USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 754 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 67 MET CE :methyl -135:sc= -5.83! (180deg=-7.53!) USER MOD Set 1.2: A 111 MET CE :methyl 169:sc= -3.8 (180deg=-2.64) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 MET CE :methyl 170:sc= -0.0127 (180deg=-0.19) USER MOD Single : A 20 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.033) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot -140:sc= 0.424 USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot -62:sc= -0.507 USER MOD Single : A 72 SER OG : rot 80:sc= 0.971 USER MOD Single : A 74 ASN : amide:sc= -0.126 K(o=-0.13,f=-1.2!) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.261 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 69:sc= 2.12 USER MOD Single : A 84 THR OG1 : rot -23:sc= 1.23 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.0524 X(o=-0.052,f=0) USER MOD Single : A 90 SER OG : rot 120:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -0.357 X(o=-0.36,f=-0.55) USER MOD Single : A 95 ASN : amide:sc= -0.2 X(o=-0.2,f=-0.36) USER MOD Single : A 96 TYR OH : rot 30:sc= -0.627 USER MOD Single : A 99 GLN :FLIP amide:sc= -1.49 F(o=-2.1,f=-1.5) USER MOD Single : A 105 SER OG : rot -93:sc= 0.671 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -0.194 K(o=-0.19,f=-1.4!) USER MOD Single : A 131 CYS SG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 4.070 4.360 -7.126 1.00 72.43 N ATOM 70 CA LYS A 4 5.429 4.788 -6.820 1.00 25.20 C ATOM 71 C LYS A 4 6.073 3.861 -5.794 1.00 4.34 C ATOM 72 O LYS A 4 6.653 4.318 -4.808 1.00 43.34 O ATOM 73 CB LYS A 4 5.427 6.225 -6.295 1.00 3.23 C ATOM 74 CG LYS A 4 4.468 6.449 -5.138 1.00 61.24 C ATOM 75 CD LYS A 4 5.088 7.323 -4.061 1.00 32.32 C ATOM 76 CE LYS A 4 4.179 8.487 -3.696 1.00 61.51 C ATOM 77 NZ LYS A 4 4.099 8.687 -2.223 1.00 11.13 N ATOM 0 HA LYS A 4 6.013 4.745 -7.739 1.00 25.20 H new ATOM 0 HB2 LYS A 4 6.436 6.488 -5.976 1.00 3.23 H new ATOM 0 HB3 LYS A 4 5.164 6.900 -7.109 1.00 3.23 H new ATOM 0 HG2 LYS A 4 3.555 6.917 -5.506 1.00 61.24 H new ATOM 0 HG3 LYS A 4 4.183 5.488 -4.709 1.00 61.24 H new ATOM 0 HD2 LYS A 4 5.286 6.723 -3.173 1.00 32.32 H new ATOM 0 HD3 LYS A 4 6.048 7.705 -4.409 1.00 32.32 H new ATOM 0 HE2 LYS A 4 4.549 9.398 -4.167 1.00 61.51 H new ATOM 0 HE3 LYS A 4 3.180 8.306 -4.093 1.00 61.51 H new ATOM 0 HZ1 LYS A 4 3.470 9.489 -2.015 1.00 11.13 H new ATOM 0 HZ2 LYS A 4 3.722 7.827 -1.776 1.00 11.13 H new ATOM 0 HZ3 LYS A 4 5.048 8.885 -1.847 1.00 11.13 H new ATOM 91 N ASP A 5 5.969 2.559 -6.032 1.00 31.44 N ATOM 92 CA ASP A 5 6.544 1.568 -5.129 1.00 35.20 C ATOM 93 C ASP A 5 8.053 1.466 -5.323 1.00 42.43 C ATOM 94 O ASP A 5 8.569 0.420 -5.717 1.00 41.02 O ATOM 95 CB ASP A 5 5.895 0.202 -5.357 1.00 74.30 C ATOM 96 CG ASP A 5 5.901 -0.658 -4.108 1.00 52.12 C ATOM 97 OD1 ASP A 5 6.771 -0.437 -3.240 1.00 14.24 O ATOM 98 OD2 ASP A 5 5.035 -1.551 -3.999 1.00 63.21 O ATOM 0 H ASP A 5 5.492 2.164 -6.843 1.00 31.44 H new ATOM 0 HA ASP A 5 6.348 1.889 -4.106 1.00 35.20 H new ATOM 0 HB2 ASP A 5 4.868 0.343 -5.693 1.00 74.30 H new ATOM 0 HB3 ASP A 5 6.423 -0.319 -6.156 1.00 74.30 H new ATOM 103 N ILE A 6 8.755 2.560 -5.046 1.00 30.03 N ATOM 104 CA ILE A 6 10.205 2.594 -5.190 1.00 60.41 C ATOM 105 C ILE A 6 10.886 2.826 -3.846 1.00 1.13 C ATOM 106 O ILE A 6 10.267 3.317 -2.902 1.00 3.15 O ATOM 107 CB ILE A 6 10.647 3.693 -6.174 1.00 24.11 C ATOM 108 CG1 ILE A 6 9.792 4.948 -5.989 1.00 21.04 C ATOM 109 CG2 ILE A 6 10.556 3.190 -7.607 1.00 33.43 C ATOM 110 CD1 ILE A 6 9.977 5.612 -4.642 1.00 45.12 C ATOM 0 H ILE A 6 8.343 3.434 -4.721 1.00 30.03 H new ATOM 0 HA ILE A 6 10.506 1.623 -5.583 1.00 60.41 H new ATOM 0 HB ILE A 6 11.686 3.950 -5.965 1.00 24.11 H new ATOM 0 HG12 ILE A 6 10.036 5.663 -6.774 1.00 21.04 H new ATOM 0 HG13 ILE A 6 8.742 4.684 -6.114 1.00 21.04 H new ATOM 0 HG21 ILE A 6 10.872 3.979 -8.290 1.00 33.43 H new ATOM 0 HG22 ILE A 6 11.204 2.322 -7.730 1.00 33.43 H new ATOM 0 HG23 ILE A 6 9.527 2.908 -7.829 1.00 33.43 H new ATOM 0 HD11 ILE A 6 9.340 6.495 -4.581 1.00 45.12 H new ATOM 0 HD12 ILE A 6 9.705 4.913 -3.851 1.00 45.12 H new ATOM 0 HD13 ILE A 6 11.019 5.907 -4.522 1.00 45.12 H new ATOM 122 N ARG A 7 12.165 2.471 -3.767 1.00 54.52 N ATOM 123 CA ARG A 7 12.931 2.642 -2.538 1.00 74.05 C ATOM 124 C ARG A 7 13.425 4.079 -2.401 1.00 15.12 C ATOM 125 O ARG A 7 14.623 4.323 -2.261 1.00 41.44 O ATOM 126 CB ARG A 7 14.119 1.679 -2.515 1.00 73.42 C ATOM 127 CG ARG A 7 13.748 0.264 -2.102 1.00 34.24 C ATOM 128 CD ARG A 7 14.189 -0.034 -0.677 1.00 52.01 C ATOM 129 NE ARG A 7 15.402 -0.846 -0.638 1.00 71.24 N ATOM 130 CZ ARG A 7 15.422 -2.150 -0.890 1.00 75.34 C ATOM 