOM 289 CH2 TRP A 18 9.499 -21.435 -0.161 1.00 0.00 C ATOM 0 H TRP A 18 4.702 -22.850 5.955 1.00 0.00 H new ATOM 0 HA TRP A 18 6.050 -20.403 5.101 1.00 0.00 H new ATOM 0 HB2 TRP A 18 6.518 -23.102 4.728 1.00 0.00 H new ATOM 0 HB3 TRP A 18 5.719 -22.677 3.227 1.00 0.00 H new ATOM 0 HD1 TRP A 18 8.480 -20.844 5.323 1.00 0.00 H new ATOM 0 HE1 TRP A 18 10.396 -20.151 3.733 1.00 0.00 H new ATOM 0 HE3 TRP A 18 6.576 -22.753 0.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 10.976 -20.407 0.992 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 7.877 -22.491 -1.094 1.00 0.00 H new ATOM 0 HH2 TRP A 18 10.049 -21.334 -1.085 1.00 0.00 H new ATOM 300 N GLN A 19 3.165 -21.403 3.947 1.00 0.00 N ATOM 301 CA GLN A 19 2.024 -21.015 3.124 1.00 0.00 C ATOM 302 C GLN A 19 1.064 -20.111 3.897 1.00 0.00 C ATOM 303 O GLN A 19 -0.083 -19.924 3.493 1.00 0.00 O ATOM 304 CB GLN A 19 1.281 -22.258 2.629 1.00 0.00 C ATOM 305 CG GLN A 19 1.960 -22.946 1.456 1.00 0.00 C ATOM 306 CD GLN A 19 0.989 -23.739 0.605 1.00 0.00 C ATOM 307 OE1 GLN A 19 0.289 -24.623 1.099 1.00 0.00 O ATOM 308 NE2 GLN A 19 0.940 -23.426 -0.685 1.00 0.00 N ATOM 0 H GLN A 19 2.997 -22.210 4.548 1.00 0.00 H new ATOM 0 HA GLN A 19 2.404 -20.457 2.268 1.00 0.00 H new ATOM 0 HB2 GLN A 19 1.189 -22.967 3.451 1.00 0.00 H new ATOM 0 HB3 GLN A 19 0.270 -21.974 2.337 1.00 0.00 H new ATOM 0 HG2 GLN A 19 2.453 -22.197 0.836 1.00 0.00 H new ATOM 0 HG3 GLN A 19 2.737 -23.612 1.830 1.00 0.00 H new ATOM 0 HE21 GLN A 19 1.538 -22.686 -1.053 1.00 0.00 H new ATOM 0 HE22 GLN A 19 0.305 -23.925 -1.307 1.00 0.00 H new ATOM 348 N GLU A 22 -0.181 -12.953 5.156 1.00 0.00 N ATOM 349 CA GLU A 22 -0.297 -11.928 6.188 1.00 0.00 C ATOM 350 C GLU A 22 0.974 -11.855 7.026 1.00 0.00 C ATOM 351 O GLU A 22 1.305 -12.791 7.754 1.00 0.00 O ATOM 352 CB GLU A 22 -1.501 -12.213 7.088 1.00 0.00 C ATOM 353 CG GLU A 22 -2.810 -12.349 6.329 1.00 0.00 C ATOM 354 CD GLU A 22 -3.973 -12.710 7.232 1.00 0.00 C ATOM 355 OE1 GLU A 22 -4.870 -11.859 7.414 1.00 0.00 O ATOM 356 OE2 GLU A 22 -3.988 -13.843 7.756 1.00 0.00 O ATOM 0 HA GLU A 22 -0.442 -10.966 5.695 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -1.317 -13.131 7.646 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.596 -11.410 7.818 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.029 -11.411 5.818 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.702 -13.113 5.559 1.00 0.00 H new ATOM 364 N HIS A 23 1.685 -10.736 6.919 1.00 0.00 N ATOM 365 CA HIS A 23 2.921 -10.542 7.667 1.00 0.00 C ATOM 366 C HIS A 23 3.024 -9.112 8.188 1.00 0.00 C ATOM 367 O HIS A 23 2.256 -8.238 7.785 1.00 0.00 O ATOM 368 CB HIS A 23 4.131 -10.864 6.788 1.00 0.00 C ATOM 369 CG HIS A 23 4.058 -10.250 5.424 1.00 0.00 C ATOM 370 ND1 HIS A 23 3.478 -10.882 4.344 1.00 0.00 N ATOM 371 CD2 HIS A 23 4.496 -9.053 4.966 1.00 0.00 C ATOM 372 CE1 HIS A 23 3.563 -10.102 3.281 1.00 0.00 C ATOM 373 NE2 HIS A 23 4.176 -8.986 3.632 1.00 0.00 N ATOM 0 H HIS A 23 1.426 -9.951 6.322 1.00 0.00 H new ATOM 0 HA HIS A 23 2.909 -11.221 8.520 1.00 0.00 H new ATOM 0 HB2 HIS A 23 5.035 -10.516 7.287 1.00 0.00 H new ATOM 0 HB3 HIS A 23 4.219 -11.946 6.687 1.00 0.00 H new ATOM 0 HD2 HIS A 23 5.002 -8.293 5.542 1.00 0.00 H new ATOM 0 HE1 HIS A 23 3.194 -10.337 2.293 1.00 0.00 H new ATOM 0 HE2 HIS A 23 4.379 -8.201 3.013 1.00 0.00 H new ATOM 382 N TYR A 24 3.977 -8.881 9.085 1.00 0.00 N ATOM 383 CA TYR A 24 4.181 -7.557 9.661 1.00 0.00 C ATOM 384 C TYR A 24 5.004 -6.679 8.724 1.00 0.00 C ATOM 385 O TYR A 24 6.201 -6.901 8.540 1.00 0.00 O ATOM 386 CB TYR A 24 4.879 -7.672 11.017 1.00 0.00 C ATOM 387 CG TYR A 24 4.632 -6.489 11.927 1.00 0.00 C ATOM 388 CD1 TYR A 24 3.501 -6.434 12.733 1.00 0.00 C ATOM 389 CD2 TYR A 24 5.529 -5.429 11.982 1.00 0.00 C ATOM 390 CE1 TYR A 24 3.272 -5.356 13.567 1.00 0.00 C ATOM 391 CE2 TYR A 24 5.307 -4.348 12.813 1.00 0.00 C ATOM 392 CZ TYR A 24 4.178 -4.316 13.604 1.00 0.00 C ATOM 393 OH TYR A 24 3.953 -3.241 14.433 1.00 0.00 O ATOM 0 H TYR A 24 4.620 -9.594 9.429 1.00 0.00 H new ATOM 0 HA TYR A 24 3.205 -7.092 9.801 1.00 0.00 H new ATOM 0 HB2 TYR A 24 4.540 -8.580 11.515 1.00 0.00 H new ATOM 0 HB3 TYR A 24 5.952 -7.778 10.856 1.00 0.00 H new ATOM 0 HD1 TYR A 24 2.790 -7.246 12.707 1.00 0.00 H new ATOM 0 HD2 TYR A 24 6.415 -5.451 11.365 1.00 0.00 H new ATOM 0 HE1 TYR A 24 2.388 -5.328 14.187 1.00 0.00 H new ATOM 0 HE2 TYR A 24 6.014 -3.532 12.843 1.00 0.00 H new ATOM 0 HH TYR A 24 3.541 -2.514 13.921 1.00 0.00 H new ATOM 403 N ASP A 25 4.355 -5.682 8.133 1.00 0.00 N ATOM 404 CA ASP A 25 5.027 -4.770 7.215 1.00 0.00 C ATOM 405 C ASP A 25 5.551 -3.541 7.951 1.00 0.00 C ATOM 406 O ASP A 25 4.847 -2.947 8.766 1.00 0.00 O ATOM 407 CB ASP A 25 4.071 -4.340 6.099 1.00 0.00 C ATOM 408 CG ASP A 25 3.568 -5.515 5.284 1.00 0.00 C ATOM 409 OD1 ASP A 25 3.190 -6.540 5.890 1.00 0.00 O ATOM 410 OD2 ASP A 25 3.553 -5.411 4.040 1.00 0.00 O ATOM 0 H ASP A 25 3.364 -5.485 8.273 1.00 0.00 H new ATOM 0 HA ASP A 25 5.875 -5.297 6.777 1.00 0.00 H new ATOM 0 HB2 ASP A 25 3.222 -3.813 6.535 1.00 0.00 H new ATOM 0 HB3 ASP A 25 4.579 -3.636 5.440 1.00 0.00 H new ATOM 416 N LEU A 26 6.792 -3.166 7.656 1.00 0.00 N ATOM 417 CA LEU A 26 7.411 -2.008 8.289 1.00 0.00 C ATOM 418 C LEU A 26 7.796 -0.962 7.249 1.00 0.00 C ATOM 419 O LEU A 26 8.693 -1.182 6.435 1.00 0.00 O ATOM 420 CB LEU A 26 8.648 -2.434 9.083 1.00 0.00 C ATOM 421 CG LEU A 26 9.057 -1.478 10.206 1.00 0.00 C ATOM 422 CD1 LEU A 26 8.396 -1.880 11.515 1.00 0.00 C ATOM 423 CD2 LEU A 26 10.571 -1.452 10.356 1.00 0.00 C ATOM 0 H LEU A 26 7.388 -3.648 6.983 1.00 0.00 H new ATOM 0 HA LEU A 26 6.685 -1.567 8.971 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.464 -3.418 9.513 1.00 0.00 H new ATOM 0 HB3 LEU A 26 9.485 -2.540 8.393 1.00 0.00 H new ATOM 0 HG LEU A 26 8.720 -0.475 9.946 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.698 -1.189 12.302 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.313 -1.848 11.400 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.703 -2.891 11.782 1.00 0.00 H new ATOM 0 HD21 LEU A 26 10.845 -0.767 11.159 1.00 0.00 H new ATOM 0 HD22 LEU A 26 10.930 -2.453 10.594 1.00 0.00 H new ATOM 0 HD23 LEU A 26 11.023 -1.117 9.423 1.00 0.00 H new ATOM 435 N TYR A 27 7.111 0.177 7.281 1.00 0.00 N ATOM 436 CA TYR A 27 7.381 1.258 6.339 1.00 0.00 C ATOM 437 C TYR A 27 8.260 2.328 6.977 1.00 0.00 C ATOM 438 O TYR A 27 7.928 2.873 8.030 1.00 0.00 O ATOM 439 CB TYR A 27 6.069 1.881 5.857 1.00 0.00 C ATOM 440 CG TYR A 27 5.241 0.956 4.992 1.00 0.00 C ATOM 441 CD1 TYR A 27 4.554 -0.116 5.548 1.00 0.00 C ATOM 442 CD2 TYR A 27 5.146 1.157 3.620 1.00 0.00 C ATOM 443 CE1 TYR A 27 3.795 -0.962 4.762 1.00 0.00 C ATOM 444 CE2 TYR A 27 4.388 0.315 2.827 1.00 0.00 C ATOM 445 CZ TYR A 27 3.716 -0.742 3.403 1.00 0.00 C ATOM 446 OH TYR A 27 2.961 -1.583 2.617 1.00 0.00 O ATOM 0 H TYR A 27 6.366 0.375 7.948 1.00 0.00 H new ATOM 0 HA TYR A 27 7.912 0.838 5.485 1.00 0.00 H new ATOM 0 HB2 TYR A 27 5.479 2.180 6.723 1.00 0.00 H new ATOM 0 HB3 TYR A 27 6.292 2.788 5.295 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.614 -0.291 6.612 1.00 0.00 H new ATOM 0 HD2 TYR A 27 5.672 1.984 3.166 1.00 0.00 H new ATOM 0 HE1 TYR A 27 3.267 -1.791 5.210 1.00 0.00 H new ATOM 0 HE2 TYR A 27 4.323 0.485 1.762 1.00 0.00 H new ATOM 0 HH TYR A 27 3.010 -1.289 1.683 1.00 0.00 H new ATOM 456 N ILE A 28 9.384 2.626 6.332 1.00 0.00 N ATOM 457 CA ILE A 28 10.311 3.632 6.835 1.00 0.00 C ATOM 458 C ILE A 28 11.162 4.209 5.703 1.00 0.00 C ATOM 459 O ILE A 28 11.690 3.467 4.876 1.00 0.00 O ATOM 460 CB ILE A 28 11.238 3.046 7.921 1.00 0.00 C ATOM 461 CG1 ILE A 28 12.112 4.144 8.530 1.00 0.00 C ATOM 462 CG2 ILE A 28 12.100 1.934 7.342 1.00 0.00 C ATOM 463 CD1 ILE A 28 11.442 4.893 9.662 1.00 0.00 C ATOM 0 H ILE A 28 9.674 2.184 5.460 1.00 0.00 H new ATOM 0 HA ILE A 28 9.711 4.429 7.274 1.00 0.00 H new ATOM 0 HB ILE A 28 10.619 2.623 8.712 1.00 0.00 H new ATOM 0 HG12 ILE A 28 13.037 3.699 8.897 1.00 0.00 H new ATOM 0 HG13 ILE A 28 12.387 4.853 7.749 1.00 0.00 H new ATOM 0 HG21 ILE A 28 12.747 1.532 8.121 1.00 0.00 H new ATOM 0 HG22 ILE A 28 11.460 1.140 6.957 1.00 0.00 H new ATOM 0 HG23 ILE A 28 12.711 2.332 6.532 1.00 0.00 H new ATOM 0 HD11 ILE A 28 12.120 5.656 10.045 1.00 0.00 H new ATOM 0 HD12 ILE A 28 10.532 5.367 9.296 1.00 0.00 H new ATOM 0 HD13 ILE A 28 11.191 4.196 10.461 1.00 0.00 H new ATOM 475 N PRO A 29 11.308 5.546 5.650 1.00 0.00 N ATOM 476 CA PRO A 29 12.101 6.210 4.610 1.00 0.00 C ATOM 477 C PRO A 29 13.597 5.969 4.782 1.00 0.00 C ATOM 478 O PRO A 29 14.022 5.270 5.702 1.00 0.00 O ATOM 479 CB PRO A 29 11.773 7.692 4.805 1.00 0.00 C ATOM 480 CG PRO A 29 11.389 7.809 6.238 1.00 0.00 C ATOM 481 CD PRO A 29 10.715 6.513 6.595 1.00 0.00 C ATOM 0 HA PRO A 29 11.864 5.835 3.614 1.00 0.00 H new ATOM 0 HB2 PRO A 29 12.632 8.322 4.573 1.00 0.00 H new ATOM 0 HB3 PRO A 29 10.960 8.007 4.150 1.00 0.00 H new ATOM 0 HG2 PRO A 29 12.265 7.978 6.864 1.00 0.00 H new ATOM 0 HG3 PRO A 29 10.718 8.654 6.394 1.00 0.00 H new ATOM 0 HD2 PRO A 29 10.907 6.232 7.630 1.00 0.00 H new ATOM 0 HD3 PRO A 29 9.633 6.577 6.478 1.00 0.00 H new ATOM 489 N ALA A 30 14.392 6.553 3.891 1.00 0.00 N ATOM 490 CA ALA A 30 15.841 6.400 3.945 1.00 0.00 C ATOM 491 C ALA A 30 16.524 7.249 2.878 1.00 0.00 C ATOM 492 O ALA A 30 17.297 8.155 3.192 1.00 0.00 O ATOM 493 CB ALA A 30 16.224 4.937 3.782 1.00 0.00 C ATOM 0 H ALA A 30 14.057 7.136 3.124 1.00 0.00 H new ATOM 0 HA ALA A 30 16.181 6.747 4.921 1.00 0.00 H new ATOM 0 HB1 ALA A 30 17.309 4.838 3.824 1.00 0.00 H new ATOM 0 HB2 ALA A 30 15.775 4.352 4.584 1.00 0.00 H new ATOM 0 HB3 ALA A 30 15.864 4.571 2.820 1.00 0.00 H new ATOM 499 N ILE A 31 16.236 6.950 1.615 1.00 0.00 N ATOM 500 CA ILE A 31 16.825 7.686 0.503 1.00 0.00 C ATOM 501 C ILE A 31 15.873 8.758 -0.015 1.00 0.00 C ATOM 502 O ILE A 31 14.685 8.504 -0.216 1.00 0.00 O ATOM 503 CB ILE A 31 17.200 6.745 -0.659 1.00 0.00 C ATOM 504 CG1 ILE A 31 17.988 5.542 -0.136 1.00 0.00 C ATOM 505 CG2 ILE A 31 18.002 7.496 -1.711 1.00 0.00 C ATOM 506 CD1 ILE A 31 17.138 4.307 0.073 1.00 0.00 C ATOM 0 H ILE A 31 15.599 6.204 1.337 1.00 0.00 H new ATOM 0 HA ILE A 31 17.729 8.161 0.884 1.00 0.00 H new ATOM 0 HB ILE A 31 16.283 6.380 -1.122 1.00 0.00 H new ATOM 0 HG12 ILE A 31 18.788 5.308 -0.839 1.00 0.00 H new ATOM 0 HG13 ILE A 31 18.462 5.811 0.808 1.00 0.00 H new ATOM 0 HG21 ILE A 31 18.259 6.818 -2.525 1.00 0.00 H new ATOM 0 HG22 ILE A 31 17.407 8.322 -2.101 1.00 0.00 H new ATOM 0 HG23 ILE A 31 18.915 7.887 -1.262 1.00 0.00 H new ATOM 0 HD11 ILE A 31 17.762 3.494 0.444 1.00 0.00 H new ATOM 0 HD12 ILE A 31 16.354 4.523 0.799 1.00 0.00 H new ATOM 0 HD13 ILE A 31 16.685 4.013 -0.874 1.00 0.00 H new ATOM 518 N THR A 32 16.403 9.958 -0.231 1.00 0.00 N ATOM 519 CA THR A 32 15.601 11.071 -0.726 1.00 0.00 C ATOM 520 C THR A 32 16.479 12.100 -1.430 1.00 0.00 C ATOM 521 O THR A 32 17.671 12.215 -1.142 1.00 0.00 O ATOM 522 CB THR A 32 14.840 11.732 0.424 1.00 0.00 C ATOM 523 OG1 THR A 32 13.992 12.757 -0.061 1.00 0.00 O ATOM 524 CG2 THR A 32 15.748 12.343 1.469 1.00 0.00 C ATOM 0 H THR A 32 17.385 10.184 -0.071 1.00 0.00 H new ATOM 0 HA THR A 32 14.883 10.678 -1.446 1.00 0.00 H new ATOM 0 HB THR A 32 14.265 10.931 0.889 1.00 0.00 H new ATOM 0 HG1 THR A 32 13.058 12.518 0.112 1.00 0.00 H new ATOM 0 HG21 THR A 32 15.144 12.795 2.256 1.00 0.00 H new ATOM 0 HG22 THR A 32 16.382 11.567 1.898 1.00 0.00 H new ATOM 0 HG23 THR A 32 16.372 13.107 1.006 1.00 0.00 H new ATOM 532 N TRP A 33 15.883 12.849 -2.351 1.00 0.00 N ATOM 533 CA TRP A 33 16.613 13.870 -3.096 1.00 0.00 C ATOM 534 C TRP A 33 15.735 15.093 -3.343 1.00 0.00 C ATOM 535 O TRP A 33 14.508 14.993 -3.371 1.00 0.00 O ATOM 536 CB TRP A 33 17.111 13.304 -4.427 1.00 0.00 C ATOM 537 CG TRP A 33 16.006 12.876 -5.344 1.00 0.00 C ATOM 538 CD1 TRP A 33 14.997 12.001 -5.059 1.00 0.00 C ATOM 539 CD2 TRP A 33 15.800 13.301 -6.696 1.00 0.00 C ATOM 540 NE1 TRP A 33 14.176 11.858 -6.151 1.00 0.00 N ATOM 541 CE2 TRP A 33 14.648 12.645 -7.169 1.00 0.00 C ATOM 542 CE3 TRP A 33 16.479 14.174 -7.552 1.00 0.00 C ATOM 543 CZ2 TRP A 33 14.160 12.835 -8.459 1.00 0.00 C ATOM 544 CZ3 TRP A 33 15.993 14.361 -8.832 1.00 0.00 C ATOM 545 CH2 TRP A 33 14.843 13.694 -9.275 1.00 0.00 C ATOM 0 H TRP A 33 14.897 12.769 -2.600 1.00 0.00 H new ATOM 0 HA TRP A 33 17.472 14.177 -2.499 1.00 0.00 H new ATOM 0 HB2 TRP A 33 17.718 14.057 -4.929 1.00 0.00 H new ATOM 0 HB3 TRP A 33 17.760 12.451 -4.230 1.00 0.00 H new ATOM 0 HD1 TRP A 33 14.864 11.496 -4.114 1.00 0.00 H new ATOM 0 HE1 TRP A 33 13.349 11.263 -6.197 1.00 0.00 H new ATOM 0 HE3 TRP A 33 17.366 14.692 -7.219 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 13.274 12.322 -8.