USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 680 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 161 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 8 TYR OH : rot 71:sc= 2.05 USER MOD Set 2.2: A 44 GLN : amide:sc= 1.12 K(o=7.7,f=6.7) USER MOD Set 2.3: A 82 LYS NZ :NH3+ 166:sc= 3.37 (180deg=2.26) USER MOD Set 2.4: A 94 TYR OH : rot -2:sc= 1.17 USER MOD Single : A 5 ASN : amide:sc=-0.00407 X(o=-0.0041,f=-0.0079) USER MOD Single : A 6 THR OG1 : rot -3:sc= 0.517 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 177:sc= 1.22 (180deg=1.13) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.652 K(o=-0.65,f=-2.5!) USER MOD Single : A 80 THR OG1 : rot 68:sc= 1.06 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 34:sc= 0.176 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 85:sc= 1.28 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= 1.21 K(o=1.2,f=-0.38) USER MOD Single : A 163 SER OG : rot -140:sc= 0.99 USER MOD Single : A 167 SER OG : rot -160:sc= 0 USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 59 N ASN A 5 -14.188 -15.607 -3.547 1.00 0.00 N ATOM 60 CA ASN A 5 -13.599 -14.274 -3.488 1.00 0.00 C ATOM 61 C ASN A 5 -12.561 -14.193 -2.352 1.00 0.00 C ATOM 62 O ASN A 5 -12.253 -15.183 -1.687 1.00 0.00 O ATOM 63 CB ASN A 5 -14.724 -13.224 -3.360 1.00 0.00 C ATOM 64 CG ASN A 5 -15.133 -12.911 -1.922 1.00 0.00 C ATOM 65 OD1 ASN A 5 -14.803 -11.846 -1.409 1.00 0.00 O ATOM 66 ND2 ASN A 5 -15.832 -13.808 -1.240 1.00 0.00 N ATOM 0 HA ASN A 5 -13.057 -14.060 -4.409 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -14.400 -12.302 -3.842 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -15.599 -13.578 -3.905 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -16.103 -13.617 -0.275 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -16.099 -14.689 -1.680 1.00 0.00 H new ATOM 73 N THR A 6 -11.958 -13.027 -2.117 1.00 0.00 N ATOM 74 CA THR A 6 -11.047 -12.833 -0.992 1.00 0.00 C ATOM 75 C THR A 6 -11.206 -11.407 -0.468 1.00 0.00 C ATOM 76 O THR A 6 -10.929 -10.437 -1.178 1.00 0.00 O ATOM 77 CB THR A 6 -9.617 -13.200 -1.419 1.00 0.00 C ATOM 78 OG1 THR A 6 -9.596 -14.563 -1.804 1.00 0.00 O ATOM 79 CG2 THR A 6 -8.596 -13.020 -0.292 1.00 0.00 C ATOM 0 H THR A 6 -12.087 -12.198 -2.697 1.00 0.00 H new ATOM 0 HA THR A 6 -11.286 -13.496 -0.160 1.00 0.00 H new ATOM 0 HB THR A 6 -9.343 -12.533 -2.236 1.00 0.00 H new ATOM 0 HG1 THR A 6 -10.483 -14.956 -1.665 1.00 0.00 H new ATOM 0 HG21 THR A 6 -7.604 -13.294 -0.652 1.00 0.00 H new ATOM 0 HG22 THR A 6 -8.590 -11.979 0.030 1.00 0.00 H new ATOM 0 HG23 THR A 6 -8.866 -13.659 0.549 1.00 0.00 H new ATOM 87 N TRP A 7 -11.683 -11.294 0.776 1.00 0.00 N ATOM 88 CA TRP A 7 -12.072 -10.055 1.427 1.00 0.00 C ATOM 89 C TRP A 7 -11.129 -9.801 2.600 1.00 0.00 C ATOM 90 O TRP A 7 -10.863 -10.717 3.379 1.00 0.00 O ATOM 91 CB TRP A 7 -13.541 -10.146 1.863 1.00 0.00 C ATOM 92 CG TRP A 7 -13.905 -11.236 2.833 1.00 0.00 C ATOM 93 CD1 TRP A 7 -14.138 -11.059 4.154 1.00 0.00 C ATOM 94 CD2 TRP A 7 -14.093 -12.666 2.589 1.00 0.00 C ATOM 95 NE1 TRP A 7 -14.465 -12.267 4.738 1.00 0.00 N ATOM 96 CE2 TRP A 7 -14.465 -13.292 3.816 1.00 0.00 C ATOM 97 CE3 TRP A 7 -13.985 -13.502 1.457 1.00 0.00 C ATOM 98 CZ2 TRP A 7 -14.736 -14.668 3.907 1.00 0.00 C ATOM 99 CZ3 TRP A 7 -14.233 -14.884 1.537 1.00 0.00 C ATOM 100 CH2 TRP A 7 -14.615 -15.467 2.758 1.00 0.00 C ATOM 0 H TRP A 7 -11.811 -12.107 1.378 1.00 0.00 H new ATOM 0 HA TRP A 7 -11.991 -9.211 0.743 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -13.821 -9.191 2.308 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -14.151 -10.272 0.969 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -14.077 -10.114 4.674 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -14.680 -12.386 5.728 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -13.705 -13.070 0.507 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -15.034 -15.106 4.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -14.130 -15.500 0.656 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -14.815 -16.527 2.812 1.00 0.00 H new ATOM 111 N TYR A 8 -10.594 -8.579 2.699 1.00 0.00 N ATOM 112 CA TYR A 8 -9.534 -8.222 3.634 1.00 0.00 C ATOM 113 C TYR A 8 -9.870 -6.950 4.412 1.00 0.00 C ATOM 114 O TYR A 8 -10.624 -6.105 3.926 1.00 0.00 O ATOM 115 CB TYR A 8 -8.143 -8.131 2.951 1.00 0.00 C ATOM 116 CG TYR A 8 -8.016 -7.588 1.531 1.00 0.00 C ATOM 117 CD1 TYR A 8 -8.581 -8.284 0.442 1.00 0.00 C ATOM 118 CD2 TYR A 8 -7.224 -6.449 1.280 1.00 0.00 C ATOM 119 CE1 TYR A 8 -8.440 -7.803 -0.870 1.00 0.00 C ATOM 120 CE2 TYR A 8 -7.040 -5.982 -0.035 1.00 0.00 C ATOM 121 CZ TYR A 8 -7.673 -6.642 -1.113 1.00 0.00 C ATOM 122 OH TYR A 8 -7.582 -6.129 -2.372 1.00 0.00 O ATOM 0 H TYR A 8 -10.896 -7.798 2.117 1.00 0.00 H new ATOM 0 HA TYR A 8 -9.470 -9.036 4.356 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -7.510 -7.515 3.590 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -7.717 -9.134 2.952 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -9.129 -9.198 0.619 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -6.755 -5.931 2.103 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -8.916 -8.319 -1.690 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -6.416 -5.120 -0.220 1.00 0.00 H new ATOM 0 HH TYR A 8 -8.442 -5.735 -2.628 1.00 0.00 H new ATOM 132 N THR A 9 -9.256 -6.817 5.594 1.00 0.00 N ATOM 133 CA THR A 9 -9.369 -5.695 6.528 1.00 0.00 C ATOM 134 C THR A 9 -7.986 -5.473 7.158 1.00 0.00 C ATOM 135 O THR A 9 -7.255 -6.441 7.382 1.00 0.00 O ATOM 136 CB THR A 9 -10.424 -6.024 7.604 1.00 0.00 C ATOM 137 OG1 THR A 9 -11.650 -6.393 7.005 1.00 0.00 O ATOM 138 CG2 THR A 9 -10.707 -4.838 8.534 1.00 0.00 C ATOM 0 H THR A 9 -8.626 -7.539 5.944 1.00 0.00 H new ATOM 0 HA THR A 9 -9.688 -4.787 6.017 1.00 0.00 H new ATOM 0 HB THR A 9 -10.008 -6.845 8.187 1.00 0.00 H new ATOM 0 HG1 THR A 9 -12.306 -6.600 7.703 1.00 0.00 H new ATOM 0 HG21 THR A 9 -11.456 -5.125 9.272 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.788 -4.548 9.044 1.00 0.00 H new ATOM 0 HG23 THR A 9 -11.078 -3.997 7.948 1.00 0.00 H new ATOM 146 N GLY A 10 -7.602 -4.224 7.443 1.00 0.00 N ATOM 147 CA GLY A 10 -6.243 -3.884 7.837 1.00 0.00 C ATOM 148 C GLY A 10 -6.058 -2.406 8.175 1.00 0.00 C ATOM 149 O GLY A 10 -7.030 -1.702 8.457 1.00 0.00 O ATOM 0 H GLY A 10 -8.232 -3.423 7.405 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -5.963 -4.484 8.703 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -5.561 -4.152 7.030 1.00 0.00 H new ATOM 153 N ALA A 11 -4.804 -1.937 8.129 1.00 0.00 N ATOM 154 CA ALA A 11 -4.422 -0.542 8.349 1.00 0.00 C ATOM 155 C ALA A 11 -3.423 -0.081 7.282 1.00 0.00 C ATOM 156 O ALA A 11 -2.754 -0.916 6.666 1.00 0.00 O ATOM 157 CB ALA A 11 -3.845 -0.383 9.759 1.00 0.00 C ATOM 0 H ALA A 11 -4.005 -2.539 7.931 1.00 0.00 H new ATOM 0 HA ALA A 11 -5.306 0.090 8.264 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.561 0.657 9.921 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -4.596 -0.673 10.494 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -2.967 -1.020 9.867 1.00 0.00 H new ATOM 163 N LYS A 12 -3.329 1.241 7.065 1.00 0.00 N ATOM 164 CA LYS A 12 -2.504 1.843 6.013 1.00 0.00 C ATOM 165 C LYS A 12 -1.939 3.207 6.411 1.00 0.00 C ATOM 166 O LYS A 12 -2.433 3.845 7.345 1.00 0.00 O ATOM 167 CB LYS A 12 -3.286 1.904 4.680 1.00 0.00 C ATOM 168 CG LYS A 12 -4.653 2.618 4.701 1.00 0.00 C ATOM 169 CD LYS A 12 -4.591 4.149 4.627 1.00 0.00 C ATOM 170 CE LYS A 12 -6.013 4.710 4.499 1.00 0.00 C ATOM 171 NZ LYS A 12 -6.027 6.187 4.456 1.00 0.00 N ATOM 0 H LYS A 12 -3.833 1.929 7.625 1.00 0.00 H new ATOM 0 HA LYS A 12 -1.638 1.197 5.869 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -2.657 2.399 3.941 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.443 0.883 4.332 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -5.248 2.253 3.864 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -5.179 2.335 5.613 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.110 4.548 5.520 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.988 4.459 3.774 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -6.477 4.317 3.594 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -6.615 4.367 5.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -7.002 6.521 4.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -5.655 6.564 5.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -5.433 6.517 3.668 1.00 0.00 H new ATOM 185 N LEU A 13 -0.924 3.654 5.661 1.00 0.00 N ATOM 186 CA LEU A 13 -0.309 4.978 5.694 1.00 0.00 C ATOM 187 C LEU A 13 0.032 5.416 4.265 1.00 0.00 C ATOM 188 O LEU A 13 0.045 4.590 3.354 1.00 0.00 O ATOM 189 CB LEU A 13 0.964 4.998 6.569 1.00 0.00 C ATOM 190 CG LEU A 13 0.721 4.825 8.085 1.00 0.00 C ATOM 191 CD1 LEU A 13 0.904 3.368 8.536 1.00 0.00 C ATOM 192 CD2 LEU A 13 1.688 5.705 8.888 1.00 0.00 C ATOM 0 H LEU A 13 -0.482 3.052 4.966 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.023 5.672 6.137 1.00 0.00 H new ATOM 0 HB2 LEU A 13 1.631 4.205 6.231 1.00 0.00 H new ATOM 0 HB3 LEU A 13 1.483 5.942 6.406 1.00 0.00 H new ATOM 0 HG LEU A 13 -0.310 5.124 8.272 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.723 3.294 9.608 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.197 2.731 8.004 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.921 3.044 8.316 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.503 5.571 9.954 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.715 5.420 8.659 1.00 0.00 H new ATOM 0 HD23 LEU A 13 1.534 6.751 8.622 1.00 0.00 H new ATOM 204 N GLY A 14 0.330 6.707 4.070 1.00 0.00 N ATOM 205 CA GLY A 14 0.860 7.245 2.819 1.00 0.00 C ATOM 206 C GLY A 14 1.769 8.448 3.047 1.00 0.00 C ATOM 207 O GLY A 14 1.842 8.946 4.172 1.00 0.00 O ATOM 0 H GLY A 14 0.206 7.416 4.793 1.00 0.00 H new ATOM 0 HA2 GLY A 14 1.416 6.466 2.297 1.00 0.00 H new ATOM 0 HA3 GLY A 14 0.033 7.535 2.171 1.00 0.00 H new ATOM 211 N PHE A 15 2.457 8.909 1.991 1.00 0.00 N ATOM 212 CA PHE A 15 3.413 10.017 2.061 1.00 0.00 C ATOM 213 C PHE A 15 3.646 10.668 0.687 1.00 0.00 C ATOM 214 O PHE A 15 3.599 9.982 -0.336 1.00 0.00 O ATOM 215 CB PHE A 15 4.735 9.480 2.639 1.00 0.00 C ATOM 216 CG PHE A 15 5.863 10.487 2.761 1.00 0.00 C ATOM 217 CD1 PHE A 15 5.829 