131 NH1 ARG A 7 14.300 -2.786 -1.198 1.00 73.33 N ATOM 132 NH2 ARG A 7 16.565 -2.821 -0.835 1.00 43.33 N ATOM 0 H ARG A 7 12.692 2.063 -4.539 1.00 54.52 H new ATOM 0 HA ARG A 7 12.275 2.420 -1.696 1.00 74.05 H new ATOM 0 HB2 ARG A 7 14.573 1.652 -3.505 1.00 73.42 H new ATOM 0 HB3 ARG A 7 14.874 2.063 -1.829 1.00 73.42 H new ATOM 0 HG2 ARG A 7 12.669 0.130 -2.186 1.00 34.24 H new ATOM 0 HG3 ARG A 7 14.212 -0.449 -2.784 1.00 34.24 H new ATOM 0 HD2 ARG A 7 14.363 0.903 -0.148 1.00 52.01 H new ATOM 0 HD3 ARG A 7 13.388 -0.553 -0.151 1.00 52.01 H new ATOM 0 HE ARG A 7 16.282 -0.387 -0.404 1.00 71.24 H new ATOM 0 HH11 ARG A 7 13.419 -2.274 -1.242 1.00 73.33 H new ATOM 0 HH12 ARG A 7 14.318 -3.787 -1.391 1.00 73.33 H new ATOM 0 HH21 ARG A 7 17.430 -2.336 -0.599 1.00 43.33 H new ATOM 0 HH22 ARG A 7 16.578 -3.822 -1.029 1.00 43.33 H new ATOM 146 N ASP A 8 12.493 5.026 -2.441 1.00 63.44 N ATOM 147 CA ASP A 8 12.833 6.439 -2.321 1.00 25.44 C ATOM 148 C ASP A 8 13.975 6.805 -3.264 1.00 54.33 C ATOM 149 O ASP A 8 14.965 7.410 -2.852 1.00 33.02 O ATOM 150 CB ASP A 8 13.221 6.770 -0.879 1.00 12.43 C ATOM 151 CG ASP A 8 12.132 6.408 0.111 1.00 35.14 C ATOM 152 OD1 ASP A 8 11.192 7.213 0.282 1.00 42.30 O ATOM 153 OD2 ASP A 8 12.218 5.318 0.715 1.00 11.42 O ATOM 0 H ASP A 8 11.497 4.840 -2.556 1.00 63.44 H new ATOM 0 HA ASP A 8 11.956 7.024 -2.597 1.00 25.44 H new ATOM 0 HB2 ASP A 8 14.135 6.236 -0.620 1.00 12.43 H new ATOM 0 HB3 ASP A 8 13.440 7.835 -0.800 1.00 12.43 H new ATOM 158 N TYR A 9 13.830 6.435 -4.532 1.00 34.24 N ATOM 159 CA TYR A 9 14.850 6.722 -5.533 1.00 74.52 C ATOM 160 C TYR A 9 16.188 6.104 -5.140 1.00 2.32 C ATOM 161 O TYR A 9 17.197 6.800 -5.033 1.00 64.43 O ATOM 162 CB TYR A 9 15.006 8.232 -5.715 1.00 13.34 C ATOM 163 CG TYR A 9 13.689 8.972 -5.795 1.00 62.31 C ATOM 164 CD1 TYR A 9 13.044 9.409 -4.645 1.00 74.40 C ATOM 165 CD2 TYR A 9 13.091 9.234 -7.022 1.00 4.23 C ATOM 166 CE1 TYR A 9 11.840 10.084 -4.714 1.00 64.30 C ATOM 167 CE2 TYR A 9 11.889 9.910 -7.100 1.00 61.13 C ATOM 168 CZ TYR A 9 11.267 10.332 -5.944 1.00 3.22 C ATOM 169 OH TYR A 9 10.070 11.006 -6.017 1.00 35.32 O ATOM 0 H TYR A 9 13.016 5.936 -4.890 1.00 34.24 H new ATOM 0 HA TYR A 9 14.530 6.281 -6.477 1.00 74.52 H new ATOM 0 HB2 TYR A 9 15.588 8.631 -4.884 1.00 13.34 H new ATOM 0 HB3 TYR A 9 15.576 8.423 -6.624 1.00 13.34 