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 16.508 15.033 -9.502 1.00 0.00 H new ATOM 0 HH2 TRP A 33 14.489 13.862 -10.281 1.00 0.00 H new ATOM 896 N GLY A 53 10.591 9.419 11.993 1.00 0.00 N ATOM 897 CA GLY A 53 9.275 8.817 12.112 1.00 0.00 C ATOM 898 C GLY A 53 9.181 7.484 11.394 1.00 0.00 C ATOM 899 O GLY A 53 10.144 7.039 10.770 1.00 0.00 O ATOM 0 HA2 GLY A 53 9.037 8.676 13.166 1.00 0.00 H new ATOM 0 HA3 GLY A 53 8.528 9.499 11.705 1.00 0.00 H new ATOM 903 N GLY A 54 8.018 6.847 11.483 1.00 0.00 N ATOM 904 CA GLY A 54 7.825 5.565 10.831 1.00 0.00 C ATOM 905 C GLY A 54 6.609 4.827 11.355 1.00 0.00 C ATOM 906 O GLY A 54 5.949 5.285 12.288 1.00 0.00 O ATOM 0 H GLY A 54 7.207 7.195 11.994 1.00 0.00 H new ATOM 0 HA2 GLY A 54 7.718 5.719 9.757 1.00 0.00 H new ATOM 0 HA3 GLY A 54 8.712 4.949 10.978 1.00 0.00 H new ATOM 910 N GLY A 55 6.312 3.679 10.754 1.00 0.00 N ATOM 911 CA GLY A 55 5.168 2.894 11.178 1.00 0.00 C ATOM 912 C GLY A 55 5.154 1.508 10.566 1.00 0.00 C ATOM 913 O GLY A 55 6.158 1.054 10.017 1.00 0.00 O ATOM 0 H GLY A 55 6.843 3.279 9.981 1.00 0.00 H new ATOM 0 HA2 GLY A 55 5.174 2.807 12.265 1.00 0.00 H new ATOM 0 HA3 GLY A 55 4.252 3.417 10.905 1.00 0.00 H new ATOM 917 N PHE A 56 4.012 0.833 10.662 1.00 0.00 N ATOM 918 CA PHE A 56 3.870 -0.511 10.113 1.00 0.00 C ATOM 919 C PHE A 56 2.448 -0.748 9.617 1.00 0.00 C ATOM 920 O PHE A 56 1.566 0.090 9.804 1.00 0.00 O ATOM 921 CB PHE A 56 4.235 -1.556 11.169 1.00 0.00 C ATOM 922 CG PHE A 56 3.513 -1.369 12.472 1.00 0.00 C ATOM 923 CD1 PHE A 56 2.274 -1.953 12.682 1.00 0.00 C ATOM 924 CD2 PHE A 56 4.072 -0.609 13.487 1.00 0.00 C ATOM 925 CE1 PHE A 56 1.607 -1.785 13.881 1.00 0.00 C ATOM 926 CE2 PHE A 56 3.409 -0.436 14.687 1.00 0.00 C ATOM 927 CZ PHE A 56 2.175 -1.024 14.885 1.00 0.00 C ATOM 0 H PHE A 56 3.172 1.195 11.114 1.00 0.00 H new ATOM 0 HA PHE A 56 4.551 -0.605 9.267 1.00 0.00 H new ATOM 0 HB2 PHE A 56 4.012 -2.549 10.778 1.00 0.00 H new ATOM 0 HB3 PHE A 56 5.309 -1.519 11.349 1.00 0.00 H new ATOM 0 HD1 PHE A 56 1.824 -2.546 11.900 1.00 0.00 H new ATOM 0 HD2 PHE A 56 5.037 -0.147 13.339 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.643 -2.248 14.033 1.00 0.00 H new ATOM 0 HE2 PHE A 56 3.856 0.159 15.470 1.00 0.00 H new ATOM 0 HZ PHE A 56 1.655 -0.889 15.822 1.00 0.00 H new ATOM 937 N GLY A 57 2.230 -1.897 8.984 1.00 0.00 N ATOM 938 CA GLY A 57 0.913 -2.224 8.472 1.00 0.00 C ATOM 939 C GLY A 57 0.841 -3.632 7.914 1.00 0.00 C ATOM 940 O GLY A 57 1.749 -4.437 8.122 1.00 0.00 O ATOM 0 H GLY A 57 2.943 -2.607 8.817 1.00 0.00 H new ATOM 0 HA2 GLY A 57 0.179 -2.115 9.270 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.643 -1.513 7.691 1.00 0.00 H new ATOM 944 N LEU A 58 -0.242 -3.930 7.204 1.00 0.00 N ATOM 945 CA LEU A 58 -0.430 -5.250 6.613 1.00 0.00 C ATOM 946 C LEU A 58 -0.858 -5.137 5.153 1.00 0.00 C ATOM 947 O LEU A 58 -1.424 -4.126 4.739 1.00 0.00 O ATOM 948 CB LEU A 58 -1.473 -6.043 7.406 1.00 0.00 C ATOM 949 CG LEU A 58 -1.059 -7.468 7.775 1.00 0.00 C ATOM 950 CD1 LEU A 58 -1.674 -7.876 9.104 1.00 0.00 C ATOM 951 CD2 LEU A 58 -1.463 -8.441 6.677 1.00 0.00 C ATOM 0 H LEU A 58 -1.003 -3.275 7.024 1.00 0.00 H new ATOM 0 HA LEU A 58 0.523 -5.778 6.652 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.702 -5.499 8.322 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.393 -6.088 6.824 1.00 0.00 H new ATOM 0 HG LEU A 58 0.026 -7.496 7.877 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.368 -8.893 9.350 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.335 -7.196 9.886 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.761 -7.832 9.031 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.161 -9.450 6.956 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.544 -8.410 6.543 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.974 -8.161 5.744 1.00 0.00 H new ATOM 963 N SER A 59 -0.581 -6.180 4.378 1.00 0.00 N ATOM 964 CA SER A 59 -0.936 -6.196 2.962 1.00 0.00 C ATOM 965 C SER A 59 -1.810 -7.401 2.633 1.00 0.00 C ATOM 966 O SER A 59 -1.683 -8.460 3.248 1.00 0.00 O ATOM 967 CB SER A 59 0.327 -6.215 2.099 1.00 0.00 C ATOM 968 OG SER A 59 0.078 -5.660 0.819 1.00 0.00 O ATOM 0 H SER A 59 -0.112 -7.025 4.705 1.00 0.00 H new ATOM 0 HA SER A 59 -1.503 -5.291 2.745 1.00 0.00 H new ATOM 0 HB2 SER A 59 1.119 -5.653 2.595 1.00 0.00 H new ATOM 0 HB3 SER A 59 0.683 -7.240 1.992 1.00 0.00 H new ATOM 0 HG SER A 59 0.901 -5.682 0.287 1.00 0.00 H new ATOM 974 N ARG A 60 -2.695 -7.233 1.657 1.00 0.00 N ATOM 975 CA ARG A 60 -3.591 -8.307 1.242 1.00 0.00 C ATOM 976 C ARG A 60 -3.742 -8.329 -0.277 1.00 0.00 C ATOM 977 O ARG A 60 -3.782 -7.282 -0.922 1.00 0.00 O ATOM 978 CB ARG A 60 -4.963 -8.140 1.901 1.00 0.00 C ATOM 979 CG ARG A 60 -5.584 -9.452 2.353 1.00 0.00 C ATOM 980 CD ARG A 60 -6.986 -9.246 2.905 1.00 0.00 C ATOM 981 NE ARG A 60 -7.134 -9.805 4.246 1.00 0.00 N ATOM 982 CZ ARG A 60 -7.137 -11.110 4.510 1.00 0.00 C ATOM 983 NH1 ARG A 60 -7.003 -11.993 3.529 1.00 0.00 N ATOM 984 NH2 ARG A 60 -7.275 -11.533 5.759 1.00 0.00 N ATOM 0 H ARG A 60 -2.812 -6.363 1.138 1.00 0.00 H new ATOM 0 HA ARG A 60 -3.157 -9.254 1.561 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.865 -7.478 2.762 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -5.638 -7.651 1.198 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -5.621 -10.146 1.513 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -4.955 -9.909 3.117 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -7.213 -8.180 2.930 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -7.711 -9.711 2.237 1.00 0.00 H new ATOM 0 HE ARG A 60 -7.241 -9.157 5.027 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.897 -11.673 2.566 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -7.006 -12.991 3.738 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -7.379 -10.859 6.517 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -7.277 -12.533 5.962 1.00 0.00 H new ATOM 998 N TRP A 61 -3.823 -9.529 -0.841 1.00 0.00 N ATOM 999 CA TRP A 61 -3.968 -9.686 -2.284 1.00 0.00 C ATOM 1000 C TRP A 61 -5.376 -10.148 -2.646 1.00 0.00 C ATOM 1001 O TRP A 61 -6.150 -10.551 -1.778 1.00 0.00 O ATOM 1002 CB TRP A 61 -2.938 -10.685 -2.815 1.00 0.00 C ATOM 1003 CG TRP A 61 -2.866 -11.949 -2.013 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -3.917 -12.691 -1.555 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -1.680 -12.619 -1.572 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -3.456 -13.781 -0.857 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -2.086 -13.758 -0.853 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -0.313 -12.366 -1.717 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -1.175 -14.642 -0.282 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 0.592 -13.244 -1.148 1.00 0.00 C ATOM 1011 CH2 TRP A 61 0.156 -14.371 -0.439 1.00 0.00 C ATOM 0 H TRP A 61 -3.791 -10.406 -0.322 1.00 0.00 H new ATOM 0 HA TRP A 61 -3.796 -8.715 -2.748 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -3.182 -10.932 -3.848 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -1.956 -10.213 -2.824 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -4.958 -12.455 -1.718 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -4.039 -14.491 -0.414 1.00 0.00 H new ATOM 0 HE3 TRP A 61 0.031 -11.500 -2.264 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -1.508 -15.511 0.266 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 1.651 -13.058 -1.252 1.00 0.00 H new ATOM 0 HH2 TRP A 61 0.886 -15.040 -0.008 1.00 0.00 H new ATOM 1022 N ASP A 62 -5.698 -10.086 -3.933 1.00 0.00 N ATOM 1023 CA ASP A 62 -7.011 -10.499 -4.415 1.00 0.00 C ATOM 1024 C ASP A 62 -6.884 -11.645 -5.414 1.00 0.00 C ATOM 1025 O ASP A 62 -5.983 -11.652 -6.253 1.00 0.00 O ATOM 1026 CB ASP A 62 -7.734 -9.318 -5.066 1.00 0.00 C ATOM 1027 CG ASP A 62 -9.221 -9.318 -4.772 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -9.594 -9.158 -3.591 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -10.014 -9.478 -5.724 1.00 0.00 O ATOM 0 H ASP A 62 -5.067 -9.753 -4.662 1.00 0.00 H new ATOM 0 HA ASP A 62 -7.593 -10.845 -3.561 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -7.296 -8.386 -4.709 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.580 -9.351 -6.145 1.00 0.00 H new ATOM 1035 N GLU A 63 -7.792 -12.613 -5.315 1.00 0.00 N ATOM 1036 CA GLU A 63 -7.784 -13.769 -6.207 1.00 0.00 C ATOM 1037 C GLU A 63 -7.759 -13.334 -7.669 1.00 0.00 C ATOM 1038 O GLU A 63 -7.198 -14.020 -8.522 1.00 0.00 O ATOM 1039 CB GLU A 63 -9.009 -14.648 -5.947 1.00 0.00 C ATOM 1040 CG GLU A 63 -8.960 -15.379 -4.614 1.00 0.00 C ATOM 1041 CD GLU A 63 -9.516 -16.787 -4.702 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -10.618 -16.956 -5.264 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -8.849 -17.720 -4.208 1.00 0.00 O ATOM 0 H GLU A 63 -8.543 -12.619 -4.625 1.00 0.00 H new ATOM 0 HA GLU A 63 -6.880 -14.344 -6.004 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -9.905 -14.028 -5.979 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -9.099 -15.379 -6.750 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -7.929 -15.421 -4.264 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.526 -14.814 -3.873 1.00 0.00 H new ATOM 1051 N LYS A 64 -8.367 -12.186 -7.949 1.00 0.00 N ATOM 1052 CA LYS A 64 -8.410 -11.658 -9.307 1.00 0.00 C ATOM 1053 C LYS A 64 -7.023 -11.209 -9.762 1.00 0.00 C ATOM 1054 O LYS A 64 -6.771 -11.056 -10.957 1.00 0.00 O ATOM 1055 CB LYS A 64 -9.390 -10.487 -9.390 1.00 0.00 C ATOM 1056 CG LYS A 64 -10.066 -10.354 -10.746 1.00 0.00 C ATOM 1057 CD LYS A 64 -11.135 -9.275 -10.732 1.00 0.00 C ATOM 1058 CE LYS A 64 -10.590 -7.940 -11.212 1.00 0.00 C ATOM 1059 NZ LYS A 64 -11.480 -7.306 -12.223 1.00 0.00 N ATOM 0 H LYS A 64 -8.836 -11.604 -7.255 1.00 0.00 H new ATOM 0 HA LYS A 64 -8.749 -12.455 -9.969 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -10.154 -10.609 -8.623 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -8.858 -9.562 -9.166 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -9.319 -10.118 -11.504 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -10.514 -11.308 -11.026 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.967 -9.578 -11.367 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -11.529 -9.166 -9.722 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -10.472 -7.269 -10.361 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -9.599 -8.086 -11.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -11.072 -6.398 -12.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -11.572 -7.934 -13.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -12.418 -7.142 -11.806 1.00 0.00 H new ATOM 1073 N GLY A 65 -6.125 -10.997 -8.802 1.00 0.00 N ATOM 1074 CA GLY A 65 -4.778 -10.568 -9.125 1.00 0.00 C ATOM 1075 C GLY A 65 -4.522 -9.128 -8.731 1.00 0.00 C ATOM 1076 O GLY A 65 -3.985 -8.348 -9.518 1.00 0.00 O ATOM 0 H GLY A 65 -6.309 -11.115 -7.806 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.062 -11.214 -8.617 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.609 -10.685 -10.195 1.00 0.00 H new ATOM 1080 N ASN A 66 -4.911 -8.771 -7.511 1.00 0.00 N ATOM 1081 CA ASN A 66 -4.723 -7.412 -7.016 1.00 0.00 C ATOM 1082 C ASN A 66 -3.889 -7.403 -5.738 1.00 0.00 C ATOM 1083 O ASN A 66 -3.757 -8.423 -5.063 1.00 0.00 O ATOM 1084 CB ASN A 66 -6.078 -6.750 -6.758 1.00 0.00 C ATOM 1085 CG ASN A 66 -6.570 -5.957 -7.953 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -6.347 -6.341 -9.102 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -7.244 -4.843 -7.689 1.00 0.00 N ATOM 0 H ASN A 66 -5.358 -9.404 -6.847 1.00 0.00 H new ATOM 0 HA ASN A 66 -4.187 -6.847 -7.779 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -6.812 -7.516 -6.507 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -5.998 -6.089 -5.895 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -7.599 -4.269 -8.453 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -7.406 -4.562 -6.722 1.00 0.00 H new ATOM 1094 N TRP A 67 -3.328 -6.242 -5.414 1.00 0.00 N ATOM 1095 CA TRP A 67 -2.507 -6.095 -4.218 1.00 0.00 C ATOM 1096 C TRP A 67 -2.821 -4.785 -3.503 1.00 0.00 C ATOM 1097 O TRP A 67 -2.428 -3.709 -3.956 1.00 0.00 O ATOM 1098 CB TRP A 67 -1.021 -6.150 -4.583 1.00 0.00 C ATOM 1099 CG TRP A 67 -0.357 -7.431 -4.181 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -0.729 -8.695 -4.538 1.00 0.00 C ATOM 1101 CD2 TRP A 67 0.795 -7.574 -3.342 1.00 0.00 C ATOM 1102 NE1 TRP A 67 0.121 -9.615 -3.972 1.00 0.00 N ATOM 1103 CE2 TRP A 67 1.065 -8.952 -3.234 1.00 0.00 C ATOM 1104 CE3 TRP A 67 1.625 -6.670 -2.672 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 2.129 -9.445 -2.484 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 2.681 -7.163 -1.927 1.00 0.00 C ATOM 1107 CH2 TRP A 67 2.925 -8.539 -1.839 1.00 0.00 C ATOM 0 H TRP A 67 -3.427 -5.389 -5.964 1.00 0.00 H new ATOM 0 HA TRP A 67 -2.737 -6.920 -3.544 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -0.914 -6.016 -5.659 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -0.506 -5.317 -4.105 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -1.569 -8.937 -5.173 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.059 -10.627 -4.084 1.00 0.00 H new ATOM 0 HE3 TRP A 67 1.445 -5.607 -2.735 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 2.319 -10.506 -2.414 