11.463 3.773 1.00 0.00 C ATOM 218 CD2 PHE A 15 6.969 10.424 1.890 1.00 0.00 C ATOM 219 CE1 PHE A 15 6.896 12.365 3.921 1.00 0.00 C ATOM 220 CE2 PHE A 15 8.039 11.323 2.044 1.00 0.00 C ATOM 221 CZ PHE A 15 8.003 12.294 3.059 1.00 0.00 C ATOM 0 H PHE A 15 2.361 8.516 1.055 1.00 0.00 H new ATOM 0 HA PHE A 15 3.005 10.795 2.706 1.00 0.00 H new ATOM 0 HB2 PHE A 15 4.535 9.066 3.627 1.00 0.00 H new ATOM 0 HB3 PHE A 15 5.075 8.657 2.011 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.980 11.519 4.438 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.995 9.684 1.103 1.00 0.00 H new ATOM 0 HE1 PHE A 15 6.865 13.114 4.699 1.00 0.00 H new ATOM 0 HE2 PHE A 15 8.890 11.267 1.381 1.00 0.00 H new ATOM 0 HZ PHE A 15 8.825 12.985 3.176 1.00 0.00 H new ATOM 231 N SER A 16 3.956 11.972 0.674 1.00 0.00 N ATOM 232 CA SER A 16 4.553 12.709 -0.441 1.00 0.00 C ATOM 233 C SER A 16 5.367 13.872 0.134 1.00 0.00 C ATOM 234 O SER A 16 4.960 14.485 1.121 1.00 0.00 O ATOM 235 CB SER A 16 3.457 13.267 -1.362 1.00 0.00 C ATOM 236 OG SER A 16 3.993 13.964 -2.480 1.00 0.00 O ATOM 0 H SER A 16 3.787 12.569 1.484 1.00 0.00 H new ATOM 0 HA SER A 16 5.189 12.041 -1.021 1.00 0.00 H new ATOM 0 HB2 SER A 16 2.830 12.448 -1.714 1.00 0.00 H new ATOM 0 HB3 SER A 16 2.814 13.938 -0.792 1.00 0.00 H new ATOM 0 HG SER A 16 3.261 14.299 -3.038 1.00 0.00 H new ATOM 509 N LEU A 35 1.860 13.385 4.971 1.00 0.00 N ATOM 510 CA LEU A 35 1.655 11.981 5.276 1.00 0.00 C ATOM 511 C LEU A 35 0.157 11.725 5.400 1.00 0.00 C ATOM 512 O LEU A 35 -0.628 12.663 5.562 1.00 0.00 O ATOM 513 CB LEU A 35 2.485 11.538 6.502 1.00 0.00 C ATOM 514 CG LEU A 35 2.060 11.958 7.930 1.00 0.00 C ATOM 515 CD1 LEU A 35 1.850 13.468 8.097 1.00 0.00 C ATOM 516 CD2 LEU A 35 0.840 11.197 8.471 1.00 0.00 C ATOM 0 HA LEU A 35 2.026 11.355 4.465 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.527 10.449 6.486 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.502 11.899 6.350 1.00 0.00 H new ATOM 0 HG LEU A 35 2.921 11.672 8.535 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.554 13.683 9.124 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.779 13.992 7.870 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.068 13.804 7.416 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.607 11.550 9.476 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.016 11.370 7.818 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.062 10.130 8.504 1.00 0.00 H new ATOM 528 N GLY A 36 -0.226 10.452 5.345 1.00 0.00 N ATOM 529 CA GLY A 36 -1.571 9.976 5.610 1.00 0.00 C ATOM 530 C GLY A 36 -1.502 8.698 6.436 1.00 0.00 C ATOM 531 O GLY A 36 -0.448 8.064 6.526 1.00 0.00 O ATOM 0 H GLY A 36 0.420 9.700 5.105 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.139 10.737 6.144 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -2.093 9.788 4.672 1.00 0.00 H new ATOM 535 N ALA A 37 -2.640 8.313 7.012 1.00 0.00 N ATOM 536 CA ALA A 37 -2.836 7.134 7.841 1.00 0.00 C ATOM 537 C ALA A 37 -4.252 6.611 7.588 1.00 0.00 C ATOM 538 O ALA A 37 -5.031 7.253 6.877 1.00 0.00 O ATOM 539 CB ALA A 37 -2.629 7.509 9.314 1.00 0.00 C ATOM 0 H ALA A 37 -3.499 8.852 6.903 1.00 0.00 H new ATOM 0 HA ALA A 37 -2.118 6.352 7.594 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -2.775 6.627 9.938 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.617 7.889 9.454 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -3.348 8.278 9.598 1.00 0.00 H new ATOM 545 N GLY A 38 -4.610 5.466 8.167 1.00 0.00 N ATOM 546 CA GLY A 38 -6.002 5.067 8.278 1.00 0.00 C ATOM 547 C GLY A 38 -6.174 3.561 8.366 1.00 0.00 C ATOM 548 O GLY A 38 -5.214 2.814 8.577 1.00 0.00 O ATOM 0 H GLY A 38 -3.949 4.800 8.566 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -6.439 5.531 9.162 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.553 5.442 7.416 1.00 0.00 H new ATOM 552 N ALA A 39 -7.417 3.132 8.152 1.00 0.00 N ATOM 553 CA ALA A 39 -7.774 1.727 8.070 1.00 0.00 C ATOM 554 C ALA A 39 -7.752 1.334 6.593 1.00 0.00 C ATOM 555 O ALA A 39 -7.814 2.197 5.715 1.00 0.00 O ATOM 556 CB ALA A 39 -9.168 1.511 8.667 1.00 0.00 C ATOM 0 H ALA A 39 -8.210 3.762 8.030 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.072 1.111 8.632 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.432 0.455 8.603 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -9.169 1.823 9.711 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -9.897 2.101 8.112 1.00 0.00 H new ATOM 562 N PHE A 40 -7.657 0.034 6.328 1.00 0.00 N ATOM 563 CA PHE A 40 -7.450 -0.551 5.010 1.00 0.00 C ATOM 564 C PHE A 40 -8.405 -1.737 4.874 1.00 0.00 C ATOM 565 O PHE A 40 -8.825 -2.317 5.879 1.00 0.00 O ATOM 566 CB PHE A 40 -5.973 -0.967 4.911 1.00 0.00 C ATOM 567 CG PHE A 40 -5.391 -1.245 3.537 1.00 0.00 C ATOM 568 CD1 PHE A 40 -5.561 -0.331 2.477 1.00 0.00 C ATOM 569 CD2 PHE A 40 -4.565 -2.371 3.353 1.00 0.00 C ATOM 570 CE1 PHE A 40 -4.924 -0.552 1.244 1.00 0.00 C ATOM 571 CE2 PHE A 40 -3.936 -2.598 2.117 1.00 0.00 C ATOM 572 CZ PHE A 40 -4.109 -1.683 1.066 1.00 0.00 C ATOM 0 H PHE A 40 -7.726 -0.671 7.061 1.00 0.00 H new ATOM 0 HA PHE A 40 -7.659 0.146 4.198 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -5.375 -0.181 5.372 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -5.840 -1.864 5.516 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -6.183 0.542 2.613 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -4.414 -3.064 4.167 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -5.061 0.148 0.433 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -3.321 -3.474 1.976 1.00 0.00 H new ATOM 0 HZ PHE A 40 -3.615 -1.849 0.120 1.00 0.00 H new ATOM 582 N GLY A 41 -8.764 -2.101 3.648 1.00 0.00 N ATOM 583 CA GLY A 41 -9.661 -3.206 3.365 1.00 0.00 C ATOM 584 C GLY A 41 -9.563 -3.601 1.901 1.00 0.00 C ATOM 585 O GLY A 41 -8.882 -2.937 1.123 1.00 0.00 O ATOM 0 H GLY A 41 -8.431 -1.625 2.810 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.410 -4.058 3.997 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -10.686 -2.922 3.605 1.00 0.00 H new ATOM 589 N GLY A 42 -10.204 -4.697 1.504 1.00 0.00 N ATOM 590 CA GLY A 42 -10.404 -4.976 0.095 1.00 0.00 C ATOM 591 C GLY A 42 -11.376 -6.111 -0.154 1.00 0.00 C ATOM 592 O GLY A 42 -11.705 -6.861 0.762 1.00 0.00 O ATOM 0 H GLY A 42 -10.589 -5.398 2.137 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -10.771 -4.076 -0.399 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -9.444 -5.221 -0.361 1.00 0.00 H new ATOM 596 N TYR A 43 -11.807 -6.229 -1.411 1.00 0.00 N ATOM 597 CA TYR A 43 -12.571 -7.354 -1.925 1.00 0.00 C ATOM 598 C TYR A 43 -11.986 -7.673 -3.295 1.00 0.00 C ATOM 599 O TYR A 43 -12.190 -6.912 -4.239 1.00 0.00 O ATOM 600 CB TYR A 43 -14.065 -7.004 -2.025 1.00 0.00 C ATOM 601 CG TYR A 43 -14.783 -6.912 -0.692 1.00 0.00 C ATOM 602 CD1 TYR A 43 -14.775 -5.707 0.036 1.00 0.00 C ATOM 603 CD2 TYR A 43 -15.459 -8.036 -0.179 1.00 0.00 C ATOM 604 CE1 TYR A 43 -15.423 -5.623 1.281 1.00 0.00 C ATOM 605 CE2 TYR A 43 -16.117 -7.959 1.062 1.00 0.00 C ATOM 606 CZ TYR A 43 -16.094 -6.755 1.801 1.00 0.00 C ATOM 607 OH TYR A 43 -16.719 -6.697 3.011 1.00 0.00 O ATOM 0 H TYR A 43 -11.625 -5.517 -2.118 1.00 0.00 H new ATOM 0 HA TYR A 43 -12.503 -8.216 -1.261 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -14.167 -6.051 -2.544 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.561 -7.756 -2.639 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -14.268 -4.842 -0.364 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -15.472 -8.959 -0.740 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -15.409 -4.698 1.838 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -16.640 -8.821 1.450 1.00 0.00 H new ATOM 0 HH TYR A 43 -17.128 -7.565 3.210 1.00 0.00 H new ATOM 617 N GLN A 44 -11.229 -8.763 -3.412 1.00 0.00 N ATOM 618 CA GLN A 44 -10.781 -9.283 -4.697 1.00 0.00 C ATOM 619 C GLN A 44 -11.753 -10.376 -5.123 1.00 0.00 C ATOM 620 O GLN A 44 -12.092 -11.246 -4.319 1.00 0.00 O ATOM 621 CB GLN A 44 -9.336 -9.785 -4.604 1.00 0.00 C ATOM 622 CG GLN A 44 -8.366 -8.603 -4.708 1.00 0.00 C ATOM 623 CD GLN A 44 -6.912 -9.058 -4.684 1.00 0.00 C ATOM 624 OE1 GLN A 44 -6.351 -9.417 -5.716 1.00 0.00 O ATOM 625 NE2 GLN A 44 -6.262 -9.059 -3.524 1.00 0.00 N ATOM 0 H GLN A 44 -10.909 -9.310 -2.613 1.00 0.00 H new ATOM 0 HA GLN A 44 -10.778 -8.498 -5.453 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -9.184 -10.310 -3.661 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -9.138 -10.500 -5.402 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.560 -8.054 -5.630 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -8.544 -7.913 -3.883 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -6.737 -8.759 -2.673 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -5.288 -9.360 -3.485 1.00 0.00 H new ATOM 634 N VAL A 45 -12.202 -10.333 -6.385 1.00 0.00 N ATOM 635 CA VAL A 45 -13.095 -11.357 -6.933 1.00 0.00 C ATOM 636 C VAL A 45 -12.352 -12.693 -7.038 1.00 0.00 C ATOM 637 O VAL A 45 -12.968 -13.752 -6.931 1.00 0.00 O ATOM 638 CB VAL A 45 -13.739 -10.910 -8.262 1.00 0.00 C ATOM 639 CG1 VAL A 45 -14.691 -9.728 -8.020 1.00 0.00 C ATOM 640 CG2 VAL A 45 -12.727 -10.521 -9.350 1.00 0.00 C ATOM 0 H VAL A 45 -11.959 -9.595 -7.046 1.00 0.00 H new ATOM 0 HA VAL A 45 -13.930 -11.501 -6.247 1.00 0.00 H new ATOM 0 HB VAL A 45 -14.282 -11.780 -8.631 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -15.139 -9.422 -8.965 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -15.477 -10.029 -7.327 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -14.134 -8.893 -7.596 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -13.260 -10.219 -10.252 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -12.113 -9.692 -8.997 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -12.088 -11.375 -9.575 1.00 0.00 H new ATOM 699 N VAL A 49 -7.262 -9.957 -8.881 1.00 0.00 N ATOM 700 CA VAL A 49 -8.016 -8.804 -9.368 1.00 0.00 C ATOM 701 C VAL A 49 -9.243 -8.511 -8.491 1.00 0.00 C ATOM 702 O VAL A 49 -9.857 -9.411 -7.911 1.00 0.00 O ATOM 703 CB VAL A 49 -8.374 -9.042 -10.856 1.00 0.00 C ATOM 704 CG1 VAL A 49 -9.400 -10.167 -11.065 1.00 0.00 C ATOM 705 CG2 VAL A 49 -8.877 -7.772 -11.558 1.00 0.00 C ATOM 0 HA VAL A 49 -7.402 -7.906 -9.300 1.00 0.00 H new ATOM 0 HB VAL A 49 -7.431 -9.349 -11.310 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -9.605 -10.280 -12.130 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -9.000 -11.102 -10.671 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -10.324 -9.919 -10.542 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -9.112 -8.000 -12.598 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -9.773 -7.409 -11.055 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.103 -7.005 -11.521 1.00 0.00 H new ATOM 715 N GLY A 50 -9.640 -7.237 -8.445 1.00 0.00 N ATOM 716 CA GLY A 50 -10.902 -6.769 -7.899 1.00 0.00 C ATOM 717 C GLY A 50 -10.706 -5.386 -7.302 1.00 0.00 C ATOM 718 O GLY A 50 -10.382 -4.452 -8.035 1.00 0.00 O ATOM 0 H GLY A 50 -9.062 -6.477 -8.804 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -11.660 -6.736 -8.681 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -11.260 -7.460 -7.136 1.00 0.00 H new ATOM 722 N PHE A 51 -10.891 -5.256 -5.985 1.00 0.00 N ATOM 723 CA PHE A 51 -10.923 -3.982 -5.289 1.00 0.00 C ATOM 724 C PHE A 51 -10.126 -4.024 -3.986 1.00 0.00 C ATOM 725 O PHE A 51 -9.871 -5.080 -3.384 1.00 0.00 O ATOM 726 CB PHE A 51 -12.380 -3.573 -5.009 1.00 0.00 C ATOM 727 CG PHE A 51 -13.245 -3.454 -6.249 1.00 0.00 C ATOM 728 CD1 PHE A 51 -13.240 -2.263 -6.998 1.00 0.00 C ATOM 729 CD2 PHE A 51 -14.035 -4.542 -6.669 1.00 0.00 C ATOM 730 CE1 PHE A 51 -14.017 -2.160 -8.165 1.00 0.00 C ATOM 731 CE2 PHE A 51 -14.811 -4.439 -7.837 1.00 0.00 C ATOM 732 CZ PHE A 51 -14.802 -3.248 -8.585 1.00 0.00 C ATOM 0 H PHE A 51 -11.025 -6.056 -5.366 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.454 -3.239 -5.935 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -12.828 -4.305 -4.337 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -12.382 -2.617 -4.486 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -12.638 -1.426 -6.676 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -14.045 -5.456 -6.094 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -14.011 -1.245 -8.739 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -15.414 -5.275 -8.160 1.00 0.00 H new ATOM 0 HZ PHE A 51 -15.398 -3.169 -9.482 1.00 0.00 H new ATOM 742 N GLU A 52 -9.773 -2.818 -3.549 1.00 0.00 N ATOM 743 CA GLU A 52 -9.030 -2.473 -2.355 1.00 0.00 C ATOM 744 C GLU A 52 -9.620 -1.148 -1.849 1.00 0.00 C ATOM 745 O GLU A 52 -10.234 -0.395 -2.610 1.00 0.00 O ATOM 746 CB GLU A 52 -7.548 -2.438 -2.747 1.00 0.00 C ATOM 747 CG GLU A 52 -6.567 -2.127 -1.617 1.00 0.00 C ATOM 748 CD GLU A 52 -5.167 -2.601 -2.018 1.00 0.00 C ATOM 749 OE1 GLU A 52 -4.490 -1.895 -2.808 1.00 0.00 O ATOM 750 OE2 GLU A 52 -4.779 -3.717 -1.618 1.00 0.00 O ATOM 0 H GLU A 52 -10.028 -1.983 -4.077 1.00 0.00 H new ATOM 0 HA GLU A 52 -9.106 -3.183 -1.531 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -7.283 -3.404 -3.177 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -7.417 -1.693 -3.532 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -6.557 -1.056 -1.413 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -6.882 -2.623 -0.699 1.00 0.00 H new ATOM 757 N MET A 53 -9.547 -0.909 -0.543 1.00 0.00 N ATOM 758 CA MET A 53 -10.345 0.083 0.165 1.00 0.00 C ATOM 759 C MET A 53 -9.583 0.561 1.403 1.00 0.00 C ATOM 760 O MET A 53 -8.573 -0.027 1.788 1.00 0.00 O ATOM 761 CB MET A 53 -11.692 -0.534 0.599 1.00 0.00 C ATOM 762 CG MET A 53 -12.567 -1.027 -0.559 1.00 0.00 C ATOM 763 SD MET A 53 -14.149 -1.743 -0.044 1.00 0.00 S ATOM 764 CE MET A 53 -14.809 -2.187 -1.672 1.00 0.00 C ATOM 0 H MET A 53 -8.910 -1.418 0.070 1.00 0.00 H new ATOM 0 HA MET A 53 -10.535 0.927 -0.498 1.00 0.00 H new ATOM 0 HB2 MET A 53 -11.495 -1.370 1.270 1.00 0.00 H new ATOM 0 HB3 MET A 53 -12.250 0.208 1.169 1.00 0.00 H new ATOM 0 HG2 MET A 53 -12.761 -0.193 -1.233 1.00 0.00 H new ATOM 0 HG3 MET A 53 -12.011 -1.773 -1.127 1.00 0.00 H new ATOM 0 HE1 MET A 53 -15.790 -2.647 -1.554 1.00 0.00 H new ATOM 0 HE2 MET A 53 -14.900 -1.290 -2.285 1.00 0.00 H new ATOM 0 HE3 MET A 53 -14.134 -2.892 -2.158 1.00 0.00 H new ATOM 774 N GLY A 54 -10.088 1.602 2.061 1.00 0.00 N ATOM 775 CA GLY A 54 -9.613 2.057 3.354 1.00 0.00 C ATOM 776 C GLY A 54 -10.547 3.109 3.937 1.00 0.00 C ATOM 777 O GLY A 54 -11.544 3.475 3.312 1.00 0.00 O ATOM 0 H GLY A 54 -10.858 2.163 1.696 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -9.540 1.211 4.037 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -8.610 2.472 3.252 1.00 0.00 H new ATOM 781 N TYR A 55 -10.219 3.608 5.129 1.00 0.00 N ATOM 782 CA TYR A 55 -10.981 4.650 5.806 1.00 0.00 C ATOM 783 C TYR A 55 -10.021 5.641 6.456 1.00 0.00 C ATOM 784 O TYR A 55 -8.959 5.241 6.943 1.00 0.00 O ATOM 785 CB TYR A 55 -11.924 4.015 6.839 1.00 0.00 C ATOM 786 CG TYR A 55 -13.180 4.826 7.087 1.00 0.00 C ATOM 787 CD1 TYR A 55 -13.169 5.906 7.991 1.00 0.00 C ATOM 788 CD2 TYR A 55 -14.361 4.503 6.391 1.00 0.00 C ATOM 789 CE1 TYR A 55 -14.332 6.669 8.193 1.00 0.00 C ATOM 790 CE2 TYR A 55 -15.531 5.251 6.601 1.00 0.00 C ATOM 791 CZ TYR A 55 -15.520 6.343 7.497 1.00 0.00 C ATOM 792 OH TYR A 55 -16.660 7.066 7.678 1.00 0.00 O ATOM 0 H TYR A 55 -9.405 3.293 5.656 1.00 0.00 H new ATOM 0 HA TYR A 55 -11.592 5.193 5.086 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -12.205 3.018 6.499 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -11.389 3.891 7.780 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -12.265 6.148 8.530 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -14.367 3.678 5.694 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -14.319 7.503 8.879 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -16.439 4.991 6.077 1.00 0.00 H new ATOM 0 HH TYR A 55 -17.374 6.697 7.117 1.00 0.00 H new ATOM 1108 N GLY A 76 -12.752 10.560 5.602 1.00 0.00 N ATOM 1109 CA GLY A 76 -12.602 10.157 4.218 1.00 0.00 C ATOM 1110 C GLY A 76 -12.682 8.639 4.085 1.00 0.00 C ATOM 1111 O GLY A 76 -12.666 7.915 5.084 1.00 0.00 O ATOM 0 HA2 GLY A 76 -13.381 10.621 3.613 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.646 10.511 3.833 1.00 0.00 H new ATOM 1115 N VAL A 77 -12.761 8.163 2.842 1.00 0.00 N ATOM 1116 CA VAL A 77 -12.874 6.749 2.501 1.00 0.00 C ATOM 1117 C VAL A 77 -11.973 6.504 1.294 1.00 0.00 C ATOM 1118 O VAL A 77 -12.033 7.250 0.319 1.00 0.00 O ATOM 1119 CB VAL A 77 -14.342 6.361 2.202 1.00 0.00 C ATOM 1120 CG1 VAL A 77 -14.483 4.833 2.107 1.00 0.00 C ATOM 1121 CG2 VAL A 77 -15.330 6.866 3.268 1.00 0.00 C ATOM 0 H VAL A 77 -12.748 8.770 2.023 1.00 0.00 H new ATOM 0 HA VAL A 77 -12.561 6.126 3.339 1.00 0.00 H new ATOM 0 HB VAL A 77 -14.589 6.838 1.254 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -15.521 4.576 1.896 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -13.846 4.458 1.306 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -14.182 4.380 3.052 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -16.342 6.561 3.000 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -15.068 6.442 4.237 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -15.281 7.954 3.323 1.00 0.00 H new ATOM 1131 N GLN A 78 -11.145 5.462 1.344 1.00 0.00 N ATOM 1132 CA GLN A 78 -10.328 5.021 0.224 1.00 0.00 C ATOM 1133 C GLN A 78 -11.087 3.909 -0.491 1.00 0.00 C ATOM 1134 O GLN A 78 -11.598 2.992 0.151 1.00 0.00 O ATOM 1135 CB GLN A 78 -8.932 4.635 0.743 1.00 0.00 C ATOM 1136 CG GLN A 78 -8.023 3.927 -0.276 1.00 0.00 C ATOM 1137 CD GLN A 78 -6.636 3.614 0.303 1.00 0.00 C ATOM 1138 OE1 GLN A 78 -6.475 3.383 1.497 1.00 0.00 O ATOM 1139 NE2 GLN A 78 -5.602 3.600 -0.531 1.00 0.00 N ATOM 0 H GLN A 78 -11.024 4.893 2.182 1.00 0.00 H new ATOM 0 HA GLN A 78 -10.152 5.804 -0.514 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -8.428 5.538 1.088 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.052 3.986 1.610 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -8.497 3.001 -0.601 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.913 4.555 -1.160 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -5.744 3.793 -1.522 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -4.666 3.396 -0.180 1.00 0.00 H new ATOM 1148 N LEU A 79 -11.175 4.003 -1.821 1.00 0.00 N ATOM 1149 CA LEU A 79 -11.779 2.988 -2.670 1.00 0.00 C ATOM 1150 C LEU A 79 -11.016 2.934 -3.990 1.00 0.00 C ATOM 1151 O LEU A 79 -10.659 3.963 -4.568 1.00 0.00 O ATOM 1152 CB LEU A 79 -13.307 3.163 -2.844 1.00 0.00 C ATOM 1153 CG LEU A 79 -13.960 4.543 -3.109 1.00 0.00 C ATOM 1154 CD1 LEU A 79 -14.043 5.428 -1.858 1.00 0.00 C ATOM 1155 CD2 LEU A 79 -13.355 5.344 -4.266 1.00 0.00 C ATOM 0 H LEU A 79 -10.820 4.805 -2.342 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.689 2.020 -2.178 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -13.604 2.514 -3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -13.772 2.766 -1.942 1.00 0.00 H new ATOM 0 HG LEU A 79 -14.969 4.266 -3.415 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -14.510 6.379 -2.115 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -14.638 4.925 -1.096 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -13.039 5.609 -1.473 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -13.883 6.292 -4.367 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -12.301 5.535 -4.064 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -13.450 4.775 -5.191 1.00 0.00 H new ATOM 1167 N THR A 80 -10.671 1.720 -4.421 1.00 0.00 N ATOM 1168 CA THR A 80 -9.808 1.525 -5.568 1.00 0.00 C ATOM 1169 C THR A 80 -10.057 0.151 -6.206 1.00 0.00 C ATOM 1170 O THR A 80 -10.303 -0.835 -5.511 1.00 0.00 O ATOM 1171 CB THR A 80 -8.342 1.835 -5.159 1.00 0.00 C ATOM 1172 OG1 THR A 80 -7.429 1.222 -6.039 1.00 0.00 O ATOM 1173 CG2 THR A 80 -7.920 1.486 -3.724 1.00 0.00 C ATOM 0 H THR A 80 -10.984 0.854 -3.982 1.00 0.00 H new ATOM 0 HA THR A 80 -10.041 2.227 -6.369 1.00 0.00 H new ATOM 0 HB THR A 80 -8.316 2.923 -5.217 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.488 1.647 -6.920 1.00 0.00 H new ATOM 0 HG21 THR A 80 -6.874 1.755 -3.577 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.540 2.039 -3.018 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.046 0.416 -3.558 1.00 0.00 H new ATOM 1181 N ALA A 81 -9.993 0.098 -7.542 1.00 0.00 N ATOM 1182 CA ALA A 81 -9.899 -1.126 -8.325 1.00 0.00 C ATOM 1183 C ALA A 81 -8.424 -1.526 -8.427 1.00 0.00 C ATOM 1184 O ALA A 81 -7.549 -0.658 -8.478 1.00 0.00 O ATOM 