H new ATOM 0 HD1 TYR A 9 13.491 9.218 -3.681 1.00 74.40 H new ATOM 0 HD2 TYR A 9 13.574 8.904 -7.930 1.00 4.23 H new ATOM 0 HE1 TYR A 9 11.351 10.415 -3.810 1.00 64.30 H new ATOM 0 HE2 TYR A 9 11.439 10.107 -8.062 1.00 61.13 H new ATOM 0 HH TYR A 9 9.804 11.100 -6.956 1.00 35.32 H new ATOM 179 N ASN A 10 16.187 4.793 -4.926 1.00 24.42 N ATOM 180 CA ASN A 10 17.401 4.080 -4.544 1.00 61.42 C ATOM 181 C ASN A 10 17.770 3.034 -5.592 1.00 33.52 C ATOM 182 O ASN A 10 18.704 3.223 -6.371 1.00 20.42 O ATOM 183 CB ASN A 10 17.217 3.410 -3.181 1.00 73.30 C ATOM 184 CG ASN A 10 18.443 2.628 -2.750 1.00 51.24 C ATOM 185 OD1 ASN A 10 19.507 3.201 -2.516 1.00 62.02 O ATOM 186 ND2 ASN A 10 18.298 1.312 -2.644 1.00 45.33 N ATOM 0 H ASN A 10 15.360 4.202 -5.010 1.00 24.42 H new ATOM 0 HA ASN A 10 18.213 4.805 -4.478 1.00 61.42 H new ATOM 0 HB2 ASN A 10 16.993 4.170 -2.433 1.00 73.30 H new ATOM 0 HB3 ASN A 10 16.358 2.740 -3.222 1.00 73.30 H new ATOM 0 HD21 ASN A 10 19.088 0.733 -2.358 1.00 45.33 H new ATOM 0 HD22 ASN A 10 17.397 0.880 -2.848 1.00 45.33 H new ATOM 193 N ASP A 11 17.029 1.931 -5.605 1.00 21.24 N ATOM 194 CA ASP A 11 17.276 0.855 -6.557 1.00 62.23 C ATOM 195 C ASP A 11 16.065 -0.066 -6.664 1.00 15.14 C ATOM 196 O ASP A 11 16.161 -1.266 -6.411 1.00 71.53 O ATOM 197 CB ASP A 11 18.509 0.050 -6.142 1.00 12.11 C ATOM 198 CG ASP A 11 19.799 0.666 -6.646 1.00 2.11 C ATOM 199 OD1 ASP A 11 19.906 0.904 -7.867 1.00 61.04 O ATOM 200 OD2 ASP A 11 20.702 0.911 -5.819 1.00 12.13 O ATOM 0 H ASP A 11 16.252 1.759 -4.967 1.00 21.24 H new ATOM 0 HA ASP A 11 17.456 1.303 -7.534 1.00 62.23 H new ATOM 0 HB2 ASP A 11 18.544 -0.021 -5.055 1.00 12.11 H new ATOM 0 HB3 ASP A 11 18.421 -0.967 -6.525 1.00 12.11 H new ATOM 205 N ALA A 12 14.925 0.506 -7.038 1.00 35.32 N ATOM 206 CA ALA A 12 13.694 -0.264 -7.178 1.00 44.43 C ATOM 207 C ALA A 12 13.764 -1.196 -8.383 1.00 43.42 C ATOM 208 O ALA A 12 13.235 -2.307 -8.352 1.00 5.12 O ATOM 209 CB ALA A 12 12.499 0.670 -7.299 1.00 61.04 C ATOM 0 H ALA A 12 14.828 1.499 -7.249 1.00 35.32 H new ATOM 0 HA ALA A 12 13.573 -0.877 -6.285 1.00 44.43 H new ATOM 0 HB1 ALA A 12 11.587 0.082 -7.403 1.00 61.04 H new ATOM 0 HB2 ALA A 12 12.431 1.291 -6.406 1.00 61.04 H new ATOM 0 HB3 ALA A 12 12.622 1.307 -8.175 1.00 61.04 H new ATOM 215 N ASP A 13 14.419 -0.736 -9.444 1.00 1.24 N ATOM 216 