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 3.329 -6.475 -1.404 1.00 0.00 H new ATOM 0 HH2 TRP A 67 3.759 -8.892 -1.250 1.00 0.00 H new ATOM 1118 N HIS A 68 -3.535 -4.881 -2.386 1.00 0.00 N ATOM 1119 CA HIS A 68 -3.904 -3.702 -1.611 1.00 0.00 C ATOM 1120 C HIS A 68 -3.594 -3.902 -0.130 1.00 0.00 C ATOM 1121 O HIS A 68 -3.803 -4.984 0.417 1.00 0.00 O ATOM 1122 CB HIS A 68 -5.390 -3.391 -1.793 1.00 0.00 C ATOM 1123 CG HIS A 68 -6.273 -4.594 -1.664 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -6.973 -5.133 -2.723 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -6.568 -5.365 -0.590 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -7.660 -6.181 -2.306 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -7.431 -6.343 -1.016 1.00 0.00 N ATOM 0 H HIS A 68 -3.869 -5.763 -1.997 1.00 0.00 H new ATOM 0 HA HIS A 68 -3.315 -2.861 -1.977 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -5.691 -2.649 -1.054 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -5.542 -2.943 -2.775 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -6.194 -5.234 0.415 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -8.300 -6.800 -2.917 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -7.831 -7.076 -0.431 1.00 0.00 H new ATOM 1136 N GLY A 69 -3.094 -2.850 0.512 1.00 0.00 N ATOM 1137 CA GLY A 69 -2.765 -2.932 1.924 1.00 0.00 C ATOM 1138 C GLY A 69 -2.860 -1.590 2.621 1.00 0.00 C ATOM 1139 O GLY A 69 -3.283 -0.602 2.023 1.00 0.00 O ATOM 0 H GLY A 69 -2.911 -1.944 0.081 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -3.438 -3.639 2.410 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -1.755 -3.325 2.036 1.00 0.00 H new ATOM 1143 N LEU A 70 -2.464 -1.554 3.891 1.00 0.00 N ATOM 1144 CA LEU A 70 -2.504 -0.322 4.672 1.00 0.00 C ATOM 1145 C LEU A 70 -1.273 -0.207 5.565 1.00 0.00 C ATOM 1146 O LEU A 70 -0.625 -1.208 5.872 1.00 0.00 O ATOM 1147 CB LEU A 70 -3.774 -0.276 5.525 1.00 0.00 C ATOM 1148 CG LEU A 70 -3.899 -1.393 6.562 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -4.643 -0.898 7.792 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -4.601 -2.601 5.961 1.00 0.00 C ATOM 0 H LEU A 70 -2.112 -2.364 4.401 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.509 0.520 3.980 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -3.812 0.684 6.041 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -4.639 -0.317 4.863 1.00 0.00 H new ATOM 0 HG LEU A 70 -2.897 -1.695 6.867 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -4.722 -1.706 8.519 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -4.099 -0.064 8.235 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.642 -0.569 7.505 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -4.681 -3.386 6.713 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.598 -2.314 5.628 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -4.027 -2.970 5.111 1.00 0.00 H new ATOM 1162 N TYR A 71 -0.953 1.015 5.982 1.00 0.00 N ATOM 1163 CA TYR A 71 0.204 1.243 6.841 1.00 0.00 C ATOM 1164 C TYR A 71 0.058 2.544 7.624 1.00 0.00 C ATOM 1165 O TYR A 71 -0.031 3.623 7.040 1.00 0.00 O ATOM 1166 CB TYR A 71 1.487 1.278 6.006 1.00 0.00 C ATOM 1167 CG TYR A 71 1.536 2.422 5.018 1.00 0.00 C ATOM 1168 CD1 TYR A 71 0.922 2.320 3.777 1.00 0.00 C ATOM 1169 CD2 TYR A 71 2.199 3.603 5.328 1.00 0.00 C ATOM 1170 CE1 TYR A 71 0.966 3.362 2.871 1.00 0.00 C ATOM 1171 CE2 TYR A 71 2.247 4.651 4.427 1.00 0.00 C ATOM 1172 CZ TYR A 71 1.629 4.526 3.201 1.00 0.00 C ATOM 1173 OH TYR A 71 1.675 5.566 2.302 1.00 0.00 O ATOM 0 H TYR A 71 -1.475 1.857 5.741 1.00 0.00 H new ATOM 0 HA TYR A 71 0.262 0.419 7.552 1.00 0.00 H new ATOM 0 HB2 TYR A 71 2.344 1.350 6.675 1.00 0.00 H new ATOM 0 HB3 TYR A 71 1.584 0.337 5.464 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.401 1.411 3.515 1.00 0.00 H new ATOM 0 HD2 TYR A 71 2.684 3.704 6.287 1.00 0.00 H new ATOM 0 HE1 TYR A 71 0.484 3.266 1.909 1.00 0.00 H new ATOM 0 HE2 TYR A 71 2.766 5.563 4.683 1.00 0.00 H new ATOM 0 HH TYR A 71 2.179 6.312 2.690 1.00 0.00 H new ATOM 1183 N ALA A 72 0.038 2.431 8.947 1.00 0.00 N ATOM 1184 CA ALA A 72 -0.096 3.596 9.813 1.00 0.00 C ATOM 1185 C ALA A 72 1.268 4.119 10.248 1.00 0.00 C ATOM 1186 O ALA A 72 2.026 3.422 10.922 1.00 0.00 O ATOM 1187 CB ALA A 72 -0.945 3.255 11.028 1.00 0.00 C ATOM 0 H ALA A 72 0.113 1.543 9.444 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.592 4.383 9.246 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -1.037 4.134 11.666 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -1.936 2.938 10.702 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.472 2.448 11.588 1.00 0.00 H new ATOM 1193 N MET A 73 1.574 5.353 9.859 1.00 0.00 N ATOM 1194 CA MET A 73 2.848 5.972 10.211 1.00 0.00 C ATOM 1195 C MET A 73 2.639 7.125 11.186 1.00 0.00 C ATOM 1196 O MET A 73 1.751 7.956 10.998 1.00 0.00 O ATOM 1197 CB MET A 73 3.560 6.473 8.954 1.00 0.00 C ATOM 1198 CG MET A 73 4.437 5.423 8.292 1.00 0.00 C ATOM 1199 SD MET A 73 5.954 6.117 7.606 1.00 0.00 S ATOM 1200 CE MET A 73 5.313 7.550 6.746 1.00 0.00 C ATOM 0 H MET A 73 0.958 5.944 9.300 1.00 0.00 H new ATOM 0 HA MET A 73 3.470 5.218 10.695 1.00 0.00 H new ATOM 0 HB2 MET A 73 2.814 6.816 8.237 1.00 0.00 H new ATOM 0 HB3 MET A 73 4.174 7.336 9.214 1.00 0.00 H new ATOM 0 HG2 MET A 73 4.691 4.655 9.022 1.00 0.00 H new ATOM 0 HG3 MET A 73 3.874 4.934 7.497 1.00 0.00 H new ATOM 0 HE1 MET A 73 6.056 7.909 6.034 1.00 0.00 H new ATOM 0 HE2 MET A 73 4.402 7.277 6.214 1.00 0.00 H new ATOM 0 HE3 MET A 73 5.091 8.337 7.466 1.00 0.00 H new ATOM 1210 N ALA A 74 3.462 7.169 12.229 1.00 0.00 N ATOM 1211 CA ALA A 74 3.366 8.221 13.235 1.00 0.00 C ATOM 1212 C ALA A 74 4.619 9.088 13.246 1.00 0.00 C ATOM 1213 O ALA A 74 5.737 8.585 13.123 1.00 0.00 O ATOM 1214 CB ALA A 74 3.128 7.615 14.609 1.00 0.00 C ATOM 0 H ALA A 74 4.203 6.489 12.400 1.00 0.00 H new ATOM 0 HA ALA A 74 2.520 8.858 12.979 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.058 8.411 15.351 1.00 0.00 H new ATOM 0 HB2 ALA A 74 2.199 7.046 14.599 1.00 0.00 H new ATOM 0 HB3 ALA A 74 3.956 6.954 14.863 1.00 0.00 H new ATOM 1220 N PHE A 75 4.427 10.395 13.397 1.00 0.00 N ATOM 1221 CA PHE A 75 5.541 11.335 13.426 1.00 0.00 C ATOM 1222 C PHE A 75 5.496 12.191 14.689 1.00 0.00 C ATOM 1223 O PHE A 75 4.477 12.806 14.998 1.00 0.00 O ATOM 1224 CB PHE A 75 5.513 12.230 12.185 1.00 0.00 C ATOM 1225 CG PHE A 75 6.546 11.864 11.158 1.00 0.00 C ATOM 1226 CD1 PHE A 75 6.508 10.631 10.526 1.00 0.00 C ATOM 1227 CD2 PHE A 75 7.556 12.752 10.824 1.00 0.00 C ATOM 1228 CE1 PHE A 75 7.457 10.291 9.580 1.00 0.00 C ATOM 1229 CE2 PHE A 75 8.508 12.418 9.879 1.00 0.00 C ATOM 1230 CZ PHE A 75 8.458 11.186 9.257 1.00 0.00 C ATOM 0 H PHE A 75 3.509 10.827 13.501 1.00 0.00 H new ATOM 0 HA PHE A 75 6.469 10.763 13.430 1.00 0.00 H new ATOM 0 HB2 PHE A 75 4.524 12.175 11.730 1.00 0.00 H new ATOM 0 HB3 PHE A 75 5.666 13.265 12.490 1.00 0.00 H new ATOM 0 HD1 PHE A 75 5.728 9.927 10.776 1.00 0.00 H new ATOM 0 HD2 PHE A 75 7.600 13.717 11.308 1.00 0.00 H new ATOM 0 HE1 PHE A 75 7.416 9.327 9.094 1.00 0.00 H new ATOM 0 HE2 PHE A 75 9.290 13.119 9.627 1.00 0.00 H new ATOM 0 HZ PHE A 75 9.201 10.923 8.519 1.00 0.00 H new ATOM 1240 N LYS A 76 6.608 12.223 15.417 1.00 0.00 N ATOM 1241 CA LYS A 76 6.695 13.002 16.646 1.00 0.00 C ATOM 1242 C LYS A 76 7.591 14.223 16.456 1.00 0.00 C ATOM 1243 O LYS A 76 8.764 14.097 16.107 1.00 0.00 O ATOM 1244 CB LYS A 76 7.232 12.136 17.787 1.00 0.00 C ATOM 1245 CG LYS A 76 6.503 10.811 17.938 1.00 0.00 C ATOM 1246 CD LYS A 76 6.442 10.370 19.392 1.00 0.00 C ATOM 1247 CE LYS A 76 7.832 10.150 19.966 1.00 0.00 C ATOM 1248 NZ LYS A 76 7.784 9.750 21.399 1.00 0.00 N ATOM 0 H LYS A 76 7.461 11.718 15.177 1.00 0.00 H new ATOM 0 HA LYS A 76 5.692 13.345 16.899 1.00 0.00 H new ATOM 0 HB2 LYS A 76 8.291 11.942 17.617 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.156 12.692 18.721 1.00 0.00 H new ATOM 0 HG2 LYS A 76 5.492 10.904 17.542 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.008 10.047 17.346 1.00 0.00 H new ATOM 0 HD2 LYS A 76 5.919 11.124 19.980 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.865 9.449 19.470 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.344 9.379 19.391 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.416 11.065 19.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.752 9.610 21.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.318 10.497 21.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.249 8.863 21.494 1.00 0.00 H new ATOM 1262 N ASP A 77 7.029 15.405 16.689 1.00 0.00 N ATOM 1263 CA ASP A 77 7.775 16.649 16.544 1.00 0.00 C ATOM 1264 C ASP A 77 7.860 17.391 17.874 1.00 0.00 C ATOM 1265 O ASP A 77 7.495 16.855 18.920 1.00 0.00 O ATOM 1266 CB ASP A 77 7.117 17.543 15.491 1.00 0.00 C ATOM 1267 CG ASP A 77 6.804 16.793 14.210 1.00 0.00 C ATOM 1268 OD1 ASP A 77 5.778 17.110 13.573 1.00 0.00 O ATOM 1269 OD2 ASP A 77 7.586 15.891 13.845 1.00 0.00 O ATOM 0 H ASP A 77 6.059 15.527 16.979 1.00 0.00 H new ATOM 0 HA ASP A 77 8.786 16.401 16.221 1.00 0.00 H new ATOM 0 HB2 ASP A 77 6.197 17.962 15.898 1.00 0.00 H new ATOM 0 HB3 ASP A 77 7.777 18.381 15.266 1.00 0.00 H new ATOM 1275 N SER A 78 8.344 18.629 17.826 1.00 0.00 N ATOM 1276 CA SER A 78 8.477 19.445 19.028 1.00 0.00 C ATOM 1277 C SER A 78 7.121 19.658 19.693 1.00 0.00 C ATOM 1278 O SER A 78 7.035 19.817 20.911 1.00 0.00 O ATOM 1279 CB SER A 78 9.107 20.796 18.683 1.00 0.00 C ATOM 1280 OG SER A 78 10.494 20.661 18.425 1.00 0.00 O ATOM 0 H SER A 78 8.650 19.088 16.968 1.00 0.00 H new ATOM 0 HA SER A 78 9.125 18.917 19.727 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.611 21.220 17.810 1.00 0.00 H new ATOM 0 HB3 SER A 78 8.953 21.493 19.506 1.00 0.00 H new ATOM 0 HG SER A 78 10.873 21.538 18.205 1.00 0.00 H new ATOM 1286 N TRP A 79 6.064 19.659 18.887 1.00 0.00 N ATOM 1287 CA TRP A 79 4.711 19.851 19.396 1.00 0.00 C ATOM 1288 C TRP A 79 4.339 18.761 20.399 1.00 0.00 C ATOM 1289 O TRP A 79 3.410 18.926 21.190 1.00 0.00 O ATOM 1290 CB TRP A 79 3.708 19.863 18.241 1.00 0.00 C ATOM 1291 CG TRP A 79 2.656 20.920 18.379 1.00 0.00 C ATOM 1292 CD1 TRP A 79 1.306 20.755 18.256 1.00 0.00 C ATOM 1293 CD2 TRP A 79 2.866 22.307 18.667 1.00 0.00 C ATOM 1294 NE1 TRP A 79 0.665 21.955 18.448 1.00 0.00 N ATOM 1295 CE2 TRP A 79 1.600 22.923 18.702 1.00 0.00 C ATOM 1296 CE3 TRP A 79 4.001 23.089 18.898 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 1.440 24.283 18.960 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 3.841 24.438 19.154 1.00 0.00 C ATOM 1299 CH2 TRP A 79 2.569 25.023 19.183 1.00 0.00 C ATOM 0 H TRP A 79 6.119 19.529 17.877 1.00 0.00 H new ATOM 0 HA TRP A 79 4.678 20.812 19.909 1.00 0.00 H new ATOM 0 HB2 TRP A 79 4.245 20.015 17.305 1.00 0.00 H new ATOM 0 HB3 TRP A 79 3.226 18.887 18.177 1.00 0.00 H new ATOM 0 HD1 TRP A 79 0.814 19.818 18.039 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -0.344 22.101 18.408 1.00 0.00 H new ATOM 0 HE3 TRP A 79 4.986 22.647 18.877 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 0.460 24.737 18.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 4.712 25.051 19.335 1.00 0.00 H new ATOM 0 HH2 TRP A 79 2.477 26.080 19.386 1.00 0.00 H new ATOM 1310 N ASN A 80 5.064 17.645 20.360 1.00 0.00 N ATOM 1311 CA ASN A 80 4.804 16.530 21.265 1.00 0.00 C ATOM 1312 C ASN A 80 3.430 15.923 20.995 1.00 0.00 C ATOM 1313 O ASN A 80 2.561 15.907 21.867 1.00 0.00 O ATOM 1314 CB ASN A 80 4.900 16.990 22.723 1.00 0.00 C ATOM 1315 CG ASN A 80 6.273 16.742 23.317 1.00 0.00 C ATOM 1316 OD1 ASN A 80 7.289 16.852 22.629 1.00 0.00 O ATOM 1317 ND2 ASN A 80 6.311 16.403 24.600 1.00 0.00 N ATOM 0 H ASN A 80 5.836 17.490 19.711 1.00 0.00 H new ATOM 0 HA ASN A 80 5.560 15.765 21.088 1.00 0.00 H new ATOM 0 HB2 ASN A 80 4.668 18.053 22.782 1.00 0.00 H new ATOM 0 HB3 ASN A 80 4.150 16.467 23.317 1.00 0.00 H new ATOM 0 HD21 ASN A 80 7.207 16.222 25.053 1.00 0.00 H new ATOM 0 HD22 ASN A 80 5.445 16.323 25.132 1.00 0.00 H new ATOM 1324 N LYS A 81 3.243 15.423 19.777 1.00 0.00 N ATOM 1325 CA LYS A 81 1.977 14.813 19.386 1.00 0.00 C ATOM 1326 C LYS A 81 2.156 13.947 18.143 1.00 0.00 C ATOM 1327 O LYS A 81 2.254 14.459 17.028 1.00 0.00 O ATOM 1328 CB LYS A 81 0.926 15.893 19.124 1.00 0.00 C ATOM 1329 CG LYS A 81 0.225 16.378 20.382 1.00 0.00 C ATOM 1330 CD LYS A 81 -1.198 16.824 20.089 1.00 0.00 C ATOM 1331 CE LYS A 81 -1.874 17.384 21.331 1.00 0.00 C ATOM 1332 NZ LYS A 81 -1.726 18.863 21.426 1.00 0.00 N ATOM 0 H LYS A 81 3.952 15.428 19.044 1.00 0.00 H new ATOM 0 HA LYS A 81 1.637 14.179 20.205 1.00 0.00 H new ATOM 0 HB2 LYS A 81 1.404 16.742 18.634 1.00 0.00 H new ATOM 0 HB3 LYS A 81 0.181 15.503 18.431 1.00 0.00 H new ATOM 0 HG2 LYS A 81 0.212 15.579 21.124 1.00 0.00 H new ATOM 0 HG3 LYS A 81 0.785 17.206 20.816 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -1.189 17.582 19.306 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -1.774 15.980 19.709 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -2.933 17.126 21.316 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -1.445 16.919 22.