1185 CB ALA A 81 -10.487 -0.888 -9.720 1.00 0.00 C ATOM 0 H ALA A 81 -10.006 0.938 -8.121 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.461 -1.928 -7.846 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.416 -1.804 -10.306 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.533 -0.595 -9.629 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.930 -0.095 -10.219 1.00 0.00 H new ATOM 1191 N LYS A 82 -8.154 -2.832 -8.472 1.00 0.00 N ATOM 1192 CA LYS A 82 -6.840 -3.431 -8.260 1.00 0.00 C ATOM 1193 C LYS A 82 -6.677 -4.630 -9.195 1.00 0.00 C ATOM 1194 O LYS A 82 -7.590 -5.452 -9.296 1.00 0.00 O ATOM 1195 CB LYS A 82 -6.778 -3.833 -6.777 1.00 0.00 C ATOM 1196 CG LYS A 82 -5.553 -4.664 -6.368 1.00 0.00 C ATOM 1197 CD LYS A 82 -5.599 -4.874 -4.851 1.00 0.00 C ATOM 1198 CE LYS A 82 -4.565 -5.867 -4.315 1.00 0.00 C ATOM 1199 NZ LYS A 82 -4.719 -6.057 -2.861 1.00 0.00 N ATOM 0 H LYS A 82 -8.875 -3.527 -8.665 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.025 -2.744 -8.485 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -6.799 -2.927 -6.172 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.677 -4.399 -6.534 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -5.556 -5.624 -6.884 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -4.634 -4.151 -6.653 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -5.449 -3.913 -4.359 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -6.595 -5.222 -4.575 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.677 -6.824 -4.824 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.560 -5.505 -4.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.180 -6.894 -2.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.361 -5.218 -2.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.725 -6.193 -2.633 1.00 0.00 H new ATOM 1213 N LEU A 83 -5.515 -4.741 -9.846 1.00 0.00 N ATOM 1214 CA LEU A 83 -5.131 -5.844 -10.725 1.00 0.00 C ATOM 1215 C LEU A 83 -3.636 -6.081 -10.533 1.00 0.00 C ATOM 1216 O LEU A 83 -2.860 -5.126 -10.600 1.00 0.00 O ATOM 1217 CB LEU A 83 -5.445 -5.473 -12.187 1.00 0.00 C ATOM 1218 CG LEU A 83 -4.877 -6.449 -13.243 1.00 0.00 C ATOM 1219 CD1 LEU A 83 -5.431 -7.873 -13.116 1.00 0.00 C ATOM 1220 CD2 LEU A 83 -5.205 -5.916 -14.644 1.00 0.00 C ATOM 0 H LEU A 83 -4.786 -4.032 -9.770 1.00 0.00 H new ATOM 0 HA LEU A 83 -5.685 -6.751 -10.485 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -6.527 -5.419 -12.308 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -5.052 -4.476 -12.386 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.802 -6.506 -13.075 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -4.991 -8.505 -13.887 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.183 -8.274 -12.133 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -6.514 -7.854 -13.237 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.808 -6.599 -15.395 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.286 -5.838 -14.760 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -4.754 -4.932 -14.774 1.00 0.00 H new ATOM 1232 N GLY A 84 -3.227 -7.325 -10.290 1.00 0.00 N ATOM 1233 CA GLY A 84 -1.829 -7.659 -10.079 1.00 0.00 C ATOM 1234 C GLY A 84 -1.423 -8.959 -10.747 1.00 0.00 C ATOM 1235 O GLY A 84 -2.238 -9.601 -11.409 1.00 0.00 O ATOM 0 H GLY A 84 -3.858 -8.125 -10.235 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -1.206 -6.850 -10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -1.636 -7.731 -9.009 1.00 0.00 H new ATOM 1239 N TYR A 85 -0.144 -9.309 -10.603 1.00 0.00 N ATOM 1240 CA TYR A 85 0.434 -10.543 -11.120 1.00 0.00 C ATOM 1241 C TYR A 85 1.479 -11.070 -10.125 1.00 0.00 C ATOM 1242 O TYR A 85 2.276 -10.271 -9.627 1.00 0.00 O ATOM 1243 CB TYR A 85 1.085 -10.283 -12.490 1.00 0.00 C ATOM 1244 CG TYR A 85 0.157 -9.670 -13.526 1.00 0.00 C ATOM 1245 CD1 TYR A 85 -0.683 -10.493 -14.302 1.00 0.00 C ATOM 1246 CD2 TYR A 85 0.098 -8.270 -13.675 1.00 0.00 C ATOM 1247 CE1 TYR A 85 -1.582 -9.919 -15.219 1.00 0.00 C ATOM 1248 CE2 TYR A 85 -0.800 -7.689 -14.588 1.00 0.00 C ATOM 1249 CZ TYR A 85 -1.647 -8.515 -15.363 1.00 0.00 C ATOM 1250 OH TYR A 85 -2.522 -7.967 -16.252 1.00 0.00 O ATOM 0 H TYR A 85 0.533 -8.725 -10.111 1.00 0.00 H new ATOM 0 HA TYR A 85 -0.350 -11.290 -11.245 1.00 0.00 H new ATOM 0 HB2 TYR A 85 1.940 -9.622 -12.351 1.00 0.00 H new ATOM 0 HB3 TYR A 85 1.470 -11.225 -12.879 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -0.637 -11.566 -14.193 1.00 0.00 H new ATOM 0 HD2 TYR A 85 0.746 -7.640 -13.085 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -2.223 -10.552 -15.814 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -0.843 -6.615 -14.697 1.00 0.00 H new ATOM 0 HH TYR A 85 -2.443 -6.990 -16.229 1.00 0.00 H new ATOM 1260 N PRO A 86 1.545 -12.390 -9.858 1.00 0.00 N ATOM 1261 CA PRO A 86 2.526 -12.963 -8.943 1.00 0.00 C ATOM 1262 C PRO A 86 3.930 -12.728 -9.504 1.00 0.00 C ATOM 1263 O PRO A 86 4.249 -13.202 -10.595 1.00 0.00 O ATOM 1264 CB PRO A 86 2.164 -14.445 -8.803 1.00 0.00 C ATOM 1265 CG PRO A 86 1.389 -14.753 -10.083 1.00 0.00 C ATOM 1266 CD PRO A 86 0.688 -13.432 -10.400 1.00 0.00 C ATOM 0 HA PRO A 86 2.516 -12.502 -7.955 1.00 0.00 H new ATOM 0 HB2 PRO A 86 3.054 -15.068 -8.715 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.558 -14.627 -7.915 1.00 0.00 H new ATOM 0 HG2 PRO A 86 2.053 -15.059 -10.891 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.674 -15.562 -9.935 1.00 0.00 H new ATOM 0 HD2 PRO A 86 0.554 -13.308 -11.475 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.304 -13.397 -9.949 1.00 0.00 H new ATOM 1274 N ILE A 87 4.759 -11.966 -8.780 1.00 0.00 N ATOM 1275 CA ILE A 87 6.101 -11.595 -9.232 1.00 0.00 C ATOM 1276 C ILE A 87 7.142 -12.625 -8.756 1.00 0.00 C ATOM 1277 O ILE A 87 8.281 -12.631 -9.222 1.00 0.00 O ATOM 1278 CB ILE A 87 6.390 -10.105 -8.921 1.00 0.00 C ATOM 1279 CG1 ILE A 87 7.722 -9.644 -9.552 1.00 0.00 C ATOM 1280 CG2 ILE A 87 6.338 -9.774 -7.423 1.00 0.00 C ATOM 1281 CD1 ILE A 87 7.835 -8.123 -9.716 1.00 0.00 C ATOM 0 H ILE A 87 4.516 -11.590 -7.864 1.00 0.00 H new ATOM 0 HA ILE A 87 6.173 -11.647 -10.318 1.00 0.00 H new ATOM 0 HB ILE A 87 5.580 -9.541 -9.383 1.00 0.00 H new ATOM 0 HG12 ILE A 87 8.547 -9.996 -8.933 1.00 0.00 H new ATOM 0 HG13 ILE A 87 7.833 -10.115 -10.529 1.00 0.00 H new ATOM 0 HG21 ILE A 87 6.550 -8.715 -7.277 1.00 0.00 H new ATOM 0 HG22 ILE A 87 5.346 -10.003 -7.034 1.00 0.00 H new ATOM 0 HG23 ILE A 87 7.082 -10.369 -6.893 1.00 0.00 H new ATOM 0 HD11 ILE A 87 8.797 -7.876 -10.165 1.00 0.00 H new ATOM 0 HD12 ILE A 87 7.031 -7.766 -10.360 1.00 0.00 H new ATOM 0 HD13 ILE A 87 7.757 -7.645 -8.740 1.00 0.00 H new ATOM 1331 N LEU A 91 4.954 -12.858 -3.259 1.00 0.00 N ATOM 1332 CA LEU A 91 4.737 -11.465 -3.632 1.00 0.00 C ATOM 1333 C LEU A 91 4.061 -11.384 -4.998 1.00 0.00 C ATOM 1334 O LEU A 91 4.339 -12.177 -5.904 1.00 0.00 O ATOM 1335 CB LEU A 91 6.012 -10.581 -3.603 1.00 0.00 C ATOM 1336 CG LEU A 91 7.382 -11.242 -3.341 1.00 0.00 C ATOM 1337 CD1 LEU A 91 7.854 -12.141 -4.489 1.00 0.00 C ATOM 1338 CD2 LEU A 91 8.451 -10.158 -3.133 1.00 0.00 C ATOM 0 HA LEU A 91 4.083 -11.053 -2.863 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.075 -10.065 -4.561 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.865 -9.818 -2.839 1.00 0.00 H new ATOM 0 HG LEU A 91 7.251 -11.862 -2.454 1.00 0.00 H new ATOM 0 HD11 LEU A 91 8.823 -12.573 -4.238 1.00 0.00 H new ATOM 0 HD12 LEU A 91 7.130 -12.941 -4.646 1.00 0.00 H new ATOM 0 HD13 LEU A 91 7.945 -11.550 -5.400 1.00 0.00 H new ATOM 0 HD21 LEU A 91 9.416 -10.630 -2.948 1.00 0.00 H new ATOM 0 HD22 LEU A 91 8.516 -9.535 -4.025 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.180 -9.539 -2.278 1.00 0.00 H new ATOM 1350 N ASP A 92 3.234 -10.348 -5.146 1.00 0.00 N ATOM 1351 CA ASP A 92 2.468 -10.010 -6.337 1.00 0.00 C ATOM 1352 C ASP A 92 2.664 -8.519 -6.615 1.00 0.00 C ATOM 1353 O ASP A 92 2.654 -7.718 -5.677 1.00 0.00 O ATOM 1354 CB ASP A 92 0.996 -10.379 -6.093 1.00 0.00 C ATOM 1355 CG ASP A 92 0.108 -10.141 -7.316 1.00 0.00 C ATOM 1356 OD1 ASP A 92 0.035 -8.978 -7.764 1.00 0.00 O ATOM 1357 OD2 ASP A 92 -0.478 -11.129 -7.810 1.00 0.00 O ATOM 0 H ASP A 92 3.074 -9.684 -4.388 1.00 0.00 H new ATOM 0 HA ASP A 92 2.803 -10.564 -7.214 1.00 0.00 H new ATOM 0 HB2 ASP A 92 0.933 -11.428 -5.804 1.00 0.00 H new ATOM 0 HB3 ASP A 92 0.615 -9.795 -5.255 1.00 0.00 H new ATOM 1362 N ILE A 93 2.879 -8.149 -7.883 1.00 0.00 N ATOM 1363 CA ILE A 93 2.997 -6.766 -8.325 1.00 0.00 C ATOM 1364 C ILE A 93 1.587 -6.303 -8.713 1.00 0.00 C ATOM 1365 O ILE A 93 1.021 -6.776 -9.699 1.00 0.00 O ATOM 1366 CB ILE A 93 4.101 -6.626 -9.406 1.00 0.00 C ATOM 1367 CG1 ILE A 93 4.525 -5.163 -9.674 1.00 0.00 C ATOM 1368 CG2 ILE A 93 3.861 -7.384 -10.726 1.00 0.00 C ATOM 1369 CD1 ILE A 93 3.507 -4.255 -10.380 1.00 0.00 C ATOM 0 H ILE A 93 2.977 -8.823 -8.643 1.00 0.00 H new ATOM 0 HA ILE A 93 3.346 -6.092 -7.543 1.00 0.00 H new ATOM 0 HB ILE A 93 4.939 -7.140 -8.935 1.00 0.00 H new ATOM 0 HG12 ILE A 93 4.780 -4.705 -8.718 1.00 0.00 H new ATOM 0 HG13 ILE A 93 5.435 -5.180 -10.273 1.00 0.00 H new ATOM 0 HG21 ILE A 93 4.698 -7.211 -11.402 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.774 -8.451 -10.522 1.00 0.00 H new ATOM 0 HG23 ILE A 93 2.941 -7.027 -11.189 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.933 -3.259 -10.505 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.265 -4.671 -11.358 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.600 -4.189 -9.779 1.00 0.00 H new ATOM 1381 N TYR A 94 1.023 -5.393 -7.910 1.00 0.00 N ATOM 1382 CA TYR A 94 -0.355 -4.922 -7.966 1.00 0.00 C ATOM 1383 C TYR A 94 -0.407 -3.465 -8.419 1.00 0.00 C ATOM 1384 O TYR A 94 0.085 -2.564 -7.724 1.00 0.00 O ATOM 1385 CB TYR A 94 -1.033 -5.066 -6.597 1.00 0.00 C ATOM 1386 CG TYR A 94 -1.735 -6.384 -6.365 1.00 0.00 C ATOM 1387 CD1 TYR A 94 -2.953 -6.652 -7.016 1.00 0.00 C ATOM 1388 CD2 TYR A 94 -1.207 -7.318 -5.460 1.00 0.00 C ATOM 1389 CE1 TYR A 94 -3.659 -7.837 -6.744 1.00 0.00 C ATOM 1390 CE2 TYR A 94 -1.922 -8.490 -5.156 1.00 0.00 C ATOM 1391 CZ TYR A 94 -3.151 -8.752 -5.793 1.00 0.00 C ATOM 1392 OH TYR A 94 -3.874 -9.844 -5.427 1.00 0.00 O ATOM 0 H TYR A 94 1.552 -4.943 -7.163 1.00 0.00 H new ATOM 0 HA TYR A 94 -0.891 -5.536 -8.690 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -0.280 -4.931 -5.820 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -1.758 -4.260 -6.481 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -3.348 -5.943 -7.729 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.249 -7.136 -4.996 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -4.585 -8.047 -7.259 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -1.529 -9.190 -4.434 1.00 0.00 H new ATOM 0 HH TYR A 94 -4.738 -9.834 -5.889 1.00 0.00 H new ATOM 1402 N THR A 95 -1.068 -3.251 -9.559 1.00 0.00 N ATOM 1403 CA THR A 95 -1.421 -1.953 -10.122 1.00 0.00 C ATOM 1404 C THR A 95 -2.869 -1.635 -9.722 1.00 0.00 C ATOM 1405 O THR A 95 -3.660 -2.541 -9.435 1.00 0.00 O ATOM 1406 CB THR A 95 -1.232 -2.020 -11.648 1.00 0.00 C ATOM 1407 OG1 THR A 95 0.069 -2.497 -11.924 1.00 0.00 O ATOM 1408 CG2 THR A 95 -1.380 -0.665 -12.350 1.00 0.00 C ATOM 0 H THR A 95 -1.387 -4.024 -10.143 1.00 0.00 H new ATOM 0 HA THR A 95 -0.785 -1.153 -9.742 1.00 0.00 H new ATOM 0 HB THR A 95 -2.015 -2.678 -12.025 1.00 0.00 H new ATOM 0 HG1 THR A 95 0.201 -2.546 -12.894 1.00 0.00 H new ATOM 0 HG21 THR A 95 -1.233 -0.793 -13.422 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.378 -0.266 -12.165 1.00 0.00 H new ATOM 0 HG23 THR A 95 -0.634 0.029 -11.962 1.00 0.00 H new ATOM 1416 N ARG A 96 -3.224 -0.346 -9.666 1.00 0.00 N ATOM 1417 CA ARG A 96 -4.530 0.079 -9.181 1.00 0.00 C ATOM 1418 C ARG A 96 -4.989 1.400 -9.799 1.00 0.00 C ATOM 1419 O ARG A 96 -4.174 2.171 -10.309 1.00 0.00 O ATOM 1420 CB ARG A 96 -4.468 0.186 -7.649 1.00 0.00 C ATOM 1421 CG ARG A 96 -3.577 1.337 -7.139 1.00 0.00 C ATOM 1422 CD ARG A 96 -4.312 2.340 -6.234 1.00 0.00 C ATOM 1423 NE ARG A 96 -4.098 2.053 -4.811 1.00 0.00 N ATOM 1424 CZ ARG A 96 -4.352 0.921 -4.149 1.00 0.00 C ATOM 1425 NH1 ARG A 96 -5.222 0.022 -4.593 1.00 0.00 N ATOM 1426 NH2 ARG A 96 -3.717 0.649 -3.018 1.00 0.00 N ATOM 0 H ARG A 96 -2.616 0.421 -9.954 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.268 -0.665 -9.482 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -5.478 0.323 -7.263 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -4.097 -0.755 -7.243 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -2.735 0.916 -6.589 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -3.164 1.870 -7.995 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.967 3.350 -6.456 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -5.379 2.312 -6.453 1.00 0.00 H new ATOM 0 HE ARG A 96 -3.706 2.814 -4.257 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -5.722 0.185 -5.467 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -5.390 -0.831 -4.060 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -3.030 1.306 -2.648 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -3.916 -0.217 -2.517 1.00 0.00 H new ATOM 1440 N LEU A 97 -6.283 1.690 -9.647 1.00 0.00 N ATOM 1441 CA LEU A 97 -6.934 2.964 -9.946 1.00 0.00 C ATOM 1442 C LEU A 97 -7.926 3.252 -8.816 1.00 0.00 C ATOM 1443 O LEU A 97 -8.433 2.301 -8.216 1.00 0.00 O ATOM 1444 CB LEU A 97 -7.595 2.860 -11.334 1.00 0.00 C ATOM 1445 CG LEU A 97 -8.388 4.111 -11.776 1.00 0.00 C ATOM 1446 CD1 LEU A 97 -8.231 4.342 -13.285 1.00 0.00 C ATOM 1447 CD2 LEU A 97 -9.887 3.982 -11.462 1.00 0.00 C ATOM 0 H LEU A 97 -6.943 0.999 -9.290 1.00 0.00 H new ATOM 0 HA LEU A 97 -6.233 3.797 -9.992 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -6.821 2.659 -12.074 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.268 2.003 -11.336 1.00 0.00 H new ATOM 0 HG LEU A 97 -7.980 4.953 -11.217 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -8.796 5.227 -13.578 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -7.177 4.489 -13.523 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -8.608 3.475 -13.827 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -10.406 4.883 -11.789 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -10.295 3.118 -11.986 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -10.024 3.854 -10.388 1.00 0.00 H new ATOM 1459 N GLY A 98 -8.213 4.523 -8.509 1.00 0.00 N ATOM 1460 CA GLY A 98 -9.203 4.915 -7.508 1.00 0.00 C ATOM 1461 C GLY A 98 -8.787 6.192 -6.793 1.00 0.00 C ATOM 1462 O GLY A 98 -8.284 7.112 -7.436 1.00 0.00 O ATOM 0 H GLY A 98 -7.755 5.317 -8.958 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -10.170 5.063 -7.988 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -9.327 4.112 -6.781 1.00 0.00 H new ATOM 1466 N GLY A 99 -9.004 6.261 -5.474 1.00 0.00 N ATOM 1467 CA GLY A 99 -8.505 7.359 -4.657 1.00 0.00 C ATOM 1468 C GLY A 99 -8.985 7.274 -3.210 1.00 0.00 C ATOM 1469 O GLY A 99 -9.759 6.384 -2.847 1.00 0.00 O ATOM 0 H GLY A 99 -9.528 5.559 -4.951 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -7.415 7.356 -4.676 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -8.829 8.306 -5.089 1.00 0.00 H new ATOM 1473 N MET A 100 -8.525 8.231 -2.396 1.00 0.00 N ATOM 1474 CA MET A 100 -9.016 8.490 -1.050 1.00 0.00 C ATOM 1475 C MET A 100 -9.909 9.725 -1.119 1.00 0.00 C ATOM 1476 O MET A 100 -9.433 10.839 -1.304 1.00 0.00 O ATOM 1477 CB MET A 100 -7.856 8.612 -0.038 1.00 0.00 C ATOM 1478 CG MET A 100 -6.680 9.527 -0.427 1.00 0.00 C ATOM 1479 SD MET A 100 -5.552 8.869 -1.694 1.00 0.00 S ATOM 1480 CE MET A 100 -4.425 10.274 -1.884 1.00 0.00 C ATOM 0 H MET A 100 -7.775 8.865 -2.672 1.00 0.00 H new ATOM 0 HA MET A 100 -9.608 7.653 -0.680 1.00 0.00 H new ATOM 0 HB2 MET A 100 -8.267 8.971 0.906 1.00 0.00 H new ATOM 0 HB3 MET A 100 -7.461 7.613 0.146 1.00 0.00 H new ATOM 0 HG2 MET A 100 -7.084 10.475 -0.784 1.00 0.00 H new ATOM 0 HG3 MET A 100 -6.101 9.745 0.470 1.00 0.00 H new ATOM 0 HE1 MET A 100 -3.667 10.034 -2.630 1.00 0.00 H new ATOM 0 HE2 MET A 100 -4.987 11.150 -2.207 1.00 0.00 H new ATOM 0 HE3 MET A 100 -3.942 10.484 -0.930 1.00 0.00 H new ATOM 1490 N VAL A 101 -11.216 9.513 -0.976 1.00 0.00 N ATOM 1491 CA VAL A 101 -12.258 10.515 -1.118 1.00 0.00 C ATOM 1492 C VAL A 101 -12.393 11.194 0.239 1.00 0.00 C ATOM 1493 O VAL A 101 -12.642 10.520 1.240 1.00 0.00 O ATOM 1494 CB VAL A 101 -13.579 9.839 -1.554 1.00 0.00 C ATOM 1495 CG1 VAL A 101 -14.680 10.885 -1.788 1.00 0.00 C ATOM 1496 CG2 VAL A 101 -13.407 9.024 -2.848 1.00 0.00 C ATOM 0 H VAL A 101 -11.590 8.592 -0.747 1.00 0.00 H new ATOM 0 HA VAL A 101 -12.014 11.252 -1.883 1.00 0.00 H new ATOM 0 HB VAL A 101 -13.863 9.168 -0.743 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -15.599 10.384 -2.094 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -14.858 11.438 -0.866 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -14.366 11.575 -2.571 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -14.358 8.566 -3.119 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -13.080 9.683 -3.652 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -12.661 8.245 -2.691 1.00 0.00 H new ATOM 1506 N PHE A 102 -12.226 12.516 0.279 1.00 0.00 N ATOM 1507 CA PHE A 102 -12.359 13.295 1.501 1.00 0.00 C ATOM 1508 C PHE A 102 -13.819 13.725 1.666 1.00 0.00 C ATOM 1509 O PHE A 102 -14.533 13.908 0.673 1.00 0.00 O ATOM 1510 CB PHE A 102 -11.434 14.513 1.385 1.00 0.00 C ATOM 1511 CG PHE A 102 -11.536 15.492 2.535 1.00 0.00 C ATOM 1512 CD1 PHE A 102 -10.959 15.184 3.781 1.00 0.00 C ATOM 1513 CD2 PHE A 102 -12.218 16.710 2.360 1.00 0.00 C ATOM 1514 CE1 PHE A 102 -11.049 16.101 4.843 1.00 0.00 C ATOM 1515 CE2 PHE A 102 -12.308 17.626 3.421 1.00 0.00 C ATOM 1516 CZ PHE A 102 -11.721 17.324 4.662 1.00 0.00 C ATOM 0 H PHE A 102 -11.994 13.075 -0.542 1.00 0.00 H new ATOM 0 HA PHE A 102 -12.078 12.710 2.377 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -10.404 14.165 1.311 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -11.660 15.038 0.457 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -10.447 14.243 3.921 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -12.673 16.941 1.408 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -10.602 15.867 5.798 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -12.828 18.562 3.283 1.00 0.00 H new ATOM 0 HZ PHE A 102 -11.786 18.030 5.476 1.00 0.00 H new ATOM 1526 N ARG A 103 -14.276 13.898 2.912 1.00 0.00 N ATOM 1527 CA ARG A 103 -15.576 14.470 3.238 1.00 0.00 C ATOM 1528 C ARG A 103 -15.460 15.329 4.496 1.00 0.00 C ATOM 1529 O ARG A 103 -15.329 14.780 5.591 1.00 0.00 O ATOM 1530 CB ARG A 103 -16.614 13.334 3.362 1.00 0.00 C ATOM 1531 CG ARG A 103 -18.067 13.831 3.448 1.00 0.00 C ATOM 1532 CD ARG A 103 -18.606 13.905 4.882 1.00 0.00 C ATOM 1533 NE ARG A 103 -19.921 14.564 4.899 1.00 0.00 N ATOM 1534 CZ ARG A 103 -20.534 15.102 5.960 1.00 0.00 C ATOM 1535 NH1 ARG A 103 -20.104 14.862 7.197 1.00 0.00 N ATOM 1536 NH2 ARG A 103 -21.571 15.912 5.755 1.00 0.00 N ATOM 0 H ARG A 103 -13.735 13.636 3.736 1.00 0.00 H new ATOM 0 HA ARG A 103 -15.921 15.131 2.443 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -16.517 12.670 2.503 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -16.388 12.743 4.250 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -18.132 14.819 2.993 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -18.704 13.168 2.863 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -18.689 12.901 5.299 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -17.908 14.455 5.512 1.00 0.00 H new ATOM 0 HE ARG A 103 -20.417 14.616 4.009 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -19.295 14.259 7.348 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -20.584 15.281 7.994 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -21.883 16.111 4.804 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -22.054 16.333 6.549 1.00 0.00 H new ATOM 1779 N SER A 120 -9.316 14.218 -6.531 1.00 0.00 N ATOM 1780 CA SER A 120 -8.860 13.902 -7.878 1.00 0.00 C ATOM 1781 C SER A 120 -8.658 12.380 -7.973 1.00 0.00 C ATOM 1782 O SER A 120 -7.966 11.829 -7.115 1.00 0.00 O ATOM 1783 CB SER A 120 -7.534 14.623 -8.150 1.00 0.00 C ATOM 1784 OG SER A 120 -7.650 16.006 -7.871 1.00 0.00 O ATOM 0 HA SER A 120 -9.594 14.227 -8.615 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.745 14.188 -7.536 1.00 0.00 H new ATOM 0 HB3 SER A 120 -7.243 14.480 -9.191 1.00 0.00 H new ATOM 0 HG SER A 120 -8.269 16.138 -7.123 1.00 0.00 H new ATOM 1790 N PRO A 121 -9.226 11.677 -8.970 1.00 0.00 N ATOM 1791 CA PRO A 121 -8.968 10.253 -9.145 1.00 