CA ASP A 13 14.558 -1.529 -10.659 1.00 43.14 C ATOM 217 C ASP A 13 15.141 -2.904 -10.348 1.00 2.25 C ATOM 218 O ASP A 13 14.712 -3.912 -10.907 1.00 71.13 O ATOM 219 CB ASP A 13 15.447 -0.802 -11.669 1.00 42.54 C ATOM 220 CG ASP A 13 16.640 -0.132 -11.015 1.00 33.43 C ATOM 221 OD1 ASP A 13 17.556 -0.855 -10.569 1.00 35.51 O ATOM 222 OD2 ASP A 13 16.658 1.114 -10.949 1.00 13.33 O ATOM 0 H ASP A 13 14.862 0.182 -9.487 1.00 1.24 H new ATOM 0 HA ASP A 13 13.566 -1.664 -11.090 1.00 43.14 H new ATOM 0 HB2 ASP A 13 15.798 -1.513 -12.417 1.00 42.54 H new ATOM 0 HB3 ASP A 13 14.856 -0.052 -12.195 1.00 42.54 H new ATOM 227 N MET A 14 16.122 -2.936 -9.451 1.00 42.54 N ATOM 228 CA MET A 14 16.764 -4.187 -9.065 1.00 52.04 C ATOM 229 C MET A 14 15.769 -5.120 -8.383 1.00 74.33 C ATOM 230 O MET A 14 15.932 -6.340 -8.405 1.00 1.21 O ATOM 231 CB MET A 14 17.945 -3.913 -8.133 1.00 2.31 C ATOM 232 CG MET A 14 19.113 -4.865 -8.335 1.00 53.10 C ATOM 233 SD MET A 14 20.633 -4.273 -7.566 1.00 74.32 S ATOM 234 CE MET A 14 20.125 -4.165 -5.852 1.00 10.10 C ATOM 0 H MET A 14 16.489 -2.110 -8.978 1.00 42.54 H new ATOM 0 HA MET A 14 17.130 -4.673 -9.970 1.00 52.04 H new ATOM 0 HB2 MET A 14 18.290 -2.891 -8.288 1.00 2.31 H new ATOM 0 HB3 MET A 14 17.605 -3.982 -7.100 1.00 2.31 H new ATOM 0 HG2 MET A 14 18.857 -5.841 -7.921 1.00 53.10 H new ATOM 0 HG3 MET A 14 19.282 -5.006 -9.403 1.00 53.10 H new ATOM 0 HE1 MET A 14 20.998 -3.985 -5.224 1.00 10.10 H new ATOM 0 HE2 MET A 14 19.417 -3.344 -5.733 1.00 10.10 H new ATOM 0 HE3 MET A 14 19.650 -5.100 -5.554 1.00 10.10 H new ATOM 244 N ALA A 15 14.738 -4.539 -7.778 1.00 72.15 N ATOM 245 CA ALA A 15 13.716 -5.319 -7.092 1.00 32.32 C ATOM 246 C ALA A 15 12.857 -6.094 -8.085 1.00 60.43 C ATOM 247 O ALA A 15 12.223 -7.088 -7.729 1.00 52.33 O ATOM 248 CB ALA A 15 12.846 -4.412 -6.235 1.00 11.31 C ATOM 0 H ALA A 15 14.589 -3.530 -7.749 1.00 72.15 H new ATOM 0 HA ALA A 15 14.218 -6.040 -6.446 1.00 32.32 H new ATOM 0 HB1 ALA A 15 12.087 -5.008 -5.729 1.00 11.31 H new ATOM 0 HB2 ALA A 15 13.466 -3.908 -5.494 1.00 11.31 H new ATOM 0 HB3 ALA A 15 12.361 -3.669 -6.868 1.00 11.31 H new ATOM 254 N ARG A 16 12.841 -5.634 -9.332 1.00 13.42 N ATOM 255 CA ARG A 16 12.058 -6.283 -10.376 1.00 72.12 C ATOM 256 C ARG A 16 12.439 -7.755 -10.505 1.00 73.04 C ATOM 257 O ARG A 16 11.642 -8.576 -10.962 1.00 