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -2.200 19.205 22.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -0.716 19.109 21.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -2.158 19.309 20.592 1.00 0.00 H new ATOM 1346 N TRP A 82 2.198 12.634 18.344 1.00 0.00 N ATOM 1347 CA TRP A 82 2.366 11.696 17.239 1.00 0.00 C ATOM 1348 C TRP A 82 1.261 11.870 16.201 1.00 0.00 C ATOM 1349 O TRP A 82 0.076 11.864 16.535 1.00 0.00 O ATOM 1350 CB TRP A 82 2.372 10.258 17.759 1.00 0.00 C ATOM 1351 CG TRP A 82 1.137 9.900 18.527 1.00 0.00 C ATOM 1352 CD1 TRP A 82 -0.077 9.548 18.010 1.00 0.00 C ATOM 1353 CD2 TRP A 82 0.995 9.858 19.952 1.00 0.00 C ATOM 1354 NE1 TRP A 82 -0.965 9.290 19.026 1.00 0.00 N ATOM 1355 CE2 TRP A 82 -0.332 9.473 20.228 1.00 0.00 C ATOM 1356 CE3 TRP A 82 1.859 10.107 21.021 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 -0.812 9.334 21.527 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 1.382 9.968 22.311 1.00 0.00 C ATOM 1359 CH2 TRP A 82 0.057 9.583 22.555 1.00 0.00 C ATOM 0 H TRP A 82 2.118 12.195 19.261 1.00 0.00 H new ATOM 0 HA TRP A 82 3.323 11.906 16.761 1.00 0.00 H new ATOM 0 HB2 TRP A 82 2.478 9.575 16.916 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.243 10.114 18.398 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -0.306 9.482 16.957 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -1.938 9.008 18.905 1.00 0.00 H new ATOM 0 HE3 TRP A 82 2.882 10.403 20.843 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 -1.834 9.040 21.717 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 2.042 10.159 23.145 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -0.285 9.481 23.574 1.00 0.00 H new ATOM 1370 N GLU A 83 1.658 12.023 14.942 1.00 0.00 N ATOM 1371 CA GLU A 83 0.702 12.198 13.855 1.00 0.00 C ATOM 1372 C GLU A 83 0.549 10.907 13.052 1.00 0.00 C ATOM 1373 O GLU A 83 1.373 10.605 12.188 1.00 0.00 O ATOM 1374 CB GLU A 83 1.151 13.334 12.934 1.00 0.00 C ATOM 1375 CG GLU A 83 0.001 14.162 12.385 1.00 0.00 C ATOM 1376 CD GLU A 83 0.325 15.642 12.328 1.00 0.00 C ATOM 1377 OE1 GLU A 83 0.749 16.199 13.363 1.00 0.00 O ATOM 1378 OE2 GLU A 83 0.155 16.246 11.247 1.00 0.00 O ATOM 0 H GLU A 83 2.635 12.029 14.649 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.265 12.451 14.290 1.00 0.00 H new ATOM 0 HB2 GLU A 83 1.830 13.988 13.482 1.00 0.00 H new ATOM 0 HB3 GLU A 83 1.715 12.914 12.101 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.250 13.810 11.385 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.881 14.010 13.007 1.00 0.00 H new ATOM 1386 N PRO A 84 -0.509 10.124 13.327 1.00 0.00 N ATOM 1387 CA PRO A 84 -0.759 8.863 12.625 1.00 0.00 C ATOM 1388 C PRO A 84 -1.344 9.076 11.233 1.00 0.00 C ATOM 1389 O PRO A 84 -2.118 10.008 11.010 1.00 0.00 O ATOM 1390 CB PRO A 84 -1.772 8.161 13.528 1.00 0.00 C ATOM 1391 CG PRO A 84 -2.523 9.271 14.179 1.00 0.00 C ATOM 1392 CD PRO A 84 -1.541 10.402 14.346 1.00 0.00 C ATOM 0 HA PRO A 84 0.158 8.297 12.460 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -2.436 7.516 12.953 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -1.276 7.531 14.266 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.371 9.579 13.567 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -2.923 8.957 15.143 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -2.014 11.370 14.183 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -1.118 10.419 15.350 1.00 0.00 H new ATOM 1400 N ILE A 85 -0.971 8.206 10.300 1.00 0.00 N ATOM 1401 CA ILE A 85 -1.459 8.296 8.928 1.00 0.00 C ATOM 1402 C ILE A 85 -1.467 6.924 8.261 1.00 0.00 C ATOM 1403 O ILE A 85 -0.426 6.281 8.133 1.00 0.00 O ATOM 1404 CB ILE A 85 -0.600 9.259 8.086 1.00 0.00 C ATOM 1405 CG1 ILE A 85 0.860 8.798 8.070 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -0.709 10.676 8.628 1.00 0.00 C ATOM 1407 CD1 ILE A 85 1.261 8.112 6.782 1.00 0.00 C ATOM 0 H ILE A 85 -0.332 7.430 10.469 1.00 0.00 H new ATOM 0 HA ILE A 85 -2.477 8.682 8.978 1.00 0.00 H new ATOM 0 HB ILE A 85 -0.972 9.253 7.062 1.00 0.00 H new ATOM 0 HG12 ILE A 85 1.507 9.660 8.230 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.027 8.115 8.903 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -0.097 11.345 8.023 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -1.749 11.001 8.590 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -0.360 10.699 9.660 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.307 7.812 6.840 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.638 7.230 6.630 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.126 8.799 5.947 1.00 0.00 H new ATOM 1419 N ALA A 86 -2.647 6.483 7.837 1.00 0.00 N ATOM 1420 CA ALA A 86 -2.787 5.189 7.185 1.00 0.00 C ATOM 1421 C ALA A 86 -2.838 5.342 5.670 1.00 0.00 C ATOM 1422 O ALA A 86 -3.747 5.971 5.130 1.00 0.00 O ATOM 1423 CB ALA A 86 -4.035 4.479 7.688 1.00 0.00 C ATOM 0 H ALA A 86 -3.519 7.004 7.934 1.00 0.00 H new ATOM 0 HA ALA A 86 -1.913 4.586 7.434 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.128 3.513 7.193 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.959 4.329 8.765 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.913 5.086 7.467 1.00 0.00 H new ATOM 1429 N GLY A 87 -1.859 4.758 4.989 1.00 0.00 N ATOM 1430 CA GLY A 87 -1.813 4.838 3.542 1.00 0.00 C ATOM 1431 C GLY A 87 -2.222 3.536 2.885 1.00 0.00 C ATOM 1432 O GLY A 87 -1.799 2.461 3.310 1.00 0.00 O ATOM 0 H GLY A 87 -1.096 4.230 5.414 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -2.472 5.637 3.203 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -0.804 5.101 3.226 1.00 0.00 H new ATOM 1436 N TYR A 88 -3.049 3.631 1.849 1.00 0.00 N ATOM 1437 CA TYR A 88 -3.515 2.447 1.137 1.00 0.00 C ATOM 1438 C TYR A 88 -2.799 2.295 -0.200 1.00 0.00 C ATOM 1439 O TYR A 88 -3.021 3.074 -1.127 1.00 0.00 O ATOM 1440 CB TYR A 88 -5.026 2.522 0.913 1.00 0.00 C ATOM 1441 CG TYR A 88 -5.839 2.276 2.164 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -6.186 3.324 3.008 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -6.259 0.996 2.501 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -6.928 3.102 4.152 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -7.002 0.766 3.644 1.00 0.00 C ATOM 1446 CZ TYR A 88 -7.333 1.823 4.466 1.00 0.00 C ATOM 1447 OH TYR A 88 -8.073 1.599 5.605 1.00 0.00 O ATOM 0 H TYR A 88 -3.409 4.513 1.485 1.00 0.00 H new ATOM 0 HA TYR A 88 -3.287 1.575 1.750 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -5.277 3.505 0.515 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -5.309 1.790 0.157 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -5.871 4.328 2.766 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -6.001 0.166 1.860 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.189 3.927 4.797 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -7.321 -0.235 3.892 1.00 0.00 H new ATOM 0 HH TYR A 88 -8.278 0.644 5.679 1.00 0.00 H new ATOM 1457 N GLY A 89 -1.940 1.286 -0.291 1.00 0.00 N ATOM 1458 CA GLY A 89 -1.204 1.048 -1.519 1.00 0.00 C ATOM 1459 C GLY A 89 -1.863 -0.001 -2.393 1.00 0.00 C ATOM 1460 O GLY A 89 -1.855 -1.187 -2.064 1.00 0.00 O ATOM 0 H GLY A 89 -1.740 0.629 0.463 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.121 1.981 -2.076 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.190 0.730 -1.276 1.00 0.00 H new ATOM 1464 N TRP A 90 -2.436 0.438 -3.509 1.00 0.00 N ATOM 1465 CA TRP A 90 -3.105 -0.470 -4.434 1.00 0.00 C ATOM 1466 C TRP A 90 -2.361 -0.534 -5.764 1.00 0.00 C ATOM 1467 O TRP A 90 -2.321 0.443 -6.512 1.00 0.00 O ATOM 1468 CB TRP A 90 -4.549 -0.023 -4.665 1.00 0.00 C ATOM 1469 CG TRP A 90 -5.448 -0.290 -3.497 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -5.182 -0.034 -2.182 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -6.759 -0.866 -3.537 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -6.247 -0.416 -1.402 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -7.228 -0.929 -2.211 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -7.582 -1.333 -4.565 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -8.482 -1.441 -1.889 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -8.827 -1.841 -4.244 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -9.267 -1.890 -2.915 1.00 0.00 C ATOM 0 H TRP A 90 -2.451 1.417 -3.795 1.00 0.00 H new ATOM 0 HA TRP A 90 -3.107 -1.466 -3.990 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -4.560 1.044 -4.886 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -4.944 -0.535 -5.543 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -4.268 0.405 -1.810 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -6.299 -0.332 -0.387 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -7.251 -1.298 -5.593 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -8.823 -1.482 -0.865 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -9.471 -2.206 -5.031 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -10.246 -2.290 -2.696 1.00 0.00 H new ATOM 1488 N GLU A 91 -1.772 -1.689 -6.051 1.00 0.00 N ATOM 1489 CA GLU A 91 -1.028 -1.880 -7.291 1.00 0.00 C ATOM 1490 C GLU A 91 -1.142 -3.321 -7.777 1.00 0.00 C ATOM 1491 O GLU A 91 -1.577 -4.205 -7.038 1.00 0.00 O ATOM 1492 CB GLU A 91 0.443 -1.513 -7.088 1.00 0.00 C ATOM 1493 CG GLU A 91 1.143 -2.362 -6.041 1.00 0.00 C ATOM 1494 CD GLU A 91 2.059 -1.548 -5.147 1.00 0.00 C ATOM 1495 OE1 GLU A 91 1.923 -1.648 -3.909 1.00 0.00 O ATOM 1496 OE2 GLU A 91 2.911 -0.811 -5.685 1.00 0.00 O ATOM 0 H GLU A 91 -1.795 -2.507 -5.442 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.458 -1.225 -8.049 1.00 0.00 H new ATOM 0 HB2 GLU A 91 0.969 -1.615 -8.037 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.510 -0.465 -6.798 1.00 0.00 H new ATOM 0 HG2 GLU A 91 0.396 -2.865 -5.427 1.00 0.00 H new ATOM 0 HG3 GLU A 91 1.723 -3.140 -6.538 1.00 0.00 H new ATOM 1504 N SER A 92 -0.748 -3.551 -9.026 1.00 0.00 N ATOM 1505 CA SER A 92 -0.805 -4.884 -9.612 1.00 0.00 C ATOM 1506 C SER A 92 0.547 -5.581 -9.507 1.00 0.00 C ATOM 1507 O SER A 92 1.595 -4.948 -9.634 1.00 0.00 O ATOM 1508 CB SER A 92 -1.237 -4.803 -11.077 1.00 0.00 C ATOM 1509 OG SER A 92 -2.059 -5.902 -11.429 1.00 0.00 O ATOM 0 H SER A 92 -0.386 -2.831 -9.651 1.00 0.00 H new ATOM 0 HA SER A 92 -1.540 -5.467 -9.056 1.00 0.00 H new ATOM 0 HB2 SER A 92 -1.777 -3.872 -11.249 1.00 0.00 H new ATOM 0 HB3 SER A 92 -0.356 -4.784 -11.718 1.00 0.00 H new ATOM 0 HG SER A 92 -2.323 -5.825 -12.370 1.00 0.00 H new ATOM 1515 N THR A 93 0.517 -6.889 -9.272 1.00 0.00 N ATOM 1516 CA THR A 93 1.740 -7.672 -9.148 1.00 0.00 C ATOM 1517 C THR A 93 2.056 -8.398 -10.452 1.00 0.00 C ATOM 1518 O THR A 93 1.156 -8.873 -11.145 1.00 0.00 O ATOM 1519 CB THR A 93 1.612 -8.682 -8.007 1.00 0.00 C ATOM 1520 OG1 THR A 93 0.407 -9.418 -8.122 1.00 0.00 O ATOM 1521 CG2 THR A 93 1.629 -8.041 -6.636 1.00 0.00 C ATOM 0 H THR A 93 -0.342 -7.429 -9.164 1.00 0.00 H new ATOM 0 HA THR A 93 2.558 -6.987 -8.927 1.00 0.00 H new ATOM 0 HB THR A 93 2.482 -9.332 -8.097 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.344 -10.060 -7.384 1.00 0.00 H new ATOM 0 HG21 THR A 93 1.534 -8.813 -5.872 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.568 -7.505 -6.496 1.00 0.00 H new ATOM 0 HG23 THR A 93 0.797 -7.342 -6.551 1.00 0.00 H new ATOM 1529 N TRP A 94 3.342 -8.482 -10.780 1.00 0.00 N ATOM 1530 CA TRP A 94 3.779 -9.149 -12.001 1.00 0.00 C ATOM 1531 C TRP A 94 5.123 -9.838 -11.791 1.00 0.00 C ATOM 1532 O TRP A 94 6.055 -9.250 -11.243 1.00 0.00 O ATOM 1533 CB TRP A 94 3.882 -8.142 -13.147 1.00 0.00 C ATOM 1534 CG TRP A 94 4.088 -8.783 -14.485 1.00 0.00 C ATOM 1535 CD1 TRP A 94 5.096 -8.529 -15.370 1.00 0.00 C ATOM 1536 CD2 TRP A 94 3.264 -9.786 -15.093 1.00 0.00 C ATOM 1537 NE1 TRP A 94 4.950 -9.312 -16.490 1.00 0.00 N ATOM 1538 CE2 TRP A 94 3.834 -10.092 -16.343 1.00 0.00 C ATOM 1539 CE3 TRP A 94 2.102 -10.454 -14.699 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 3.279 -11.037 -17.202 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 1.552 -11.392 -15.553 1.00 0.00 C ATOM 1542 CH2 TRP A 94 2.141 -11.676 -16.792 1.00 0.00 C ATOM 0 H TRP A 94 4.100 -8.096 -10.217 1.00 0.00 H new ATOM 0 HA TRP A 94 3.039 -9.906 -12.258 1.00 0.00 H new ATOM 0 HB2 TRP A 94 2.973 -7.542 -13.176 1.00 0.00 H new ATOM 0 HB3 TRP A 94 4.708 -7.460 -12.948 1.00 0.00 H new ATOM 0 HD1 TRP A 94 5.892 -7.816 -15.213 1.00 0.00 H new ATOM 0 HE1 TRP A 94 5.571 -9.312 -17.299 1.00 0.00 H new ATOM 0 HE3 TRP A 94 1.642 -10.242 -13.