0.00 C ATOM 1792 C PRO A 121 -7.503 10.039 -9.547 1.00 0.00 C ATOM 1793 O PRO A 121 -6.913 10.874 -10.236 1.00 0.00 O ATOM 1794 CB PRO A 121 -9.946 9.794 -10.228 1.00 0.00 C ATOM 1795 CG PRO A 121 -10.167 11.055 -11.064 1.00 0.00 C ATOM 1796 CD PRO A 121 -10.076 12.183 -10.036 1.00 0.00 C ATOM 0 HA PRO A 121 -9.117 9.676 -8.232 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -9.531 8.983 -10.826 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.879 9.428 -9.798 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -9.411 11.159 -11.842 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -11.137 11.042 -11.562 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -9.653 13.084 -10.480 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -11.063 12.448 -9.657 1.00 0.00 H new ATOM 1804 N VAL A 122 -6.925 8.910 -9.132 1.00 0.00 N ATOM 1805 CA VAL A 122 -5.520 8.577 -9.337 1.00 0.00 C ATOM 1806 C VAL A 122 -5.381 7.114 -9.770 1.00 0.00 C ATOM 1807 O VAL A 122 -6.329 6.326 -9.699 1.00 0.00 O ATOM 1808 CB VAL A 122 -4.695 8.883 -8.061 1.00 0.00 C ATOM 1809 CG1 VAL A 122 -4.585 10.393 -7.802 1.00 0.00 C ATOM 1810 CG2 VAL A 122 -5.242 8.195 -6.798 1.00 0.00 C ATOM 0 H VAL A 122 -7.438 8.185 -8.631 1.00 0.00 H new ATOM 0 HA VAL A 122 -5.120 9.199 -10.138 1.00 0.00 H new ATOM 0 HB VAL A 122 -3.706 8.473 -8.262 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.999 10.566 -6.899 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -4.095 10.873 -8.649 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -5.582 10.814 -7.674 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.617 8.453 -5.943 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -6.263 8.530 -6.615 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -5.234 7.114 -6.940 1.00 0.00 H new ATOM 1820 N PHE A 123 -4.171 6.745 -10.192 1.00 0.00 N ATOM 1821 CA PHE A 123 -3.740 5.379 -10.425 1.00 0.00 C ATOM 1822 C PHE A 123 -2.345 5.240 -9.826 1.00 0.00 C ATOM 1823 O PHE A 123 -1.629 6.234 -9.696 1.00 0.00 O ATOM 1824 CB PHE A 123 -3.781 5.049 -11.926 1.00 0.00 C ATOM 1825 CG PHE A 123 -2.889 5.918 -12.796 1.00 0.00 C ATOM 1826 CD1 PHE A 123 -1.556 5.537 -13.047 1.00 0.00 C ATOM 1827 CD2 PHE A 123 -3.387 7.115 -13.346 1.00 0.00 C ATOM 1828 CE1 PHE A 123 -0.726 6.350 -13.838 1.00 0.00 C ATOM 1829 CE2 PHE A 123 -2.555 7.929 -14.137 1.00 0.00 C ATOM 1830 CZ PHE A 123 -1.224 7.547 -14.382 1.00 0.00 C ATOM 0 H PHE A 123 -3.437 7.426 -10.387 1.00 0.00 H new ATOM 0 HA PHE A 123 -4.408 4.662 -9.948 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -3.493 4.007 -12.062 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -4.809 5.144 -12.276 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -1.171 4.618 -12.631 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -4.410 7.409 -13.160 1.00 0.00 H new ATOM 0 HE1 PHE A 123 0.295 6.055 -14.028 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -2.939 8.847 -14.556 1.00 0.00 H new ATOM 0 HZ PHE A 123 -0.585 8.173 -14.988 1.00 0.00 H new ATOM 1840 N ALA A 124 -1.975 4.018 -9.444 1.00 0.00 N ATOM 1841 CA ALA A 124 -0.724 3.720 -8.757 1.00 0.00 C ATOM 1842 C ALA A 124 -0.315 2.280 -9.066 1.00 0.00 C ATOM 1843 O ALA A 124 -1.109 1.508 -9.612 1.00 0.00 O ATOM 1844 CB ALA A 124 -0.911 3.918 -7.242 1.00 0.00 C ATOM 0 H ALA A 124 -2.550 3.192 -9.608 1.00 0.00 H new ATOM 0 HA ALA A 124 0.062 4.393 -9.100 1.00 0.00 H new ATOM 0 HB1 ALA A 124 0.024 3.695 -6.728 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -1.198 4.951 -7.043 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -1.692 3.248 -6.881 1.00 0.00 H new ATOM 1850 N GLY A 125 0.895 1.892 -8.662 1.00 0.00 N ATOM 1851 CA GLY A 125 1.312 0.501 -8.691 1.00 0.00 C ATOM 1852 C GLY A 125 2.362 0.223 -7.632 1.00 0.00 C ATOM 1853 O GLY A 125 2.981 1.142 -7.100 1.00 0.00 O ATOM 0 H GLY A 125 1.605 2.533 -8.309 1.00 0.00 H new ATOM 0 HA2 GLY A 125 0.448 -0.144 -8.529 1.00 0.00 H new ATOM 0 HA3 GLY A 125 1.711 0.258 -9.676 1.00 0.00 H new ATOM 1857 N GLY A 126 2.549 -1.053 -7.309 1.00 0.00 N ATOM 1858 CA GLY A 126 3.466 -1.497 -6.280 1.00 0.00 C ATOM 1859 C GLY A 126 3.254 -2.979 -6.043 1.00 0.00 C ATOM 1860 O GLY A 126 3.054 -3.722 -6.999 1.00 0.00 O ATOM 0 H GLY A 126 2.054 -1.818 -7.768 1.00 0.00 H new ATOM 0 HA2 GLY A 126 4.495 -1.307 -6.584 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.298 -0.940 -5.359 1.00 0.00 H new ATOM 1864 N VAL A 127 3.317 -3.417 -4.786 1.00 0.00 N ATOM 1865 CA VAL A 127 3.406 -4.830 -4.439 1.00 0.00 C ATOM 1866 C VAL A 127 2.393 -5.157 -3.335 1.00 0.00 C ATOM 1867 O VAL A 127 1.941 -4.276 -2.591 1.00 0.00 O ATOM 1868 CB VAL A 127 4.884 -5.158 -4.074 1.00 0.00 C ATOM 1869 CG1 VAL A 127 5.140 -6.574 -3.533 1.00 0.00 C ATOM 1870 CG2 VAL A 127 5.807 -4.972 -5.293 1.00 0.00 C ATOM 0 H VAL A 127 3.307 -2.796 -3.977 1.00 0.00 H new ATOM 0 HA VAL A 127 3.139 -5.470 -5.280 1.00 0.00 H new ATOM 0 HB VAL A 127 5.103 -4.455 -3.270 1.00 0.00 H new ATOM 0 HG11 VAL A 127 6.201 -6.693 -3.312 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.560 -6.726 -2.622 1.00 0.00 H new ATOM 0 HG13 VAL A 127 4.841 -7.309 -4.280 1.00 0.00 H new ATOM 0 HG21 VAL A 127 6.833 -5.207 -5.011 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.489 -5.638 -6.095 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.753 -3.939 -5.636 1.00 0.00 H new ATOM 1880 N GLU A 128 2.049 -6.441 -3.241 1.00 0.00 N ATOM 1881 CA GLU A 128 1.483 -7.093 -2.073 1.00 0.00 C ATOM 1882 C GLU A 128 2.428 -8.249 -1.745 1.00 0.00 C ATOM 1883 O GLU A 128 2.895 -8.939 -2.653 1.00 0.00 O ATOM 1884 CB GLU A 128 0.052 -7.574 -2.346 1.00 0.00 C ATOM 1885 CG GLU A 128 -0.635 -8.144 -1.097 1.00 0.00 C ATOM 1886 CD GLU A 128 -2.101 -8.509 -1.347 1.00 0.00 C ATOM 1887 OE1 GLU A 128 -2.893 -7.618 -1.729 1.00 0.00 O ATOM 1888 OE2 GLU A 128 -2.472 -9.675 -1.073 1.00 0.00 O ATOM 0 H GLU A 128 2.166 -7.085 -4.024 1.00 0.00 H new ATOM 0 HA GLU A 128 1.400 -6.409 -1.228 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.538 -6.743 -2.732 1.00 0.00 H new ATOM 0 HB3 GLU A 128 0.073 -8.338 -3.124 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.096 -9.030 -0.763 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -0.579 -7.413 -0.290 1.00 0.00 H new ATOM 1895 N TYR A 129 2.722 -8.435 -0.458 1.00 0.00 N ATOM 1896 CA TYR A 129 3.591 -9.471 0.070 1.00 0.00 C ATOM 1897 C TYR A 129 2.767 -10.320 1.027 1.00 0.00 C ATOM 1898 O TYR A 129 2.320 -9.813 2.060 1.00 0.00 O ATOM 1899 CB TYR A 129 4.805 -8.856 0.778 1.00 0.00 C ATOM 1900 CG TYR A 129 5.785 -9.930 1.199 1.00 0.00 C ATOM 1901 CD1 TYR A 129 6.642 -10.470 0.229 1.00 0.00 C ATOM 1902 CD2 TYR A 129 5.764 -10.474 2.499 1.00 0.00 C ATOM 1903 CE1 TYR A 129 7.447 -11.577 0.526 1.00 0.00 C ATOM 1904 CE2 TYR A 129 6.577 -11.582 2.810 1.00 0.00 C ATOM 1905 CZ TYR A 129 7.397 -12.157 1.810 1.00 0.00 C ATOM 1906 OH TYR A 129 8.094 -13.300 2.053 1.00 0.00 O ATOM 0 H TYR A 129 2.340 -7.836 0.274 1.00 0.00 H new ATOM 0 HA TYR A 129 3.979 -10.090 -0.739 1.00 0.00 H new ATOM 0 HB2 TYR A 129 5.299 -8.148 0.113 1.00 0.00 H new ATOM 0 HB3 TYR A 129 4.476 -8.295 1.653 1.00 0.00 H new ATOM 0 HD1 TYR A 129 6.682 -10.028 -0.756 1.00 0.00 H new ATOM 0 HD2 TYR A 129 5.126 -10.042 3.256 1.00 0.00 H new ATOM 0 HE1 TYR A 129 8.105 -11.985 -0.227 1.00 0.00 H new ATOM 0 HE2 TYR A 129 6.574 -11.992 3.809 1.00 0.00 H new ATOM 0 HH TYR A 129 7.959 -13.574 2.984 1.00 0.00 H new ATOM 1916 N ALA A 130 2.542 -11.585 0.664 1.00 0.00 N ATOM 1917 CA ALA A 130 1.709 -12.522 1.395 1.00 0.00 C ATOM 1918 C ALA A 130 2.428 -13.872 1.467 1.00 0.00 C ATOM 1919 O ALA A 130 2.114 -14.794 0.716 1.00 0.00 O ATOM 1920 CB ALA A 130 0.350 -12.626 0.684 1.00 0.00 C ATOM 0 H ALA A 130 2.952 -11.992 -0.177 1.00 0.00 H new ATOM 0 HA ALA A 130 1.532 -12.185 2.416 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -0.289 -13.327 1.221 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -0.125 -11.645 0.662 1.00 0.00 H new ATOM 0 HB3 ALA A 130 0.499 -12.980 -0.336 1.00 0.00 H new ATOM 1926 N ILE A 131 3.361 -14.003 2.417 1.00 0.00 N ATOM 1927 CA ILE A 131 3.932 -15.301 2.774 1.00 0.00 C ATOM 1928 C ILE A 131 2.872 -16.137 3.504 1.00 0.00 C ATOM 1929 O ILE A 131 2.708 -17.324 3.231 1.00 0.00 O ATOM 1930 CB ILE A 131 5.247 -15.110 3.569 1.00 0.00 C ATOM 1931 CG1 ILE A 131 5.982 -16.439 3.844 1.00 0.00 C ATOM 1932 CG2 ILE A 131 5.063 -14.354 4.901 1.00 0.00 C ATOM 1933 CD1 ILE A 131 6.463 -17.148 2.572 1.00 0.00 C ATOM 0 H ILE A 131 3.736 -13.220 2.953 1.00 0.00 H new ATOM 0 HA ILE A 131 4.210 -15.860 1.881 1.00 0.00 H new ATOM 0 HB ILE A 131 5.860 -14.494 2.911 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.840 -16.244 4.488 1.00 0.00 H new ATOM 0 HG13 ILE A 131 5.317 -17.106 4.392 1.00 0.00 H new ATOM 0 HG21 ILE A 131 6.027 -14.259 5.401 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.657 -13.362 4.703 1.00 0.00 H new ATOM 0 HG23 ILE A 131 4.375 -14.907 5.541 1.00 0.00 H new ATOM 0 HD11 ILE A 131 6.970 -18.074 2.841 1.00 0.00 H new ATOM 0 HD12 ILE A 131 5.607 -17.375 1.936 1.00 0.00 H new ATOM 0 HD13 ILE A 131 7.154 -16.500 2.033 1.00 0.00 H new ATOM 1945 N THR A 132 2.110 -15.496 4.392 1.00 0.00 N ATOM 1946 CA THR A 132 0.838 -15.941 4.909 1.00 0.00 C ATOM 1947 C THR A 132 -0.218 -15.519 3.886 1.00 0.00 C ATOM 1948 O THR A 132 -0.412 -14.313 3.719 1.00 0.00 O ATOM 1949 CB THR A 132 0.593 -15.234 6.257 1.00 0.00 C ATOM 1950 OG1 THR A 132 1.216 -13.951 6.301 1.00 0.00 O ATOM 1951 CG2 THR A 132 1.177 -16.061 7.405 1.00 0.00 C ATOM 0 H THR A 132 2.392 -14.599 4.786 1.00 0.00 H new ATOM 0 HA THR A 132 0.805 -17.019 5.067 1.00 0.00 H new ATOM 0 HB THR A 132 -0.486 -15.124 6.360 1.00 0.00 H new ATOM 0 HG1 THR A 132 0.625 -13.286 5.891 1.00 0.00 H new ATOM 0 HG21 THR A 132 0.997 -15.549 8.350 1.00 0.00 H new ATOM 0 HG22 THR A 132 0.701 -17.041 7.426 1.00 0.00 H new ATOM 0 HG23 THR A 132 2.250 -16.182 7.257 1.00 0.00 H new ATOM 1959 N PRO A 133 -0.936 -16.436 3.212 1.00 0.00 N ATOM 1960 CA PRO A 133 -2.090 -16.041 2.414 1.00 0.00 C ATOM 1961 C PRO A 133 -3.153 -15.336 3.273 1.00 0.00 C ATOM 1962 O PRO A 133 -3.919 -14.535 2.739 1.00 0.00 O ATOM 1963 CB PRO A 133 -2.605 -17.327 1.760 1.00 0.00 C ATOM 1964 CG PRO A 133 -2.096 -18.437 2.680 1.00 0.00 C ATOM 1965 CD PRO A 133 -0.770 -17.883 3.199 1.00 0.00 