12.12 O ATOM 258 CB ARG A 16 12.265 -5.572 -11.715 1.00 32.31 C ATOM 259 CG ARG A 16 11.537 -6.233 -12.874 1.00 52.12 C ATOM 260 CD ARG A 16 12.512 -6.831 -13.876 1.00 71.10 C ATOM 261 NE ARG A 16 12.916 -8.185 -13.505 1.00 40.33 N ATOM 262 CZ ARG A 16 12.182 -9.264 -13.751 1.00 70.14 C ATOM 263 NH1 ARG A 16 11.013 -9.149 -14.366 1.00 13.24 N ATOM 264 NH2 ARG A 16 12.618 -10.462 -13.383 1.00 74.23 N ATOM 0 H ARG A 16 13.362 -4.814 -9.644 1.00 13.42 H new ATOM 0 HA ARG A 16 11.006 -6.221 -10.098 1.00 72.12 H new ATOM 0 HB2 ARG A 16 11.926 -4.540 -11.625 1.00 32.31 H new ATOM 0 HB3 ARG A 16 13.331 -5.539 -11.938 1.00 32.31 H new ATOM 0 HG2 ARG A 16 10.879 -7.015 -12.494 1.00 52.12 H new ATOM 0 HG3 ARG A 16 10.904 -5.499 -13.374 1.00 52.12 H new ATOM 0 HD2 ARG A 16 12.052 -6.848 -14.864 1.00 71.10 H new ATOM 0 HD3 ARG A 16 13.395 -6.196 -13.946 1.00 71.10 H new ATOM 0 HE ARG A 16 13.811 -8.308 -13.031 1.00 40.33 H new ATOM 0 HH11 ARG A 16 10.675 -8.230 -14.652 1.00 13.24 H new ATOM 0 HH12 ARG A 16 10.452 -9.980 -14.554 1.00 13.24 H new ATOM 0 HH21 ARG A 16 13.517 -10.555 -12.911 1.00 74.23 H new ATOM 0 HH22 ARG A 16 12.054 -11.290 -13.572 1.00 74.23 H new ATOM 278 N LEU A 17 13.661 -8.082 -10.101 1.00 42.12 N ATOM 279 CA LEU A 17 14.149 -9.455 -10.172 1.00 33.01 C ATOM 280 C LEU A 17 13.249 -10.394 -9.374 1.00 44.02 C ATOM 281 O LEU A 17 13.219 -11.600 -9.621 1.00 31.40 O ATOM 282 CB LEU A 17 15.583 -9.535 -9.646 1.00 61.55 C ATOM 283 CG LEU A 17 15.737 -9.628 -8.128 1.00 44.20 C ATOM 284 CD1 LEU A 17 15.741 -11.081 -7.679 1.00 45.22 C ATOM 285 CD2 LEU A 17 17.010 -8.925 -7.678 1.00 12.04 C ATOM 0 H LEU A 17 14.333 -7.415 -9.721 1.00 42.12 H new ATOM 0 HA LEU A 17 14.134 -9.767 -11.216 1.00 33.01 H new ATOM 0 HB2 LEU A 17 16.065 -10.404 -10.094 1.00 61.55 H new ATOM 0 HB3 LEU A 17 16.126 -8.656 -9.993 1.00 61.55 H new ATOM 0 HG LEU A 17 14.886 -9.129 -7.664 1.00 44.20 H new ATOM 0 HD11 LEU A 17 15.852 -11.127 -6.596 1.00 45.22 H new ATOM 0 HD12 LEU A 17 14.802 -11.554 -7.968 1.00 45.22 H new ATOM 0 HD13 LEU A 17 16.572 -11.605 -8.151 1.00 45.22 H new ATOM 0 HD21 LEU A 17 17.104 -9.001 -6.595 1.00 12.04 H new ATOM 0 HD22 LEU A 17 17.872 -9.395 -8.151 1.00 12.04 H new ATOM 0 HD23 LEU A 17 16.967 -7.875 -7.966 1.00 12.04 H new ATOM 297 N LEU A 18 12.517 -9.833 -8.419 1.00 11.14 N ATOM 298 CA LEU