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 3.731 -11.258 -18.158 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 0.653 -11.914 -15.260 1.00 0.00 H new ATOM 0 HH2 TRP A 94 1.687 -12.414 -17.437 1.00 0.00 H new ATOM 1553 N ARG A 95 5.216 -11.089 -12.231 1.00 0.00 N ATOM 1554 CA ARG A 95 6.448 -11.858 -12.092 1.00 0.00 C ATOM 1555 C ARG A 95 7.106 -12.084 -13.453 1.00 0.00 C ATOM 1556 O ARG A 95 6.478 -12.606 -14.373 1.00 0.00 O ATOM 1557 CB ARG A 95 6.158 -13.205 -11.424 1.00 0.00 C ATOM 1558 CG ARG A 95 5.281 -14.124 -12.260 1.00 0.00 C ATOM 1559 CD ARG A 95 4.468 -15.067 -11.388 1.00 0.00 C ATOM 1560 NE ARG A 95 4.563 -16.453 -11.845 1.00 0.00 N ATOM 1561 CZ ARG A 95 3.714 -17.412 -11.482 1.00 0.00 C ATOM 1562 NH1 ARG A 95 2.708 -17.143 -10.661 1.00 0.00 N ATOM 1563 NH2 ARG A 95 3.873 -18.646 -11.943 1.00 0.00 N ATOM 0 H ARG A 95 4.454 -11.591 -12.686 1.00 0.00 H new ATOM 0 HA ARG A 95 7.135 -11.288 -11.466 1.00 0.00 H new ATOM 0 HB2 ARG A 95 7.102 -13.708 -11.216 1.00 0.00 H new ATOM 0 HB3 ARG A 95 5.673 -13.028 -10.464 1.00 0.00 H new ATOM 0 HG2 ARG A 95 4.609 -13.526 -12.875 1.00 0.00 H new ATOM 0 HG3 ARG A 95 5.905 -14.704 -12.940 1.00 0.00 H new ATOM 0 HD2 ARG A 95 4.817 -15.000 -10.358 1.00 0.00 H new ATOM 0 HD3 ARG A 95 3.424 -14.755 -11.392 1.00 0.00 H new ATOM 0 HE ARG A 95 5.324 -16.699 -12.478 1.00 0.00 H new ATOM 0 HH11 ARG A 95 2.581 -16.196 -10.303 1.00 0.00 H new ATOM 0 HH12 ARG A 95 2.061 -17.883 -10.387 1.00 0.00 H new ATOM 0 HH21 ARG A 95 4.645 -18.859 -12.575 1.00 0.00 H new ATOM 0 HH22 ARG A 95 3.223 -19.382 -11.666 1.00 0.00 H new ATOM 1577 N PRO A 96 8.387 -11.692 -13.603 1.00 0.00 N ATOM 1578 CA PRO A 96 9.117 -11.860 -14.863 1.00 0.00 C ATOM 1579 C PRO A 96 9.095 -13.303 -15.356 1.00 0.00 C ATOM 1580 O PRO A 96 8.388 -14.147 -14.804 1.00 0.00 O ATOM 1581 CB PRO A 96 10.547 -11.440 -14.511 1.00 0.00 C ATOM 1582 CG PRO A 96 10.400 -10.541 -13.333 1.00 0.00 C ATOM 1583 CD PRO A 96 9.219 -11.061 -12.562 1.00 0.00 C ATOM 0 HA PRO A 96 8.674 -11.274 -15.668 1.00 0.00 H new ATOM 0 HB2 PRO A 96 11.166 -12.305 -14.274 1.00 0.00 H new ATOM 0 HB3 PRO A 96 11.025 -10.925 -15.345 1.00 0.00 H new ATOM 0 HG2 PRO A 96 11.301 -10.550 -12.720 1.00 0.00 H new ATOM 0 HG3 PRO A 96 10.238 -9.510 -13.647 1.00 0.00 H new ATOM 0 HD2 PRO A 96 9.521 -11.778 -11.799 1.00 0.00 H new ATOM 0 HD3 PRO A 96 8.686 -10.258 -12.052 1.00 0.00 H new ATOM 1591 N LEU A 97 9.871 -13.580 -16.399 1.00 0.00 N ATOM 1592 CA LEU A 97 9.939 -14.922 -16.965 1.00 0.00 C ATOM 1593 C LEU A 97 11.178 -15.660 -16.465 1.00 0.00 C ATOM 1594 O LEU A 97 11.081 -16.762 -15.925 1.00 0.00 O ATOM 1595 CB LEU A 97 9.954 -14.853 -18.493 1.00 0.00 C ATOM 1596 CG LEU A 97 8.575 -14.872 -19.155 1.00 0.00 C ATOM 1597 CD1 LEU A 97 8.650 -14.295 -20.560 1.00 0.00 C ATOM 1598 CD2 LEU A 97 8.019 -16.288 -19.187 1.00 0.00 C ATOM 0 H LEU A 97 10.461 -12.893 -16.869 1.00 0.00 H new ATOM 0 HA LEU A 97 9.055 -15.472 -16.642 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.473 -13.943 -18.795 1.00 0.00 H new ATOM 0 HB3 LEU A 97 10.535 -15.693 -18.874 1.00 0.00 H new ATOM 0 HG LEU A 97 7.901 -14.251 -18.565 1.00 0.00 H new ATOM 0 HD11 LEU A 97 7.660 -14.317 -21.016 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.005 -13.266 -20.512 1.00 0.00 H new ATOM 0 HD13 LEU A 97 9.339 -14.889 -21.161 1.00 0.00 H new ATOM 0 HD21 LEU A 97 7.038 -16.283 -19.661 1.00 0.00 H new ATOM 0 HD22 LEU A 97 8.693 -16.931 -19.754 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.928 -16.666 -18.169 1.00 0.00 H new ATOM 1610 N ALA A 98 12.342 -15.044 -16.649 1.00 0.00 N ATOM 1611 CA ALA A 98 13.598 -15.641 -16.216 1.00 0.00 C ATOM 1612 C ALA A 98 13.762 -15.539 -14.704 1.00 0.00 C ATOM 1613 O ALA A 98 14.204 -16.485 -14.052 1.00 0.00 O ATOM 1614 CB ALA A 98 14.770 -14.974 -16.922 1.00 0.00 C ATOM 0 H ALA A 98 12.440 -14.132 -17.095 1.00 0.00 H new ATOM 0 HA ALA A 98 13.580 -16.698 -16.483 1.00 0.00 H new ATOM 0 HB1 ALA A 98 15.702 -15.430 -16.589 1.00 0.00 H new ATOM 0 HB2 ALA A 98 14.667 -15.103 -17.999 1.00 0.00 H new ATOM 0 HB3 ALA A 98 14.781 -13.910 -16.684 1.00 0.00 H new ATOM 1620 N ASP A 99 13.402 -14.385 -14.152 1.00 0.00 N ATOM 1621 CA ASP A 99 13.508 -14.159 -12.715 1.00 0.00 C ATOM 1622 C ASP A 99 12.266 -14.665 -11.990 1.00 0.00 C ATOM 1623 O ASP A 99 11.223 -14.886 -12.606 1.00 0.00 O ATOM 1624 CB ASP A 99 13.711 -12.670 -12.426 1.00 0.00 C ATOM 1625 CG ASP A 99 15.057 -12.165 -12.908 1.00 0.00 C ATOM 1626 OD1 ASP A 99 15.601 -12.749 -13.868 1.00 0.00 O ATOM 1627 OD2 ASP A 99 15.567 -11.186 -12.324 1.00 0.00 O ATOM 0 H ASP A 99 13.034 -13.592 -14.678 1.00 0.00 H new ATOM 0 HA ASP A 99 14.371 -14.715 -12.348 1.00 0.00 H new ATOM 0 HB2 ASP A 99 12.918 -12.098 -12.908 1.00 0.00 H new ATOM 0 HB3 ASP A 99 13.624 -12.496 -11.354 1.00 0.00 H new ATOM 1633 N GLU A 100 12.384 -14.847 -10.679 1.00 0.00 N ATOM 1634 CA GLU A 100 11.269 -15.327 -9.870 1.00 0.00 C ATOM 1635 C GLU A 100 11.080 -14.456 -8.633 1.00 0.00 C ATOM 1636 O GLU A 100 9.974 -14.000 -8.345 1.00 0.00 O ATOM 1637 CB GLU A 100 11.503 -16.781 -9.455 1.00 0.00 C ATOM 1638 CG GLU A 100 10.917 -17.792 -10.427 1.00 0.00 C ATOM 1639 CD GLU A 100 9.639 -18.424 -9.911 1.00 0.00 C ATOM 1640 OE1 GLU A 100 8.552 -17.869 -10.181 1.00 0.00 O ATOM 1641 OE2 GLU A 100 9.724 -19.472 -9.238 1.00 0.00 O ATOM 0 H GLU A 100 13.240 -14.669 -10.154 1.00 0.00 H new ATOM 0 HA GLU A 100 10.363 -15.270 -10.473 1.00 0.00 H new ATOM 0 HB2 GLU A 100 12.575 -16.956 -9.364 1.00 0.00 H new ATOM 0 HB3 GLU A 100 11.068 -16.943 -8.469 1.00 0.00 H new ATOM 0 HG2 GLU A 100 10.716 -17.301 -11.379 1.00 0.00 H new ATOM 0 HG3 GLU A 100 11.652 -18.573 -10.620 1.00 0.00 H new ATOM 1649 N ASN A 101 12.167 -14.231 -7.902 1.00 0.00 N ATOM 1650 CA ASN A 101 12.121 -13.415 -6.693 1.00 0.00 C ATOM 1651 C ASN A 101 11.874 -11.948 -7.034 1.00 0.00 C ATOM 1652 O ASN A 101 11.251 -11.218 -6.264 1.00 0.00 O ATOM 1653 CB ASN A 101 13.425 -13.555 -5.907 1.00 0.00 C ATOM 1654 CG ASN A 101 13.372 -14.686 -4.899 1.00 0.00 C ATOM 1655 OD1 ASN A 101 12.728 -15.710 -5.129 1.00 0.00 O ATOM 1656 ND2 ASN A 101 14.053 -14.507 -3.773 1.00 0.00 N ATOM 0 H ASN A 101 13.091 -14.602 -8.125 1.00 0.00 H new ATOM 0 HA ASN A 101 11.294 -13.770 -6.078 1.00 0.00 H new ATOM 0 HB2 ASN A 101 14.248 -13.728 -6.601 1.00 0.00 H new ATOM 0 HB3 ASN A 101 13.636 -12.620 -5.389 1.00 0.00 H new ATOM 0 HD21 ASN A 101 14.056 -15.234 -3.058 1.00 0.00 H new ATOM 0 HD22 ASN A 101 14.573 -13.642 -3.624 1.00 0.00 H new ATOM 1663 N PHE A 102 12.367 -11.524 -8.193 1.00 0.00 N ATOM 1664 CA PHE A 102 12.200 -10.145 -8.635 1.00 0.00 C ATOM 1665 C PHE A 102 10.722 -9.790 -8.765 1.00 0.00 C ATOM 1666 O PHE A 102 10.078 -10.126 -9.759 1.00 0.00 O ATOM 1667 CB PHE A 102 12.909 -9.927 -9.974 1.00 0.00 C ATOM 1668 CG PHE A 102 13.327 -8.502 -10.207 1.00 0.00 C ATOM 1669 CD1 PHE A 102 12.391 -7.481 -10.190 1.00 0.00 C ATOM 1670 CD2 PHE A 102 14.655 -8.186 -10.442 1.00 0.00 C ATOM 1671 CE1 PHE A 102 12.772 -6.170 -10.405 1.00 0.00 C ATOM 1672 CE2 PHE A 102 15.042 -6.878 -10.657 1.00 0.00 C ATOM 1673 CZ PHE A 102 14.100 -5.868 -10.638 1.00 0.00 C ATOM 0 H PHE A 102 12.885 -12.116 -8.843 1.00 0.00 H new ATOM 0 HA PHE A 102 12.647 -9.493 -7.885 1.00 0.00 H new ATOM 0 HB2 PHE A 102 13.790 -10.567 -10.018 1.00 0.00 H new ATOM 0 HB3 PHE A 102 12.247 -10.240 -10.782 1.00 0.00 H new ATOM 0 HD1 PHE A 102 11.352 -7.712 -10.007 1.00 0.00 H new ATOM 0 HD2 PHE A 102 15.396 -8.971 -10.457 1.00 0.00 H new ATOM 0 HE1 PHE A 102 12.033 -5.383 -10.391 1.00 0.00 H new ATOM 0 HE2 PHE A 102 16.081 -6.645 -10.840 1.00 0.00 H new ATOM 0 HZ PHE A 102 14.401 -4.844 -10.805 1.00 0.00 H new ATOM 1683 N HIS A 103 10.192 -9.110 -7.755 1.00 0.00 N ATOM 1684 CA HIS A 103 8.789 -8.710 -7.755 1.00 0.00 C ATOM 1685 C HIS A 103 8.621 -7.318 -8.355 1.00 0.00 C ATOM 1686 O HIS A 103 9.375 -6.398 -8.037 1.00 0.00 O ATOM 1687 CB HIS A 103 8.229 -8.737 -6.331 1.00 0.00 C ATOM 1688 CG HIS A 103 7.557 -10.027 -5.977 1.00 0.00 C ATOM 1689 ND1 HIS A 103 6.509 -10.109 -5.084 1.00 0.00 N ATOM 1690 CD2 HIS A 103 7.787 -11.292 -6.402 1.00 0.00 C ATOM 1691 CE1 HIS A 103 6.125 -11.368 -4.975 1.00 0.00 C ATOM 1692 NE2 HIS A 103 6.883 -12.105 -5.763 1.00 0.00 N ATOM 0 H HIS A 103 10.712 -8.824 -6.926 1.00 0.00 H new ATOM 0 HA HIS A 103 8.234 -9.420 -8.369 1.00 0.00 H new ATOM 0 HB2 HIS A 103 9.041 -8.554 -5.627 1.00 0.00 H new ATOM 0 HB3 HIS A 103 7.516 -7.921 -6.214 1.00 0.00 H new ATOM 0 HD2 HIS A 103 8.540 -11.603 -7.111 1.00 0.00 H new ATOM 0 HE1 HIS A 103 5.326 -11.732 -4.347 1.00 0.00 H new ATOM 0 HE2 HIS A 103 6.810 -13.116 -5.879 1.00 0.00 H new ATOM 1701 N LEU A 104 7.626 -7.170 -9.223 1.00 0.00 N ATOM 1702 CA LEU A 104 7.357 -5.890 -9.868 1.00 0.00 C ATOM 1703 C LEU A 104 5.869 -5.556 -9.817 1.00 0.00 C ATOM 1704 O LEU A 104 5.022 -6.449 -9.848 1.00 0.00 O ATOM 1705 CB LEU A 104 7.836 -5.916 -11.320 1.00 0.00 C ATOM 1706 CG LEU A 104 8.199 -4.552 -11.909 1.00 0.00 C ATOM 1707 CD1 LEU A 104 9.372 -3.941 -11.156 1.00 0.00 C ATOM 1708 CD2 LEU A 104 8.522 -4.680 -13.390 1.00 0.00 C ATOM 0 H LEU A 104 6.992 -7.921 -9.496 1.00 0.00 H new ATOM 0 HA LEU A 104 7.903 -5.117 -9.326 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.708 -6.567 -11.387 1.00 0.00 H new ATOM 0 HB3 LEU A 104 7.056 -6.364 -11.935 1.00 0.00 H new ATOM 0 HG LEU A 104 7.340 -3.890 -11.801 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.617 -2.971 -11.589 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.104 -3.813 -10.107 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.236 -4.601 -11.232 1.00 0.00 H new ATOM 0 HD21 LEU A 104 8.778 -3.700 -13.793 1.00 0.00 H new ATOM 0 HD22 LEU A 104 9.365 -5.358 -13.521 1.00 0.00 H new ATOM 0 HD23 LEU A 104 7.654 -5.074 -13.919 1.00 0.00 H new ATOM 1720 N GLY A 105 5.559 -4.267 -9.739 1.00 0.00 N ATOM 1721 CA GLY A 105 4.174 -3.839 -9.685 1.00 0.00 C ATOM 1722 C GLY A 105 4.017 -2.351 -9.927 1.00 0.00 C ATOM 1723 O GLY A 105 4.985 -1.596 -9.843 1.00 0.00 O ATOM 0 H GLY A 105 6.243 -3.510 -9.712 1.00 0.00 H new ATOM 0 HA2 GLY A 105 3.598 -4.388 -10.430 1.00 0.00 H new ATOM 0 HA3 GLY A 105 3.757 -4.091 -8.710 1.00 0.00 H new ATOM 1727 N LEU A 106 2.793 -1.928 -10.230 1.00 0.00 N ATOM 1728 CA LEU A 106 2.514 -0.519 -10.486 1.00 0.00 C ATOM 1729 C LEU A 106 1.106 -0.152 -10.029 1.00 0.00 C ATOM 1730 O LEU A 106 0.131 -0.805 -10.402 1.00 0.00 O ATOM 1731 CB LEU A 106 2.678 -0.208 -11.975 1.00 0.00 C ATOM 1732 CG LEU A 106 4.098 -0.373 -12.518 1.00 0.00 C ATOM 1733 CD1 LEU A 106 4.086 -0.433 -14.038 1.00 0.00 C ATOM 1734 CD2 LEU A 106 4.987 0.764 -12.035 1.00 0.00 C ATOM 0 H LEU A 106 1.980 -2.540 -10.304 1.00 0.00 H new ATOM 0 HA LEU A 106 3.228 0.077 -9.917 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.011 -0.857 -12.542 1.00 0.00 H new ATOM 0 HB3 LEU A 106 2.354 0.817 -12.154 1.00 0.00 H new ATOM 0 HG LEU A 106 4.504 -1.312 -12.142 1.00 0.00 H new ATOM 0 HD11 LEU A 106 5.105 -0.551 -14.406 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.483 -1.280 -14.364 1.00 0.00 H new ATOM 0 HD13 LEU A 106 3.661 0.489 -14.435 1.00 0.00 H new ATOM 0 HD21 LEU A 106 5.994 0.632 -12.430 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.583 1.715 -12.383 1.00 0.00 H new ATOM 0 HD23 LEU A 106 5.022 0.761 -10.946 1.00 0.00 H new ATOM 1746 N GLY A 107 1.007 0.900 -9.223 1.00 0.00 N ATOM 1747 CA GLY A 107 -0.285 1.337 -8.728 1.00 0.00 C ATOM 1748 C GLY A 107 -0.229 2.714 -8.096 1.00 0.00 C ATOM 1749 O GLY A 107 0.675 3.499 -8.382 1.00 0.00 O ATOM 0 H GLY A 107 1.799 1.458 -8.904 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -1.001 1.347 -9.550 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -0.651 0.619 -7.995 1.00 0.00 H new ATOM 1753 N PHE A 108 -1.197 3.007 -7.234 1.00 0.00 N ATOM 1754 CA PHE A 108 -1.254 4.298 -6.559 1.00 0.00 C ATOM 1755 C PHE A 108 -1.477 4.119 -5.062 1.00 0.00 C ATOM 1756 O PHE A 108 -2.083 3.139 -4.627 1.00 0.00 O ATOM 1757 CB PHE A 108 -2.369 5.161 -7.154 1.00 0.00 C ATOM 1758 CG PHE A 108 -3.661 4.420 -7.350 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -4.479 4.130 -6.270 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -4.058 4.014 -8.614 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -5.668 3.448 -6.446 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -5.246 3.332 -8.797 1.00 0.00 C ATOM 1763 CZ PHE A 108 -6.051 3.049 -7.712 1.00 0.00 C ATOM 0 H PHE A 108 -1.952 2.368 -6.987 1.00 0.00 H new ATOM 0 HA PHE A 108 -0.298 4.800 -6.708 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.545 6.015 -6.500 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -2.038 5.558 -8.114 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -4.184 4.441 -5.279 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -3.432 4.233 -9.466 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -6.296 3.227 -5.596 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -5.544 3.021 -9.787 1.00 0.00 H new ATOM 0 HZ PHE A 108 -6.980 2.516 -7.853 1.00 0.00 H new ATOM 1773 N THR A 109 -0.984 5.071 -4.276 1.00 0.00 N ATOM 1774 CA THR A 109 -1.129 5.017 -2.826 1.00 0.00 C ATOM 1775 C THR A 109 -1.857 6.252 -2.304 1.00 0.00 C ATOM 1776 O THR A 109 -1.364 7.374 -2.427 1.00 0.00 O ATOM 1777 CB THR A 109 0.242 4.899 -2.159 1.00 0.00 C ATOM 1778 OG1 THR A 109 1.107 5.930 -2.604 1.00 0.00 O ATOM 1779 CG2 THR A 109 0.927 3.577 -2.430 1.00 0.00 C ATOM 0 H THR A 109 -0.481 5.889 -4.619 1.00 0.00 H new ATOM 0 HA THR A 109 -1.723 4.137 -2.579 1.00 0.00 H new ATOM 0 HB THR A 109 0.050 4.978 -1.089 1.00 0.00 H new ATOM 0 HG1 