C ATOM 0 HA PRO A 133 -1.825 -15.309 1.651 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -3.693 -17.332 1.692 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -2.221 -17.441 0.746 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -2.794 -18.637 3.493 1.00 0.00 H new ATOM 0 HG3 PRO A 133 -1.957 -19.374 2.141 1.00 0.00 H new ATOM 0 HD2 PRO A 133 -0.549 -18.262 4.197 1.00 0.00 H new ATOM 0 HD3 PRO A 133 0.058 -18.178 2.555 1.00 0.00 H new ATOM 1973 N GLU A 134 -3.165 -15.578 4.591 1.00 0.00 N ATOM 1974 CA GLU A 134 -4.061 -14.977 5.567 1.00 0.00 C ATOM 1975 C GLU A 134 -3.806 -13.488 5.768 1.00 0.00 C ATOM 1976 O GLU A 134 -4.767 -12.752 5.969 1.00 0.00 O ATOM 1977 CB GLU A 134 -3.885 -15.635 6.947 1.00 0.00 C ATOM 1978 CG GLU A 134 -4.181 -17.137 6.991 1.00 0.00 C ATOM 1979 CD GLU A 134 -3.068 -18.045 6.453 1.00 0.00 C ATOM 1980 OE1 GLU A 134 -1.986 -17.522 6.090 1.00 0.00 O ATOM 1981 OE2 GLU A 134 -3.337 -19.265 6.393 1.00 0.00 O ATOM 0 H GLU A 134 -2.512 -16.234 5.019 1.00 0.00 H new ATOM 0 HA GLU A 134 -5.064 -15.129 5.167 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -2.861 -15.472 7.282 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -4.538 -15.130 7.659 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -4.389 -17.419 8.023 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -5.090 -17.328 6.420 1.00 0.00 H new ATOM 1988 N ILE A 135 -2.546 -13.032 5.800 1.00 0.00 N ATOM 1989 CA ILE A 135 -2.223 -11.681 6.259 1.00 0.00 C ATOM 1990 C ILE A 135 -1.030 -11.174 5.463 1.00 0.00 C ATOM 1991 O ILE A 135 -0.050 -11.908 5.306 1.00 0.00 O ATOM 1992 CB ILE A 135 -2.052 -11.630 7.801 1.00 0.00 C ATOM 1993 CG1 ILE A 135 -1.747 -10.190 8.270 1.00 0.00 C ATOM 1994 CG2 ILE A 135 -1.009 -12.622 8.347 1.00 0.00 C ATOM 1995 CD1 ILE A 135 -1.839 -9.989 9.788 1.00 0.00 C ATOM 0 H ILE A 135 -1.736 -13.582 5.513 1.00 0.00 H new ATOM 0 HA ILE A 135 -3.050 -10.997 6.067 1.00 0.00 H new ATOM 0 HB ILE A 135 -3.007 -11.948 8.219 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -0.745 -9.917 7.939 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -2.441 -9.506 7.782 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -0.948 -12.526 9.431 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -1.304 -13.639 8.089 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -0.035 -12.405 7.908 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -1.611 -8.952 10.032 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -2.847 -10.228 10.126 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -1.125 -10.645 10.286 1.00 0.00 H new ATOM 2007 N ALA A 136 -1.137 -9.954 4.919 1.00 0.00 N ATOM 2008 CA ALA A 136 -0.298 -9.522 3.819 1.00 0.00 C ATOM 2009 C ALA A 136 0.011 -8.043 3.967 1.00 0.00 C ATOM 2010 O ALA A 136 -0.842 -7.279 4.421 1.00 0.00 O ATOM 2011 CB ALA A 136 -1.041 -9.773 2.505 1.00 0.00 C ATOM 0 H ALA A 136 -1.806 -9.251 5.234 1.00 0.00 H new ATOM 0 HA ALA A 136 0.639 -10.079 3.821 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -0.420 -9.452 1.669 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -1.259 -10.837 2.408 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -1.974 -9.210 2.501 1.00 0.00 H new ATOM 2017 N THR A 137 1.216 -7.651 3.555 1.00 0.00 N ATOM 2018 CA THR A 137 1.655 -6.259 3.492 1.00 0.00 C ATOM 2019 C THR A 137 1.414 -5.750 2.068 1.00 0.00 C ATOM 2020 O THR A 137 1.482 -6.531 1.122 1.00 0.00 O ATOM 2021 CB THR A 137 3.140 -6.192 3.892 1.00 0.00 C ATOM 2022 OG1 THR A 137 3.301 -6.830 5.142 1.00 0.00 O ATOM 2023 CG2 THR A 137 3.687 -4.768 4.027 1.00 0.00 C ATOM 0 H THR A 137 1.931 -8.310 3.248 1.00 0.00 H new ATOM 0 HA THR A 137 1.098 -5.625 4.181 1.00 0.00 H new ATOM 0 HB THR A 137 3.694 -6.680 3.091 1.00 0.00 H new ATOM 0 HG1 THR A 137 4.244 -6.796 5.408 1.00 0.00 H new ATOM 0 HG21 THR A 137 4.739 -4.808 4.311 1.00 0.00 H new ATOM 0 HG22 THR A 137 3.588 -4.248 3.074 1.00 0.00 H new ATOM 0 HG23 THR A 137 3.124 -4.233 4.792 1.00 0.00 H new ATOM 2031 N ARG A 138 1.181 -4.447 1.894 1.00 0.00 N ATOM 2032 CA ARG A 138 1.060 -3.783 0.601 1.00 0.00 C ATOM 2033 C ARG A 138 1.930 -2.540 0.578 1.00 0.00 C ATOM 2034 O ARG A 138 2.125 -1.899 1.613 1.00 0.00 O ATOM 2035 CB ARG A 138 -0.406 -3.387 0.325 1.00 0.00 C ATOM 2036 CG ARG A 138 -1.148 -4.384 -0.581 1.00 0.00 C ATOM 2037 CD ARG A 138 -1.750 -3.712 -1.822 1.00 0.00 C ATOM 2038 NE ARG A 138 -0.734 -3.222 -2.770 1.00 0.00 N ATOM 2039 CZ ARG A 138 -0.999 -2.615 -3.936 1.00 0.00 C ATOM 2040 NH1 ARG A 138 -2.252 -2.326 -4.306 1.00 0.00 N ATOM 2041 NH2 ARG A 138 0.018 -2.300 -4.739 1.00 0.00 N ATOM 0 H ARG A 138 1.068 -3.806 2.679 1.00 0.00 H new ATOM 0 HA ARG A 138 1.388 -4.477 -0.173 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -0.937 -3.305 1.273 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -0.427 -2.401 -0.139 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -0.459 -5.168 -0.894 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -1.942 -4.867 -0.011 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -2.400 -4.423 -2.332 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -2.376 -2.877 -1.507 1.00 0.00 H new ATOM 0 HE ARG A 138 0.246 -3.355 -2.520 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -3.033 -2.568 -3.696 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -2.427 -1.864 -5.198 1.00 0.00 H new ATOM 0 HH21 ARG A 138 0.974 -2.521 -4.462 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -0.160 -1.838 -5.631 1.00 0.00 H new ATOM 2055 N LEU A 139 2.360 -2.166 -0.629 1.00 0.00 N ATOM 2056 CA LEU A 139 2.898 -0.856 -0.958 1.00 0.00 C ATOM 2057 C LEU A 139 2.406 -0.456 -2.347 1.00 0.00 C ATOM 2058 O LEU A 139 2.134 -1.318 -3.193 1.00 0.00 O ATOM 2059 CB LEU A 139 4.435 -0.854 -0.848 1.00 0.00 C ATOM 2060 CG LEU A 139 5.165 -1.762 -1.867 1.00 0.00 C ATOM 2061 CD1 LEU A 139 5.599 -1.004 -3.131 1.00 0.00 C ATOM 2062 CD2 LEU A 139 6.410 -2.389 -1.229 1.00 0.00 C ATOM 0 H LEU A 139 2.340 -2.796 -1.431 1.00 0.00 H new ATOM 0 HA LEU A 139 2.542 -0.113 -0.245 1.00 0.00 H new ATOM 0 HB2 LEU A 139 4.792 0.168 -0.974 1.00 0.00 H new ATOM 0 HB3 LEU A 139 4.713 -1.167 0.159 1.00 0.00 H new ATOM 0 HG LEU A 139 4.450 -2.532 -2.156 1.00 0.00 H new ATOM 0 HD11 LEU A 139 6.106 -1.689 -3.810 1.00 0.00 H new ATOM 0 HD12 LEU A 139 4.721 -0.587 -3.624 1.00 0.00 H new ATOM 0 HD13 LEU A 139 6.278 -0.197 -2.856 1.00 0.00 H new ATOM 0 HD21 LEU A 139 6.912 -3.025 -1.959 1.00 0.00 H new ATOM 0 HD22 LEU A 139 7.090 -1.600 -0.906 1.00 0.00 H new ATOM 0 HD23 LEU A 139 6.115 -2.988 -0.368 1.00 0.00 H new ATOM 2074 N GLU A 140 2.348 0.852 -2.591 1.00 0.00 N ATOM 2075 CA GLU A 140 2.086 1.462 -3.883 1.00 0.00 C ATOM 2076 C GLU A 140 2.887 2.760 -3.990 1.00 0.00 C ATOM 2077 O GLU A 140 3.168 3.406 -2.978 1.00 0.00 O ATOM 2078 CB GLU A 140 0.578 1.727 -4.054 1.00 0.00 C ATOM 2079 CG GLU A 140 0.102 2.908 -3.193 1.00 0.00 C ATOM 2080 CD GLU A 140 -1.411 2.981 -3.099 1.00 0.00 C ATOM 2081 OE1 GLU A 140 -2.043 3.537 -4.017 1.00 0.00 O ATOM 2082 OE2 GLU A 140 -1.965 2.452 -2.101 1.00 0.00 O ATOM 0 H GLU A 140 2.490 1.544 -1.855 1.00 0.00 H new ATOM 0 HA GLU A 140 2.395 0.786 -4.680 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.362 1.932 -5.103 1.00 0.00 H new ATOM 0 HB3 GLU A 140 0.019 0.831 -3.783 1.00 0.00 H new ATOM 0 HG2 GLU A 140 0.522 2.817 -2.191 1.00 0.00 H new ATOM 0 HG3 GLU A 140 0.483 3.838 -3.614 1.00 0.00 H new ATOM 2089 N TYR A 141 3.169 3.167 -5.226 1.00 0.00 N ATOM 2090 CA TYR A 141 3.663 4.477 -5.598 1.00 0.00 C ATOM 2091 C TYR A 141 2.847 4.959 -6.796 1.00 0.00 C ATOM 2092 O TYR A 141 2.423 4.160 -7.638 1.00 0.00 O ATOM 2093 CB TYR A 141 5.155 4.408 -5.959 1.00 0.00 C ATOM 2094 CG TYR A 141 6.096 4.273 -4.775 1.00 0.00 C ATOM 2095 CD1 TYR A 141 6.310 3.017 -4.174 1.00 0.00 C ATOM 2096 CD2 TYR A 141 6.771 5.408 -4.283 1.00 0.00 C ATOM 2097 CE1 TYR A 141 7.181 2.894 -3.076 1.00 0.00 C ATOM 2098 CE2 TYR A 141 7.653 5.290 -3.195 1.00 0.00 C ATOM 2099 CZ TYR A 141 7.856 4.034 -2.582 1.00 0.00 C ATOM 2100 OH TYR A 141 8.703 3.932 -1.519 1.00 0.00 O ATOM 0 H TYR A 141 3.050 2.554 -6.033 1.00 0.00 H new ATOM 0 HA TYR A 141 3.558 5.170 -4.764 1.00 0.00 H new ATOM 0 HB2 TYR A 141 5.313 3.562 -6.628 1.00 0.00 H new ATOM 0 HB3 TYR A 141 5.421 5.307 -6.515 1.00 0.00 H new ATOM 0 HD1 TYR A 141 5.803 2.144 -4.558 1.00 0.00 H new ATOM 0 HD2 TYR A 141 6.610 6.372 -4.743 1.00 0.00 H new ATOM 0 HE1 TYR A 141 7.334 1.931 -2.612 1.00 0.00 H new ATOM 0 HE2 TYR A 141 8.176 6.161 -2.827 1.00 0.00 H new ATOM 0 HH TYR A 141 9.080 4.813 -1.315 1.00 0.00 H new ATOM 2110 N GLN A 142 2.679 6.277 -6.892 1.00 0.00 N ATOM 2111 CA GLN A 142 2.165 6.978 -8.055 1.00 0.00 C ATOM 2112 C GLN A 142 3.038 8.202 -8.319 1.00 0.00 C ATOM 2113 O GLN A 142 3.799 8.639 -7.452 1.00 0.00 O ATOM 2114 CB GLN A 142 0.698 7.388 -7.847 1.00 0.00 C ATOM 2115 CG GLN A 142 0.472 8.374 -6.689 1.00 0.00 C ATOM 2116 CD GLN A 142 -0.885 9.062 -6.796 1.00 0.00 C ATOM 2117 OE1 GLN A 142 -1.847 8.677 -6.144 1.00 0.00 O ATOM 2118 NE2 GLN A 142 -0.981 10.102 -7.616 1.00 0.00 N ATOM 0 H GLN A 142 2.909 6.908 -6.124 1.00 0.00 H new ATOM 0 HA GLN A 142 2.197 6.315 -8.919 1.00 0.00 H new ATOM 0 HB2 GLN A 142 0.325 7.836 -8.768 1.00 0.00 H new ATOM 0 HB3 GLN A 142 0.105 6.491 -7.666 1.00 0.00 H new ATOM 0 HG2 GLN A 142 0.538 7.843 -5.740 1.00 0.00 H new ATOM 0 HG3 GLN A 142 1.262 9.125 -6.690 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -0.167 10.407 -8.150 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -1.868 10.596 -7.711 1.00 0.00 H new ATOM 2127 N PHE A 143 2.857 8.809 -9.489 1.00 0.00 N ATOM 2128 CA PHE A 143 3.416 10.114 -9.796 1.00 0.00 C ATOM 2129 C PHE A 143 2.476 11.197 -9.245 1.00 0.00 C ATOM 2130 O PHE A 143 1.297 10.936 -8.986 1.00 0.00 O ATOM 2131 CB PHE A 143 3.573 10.199 -11.320 1.00 0.00 C ATOM 2132 CG PHE A 143 4.267 11.428 -11.877 1.00 0.00 C ATOM 2133 CD1 PHE A 143 5.481 11.892 -11.329 1.00 0.00 C ATOM 2134 CD2 PHE A 143 3.736 12.056 -13.021 1.00 0.00 C ATOM 2135 CE1 PHE A 143 6.157 12.970 -11.927 1.00 0.00 C ATOM 2136 CE2 PHE A 143 4.422 13.119 -13.628 1.00 0.00 C ATOM 2137 CZ PHE A 143 5.635 13.572 -13.086 1.00 0.00 C ATOM 0 H PHE A 143 2.315 8.404 -10.252 1.00 0.00 H new ATOM 0 HA PHE A 143 4.392 10.265 -9.334 1.00 0.00 H new ATOM 0 HB2 PHE A 143 4.124 