A 18 11.614 -10.620 -7.585 1.00 40.54 C ATOM 299 C LEU A 18 10.682 -11.469 -8.444 1.00 1.13 C ATOM 300 O LEU A 18 10.236 -12.536 -8.023 1.00 11.54 O ATOM 301 CB LEU A 18 10.794 -9.700 -6.679 1.00 21.14 C ATOM 302 CG LEU A 18 11.348 -9.477 -5.271 1.00 23.50 C ATOM 303 CD1 LEU A 18 12.698 -8.779 -5.333 1.00 15.52 C ATOM 304 CD2 LEU A 18 10.366 -8.672 -4.432 1.00 64.24 C ATOM 0 H LEU A 18 12.530 -8.836 -8.202 1.00 11.14 H new ATOM 0 HA LEU A 18 12.216 -11.286 -6.967 1.00 40.54 H new ATOM 0 HB2 LEU A 18 10.700 -8.731 -7.169 1.00 21.14 H new ATOM 0 HB3 LEU A 18 9.789 -10.112 -6.591 1.00 21.14 H new ATOM 0 HG LEU A 18 11.486 -10.449 -4.798 1.00 23.50 H new ATOM 0 HD11 LEU A 18 13.077 -8.629 -4.322 1.00 15.52 H new ATOM 0 HD12 LEU A 18 13.400 -9.394 -5.896 1.00 15.52 H new ATOM 0 HD13 LEU A 18 12.586 -7.813 -5.826 1.00 15.52 H new ATOM 0 HD21 LEU A 18 10.777 -8.523 -3.434 1.00 64.24 H new ATOM 0 HD22 LEU A 18 10.195 -7.704 -4.902 1.00 64.24 H new ATOM 0 HD23 LEU A 18 9.422 -9.212 -4.359 1.00 64.24 H new ATOM 316 N GLU A 19 10.395 -10.989 -9.650 1.00 13.24 N ATOM 317 CA GLU A 19 9.517 -11.706 -10.567 1.00 40.32 C ATOM 318 C GLU A 19 10.004 -13.136 -10.780 1.00 43.04 C ATOM 319 O GLU A 19 9.214 -14.035 -11.065 1.00 33.23 O ATOM 320 CB GLU A 19 9.440 -10.976 -11.910 1.00 5.22 C ATOM 321 CG GLU A 19 8.373 -11.525 -12.841 1.00 53.30 C ATOM 322 CD GLU A 19 7.004 -11.581 -12.191 1.00 0.53 C ATOM 323 OE1 GLU A 19 6.768 -12.506 -11.386 1.00 14.01 O ATOM 324 OE2 GLU A 19 6.170 -10.700 -12.486 1.00 53.22 O ATOM 0 H GLU A 19 10.757 -10.108 -10.014 1.00 13.24 H new ATOM 0 HA GLU A 19 8.522 -11.742 -10.124 1.00 40.32 H new ATOM 0 HB2 GLU A 19 9.243 -9.919 -11.729 1.00 5.22 H new ATOM 0 HB3 GLU A 19 10.409 -11.040 -12.405 1.00 5.22 H new ATOM 0 HG2 GLU A 19 8.321 -10.903 -13.735 1.00 53.30 H new ATOM 0 HG3 GLU A 19 8.659 -12.526 -13.165 1.00 53.30 H new ATOM 331 N GLN A 20 11.311 -13.337 -10.641 1.00 53.34 N ATOM 332 CA GLN A 20 11.904 -14.657 -10.820 1.00 54.21 C ATOM 333 C GLN A 20 11.331 -15.651 -9.816 1.00 31.25 C ATOM 334 O GLN A 20 11.414 -16.864 -10.012 1.00 2.45 O ATOM 335 CB GLN A 20 13.424 -14.581 -10.670 1.00 50.24 C ATOM 336 CG GLN A 20 13.885 -14.379 -9.236 1.00 12.11 C ATOM 337 CD GLN A 20 14.724 -15.533 -8.724 1.00 75.54 C ATOM 338 OE1 GLN A 20 15.765 -15.330 -8.100 1.00 21.32 O ATOM 339 NE2 GLN A 