THR A 109 0.578 6.716 -2.854 1.00 0.00 H new ATOM 0 HG21 THR A 109 1.894 3.559 -1.928 1.00 0.00 H new ATOM 0 HG22 THR A 109 0.308 2.763 -2.054 1.00 0.00 H new ATOM 0 HG23 THR A 109 1.073 3.456 -3.503 1.00 0.00 H new ATOM 1787 N ALA A 110 -3.030 6.037 -1.718 1.00 0.00 N ATOM 1788 CA ALA A 110 -3.826 7.130 -1.173 1.00 0.00 C ATOM 1789 C ALA A 110 -4.434 6.744 0.169 1.00 0.00 C ATOM 1790 O ALA A 110 -5.087 5.708 0.290 1.00 0.00 O ATOM 1791 CB ALA A 110 -4.917 7.529 -2.156 1.00 0.00 C ATOM 0 H ALA A 110 -3.451 5.114 -1.608 1.00 0.00 H new ATOM 0 HA ALA A 110 -3.169 7.985 -1.013 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -5.504 8.346 -1.736 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -4.462 7.852 -3.092 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -5.567 6.675 -2.344 1.00 0.00 H new ATOM 1797 N GLY A 111 -4.215 7.582 1.177 1.00 0.00 N ATOM 1798 CA GLY A 111 -4.748 7.305 2.499 1.00 0.00 C ATOM 1799 C GLY A 111 -5.355 8.530 3.151 1.00 0.00 C ATOM 1800 O GLY A 111 -5.802 9.451 2.466 1.00 0.00 O ATOM 0 H GLY A 111 -3.679 8.447 1.103 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -5.505 6.524 2.425 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -3.951 6.917 3.134 1.00 0.00 H new ATOM 1804 N VAL A 112 -5.373 8.542 4.481 1.00 0.00 N ATOM 1805 CA VAL A 112 -5.931 9.662 5.227 1.00 0.00 C ATOM 1806 C VAL A 112 -5.054 10.020 6.424 1.00 0.00 C ATOM 1807 O VAL A 112 -4.421 9.151 7.026 1.00 0.00 O ATOM 1808 CB VAL A 112 -7.354 9.351 5.725 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -8.346 9.402 4.573 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -7.395 7.996 6.415 1.00 0.00 C ATOM 0 H VAL A 112 -5.007 7.788 5.063 1.00 0.00 H new ATOM 0 HA VAL A 112 -5.969 10.509 4.542 1.00 0.00 H new ATOM 0 HB VAL A 112 -7.639 10.111 6.453 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -9.346 9.180 4.944 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -8.337 10.397 4.129 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -8.067 8.666 3.819 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -8.409 7.794 6.760 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -7.089 7.221 5.713 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -6.716 8.001 7.268 1.00 0.00 H new ATOM 1820 N THR A 113 -5.024 11.304 6.762 1.00 0.00 N ATOM 1821 CA THR A 113 -4.228 11.783 7.886 1.00 0.00 C ATOM 1822 C THR A 113 -5.111 12.055 9.099 1.00 0.00 C ATOM 1823 O THR A 113 -6.324 12.223 8.971 1.00 0.00 O ATOM 1824 CB THR A 113 -3.470 13.054 7.496 1.00 0.00 C ATOM 1825 OG1 THR A 113 -2.632 12.815 6.379 1.00 0.00 O ATOM 1826 CG2 THR A 113 -2.605 13.604 8.610 1.00 0.00 C ATOM 0 H THR A 113 -5.543 12.033 6.273 1.00 0.00 H new ATOM 0 HA THR A 113 -3.509 11.007 8.149 1.00 0.00 H new ATOM 0 HB THR A 113 -4.241 13.788 7.262 1.00 0.00 H new ATOM 0 HG1 THR A 113 -2.157 13.639 6.144 1.00 0.00 H new ATOM 0 HG21 THR A 113 -2.097 14.504 8.265 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.230 13.847 9.470 1.00 0.00 H new ATOM 0 HG23 THR A 113 -1.865 12.857 8.898 1.00 0.00 H new ATOM 1834 N ALA A 114 -4.497 12.097 10.277 1.00 0.00 N ATOM 1835 CA ALA A 114 -5.229 12.350 11.513 1.00 0.00 C ATOM 1836 C ALA A 114 -5.566 13.830 11.660 1.00 0.00 C ATOM 1837 O ALA A 114 -5.409 14.609 10.718 1.00 0.00 O ATOM 1838 CB ALA A 114 -4.424 11.867 12.710 1.00 0.00 C ATOM 0 H ALA A 114 -3.494 11.959 10.402 1.00 0.00 H new ATOM 0 HA ALA A 114 -6.166 11.795 11.471 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -4.982 12.062 13.626 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.241 10.796 12.617 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -3.472 12.396 12.745 1.00 0.00 H new ATOM 1954 N ILE A 121 -11.647 15.758 11.290 1.00 0.00 N ATOM 1955 CA ILE A 121 -11.703 15.699 9.835 1.00 0.00 C ATOM 1956 C ILE A 121 -10.364 15.248 9.251 1.00 0.00 C ATOM 1957 O ILE A 121 -9.404 16.018 9.222 1.00 0.00 O ATOM 1958 CB ILE A 121 -12.077 17.067 9.232 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -11.082 18.141 9.683 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -13.496 17.448 9.626 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -10.313 18.768 8.540 1.00 0.00 C ATOM 0 HA ILE A 121 -12.473 14.973 9.577 1.00 0.00 H new ATOM 0 HB ILE A 121 -12.030 16.994 8.145 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -11.621 18.922 10.220 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -10.376 17.699 10.386 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -13.746 18.416 9.193 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -14.191 16.694 9.256 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -13.569 17.506 10.712 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -9.627 19.519 8.932 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -9.747 17.998 8.017 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -11.010 19.239 7.848 1.00 0.00 H new ATOM 1973 N PRO A 122 -10.279 13.992 8.777 1.00 0.00 N ATOM 1974 CA PRO A 122 -9.045 13.453 8.195 1.00 0.00 C ATOM 1975 C PRO A 122 -8.691 14.121 6.871 1.00 0.00 C ATOM 1976 O PRO A 122 -9.571 14.488 6.093 1.00 0.00 O ATOM 1977 CB PRO A 122 -9.367 11.972 7.978 1.00 0.00 C ATOM 1978 CG PRO A 122 -10.851 11.916 7.869 1.00 0.00 C ATOM 1979 CD PRO A 122 -11.371 13.001 8.770 1.00 0.00 C ATOM 0 HA PRO A 122 -8.183 13.623 8.840 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -8.890 11.592 7.075 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -9.008 11.364 8.808 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -11.173 12.075 6.840 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -11.229 10.940 8.174 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -12.299 13.428 8.390 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -11.580 12.626 9.772 1.00 0.00 H new ATOM 1987 N LEU A 123 -7.394 14.275 6.622 1.00 0.00 N ATOM 1988 CA LEU A 123 -6.920 14.900 5.392 1.00 0.00 C ATOM 1989 C LEU A 123 -6.431 13.847 4.398 1.00 0.00 C ATOM 1990 O LEU A 123 -5.277 13.424 4.452 1.00 0.00 O ATOM 1991 CB LEU A 123 -5.794 15.889 5.699 1.00 0.00 C ATOM 1992 CG LEU A 123 -5.649 17.036 4.699 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -6.542 18.203 5.094 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -4.198 17.482 4.606 1.00 0.00 C ATOM 0 H LEU A 123 -6.653 13.976 7.256 1.00 0.00 H new ATOM 0 HA LEU A 123 -7.755 15.438 4.943 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -5.962 16.310 6.690 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -4.852 15.342 5.740 1.00 0.00 H new ATOM 0 HG LEU A 123 -5.962 16.679 3.718 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.426 19.011 4.371 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -7.582 17.876 5.110 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.259 18.559 6.084 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -4.114 18.299 3.890 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -3.858 17.821 5.585 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -3.581 16.646 4.277 1.00 0.00 H new ATOM 2006 N PRO A 124 -7.304 13.410 3.473 1.00 0.00 N ATOM 2007 CA PRO A 124 -6.947 12.404 2.468 1.00 0.00 C ATOM 2008 C PRO A 124 -5.942 12.934 1.451 1.00 0.00 C ATOM 2009 O PRO A 124 -5.996 14.099 1.061 1.00 0.00 O ATOM 2010 CB PRO A 124 -8.282 12.088 1.786 1.00 0.00 C ATOM 2011 CG PRO A 124 -9.113 13.305 1.997 1.00 0.00 C ATOM 2012 CD PRO A 124 -8.702 13.861 3.332 1.00 0.00 C ATOM 0 HA PRO A 124 -6.468 11.534 2.917 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -8.145 11.881 0.725 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -8.752 11.207 2.224 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -8.947 14.033 1.203 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -10.175 13.059 1.987 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -8.778 14.948 3.355 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -9.331 13.480 4.137 1.00 0.00 H new ATOM 2020 N VAL A 125 -5.025 12.070 1.027 1.00 0.00 N ATOM 2021 CA VAL A 125 -4.007 12.452 0.055 1.00 0.00 C ATOM 2022 C VAL A 125 -3.831 11.377 -1.011 1.00 0.00 C ATOM 2023 O VAL A 125 -3.879 10.183 -0.716 1.00 0.00 O ATOM 2024 CB VAL A 125 -2.650 12.712 0.737 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -2.736 13.919 1.658 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -2.193 11.479 1.500 1.00 0.00 C ATOM 0 H VAL A 125 -4.966 11.101 1.341 1.00 0.00 H new ATOM 0 HA VAL A 125 -4.351 13.372 -0.417 1.00 0.00 H new ATOM 0 HB VAL A 125 -1.911 12.928 -0.035 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -1.768 14.086 2.130 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -3.014 14.800 1.079 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -3.488 13.738 2.426 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -1.233 11.680 1.975 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -2.930 11.229 2.263 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -2.087 10.642 0.810 1.00 0.00 H new ATOM 2036 N LEU A 126 -3.624 11.809 -2.251 1.00 0.00 N ATOM 2037 CA LEU A 126 -3.440 10.883 -3.364 1.00 0.00 C ATOM 2038 C LEU A 126 -2.035 11.007 -3.946 1.00 0.00 C ATOM 2039 O LEU A 126 -1.673 12.041 -4.507 1.00 0.00 O ATOM 2040 CB LEU A 126 -4.480 11.149 -4.453 1.00 0.00 C ATOM 2041 CG LEU A 126 -4.885 9.924 -5.274 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -6.199 10.177 -5.998 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -3.790 9.563 -6.266 1.00 0.00 C ATOM 0 H LEU A 126 -3.579 12.794 -2.511 1.00 0.00 H new ATOM 0 HA LEU A 126 -3.571 9.869 -2.987 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.373 11.567 -3.987 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -4.089 11.908 -5.130 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.024 9.084 -4.594 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.471 9.295 -6.577 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -6.981 10.388 -5.269 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -6.087 11.030 -6.668 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.095 8.689 -6.842 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -3.620 10.402 -6.941 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -2.870 9.339 -5.727 1.00 0.00 H new ATOM 2055 N LEU A 127 -1.246 9.946 -3.807 1.00 0.00 N ATOM 2056 CA LEU A 127 0.119 9.936 -4.320 1.00 0.00 C ATOM 2057 C LEU A 127 0.449 8.588 -4.963 1.00 0.00 C ATOM 2058 O LEU A 127 0.321 7.544 -4.324 1.00 0.00 O ATOM 2059 CB LEU A 127 1.108 10.229 -3.189 1.00 0.00 C ATOM 2060 CG LEU A 127 1.441 11.708 -2.987 1.00 0.00 C ATOM 2061 CD1 LEU A 127 0.350 12.396 -2.181 1.00 0.00 C ATOM 2062 CD2 LEU A 127 2.790 11.860 -2.302 1.00 0.00 C ATOM 0 H LEU A 127 -1.529 9.082 -3.344 1.00 0.00 H new ATOM 0 HA LEU A 127 0.203 10.712 -5.081 1.00 0.00 H new ATOM 0 HB2 LEU A 127 0.700 9.834 -2.259 1.00 0.00 H new ATOM 0 HB3 LEU A 127 2.033 9.688 -3.387 1.00 0.00 H new ATOM 0 HG LEU A 127 1.496 12.186 -3.965 1.00 0.00 H new ATOM 0 HD11 LEU A 127 0.604 13.447 -2.047 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -0.599 12.317 -2.711 1.00 0.00 H new ATOM 0 HD13 LEU A 127 0.262 11.917 -1.206 1.00 0.00 H new ATOM 0 HD21 LEU A 127 3.012 12.918 -2.166 1.00 0.00 H new ATOM 0 HD22 LEU A 127 2.762 11.367 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 127 3.565 11.403 -2.918 1.00 0.00 H new ATOM 2074 N PRO A 128 0.880 8.586 -6.239 1.00 0.00 N ATOM 2075 CA PRO A 128 1.221 7.350 -6.953 1.00 0.00 C ATOM 2076 C PRO A 128 2.480 6.694 -6.394 1.00 0.00 C ATOM 2077 O PRO A 128 3.384 7.375 -5.910 1.00 0.00 O ATOM 2078 CB PRO A 128 1.461 7.809 -8.400 1.00 0.00 C ATOM 2079 CG PRO A 128 0.934 9.203 -8.475 1.00 0.00 C ATOM 2080 CD PRO A 128 1.061 9.769 -7.091 1.00 0.00 C ATOM 0 HA PRO A 128 0.433 6.602 -6.860 1.00 0.00 H new ATOM 0 HB2 PRO A 128 2.522 7.778 -8.650 1.00 0.00 H new ATOM 0 HB3 PRO A 128 0.948 7.158 -9.107 1.00 0.00 H new ATOM 0 HG2 PRO A 128 1.501 9.796 -9.193 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -0.105 9.210 -8.806 1.00 0.00 H new ATOM 0 HD2 PRO A 128 2.033 10.237 -6.933 1.00 0.00 H new ATOM 0 HD3 PRO A 128 0.305 10.529 -6.894 1.00 0.00 H new ATOM 2088 N LEU A 129 2.530 5.368 -6.461 1.00 0.00 N ATOM 2089 CA LEU A 129 3.678 4.620 -5.959 1.00 0.00 C ATOM 2090 C LEU A 129 3.812 3.279 -6.673 1.00 0.00 C ATOM 2091 O LEU A 129 2.826 2.714 -7.146 1.00 0.00 O ATOM 2092 CB LEU A 129 3.545 4.397 -4.451 1.00 0.00 C ATOM 2093 CG LEU A 129 4.663 3.567 -3.816 1.00 0.00 C ATOM 2094 CD1 LEU A 129 4.967 4.064 -2.411 1.00 0.00 C ATOM 2095 CD2 LEU A 129 4.283 2.094 -3.792 1.00 0.00 C ATOM 0 H LEU A 129 1.790 4.789 -6.858 1.00 0.00 H new ATOM 0 HA LEU A 129 4.576 5.205 -6.157 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.510 5.368 -3.958 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.592 3.905 -4.255 1.00 0.00 H new ATOM 0 HG LEU A 129 5.563 3.681 -4.421 1.00 0.00 H new ATOM 0 HD11 LEU A 129 5.764 3.461 -1.976 1.00 0.00 H new ATOM 0 HD12 LEU A 129 5.283 5.106 -2.454 1.00 0.00 H new ATOM 0 HD13 LEU A 129 4.072 3.981 -1.794 1.00 0.00 H new ATOM 0 HD21 LEU A 129 5.089 1.518 -3.337 1.00 0.00 H new