9.320 -11.653 1.00 0.00 H new ATOM 0 HB3 PHE A 143 2.580 10.140 -11.766 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.892 11.419 -10.449 1.00 0.00 H new ATOM 0 HD2 PHE A 143 2.797 11.718 -13.433 1.00 0.00 H new ATOM 0 HE1 PHE A 143 7.077 13.336 -11.496 1.00 0.00 H new ATOM 0 HE2 PHE A 143 4.017 13.589 -14.512 1.00 0.00 H new ATOM 0 HZ PHE A 143 6.168 14.383 -13.559 1.00 0.00 H new ATOM 2372 N GLY A 160 7.349 11.015 -6.387 1.00 0.00 N ATOM 2373 CA GLY A 160 6.104 10.275 -6.393 1.00 0.00 C ATOM 2374 C GLY A 160 5.436 10.399 -5.025 1.00 0.00 C ATOM 2375 O GLY A 160 6.077 10.794 -4.045 1.00 0.00 O ATOM 0 HA2 GLY A 160 5.443 10.660 -7.169 1.00 0.00 H new ATOM 0 HA3 GLY A 160 6.292 9.227 -6.625 1.00 0.00 H new ATOM 2379 N MET A 161 4.157 10.035 -4.965 1.00 0.00 N ATOM 2380 CA MET A 161 3.398 9.860 -3.732 1.00 0.00 C ATOM 2381 C MET A 161 3.262 8.353 -3.515 1.00 0.00 C ATOM 2382 O MET A 161 3.198 7.604 -4.491 1.00 0.00 O ATOM 2383 CB MET A 161 2.042 10.573 -3.872 1.00 0.00 C ATOM 2384 CG MET A 161 1.125 10.407 -2.656 1.00 0.00 C ATOM 2385 SD MET A 161 -0.368 11.428 -2.740 1.00 0.00 S ATOM 2386 CE MET A 161 -0.876 11.371 -1.002 1.00 0.00 C ATOM 0 H MET A 161 3.604 9.848 -5.801 1.00 0.00 H new ATOM 0 HA MET A 161 3.890 10.300 -2.864 1.00 0.00 H new ATOM 0 HB2 MET A 161 2.217 11.636 -4.040 1.00 0.00 H new ATOM 0 HB3 MET A 161 1.531 10.190 -4.755 1.00 0.00 H new ATOM 0 HG2 MET A 161 0.836 9.360 -2.568 1.00 0.00 H new ATOM 0 HG3 MET A 161 1.680 10.661 -1.753 1.00 0.00 H new ATOM 0 HE1 MET A 161 -1.788 11.953 -0.870 1.00 0.00 H new ATOM 0 HE2 MET A 161 -1.060 10.337 -0.710 1.00 0.00 H new ATOM 0 HE3 MET A 161 -0.086 11.789 -0.378 1.00 0.00 H new ATOM 2396 N LEU A 162 3.221 7.905 -2.257 1.00 0.00 N ATOM 2397 CA LEU A 162 3.176 6.486 -1.911 1.00 0.00 C ATOM 2398 C LEU A 162 2.070 6.194 -0.909 1.00 0.00 C ATOM 2399 O LEU A 162 1.635 7.088 -0.175 1.00 0.00 O ATOM 2400 CB LEU A 162 4.560 6.018 -1.414 1.00 0.00 C ATOM 2401 CG LEU A 162 5.012 6.558 -0.037 1.00 0.00 C ATOM 2402 CD1 LEU A 162 4.543 5.691 1.146 1.00 0.00 C ATOM 2403 CD2 LEU A 162 6.544 6.637 0.016 1.00 0.00 C ATOM 0 H LEU A 162 3.218 8.523 -1.446 1.00 0.00 H new ATOM 0 HA LEU A 162 2.935 5.913 -2.807 1.00 0.00 H new ATOM 0 HB2 LEU A 162 4.558 4.929 -1.370 1.00 0.00 H new ATOM 0 HB3 LEU A 162 5.305 6.306 -2.156 1.00 0.00 H new ATOM 0 HG LEU A 162 4.553 7.542 0.063 1.00 0.00 H new ATOM 0 HD11 LEU A 162 4.896 6.129 2.080 1.00 0.00 H new ATOM 0 HD12 LEU A 162 3.454 5.646 1.155 1.00 0.00 H new ATOM 0 HD13 LEU A 162 4.947 4.684 1.042 1.00 0.00 H new ATOM 0 HD21 LEU A 162 6.855 7.018 0.989 1.00 0.00 H new ATOM 0 HD22 LEU A 162 6.965 5.643 -0.136 1.00 0.00 H new ATOM 0 HD23 LEU A 162 6.901 7.306 -0.767 1.00 0.00 H new ATOM 2415 N SER A 163 1.687 4.917 -0.834 1.00 0.00 N ATOM 2416 CA SER A 163 0.912 4.350 0.259 1.00 0.00 C ATOM 2417 C SER A 163 1.489 2.974 0.602 1.00 0.00 C ATOM 2418 O SER A 163 2.196 2.362 -0.203 1.00 0.00 O ATOM 2419 CB SER A 163 -0.602 4.398 -0.051 1.00 0.00 C ATOM 2420 OG SER A 163 -1.287 3.165 0.090 1.00 0.00 O ATOM 0 H SER A 163 1.917 4.234 -1.556 1.00 0.00 H new ATOM 0 HA SER A 163 0.999 4.947 1.167 1.00 0.00 H new ATOM 0 HB2 SER A 163 -1.068 5.131 0.607 1.00 0.00 H new ATOM 0 HB3 SER A 163 -0.736 4.755 -1.072 1.00 0.00 H new ATOM 0 HG SER A 163 -1.936 3.066 -0.637 1.00 0.00 H new ATOM 2426 N LEU A 164 1.224 2.512 1.824 1.00 0.00 N ATOM 2427 CA LEU A 164 1.600 1.200 2.327 1.00 0.00 C ATOM 2428 C LEU A 164 0.562 0.752 3.347 1.00 0.00 C ATOM 2429 O LEU A 164 -0.106 1.590 3.952 1.00 0.00 O ATOM 2430 CB LEU A 164 3.032 1.230 2.898 1.00 0.00 C ATOM 2431 CG LEU A 164 3.262 2.169 4.108 1.00 0.00 C ATOM 2432 CD1 LEU A 164 2.996 1.484 5.459 1.00 0.00 C ATOM 2433 CD2 LEU A 164 4.714 2.668 4.106 1.00 0.00 C ATOM 0 H LEU A 164 0.721 3.068 2.515 1.00 0.00 H new ATOM 0 HA LEU A 164 1.613 0.469 1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 164 3.305 0.217 3.193 1.00 0.00 H new ATOM 0 HB3 LEU A 164 3.714 1.525 2.100 1.00 0.00 H new ATOM 0 HG LEU A 164 2.555 2.992 3.999 1.00 0.00 H new ATOM 0 HD11 LEU A 164 3.174 2.193 6.268 1.00 0.00 H new ATOM 0 HD12 LEU A 164 1.961 1.143 5.497 1.00 0.00 H new ATOM 0 HD13 LEU A 164 3.664 0.630 5.572 1.00 0.00 H new ATOM 0 HD21 LEU A 164 4.873 3.328 4.958 1.00 0.00 H new ATOM 0 HD22 LEU A 164 5.391 1.817 4.175 1.00 0.00 H new ATOM 0 HD23 LEU A 164 4.910 3.213 3.183 1.00 0.00 H new ATOM 2445 N GLY A 165 0.433 -0.557 3.557 1.00 0.00 N ATOM 2446 CA GLY A 165 -0.532 -1.105 4.497 1.00 0.00 C ATOM 2447 C GLY A 165 -0.237 -2.554 4.846 1.00 0.00 C ATOM 2448 O GLY A 165 0.663 -3.166 4.273 1.00 0.00 O ATOM 0 H GLY A 165 0.995 -1.262 3.080 1.00 0.00 H new ATOM 0 HA2 GLY A 165 -0.529 -0.506 5.408 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -1.533 -1.033 4.071 1.00 0.00 H new ATOM 2452 N VAL A 166 -1.014 -3.106 5.778 1.00 0.00 N ATOM 2453 CA VAL A 166 -1.033 -4.529 6.107 1.00 0.00 C ATOM 2454 C VAL A 166 -2.494 -4.927 6.326 1.00 0.00 C ATOM 2455 O VAL A 166 -3.264 -4.094 6.815 1.00 0.00 O ATOM 2456 CB VAL A 166 -0.101 -4.807 7.311 1.00 0.00 C ATOM 2457 CG1 VAL A 166 -0.542 -4.098 8.603 1.00 0.00 C ATOM 2458 CG2 VAL A 166 0.061 -6.310 7.581 1.00 0.00 C ATOM 0 H VAL A 166 -1.666 -2.559 6.340 1.00 0.00 H new ATOM 0 HA VAL A 166 -0.639 -5.148 5.301 1.00 0.00 H new ATOM 0 HB VAL A 166 0.863 -4.391 7.018 1.00 0.00 H new ATOM 0 HG11 VAL A 166 0.156 -4.337 9.406 1.00 0.00 H new ATOM 0 HG12 VAL A 166 -0.553 -3.020 8.441 1.00 0.00 H new ATOM 0 HG13 VAL A 166 -1.541 -4.434 8.879 1.00 0.00 H new ATOM 0 HG21 VAL A 166 0.723 -6.457 8.434 1.00 0.00 H new ATOM 0 HG22 VAL A 166 -0.913 -6.748 7.798 1.00 0.00 H new ATOM 0 HG23 VAL A 166 0.488 -6.793 6.703 1.00 0.00 H new ATOM 2468 N SER A 167 -2.905 -6.151 5.952 1.00 0.00 N ATOM 2469 CA SER A 167 -4.301 -6.558 6.093 1.00 0.00 C ATOM 2470 C SER A 167 -4.411 -8.069 6.222 1.00 0.00 C ATOM 2471 O SER A 167 -3.570 -8.784 5.682 1.00 0.00 O ATOM 2472 CB SER A 167 -5.114 -6.048 4.894 1.00 0.00 C ATOM 2473 OG SER A 167 -4.533 -6.433 3.663 1.00 0.00 O ATOM 0 H SER A 167 -2.293 -6.864 5.555 1.00 0.00 H new ATOM 0 HA SER A 167 -4.708 -6.118 7.003 1.00 0.00 H new ATOM 0 HB2 SER A 167 -6.131 -6.436 4.953 1.00 0.00 H new ATOM 0 HB3 SER A 167 -5.184 -4.961 4.939 1.00 0.00 H new ATOM 0 HG SER A 167 -4.867 -5.852 2.948 1.00 0.00 H new ATOM 2479 N TYR A 168 -5.458 -8.528 6.912 1.00 0.00 N ATOM 2480 CA TYR A 168 -5.831 -9.925 7.087 1.00 0.00 C ATOM 2481 C TYR A 168 -7.059 -10.224 6.223 1.00 0.00 C ATOM 2482 O TYR A 168 -7.900 -9.343 6.034 1.00 0.00 O ATOM 2483 CB TYR A 168 -6.120 -10.194 8.576 1.00 0.00 C ATOM 2484 CG TYR A 168 -6.891 -11.477 8.840 1.00 0.00 C ATOM 2485 CD1 TYR A 168 -6.225 -12.718 8.876 1.00 0.00 C ATOM 2486 CD2 TYR A 168 -8.295 -11.434 8.960 1.00 0.00 C ATOM 2487 CE1 TYR A 168 -6.957 -13.912 9.018 1.00 0.00 C ATOM 2488 CE2 TYR A 168 -9.032 -12.624 9.093 1.00 0.00 C ATOM 2489 CZ TYR A 168 -8.367 -13.870 9.111 1.00 0.00 C ATOM 2490 OH TYR A 168 -9.095 -15.017 9.196 1.00 0.00 O ATOM 0 H TYR A 168 -6.101 -7.896 7.388 1.00 0.00 H new ATOM 0 HA TYR A 168 -5.017 -10.579 6.774 1.00 0.00 H new ATOM 0 HB2 TYR A 168 -5.174 -10.234 9.116 1.00 0.00 H new ATOM 0 HB3 TYR A 168 -6.684 -9.354 8.982 1.00 0.00 H new ATOM 0 HD1 TYR A 168 -5.149 -12.753 8.794 1.00 0.00 H new ATOM 0 HD2 TYR A 168 -8.807 -10.483 8.950 1.00 0.00 H new ATOM 0 HE1 TYR A 168 -6.441 -14.860 9.056 1.00 0.00 H new ATOM 0 HE2 TYR A 168 -10.108 -12.585 9.181 1.00 0.00 H new ATOM 0 HH TYR A 168 -10.048 -14.796 9.254 1.00 0.00 H new ATOM 2500 N ARG A 169 -7.182 -11.472 5.756 1.00 0.00 N ATOM 2501 CA ARG A 169 -8.327 -12.043 5.057 1.00 0.00 C ATOM 2502 C ARG A 169 -8.565 -13.474 5.530 1.00 0.00 C ATOM 2503 O ARG A 169 -7.636 -14.170 5.935 1.00 0.00 O ATOM 2504 CB ARG A 169 -8.120 -12.066 3.529 1.00 0.00 C ATOM 2505 CG ARG A 169 -6.768 -12.592 3.018 1.00 0.00 C ATOM 2506 CD ARG A 169 -5.705 -11.489 2.936 1.00 0.00 C ATOM 2507 NE ARG A 169 -4.566 -11.933 2.127 1.00 0.00 N ATOM 2508 CZ ARG A 169 -3.973 -11.258 1.136 1.00 0.00 C ATOM 2509 NH1 ARG A 169 -4.300 -10.004 0.833 1.00 0.00 N ATOM 2510 NH2 ARG A 169 -3.022 -11.824 0.404 1.00 0.00 N ATOM 0 H ARG A 169 -6.430 -12.152 5.867 1.00 0.00 H new ATOM 0 HA ARG A 169 -9.186 -11.412 5.284 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -8.909 -12.675 3.089 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -8.253 -11.052 3.153 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -6.416 -13.384 3.679 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -6.903 -13.037 2.032 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -6.139 -10.589 2.500 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -5.366 -11.227 3.938 1.00 0.00 H new ATOM 0 HE ARG A 169 -4.185 -12.854 2.343 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -5.026 -9.524 1.364 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -3.824 -9.523 0.070 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -2.736 -12.784 0.594 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -2.577 -11.299 -0.349 1.00 0.00 H new ATOM 2524 N PHE A 170 -9.808 -13.927 5.371 1.00 0.00 N ATOM 2525 CA PHE A 170 -10.152 -15.342 5.340 1.00 0.00 C ATOM 2526 C PHE A 170 -9.538 -15.959 4.069 1.00 0.00 C ATOM 2527 O PHE A 170 -9.380 -15.259 3.065 1.00 0.00 O ATOM 2528 CB PHE A 170 -11.684 -15.425 5.339 1.00 0.00 C ATOM 2529 CG PHE A 170 -12.284 -16.803 5.533 1.00 0.00 C ATOM 2530 CD1 PHE A 170 -12.492 -17.643 4.425 1.00 0.00 C ATOM 2531 CD2 PHE A 170 -12.693 -17.222 6.814 1.00 0.00 C ATOM 2532 CE1 PHE A 170 -13.092 -18.902 4.597 1.00 0.00 C ATOM 2533 CE2 PHE A 170 -13.303 -18.478 6.984 1.00 0.00 C ATOM 2534 CZ PHE A 170 -13.499 -19.320 5.875 1.00 0.00 C ATOM 0 H PHE A 170 -10.613 -13.311 5.259 1.00 0.00 H new ATOM 0 HA PHE A 170 -9.764 -15.893 6.197 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -12.062 -14.774 6.127 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -12.047 -15.024 4.393 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -12.190 -17.320 3.440 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -12.538 -16.578 7.667 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -13.240 -19.549 3.745 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -13.621 -18.796 7.966 1.00 0.00 H new ATOM 0 HZ PHE A 170 -13.962 -20.287 6.006 1.00 0.00 H new