ATOM 0 HD22 LEU A 129 3.370 1.963 -3.210 1.00 0.00 H new ATOM 0 HD23 LEU A 129 4.117 1.744 -4.811 1.00 0.00 H new ATOM 2107 N ALA A 130 5.041 2.774 -6.745 1.00 0.00 N ATOM 2108 CA ALA A 130 5.306 1.498 -7.398 1.00 0.00 C ATOM 2109 C ALA A 130 5.872 0.485 -6.408 1.00 0.00 C ATOM 2110 O ALA A 130 6.433 0.857 -5.377 1.00 0.00 O ATOM 2111 CB ALA A 130 6.265 1.693 -8.563 1.00 0.00 C ATOM 0 H ALA A 130 5.868 3.230 -6.359 1.00 0.00 H new ATOM 0 HA ALA A 130 4.363 1.107 -7.779 1.00 0.00 H new ATOM 0 HB1 ALA A 130 6.455 0.733 -9.042 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.824 2.379 -9.286 1.00 0.00 H new ATOM 0 HB3 ALA A 130 7.204 2.107 -8.196 1.00 0.00 H new ATOM 2117 N SER A 131 5.723 -0.796 -6.728 1.00 0.00 N ATOM 2118 CA SER A 131 6.218 -1.863 -5.864 1.00 0.00 C ATOM 2119 C SER A 131 7.308 -2.669 -6.563 1.00 0.00 C ATOM 2120 O SER A 131 7.053 -3.340 -7.564 1.00 0.00 O ATOM 2121 CB SER A 131 5.072 -2.785 -5.449 1.00 0.00 C ATOM 2122 OG SER A 131 4.300 -3.178 -6.571 1.00 0.00 O ATOM 0 H SER A 131 5.264 -1.121 -7.579 1.00 0.00 H new ATOM 0 HA SER A 131 6.646 -1.404 -4.973 1.00 0.00 H new ATOM 0 HB2 SER A 131 5.474 -3.669 -4.953 1.00 0.00 H new ATOM 0 HB3 SER A 131 4.435 -2.275 -4.726 1.00 0.00 H new ATOM 0 HG SER A 131 3.795 -3.989 -6.353 1.00 0.00 H new ATOM 2128 N VAL A 132 8.523 -2.600 -6.028 1.00 0.00 N ATOM 2129 CA VAL A 132 9.651 -3.325 -6.598 1.00 0.00 C ATOM 2130 C VAL A 132 10.598 -3.810 -5.504 1.00 0.00 C ATOM 2131 O VAL A 132 11.203 -3.007 -4.794 1.00 0.00 O ATOM 2132 CB VAL A 132 10.435 -2.450 -7.596 1.00 0.00 C ATOM 2133 CG1 VAL A 132 11.011 -1.226 -6.901 1.00 0.00 C ATOM 2134 CG2 VAL A 132 11.536 -3.257 -8.270 1.00 0.00 C ATOM 0 H VAL A 132 8.751 -2.049 -5.200 1.00 0.00 H new ATOM 0 HA VAL A 132 9.242 -4.185 -7.128 1.00 0.00 H new ATOM 0 HB VAL A 132 9.744 -2.109 -8.367 1.00 0.00 H new ATOM 0 HG11 VAL A 132 11.560 -0.622 -7.623 1.00 0.00 H new ATOM 0 HG12 VAL A 132 10.201 -0.634 -6.475 1.00 0.00 H new ATOM 0 HG13 VAL A 132 11.685 -1.543 -6.106 1.00 0.00 H new ATOM 0 HG21 VAL A 132 12.077 -2.621 -8.970 1.00 0.00 H new ATOM 0 HG22 VAL A 132 12.226 -3.633 -7.515 1.00 0.00 H new ATOM 0 HG23 VAL A 132 11.095 -4.096 -8.808 1.00 0.00 H new ATOM 2144 N GLY A 133 10.720 -5.128 -5.372 1.00 0.00 N ATOM 2145 CA GLY A 133 11.593 -5.691 -4.360 1.00 0.00 C ATOM 2146 C GLY A 133 12.337 -6.918 -4.848 1.00 0.00 C ATOM 2147 O GLY A 133 12.302 -7.244 -6.035 1.00 0.00 O ATOM 0 H GLY A 133 10.231 -5.814 -5.947 1.00 0.00 H new ATOM 0 HA2 GLY A 133 12.313 -4.935 -4.046 1.00 0.00 H new ATOM 0 HA3 GLY A 133 11.003 -5.954 -3.482 1.00 0.00 H new ATOM 2151 N TYR A 134 13.012 -7.600 -3.929 1.00 0.00 N ATOM 2152 CA TYR A 134 13.770 -8.800 -4.266 1.00 0.00 C ATOM 2153 C TYR A 134 14.204 -9.536 -3.004 1.00 0.00 C ATOM 2154 O TYR A 134 14.789 -8.942 -2.098 1.00 0.00 O ATOM 2155 CB TYR A 134 14.995 -8.435 -5.107 1.00 0.00 C ATOM 2156 CG TYR A 134 15.821 -9.630 -5.526 1.00 0.00 C ATOM 2157 CD1 TYR A 134 16.816 -10.136 -4.699 1.00 0.00 C ATOM 2158 CD2 TYR A 134 15.605 -10.253 -6.749 1.00 0.00 C ATOM 2159 CE1 TYR A 134 17.573 -11.228 -5.079 1.00 0.00 C ATOM 2160 CE2 TYR A 134 16.357 -11.346 -7.137 1.00 0.00 C ATOM 2161 CZ TYR A 134 17.339 -11.829 -6.298 1.00 0.00 C ATOM 2162 OH TYR A 134 18.091 -12.917 -6.680 1.00 0.00 O ATOM 0 H TYR A 134 13.050 -7.342 -2.943 1.00 0.00 H new ATOM 0 HA TYR A 134 13.125 -9.459 -4.847 1.00 0.00 H new ATOM 0 HB2 TYR A 134 14.667 -7.900 -5.998 1.00 0.00 H new ATOM 0 HB3 TYR A 134 15.624 -7.750 -4.538 1.00 0.00 H new ATOM 0 HD1 TYR A 134 17.001 -9.668 -3.743 1.00 0.00 H new ATOM 0 HD2 TYR A 134 14.836 -9.877 -7.408 1.00 0.00 H new ATOM 0 HE1 TYR A 134 18.344 -11.609 -4.425 1.00 0.00 H new ATOM 0 HE2 TYR A 134 16.177 -11.819 -8.091 1.00 0.00 H new ATOM 0 HH TYR A 134 17.799 -13.222 -7.564 1.00 0.00 H new ATOM 2172 N GLY A 135 13.911 -10.831 -2.949 1.00 0.00 N ATOM 2173 CA GLY A 135 14.277 -11.622 -1.789 1.00 0.00 C ATOM 2174 C GLY A 135 13.531 -11.190 -0.539 1.00 0.00 C ATOM 2175 O GLY A 135 12.323 -10.960 -0.587 1.00 0.00 O ATOM 0 H GLY A 135 13.428 -11.346 -3.685 1.00 0.00 H new ATOM 0 HA2 GLY A 135 14.069 -12.673 -1.988 1.00 0.00 H new ATOM 0 HA3 GLY A 135 15.350 -11.536 -1.617 1.00 0.00 H new ATOM 2179 N PRO A 136 14.226 -11.071 0.607 1.00 0.00 N ATOM 2180 CA PRO A 136 13.609 -10.666 1.868 1.00 0.00 C ATOM 2181 C PRO A 136 13.568 -9.150 2.048 1.00 0.00 C ATOM 2182 O PRO A 136 13.502 -8.653 3.173 1.00 0.00 O ATOM 2183 CB PRO A 136 14.536 -11.299 2.899 1.00 0.00 C ATOM 2184 CG PRO A 136 15.887 -11.258 2.265 1.00 0.00 C ATOM 2185 CD PRO A 136 15.670 -11.330 0.770 1.00 0.00 C ATOM 0 HA PRO A 136 12.567 -10.978 1.939 1.00 0.00 H new ATOM 0 HB2 PRO A 136 14.522 -10.746 3.838 1.00 0.00 H new ATOM 0 HB3 PRO A 136 14.236 -12.322 3.127 1.00 0.00 H new ATOM 0 HG2 PRO A 136 16.413 -10.343 2.536 1.00 0.00 H new ATOM 0 HG3 PRO A 136 16.500 -12.092 2.607 1.00 0.00 H new ATOM 0 HD2 PRO A 136 16.271 -10.589 0.243 1.00 0.00 H new ATOM 0 HD3 PRO A 136 15.948 -12.306 0.373 1.00 0.00 H new ATOM 2193 N VAL A 137 13.606 -8.415 0.939 1.00 0.00 N ATOM 2194 CA VAL A 137 13.573 -6.959 0.988 1.00 0.00 C ATOM 2195 C VAL A 137 12.677 -6.392 -0.110 1.00 0.00 C ATOM 2196 O VAL A 137 12.679 -6.880 -1.241 1.00 0.00 O ATOM 2197 CB VAL A 137 14.988 -6.361 0.848 1.00 0.00 C ATOM 2198 CG1 VAL A 137 15.612 -6.767 -0.480 1.00 0.00 C ATOM 2199 CG2 VAL A 137 14.948 -4.847 0.986 1.00 0.00 C ATOM 0 H VAL A 137 13.660 -8.805 -0.002 1.00 0.00 H new ATOM 0 HA VAL A 137 13.166 -6.682 1.961 1.00 0.00 H new ATOM 0 HB VAL A 137 15.609 -6.758 1.651 1.00 0.00 H new ATOM 0 HG11 VAL A 137 16.610 -6.336 -0.560 1.00 0.00 H new ATOM 0 HG12 VAL A 137 15.681 -7.854 -0.532 1.00 0.00 H new ATOM 0 HG13 VAL A 137 14.992 -6.403 -1.300 1.00 0.00 H new ATOM 0 HG21 VAL A 137 15.956 -4.446 0.884 1.00 0.00 H new ATOM 0 HG22 VAL A 137 14.310 -4.427 0.208 1.00 0.00 H new ATOM 0 HG23 VAL A 137 14.549 -4.581 1.965 1.00 0.00 H new ATOM 2209 N THR A 138 11.913 -5.359 0.232 1.00 0.00 N ATOM 2210 CA THR A 138 11.013 -4.724 -0.725 1.00 0.00 C ATOM 2211 C THR A 138 11.290 -3.226 -0.818 1.00 0.00 C ATOM 2212 O THR A 138 11.635 -2.586 0.176 1.00 0.00 O ATOM 2213 CB THR A 138 9.553 -4.966 -0.328 1.00 0.00 C ATOM 2214 OG1 THR A 138 9.473 -5.766 0.839 1.00 0.00 O ATOM 2215 CG2 THR A 138 8.746 -5.650 -1.409 1.00 0.00 C ATOM 0 H THR A 138 11.899 -4.944 1.164 1.00 0.00 H new ATOM 0 HA THR A 138 11.190 -5.169 -1.704 1.00 0.00 H new ATOM 0 HB THR A 138 9.134 -3.975 -0.154 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.894 -5.295 1.588 1.00 0.00 H new ATOM 0 HG21 THR A 138 7.722 -5.792 -1.064 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.744 -5.033 -2.307 1.00 0.00 H new ATOM 0 HG23 THR A 138 9.190 -6.619 -1.636 1.00 0.00 H new ATOM 2223 N PHE A 139 11.136 -2.674 -2.017 1.00 0.00 N ATOM 2224 CA PHE A 139 11.369 -1.251 -2.238 1.00 0.00 C ATOM 2225 C PHE A 139 10.168 -0.602 -2.918 1.00 0.00 C ATOM 2226 O PHE A 139 9.622 -1.140 -3.882 1.00 0.00 O ATOM 2227 CB PHE A 139 12.624 -1.047 -3.090 1.00 0.00 C ATOM 2228 CG PHE A 139 13.208 0.333 -2.978 1.00 0.00 C ATOM 2229 CD1 PHE A 139 12.493 1.439 -3.410 1.00 0.00 C ATOM 2230 CD2 PHE A 139 14.471 0.524 -2.440 1.00 0.00 C ATOM 2231 CE1 PHE A 139 13.028 2.710 -3.309 1.00 0.00 C ATOM 2232 CE2 PHE A 139 15.010 1.792 -2.336 1.00 0.00 C ATOM 2233 CZ PHE A 139 14.287 2.886 -2.771 1.00 0.00 C ATOM 0 H PHE A 139 10.851 -3.190 -2.850 1.00 0.00 H new ATOM 0 HA PHE A 139 11.514 -0.776 -1.268 1.00 0.00 H new ATOM 0 HB2 PHE A 139 13.377 -1.777 -2.793 1.00 0.00 H new ATOM 0 HB3 PHE A 139 12.381 -1.246 -4.134 1.00 0.00 H new ATOM 0 HD1 PHE A 139 11.507 1.307 -3.830 1.00 0.00 H new ATOM 0 HD2 PHE A 139 15.040 -0.328 -2.098 1.00 0.00 H new ATOM 0 HE1 PHE A 139 12.462 3.564 -3.651 1.00 0.00 H new ATOM 0 HE2 PHE A 139 15.995 1.928 -1.915 1.00 0.00 H new ATOM 0 HZ PHE A 139 14.706 3.878 -2.690 1.00 0.00 H new ATOM 2243 N GLN A 140 9.762 0.556 -2.409 1.00 0.00 N ATOM 2244 CA GLN A 140 8.624 1.279 -2.966 1.00 0.00 C ATOM 2245 C GLN A 140 9.007 2.716 -3.304 1.00 0.00 C ATOM 2246 O GLN A 140 9.626 3.410 -2.497 1.00 0.00 O ATOM 2247 CB GLN A 140 7.454 1.268 -1.980 1.00 0.00 C ATOM 2248 CG GLN A 140 6.771 -0.084 -1.863 1.00 0.00 C ATOM 2249 CD GLN A 140 5.844 -0.167 -0.665 1.00 0.00 C ATOM 2250 OE1 GLN A 140 4.543 -0.199 -0.926 1.00 0.00 O flip ATOM 2251 NE2 GLN A 140 6.294 -0.203 0.480 1.00 0.00 N flip ATOM 0 H GLN A 140 10.204 1.014 -1.612 1.00 0.00 H new ATOM 0 HA GLN A 140 8.320 0.777 -3.885 1.00 0.00 H new ATOM 0 HB2 GLN A 140 7.815 1.570 -0.997 1.00 0.00 H new ATOM 0 HB3 GLN A 140 6.720 2.011 -2.292 1.00 0.00 H new ATOM 0 HG2 GLN A 140 6.202 -0.280 -2.772 1.00 0.00 H new ATOM 0 HG3 GLN A 140 7.528 -0.864 -1.787 1.00 0.00 H new ATOM 0 HE21 GLN A 140 7.302 -0.176 0.633 1.00 0.00 H new ATOM 0 HE22 GLN A 140 5.659 -0.260 1.276 1.00 0.00 H new ATOM 2260 N MET A 141 8.632 3.157 -4.501 1.00 0.00 N ATOM 2261 CA MET A 141 8.935 4.513 -4.946 1.00 0.00 C ATOM 2262 C MET A 141 7.654 5.296 -5.214 1.00 0.00 C ATOM 2263 O MET A 141 6.761 4.822 -5.919 1.00 0.00 O ATOM 2264 CB MET A 141 9.798 4.476 -6.209 1.00 0.00 C ATOM 2265 CG MET A 141 10.909 5.513 -6.216 1.00 0.00 C ATOM 2266 SD MET A 141 11.666 5.708 -7.842 1.00 0.00 S ATOM 2267 CE MET A 141 13.294 6.302 -7.388 1.00 0.00 C ATOM 0 H MET A 141 8.118 2.595 -5.180 1.00 0.00 H new ATOM 0 HA MET A 141 9.487 5.015 -4.152 1.00 0.00 H new ATOM 0 HB2 MET A 141 10.238 3.484 -6.310 1.00 0.00 H new ATOM 0 HB3 MET A 141 9.161 4.632 -7.079 1.00 0.00 H new ATOM 0 HG2 MET A 141 10.508 6.472 -5.889 1.00 0.00 H new ATOM 0 HG3 MET A 141 11.674 5.225 -5.495 1.00 0.00 H new ATOM 0 HE1 MET A 141 13.872 6.504 -8.290 1.00 0.00 H new ATOM 0 HE2 MET A 141 13.198 7.218 -6.806 1.00 0.00 H new ATOM 0 HE3 MET A 141 13.804 5.545 -6.792 1.00 0.00 H new ATOM 2277 N THR A 142 7.570 6.495 -4.650 1.00 0.00 N ATOM 2278 CA THR A 142 6.396 7.343 -4.829 1.00 0.00 C ATOM 2279 C THR A 142 6.723 8.545 -5.709 1.00 0.00 C ATOM 2280 O THR A 142 7.526 9.401 -5.337 1.00 0.00 O ATOM 2281 CB THR A 142 5.872 7.818 -3.473 1.00 0.00 C ATOM 2282 OG1 THR A 142 6.044 6.814 -2.489 1.00 0.00 O ATOM 2283 CG2 THR A 142 4.406 8.192 -3.496 1.00 0.00 C ATOM 0 H THR A 142 8.300 6.902 -4.065 1.00 0.00 H new ATOM 0 HA THR A 142 5.624 6.752 -5.322 1.00 0.00 H new ATOM 0 HB THR A 142 6.454 8.708 -3.234 1.00 0.00 H new ATOM 0 HG1 THR A 142 5.704 7.138 -1.629 1.00 0.00 H new ATOM 0 HG21 THR A 142 4.099 8.520 -2.503 1.00 0.00 H new ATOM 0 HG22 THR A 142 4.248 9.000 -4.210 1.00 0.00 H new ATOM 0 HG23 THR A 142 3.814 7.326 -3.791 1.00 0.00 H new ATOM 2291 N TYR A 143 6.093 8.604 -6.878 1.00 0.00 N ATOM 2292 CA TYR A 143 6.315 9.701 -7.812 1.00 0.00 C ATOM 2293 C TYR A 143 5.121 10.649 -7.831 1.00 0.00 C ATOM 2294 O TYR A 143 3.986 10.228 -8.056 1.00 0.00 O ATOM 2295 CB TYR A 143 6.574 9.158 -9.219 1.00 0.00 C ATOM 2296 CG TYR A 143 5.393 8.423 -9.812 1.00 0.00 C ATOM 2297 CD1 TYR A 143 5.157 7.088 -9.508 1.00 0.00 C ATOM 2298 CD2 TYR A 143 4.515 9.064 -10.677 1.00 0.00 C ATOM 2299 CE1 TYR A 143 4.081 6.412 -10.050 1.00 0.00 C ATOM 2300 CE2 TYR A 143 3.435 8.396 -11.222 1.00 0.00 C ATOM 2301 CZ TYR A 143 3.222 7.070 -10.905 1.00 0.00 C ATOM 2302 OH TYR A 143 2.148 6.402 -11.446 1.00 0.00 O ATOM 0 H TYR A 143 5.425 7.904 -7.201 1.00 0.00 H new ATOM 0 HA TYR A 143 7.192 10.257 -7.479 1.00 0.00 H new ATOM 0 HB2 TYR A 143 6.842 9.986 -9.875 1.00 0.00 H new ATOM 0 HB3 TYR A 143 7.431 8.485 -9.188 1.00 0.00 H new ATOM 0 HD1 TYR A 143 5.826 6.570 -8.837 1.00 0.00 H new ATOM 0 HD2 TYR A 143 4.679 10.102 -10.928 1.00 0.00 H new ATOM 0 HE1 TYR A 143 3.913 5.374 -9.805 1.00 0.00 H new ATOM 0 HE2 TYR A 143 2.761 8.909 -11.892 1.00 0.00 H new ATOM 0 HH TYR A 143 1.643 7.010 -12.026 1.00 0.00 H new ATOM 2312 N ILE A 144 5.382 11.929 -7.590 1.00 0.00 N ATOM 2313 CA ILE A 144 4.326 12.935 -7.579 1.00 0.00 C ATOM 2314 C ILE A 144 4.509 13.940 -8.713 1.00 0.00 C ATOM 2315 O ILE A 144 5.201 14.946 -8.557 1.00 0.00 O ATOM 2316 CB ILE A 144 4.290 13.695 -6.239 1.00 0.00 C ATOM 2317 CG1 ILE A 144 4.315 12.709 -5.068 1.00 0.00 C ATOM 2318 CG2 ILE A 144 3.056 14.581 -6.166 1.00 0.00 C ATOM 2319 CD1 ILE A 144 5.705 12.442 -4.533 1.00 0.00 C ATOM 0 H ILE A 144 6.315 12.295 -7.400 1.00 0.00 H new ATOM 0 HA ILE A 144 3.384 12.405 -7.716 1.00 0.00 H new ATOM 0 HB ILE A 144 5.174 14.330 -6.174 1.00 0.00 H new ATOM 0 HG12 ILE A 144 3.693 13.098 -4.262 1.00 0.00 H new ATOM 0 HG13 ILE A 144 3.870 11.767 -5.387 1.00 0.00 H new ATOM 0 HG21 ILE A 144 3.045 15.111 -5.214 1.00 0.00 H new ATOM 0 HG22 ILE A 144 3.077 15.302 -6.983 1.00 0.00 H new ATOM 0 HG23 ILE A 144 2.160 13.965 -6.249 1.00 0.00 H new ATOM 0 HD11 ILE A 144 5.647 11.735 -3.705 1.00 0.00 H new ATOM 0 HD12 ILE A 144 6.325 12.023 -5.325 1.00 0.00 H new ATOM 0 HD13 ILE A 144 6.145 13.375 -4.183 1.00 0.00 H new ATOM 2331 N PRO A 145 3.888 13.680 -9.878 1.00 0.00 N ATOM 2332 CA PRO A 145 3.987 14.570 -11.041 1.00 0.00 C ATOM 2333 C PRO A 145 3.578 16.001 -10.709 1.00 0.00 C ATOM 2334 O PRO A 145 2.460 16.248 -10.259 1.00 0.00 O ATOM 2335 CB PRO A 145 3.012 13.955 -12.049 1.00 0.00 C ATOM 2336 CG PRO A 145 2.898 12.526 -11.648 1.00 0.00 C ATOM 2337 CD PRO A 145 3.043 12.503 -10.152 1.00 0.00 C ATOM 0 HA PRO A 145 5.010 14.643 -11.411 1.00 0.00 H new ATOM 0 HB2 PRO A 145 2.043 14.453 -12.016 1.00 0.00 H new ATOM 0 HB3 PRO A 145 3.385 14.051 -13.069 1.00 0.00 H new ATOM 0 HG2 PRO A 145 1.938 12.110 -11.953 1.00 0.00 H new ATOM 0 HG3 PRO A 145 3.672 11.924 -12.124 1.00 0.00 H new ATOM 0 HD2 PRO A 145 2.077 12.576 -9.653 1.00 0.00 H new ATOM 0 HD3 PRO A 145 3.512 11.581 -9.807 1.00 0.00 H new ATOM 2422 N ASN A 152 8.022 16.250 -10.353 1.00 0.00 N ATOM 2423 CA ASN A 152 8.548 14.939 -10.714 1.00 0.00 C ATOM 2424 C ASN A 152 9.595 14.475 -9.705 1.00 0.00 C ATOM 2425 O ASN A 152 10.763 14.284 -10.049 1.00 0.00 O ATOM 2426 CB ASN A 152 9.151 14.974 -12.120 1.00 0.00 C ATOM 2427 CG ASN A 152 8.149 14.586 -13.189 1.00 0.00 C ATOM 2428 OD1 ASN A 152 7.847 15.372 -14.087 1.00 0.00 O ATOM 2429 ND2 ASN A 152 7.628 13.368 -13.097 1.00 0.00 N ATOM 0 HA ASN A 152 7.721 14.229 -10.702 1.00 0.00 H new ATOM 0 HB2 ASN A 152 9.528 15.976 -12.326 1.00 0.00 H new ATOM 0 HB3 ASN A 152 10.004 14.297 -12.163 1.00 0.00 H new ATOM 0 HD21 ASN A 152 6.948 13.051 -13.788 1.00 0.00 H new ATOM 0 HD22 ASN A 152 7.908 12.750 -12.335 1.00 0.00 H new ATOM 2436 N VAL A 153 9.170 14.295 -8.459 1.00 0.00 N ATOM 2437 CA VAL A 153 10.068 13.852 -7.401 1.00 0.00 C ATOM 2438 C VAL A 153 9.764 12.414 -6.994 1.00 0.00 C ATOM 2439 O VAL A 153 8.663 11.913 -7.223 1.00 0.00 O ATOM 2440 CB VAL A 153 9.971 14.764 -6.162 1.00 0.00 C ATOM 2441 CG1 VAL A 153 8.564 14.737 -5.584 1.00 0.00 C ATOM 2442 CG2 VAL A 153 10.995 14.354 -5.113 1.00 0.00 C ATOM 0 H VAL A 153 8.208 14.450 -8.158 1.00 0.00 H new ATOM 0 HA VAL A 153 11.082 13.906 -7.798 1.00 0.00 H new ATOM 0 HB VAL A 153 10.191 15.786 -6.471 1.00 0.00 H new ATOM 0 HG11 VAL A 153 8.517 15.387 -4.710 1.00 0.00 H new ATOM 0 HG12 VAL A 153 7.855 15.086 -6.335 1.00 0.00 H new ATOM 0 HG13 VAL A 153 8.310 13.718 -5.292 1.00 0.00 H new ATOM 0 HG21 VAL A 153 10.911 15.010 -4.246 1.00 0.00 H new ATOM 0 HG22 VAL A 153 10.811 13.324 -4.808 1.00 0.00 H new ATOM 0 HG23 VAL A 153 11.998 14.434 -5.532 1.00 0.00 H new ATOM 2452 N TYR A 154 10.746 11.753 -6.389 1.00 0.00 N ATOM 2453 CA TYR A 154 10.580 10.372 -5.951 1.00 0.00 C ATOM 2454 C TYR A 154 11.017 10.203 -4.500 1.00 0.00 C ATOM 2455 O TYR A 154 11.946 10.866 -4.039 1.00 0.00 O ATOM 2456 CB TYR A 154 11.382 9.431 -6.852 1.00 0.00 C ATOM 2457 CG TYR A 154 11.115 9.629 -8.326 1.00 0.00 C ATOM 2458 CD1 TYR A 154 9.870 9.344 -8.871 1.00 0.00 C ATOM 2459 CD2 TYR A 154 12.109 10.104 -9.174 1.00 0.00 C ATOM 2460 CE1 TYR A 154 9.622 9.524 -10.219 1.00 0.00 C ATOM 2461 CE2 TYR A 154 11.868 10.287 -10.523 1.00 0.00 C ATOM 2462 CZ TYR A 154 10.623 9.996 -11.039 1.00 0.00 C ATOM 2463 OH TYR A 154 10.381 10.178 -12.381 1.00 0.00 O ATOM 0 H TYR A 154 11.664 12.151 -6.191 1.00 0.00 H new ATOM 0 HA TYR A 154 9.522 10.119 -6.022 1.00 0.00 H new ATOM 0 HB2 TYR A 154 12.445 9.578 -6.661 1.00 0.00 H new ATOM 0 HB3 TYR A 154 11.149 8.400 -6.585 1.00 0.00 H new ATOM 0 HD1 TYR A 154 9.082 8.975 -8.231 1.00 0.00 H new ATOM 0 HD2 TYR A 154 13.085 10.334 -8.773 1.00 0.00 H new ATOM 0 HE1 TYR A 154 8.648 9.296 -10.627 1.00 0.00 H new ATOM 0 HE2 TYR A 154 12.651 10.656 -11.169 1.00 0.00 H new ATOM 0 HH TYR A 154 11.191 10.517 -12.816 1.00 0.00 H new ATOM 2473 N PHE A 155 10.342 9.309 -3.785 1.00 0.00 N ATOM 2474 CA PHE A 155 10.660 9.049 -2.385 1.00 0.00 C ATOM 2475 C PHE A 155 10.921 7.564 -2.155 1.00 0.00 C ATOM 2476 O PHE A 155 10.163 6.712 -2.616 1.00 0.00 O ATOM 2477 CB PHE A 155 9.519 9.525 -1.485 1.00 0.00 C ATOM 2478 CG PHE A 155 9.628 10.970 -1.087 1.00 0.00 C ATOM 2479 CD1 PHE A 155 10.581 11.378 -0.167 1.00 0.00 C ATOM 2480 CD2 PHE A 155 8.779 11.919 -1.633 1.00 0.00 C ATOM 2481 CE1 PHE A 155 10.684 12.706 0.201 1.00 0.00 C ATOM 2482 CE2 PHE A 155 8.878 13.248 -1.268 1.00 0.00 C ATOM 2483 CZ PHE A 155 9.832 13.642 -0.351 1.00 0.00 C ATOM 0 H PHE A 155 9.571 8.752 -4.152 1.00 0.00 H new ATOM 0 HA PHE A 155 11.565 9.602 -2.134 1.00 0.00 H new ATOM 0 HB2 PHE A 155 8.572 9.370 -2.001 1.00 0.00 H new ATOM 0 HB3 PHE A 155 9.496 8.910 -0.585 1.00 0.00 H new ATOM 0 HD1 PHE A 155 11.250 10.650 0.267 1.00 0.00 H new ATOM 0 HD2 PHE A 155 8.032 11.617 -2.352 1.00 0.00 H new ATOM 0 HE1 PHE A 155 11.430 13.011 0.920 1.00 0.00 H new ATOM 0 HE2 PHE A 155 8.210 13.978 -1.700 1.00 0.00 H new ATOM 0 HZ PHE A 155 9.912 14.681 -0.066 1.00 0.00 H new ATOM 2493 N ALA A 156 11.998 7.263 -1.436 1.00 0.00 N ATOM 2494 CA ALA A 156 12.358 5.881 -1.144 1.00 0.00 C ATOM 2495 C ALA A 156 11.740 5.418 0.170 1.00 0.00 C ATOM 2496 O ALA A 156 11.721 6.158 1.154 1.00 0.00 O ATOM 2497 CB ALA A 156 13.871 5.728 -1.099 1.00 0.00 C ATOM 0 H ALA A 156 12.635 7.957 -1.046 1.00 0.00 H new ATOM 0 HA ALA A 156 11.963 5.253 -1.943 1.00 0.00 H new ATOM 0 HB1 ALA A 156 14.125 4.691 -0.880 1.00 0.00 H new ATOM 0 HB2 ALA A 156 14.294 6.010 -2.063 1.00 0.00 H new ATOM 0 HB3 ALA A 156 14.279 6.374 -0.321 1.00 0.00 H new ATOM 2503 N TRP A 157 11.234 4.190 0.180 1.00 0.00 N ATOM 2504 CA TRP A 157 10.614 3.627 1.374 1.00 0.00 C ATOM 2505 C TRP A 157 10.951 2.147 1.516 1.00 0.00 C ATOM 2506 O TRP A 157 10.592 1.333 0.665 1.00 0.00 O ATOM 2507 CB TRP A 157 9.097 3.814 1.322 1.00 0.00 C ATOM 2508 CG TRP A 157 8.681 5.201 0.936 1.00 0.00 C ATOM 2509 CD1 TRP A 157 8.451 5.667 -0.326 1.00 0.00 C ATOM 2510 CD2 TRP A 157 8.448 6.303 1.820 1.00 0.00 C ATOM 2511 NE1 TRP A 157 8.089 6.991 -0.281 1.00 0.00 N ATOM 2512 CE2 TRP A 157 8.079 7.404 1.025 1.00 0.00 C ATOM 2513 CE3 TRP A 157 8.513 6.465 3.207 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 7.777 8.650 1.572 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 8.214 7.702 3.748 1.00 0.00 C ATOM 2516 CH2 TRP A 157 7.849 8.780 2.932 1.00 0.00 C ATOM 0 H TRP A 157 11.241 3.565 -0.626 1.00 0.00 H new ATOM 0 HA TRP A 157 11.009 4.155 2.242 1.00 0.00 H new ATOM 0 HB2 TRP A 157 8.675 3.105 0.610 1.00 0.00 H new ATOM 0 HB3 TRP A 157 8.675 3.575 2.298 1.00 0.00 H new ATOM 0 HD1 TRP A 157 8.541 5.080 -1.228 1.00 0.00 H new ATOM 0 HE1 TRP A 157 7.864 7.572 -1.089 1.00 0.00 H new ATOM 0 HE3 TRP A 157 8.792 5.639 3.845 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 7.496 9.483 0.945 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 8.263 7.839 4.818 1.00 0.00 H new ATOM 0 HH2 TRP A 157 7.620 9.733 3.385 1.00 0.00 H new ATOM 2527 N MET A 158 11.644 1.805 2.597 1.00 0.00 N ATOM 2528 CA MET A 158 12.030 0.422 2.852 1.00 0.00 C ATOM 2529 C MET A 158 10.888 -0.350 3.508 1.00 0.00 C ATOM 2530 O MET A 158 10.333 0.083 4.518 1.00 0.00 O ATOM 2531 CB MET A 158 13.275 0.373 3.741 1.00 0.00 C ATOM 2532 CG MET A 158 14.561 0.113 2.973 1.00 0.00 C ATOM 2533 SD MET A 158 14.763 -1.620 2.522 1.00 0.00 S ATOM 2534 CE MET A 158 16.350 -1.983 3.267 1.00 0.00 C ATOM 0 H MET A 158 11.950 2.467 3.311 1.00 0.00 H new ATOM 0 HA MET A 158 12.258 -0.048 1.895 1.00 0.00 H new ATOM 0 HB2 MET A 158 13.366 1.318 4.277 1.00 0.00 H new ATOM 0 HB3 MET A 158 13.145 -0.407 4.491 1.00 0.00 H new ATOM 0 HG2 MET A 158 14.569 0.723 2.070 1.00 0.00 H new ATOM 0 HG3 MET A 158 15.411 0.428 3.578 1.00 0.00 H new ATOM 0 HE1 MET A 158 16.613 -3.023 3.074 1.00 0.00 H new ATOM 0 HE2 MET A 158 17.111 -1.330 2.839 1.00 0.00 H new ATOM 0 HE3 MET A 158 16.293 -1.817 4.343 1.00 0.00 H new ATOM 2544 N ARG A 159 10.545 -1.495 2.927 1.00 0.00 N ATOM 2545 CA ARG A 159 9.470 -2.328 3.456 1.00 0.00 C ATOM 2546 C ARG A 159 10.000 -3.694 3.878 1.00 0.00 C ATOM 2547 O ARG A 159 10.399 -4.503 3.039 1.00 0.00 O ATOM 2548 CB ARG A 159 8.367 -2.496 2.410 1.00 0.00 C ATOM 2549 CG ARG A 159 7.085 -3.094 2.968 1.00 0.00 C ATOM 2550 CD ARG A 159 7.004 -4.589 2.704 1.00 0.00 C ATOM 2551 NE ARG A 159 5.721 -4.973 2.120 1.00 0.00 N ATOM 2552 CZ ARG A 159 5.514 -6.118 1.474 1.00 0.00 C ATOM 2553 NH1 ARG A 159 6.501 -6.995 1.328 1.00 0.00 N ATOM 2554 NH2 ARG A 159 4.317 -6.390 0.973 1.00 0.00 N ATOM 0 H ARG A 159 10.995 -1.867 2.091 1.00 0.00 H new ATOM 0 HA ARG A 159 9.056 -1.832 4.334 1.00 0.00 H new ATOM 0 HB2 ARG A 159 8.143 -1.524 1.971 1.00 0.00 H new ATOM 0 HB3 ARG A 159 8.735 -3.133 1.605 1.00 0.00 H new ATOM 0 HG2 ARG A 159 7.034 -2.910 4.041 1.00 0.00 H new ATOM 0 HG3 ARG A 159 6.225 -2.597 2.518 1.00 0.00 H new ATOM 0 HD2 ARG A 159 7.811 -4.883 2.032 1.00 0.00 H new ATOM 0 HD3 ARG A 159 7.154 -5.131 3.638 1.00 0.00 H new ATOM 0 HE ARG A 159 4.938 -4.326 2.213 1.00 0.00 H new ATOM 0 HH11 ARG A 159 7.424 -6.793 1.712 1.00 0.00 H new ATOM 0 HH12 ARG A 159 6.336 -7.871 0.832 1.00 0.00 H new ATOM 0 HH21 ARG A 159 3.554 -5.722 1.083 1.00 0.00 H new ATOM 0 HH22 ARG A 159 4.159 -7.268 0.478 1.00 0.00 H new ATOM 2568 N PHE A 160 10.004 -3.944 5.183 1.00 0.00 N ATOM 2569 CA PHE A 160 10.486 -5.212 5.718 1.00 0.00 C ATOM 2570 C PHE A 160 9.329 -6.049 6.258 1.00 0.00 C ATOM 2571 O PHE A 160 8.348 -5.512 6.770 1.00 0.00 O ATOM 2572 CB PHE A 160 11.516 -4.964 6.823 1.00 0.00 C ATOM 2573 CG PHE A 160 12.779 -5.758 6.652 1.00 0.00 C ATOM 2574 CD1 PHE A 160 13.832 -5.255 5.905 1.00 0.00 C ATOM 2575 CD2 PHE A 160 12.915 -7.005 7.240 1.00 0.00 C ATOM 2576 CE1 PHE A 160 14.997 -5.982 5.746 1.00 0.00 C ATOM 2577 CE2 PHE A 160 14.077 -7.737 7.085 1.00 0.00 C ATOM 2578 CZ PHE A 160 15.119 -7.225 6.337 1.00 0.00 C ATOM 0 H PHE A 160 9.679 -3.285 5.890 1.00 0.00 H new ATOM 0 HA PHE A 160 10.961 -5.765 4.908 1.00 0.00 H new ATOM 0 HB2 PHE A 160 11.764 -3.903 6.847 1.00 0.00 H new ATOM 0 HB3 PHE A 160 11.070 -5.209 7.787 1.00 0.00 H new ATOM 0 HD1 PHE A 160 13.742 -4.284 5.442 1.00 0.00 H new ATOM 0 HD2 PHE A 160 12.103 -7.410 7.826 1.00 0.00 H new ATOM 0 HE1 PHE A 160 15.810 -5.579 5.161 1.00 0.00 H new ATOM 0 HE2 PHE A 160 14.170 -8.708 7.548 1.00 0.00 H new ATOM 0 HZ PHE A 160 16.028 -7.795 6.214 1.00 0.00 H new ATOM 2588 N GLN A 161 9.455 -7.367 6.139 1.00 0.00 N ATOM 2589 CA GLN A 161 8.420 -8.279 6.615 1.00 0.00 C ATOM 2590 C GLN A 161 8.923 -9.104 7.795 1.00 0.00 C ATOM 2591 O GLN A 161 10.055 -9.586 7.791 1.00 0.00 O ATOM 2592 CB GLN A 161 7.970 -9.205 5.484 1.00 0.00 C ATOM 2593 CG GLN A 161 9.068 -10.128 4.980 1.00 0.00 C ATOM 2594 CD GLN A 161 8.718 -10.781 3.657 1.00 0.00 C ATOM 2595 OE1 GLN A 161 8.142 -11.867 3.621 1.00 0.00 O ATOM 2596 NE2 GLN A 161 9.067 -10.119 2.559 1.00 0.00 N ATOM 0 H GLN A 161 10.262 -7.827 5.718 1.00 0.00 H new ATOM 0 HA GLN A 161 7.570 -7.684 6.948 1.00 0.00 H new ATOM 0 HB2 GLN A 161 7.131 -9.808 5.831 1.00 0.00 H new ATOM 0 HB3 GLN A 161 7.606 -8.600 4.654 1.00 0.00 H new ATOM 0 HG2 GLN A 161 9.992 -9.560 4.868 1.00 0.00 H new ATOM 0 HG3 GLN A 161 9.257 -10.902 5.724 1.00 0.00 H new ATOM 0 HE21 GLN A 161 9.544 -9.220 2.635 1.00 0.00 H new ATOM 0 HE22 GLN A 161 8.858 -10.509 1.640 1.00 0.00 H new ATOM 2605 N PHE A 162 8.072 -9.262 8.804 1.00 0.00 N ATOM 2606 CA PHE A 162 8.429 -10.030 9.992 1.00 0.00 C ATOM 2607 C PHE A 162 7.365 -11.078 10.303 1.00 0.00 C ATOM 2608 O PHE A 162 6.323 -11.132 9.649 1.00 0.00 O ATOM 2609 CB PHE A 162 8.608 -9.098 11.192 1.00 0.00 C ATOM 2610 CG PHE A 162 9.605 -7.999 10.955 1.00 0.00 C ATOM 2611 CD1 PHE A 162 9.254 -6.871 10.233 1.00 0.00 C ATOM 2612 CD2 PHE A 162 10.894 -8.096 11.456 1.00 0.00 C ATOM 2613 CE1 PHE A 162 10.169 -5.859 10.015 1.00 0.00 C ATOM 2614 CE2 PHE A 162 11.813 -7.088 11.241 1.00 0.00 C ATOM 2615 CZ PHE A 162 11.451 -5.967 10.519 1.00 0.00 C ATOM 0 H PHE A 162 7.131 -8.869 8.823 1.00 0.00 H new ATOM 0 HA PHE A 162 9.371 -10.542 9.793 1.00 0.00 H new ATOM 0 HB2 PHE A 162 7.645 -8.655 11.445 1.00 0.00 H new ATOM 0 HB3 PHE A 162 8.925 -9.685 12.054 1.00 0.00 H new ATOM 0 HD1 PHE A 162 8.254 -6.781 9.836 1.00 0.00 H new ATOM 0 HD2 PHE A 162 11.183 -8.970 12.021 1.00 0.00 H new ATOM 0 HE1 PHE A 162 9.882 -4.984 9.451 1.00 0.00 H new ATOM 0 HE2 PHE A 162 12.814 -7.176 11.637 1.00 0.00 H new ATOM 0 HZ PHE A 162 12.168 -5.177 10.349 1.00 0.00 H new ATOM 2625 N LEU A 163 7.635 -11.908 11.304 1.00 0.00 N ATOM 2626 CA LEU A 163 6.700 -12.956 11.703 1.00 0.00 C ATOM 2627 C LEU A 163 6.243 -12.756 13.145 1.00 0.00 C ATOM 2628 O LEU A 163 6.949 -12.154 13.953 1.00 0.00 O ATOM 2629 CB LEU A 163 7.349 -14.334 11.542 1.00 0.00 C ATOM 2630 CG LEU A 163 6.737 -15.213 10.450 1.00 0.00 C ATOM 2631 CD1 LEU A 163 7.403 -14.943 9.110 1.00 0.00 C ATOM 2632 CD2 LEU A 163 6.859 -16.684 10.821 1.00 0.00 C ATOM 0 H LEU A 163 8.493 -11.876 11.855 1.00 0.00 H new ATOM 0 HA LEU A 163 5.826 -12.898 11.055 1.00 0.00 H new ATOM 0 HB2 LEU A 163 8.409 -14.197 11.326 1.00 0.00 H new ATOM 0 HB3 LEU A 163 7.283 -14.863 12.493 1.00 0.00 H new ATOM 0 HG LEU A 163 5.679 -14.966 10.362 1.00 0.00 H new ATOM 0 HD11 LEU A 163 6.954 -15.578 8.346 1.00 0.00 H new ATOM 0 HD12 LEU A 163 7.265 -13.896 8.839 1.00 0.00 H new ATOM 0 HD13 LEU A 163 8.468 -15.161 9.183 1.00 0.00 H new ATOM 0 HD21 LEU A 163 6.419 -17.296 10.033 1.00 0.00 H new ATOM 0 HD22 LEU A 163 7.911 -16.944 10.937 1.00 0.00 H new ATOM 0 HD23 LEU A 163 6.335 -16.867 11.759 1.00 0.00 H new