20 14.273 -16.755 -8.987 1.00 0.31 N ATOM 0 H GLN A 20 11.979 -12.603 -10.405 1.00 53.34 H new ATOM 0 HA GLN A 20 11.662 -15.003 -11.825 1.00 54.21 H new ATOM 0 HB2 GLN A 20 13.865 -15.499 -11.059 1.00 50.24 H new ATOM 0 HB3 GLN A 20 13.801 -13.762 -11.283 1.00 50.24 H new ATOM 0 HG2 GLN A 20 14.463 -13.457 -9.171 1.00 12.11 H new ATOM 0 HG3 GLN A 20 13.014 -14.255 -8.593 1.00 12.11 H new ATOM 0 HE21 GLN A 20 13.405 -16.877 -9.508 1.00 0.31 H new ATOM 0 HE22 GLN A 20 14.795 -17.571 -8.668 1.00 0.31 H new ATOM 348 N TRP A 21 10.751 -15.130 -8.741 1.00 33.35 N ATOM 349 CA TRP A 21 10.164 -15.973 -7.705 1.00 24.34 C ATOM 350 C TRP A 21 9.153 -16.945 -8.302 1.00 33.24 C ATOM 351 O TRP A 21 9.087 -18.108 -7.904 1.00 0.34 O ATOM 352 CB TRP A 21 9.492 -15.110 -6.636 1.00 32.10 C ATOM 353 CG TRP A 21 9.168 -15.863 -5.381 1.00 62.12 C ATOM 354 CD1 TRP A 21 10.047 -16.261 -4.414 1.00 51.33 C ATOM 355 CD2 TRP A 21 7.875 -16.310 -4.959 1.00 61.34 C ATOM 356 NE1 TRP A 21 9.378 -16.928 -3.417 1.00 31.22 N ATOM 357 CE2 TRP A 21 8.044 -16.971 -3.727 1.00 64.20 C ATOM 358 CE3 TRP A 21 6.591 -16.215 -5.502 1.00 13.15 C ATOM 359 CZ2 TRP A 21 6.977 -17.534 -3.032 1.00 3.44 C ATOM 360 CZ3 TRP A 21 5.533 -16.774 -4.810 1.00 53.22 C ATOM 361 CH2 TRP A 21 5.731 -17.426 -3.586 1.00 12.53 C ATOM 0 H TRP A 21 10.674 -14.128 -8.564 1.00 33.35 H new ATOM 0 HA TRP A 21 10.965 -16.550 -7.244 1.00 24.34 H new ATOM 0 HB2 TRP A 21 10.146 -14.274 -6.390 1.00 32.10 H new ATOM 0 HB3 TRP A 21 8.574 -14.687 -7.045 1.00 32.10 H new ATOM 0 HD1 TRP A 21 11.111 -16.078 -4.431 1.00 51.33 H new ATOM 0 HE1 TRP A 21 9.805 -17.327 -2.581 1.00 31.22 H new ATOM 0 HE3 TRP A 21 6.428 -15.714 -6.445 1.00 13.15 H new ATOM 0 HZ2 TRP A 21 7.128 -18.038 -2.089 1.00 3.44 H new ATOM 0 HZ3 TRP A 21 4.536 -16.707 -5.220 1.00 53.22 H new ATOM 0 HH2 TRP A 21 4.883 -17.852 -3.070 1.00 12.53 H new ATOM 372 N GLU A 22 8.367 -16.461 -9.258 1.00 74.32 N ATOM 373 CA GLU A 22 7.358 -17.289 -9.909 1.00 32.23 C ATOM 374 C GLU A 22 8.000 -18.235 -10.920 1.00 33.13 C ATOM 375 O GLU A 22 7.790 -19.447 -10.873 1.00 62.52 O ATOM 376 CB GLU A 22 6.317 -16.411 -10.605 1.00 53.44 C ATOM 377 CG GLU A 22 5.129 -17.188 -11.148 1.00 44.11 C ATOM 378 CD GLU A 22 4.007 -17.320 -10.137 1.00 22.31 C ATOM 379 OE1 GLU A 22 4.216 -16.943 -8.965 1.00 41.21 O ATOM 380 OE2 GLU A 22 2.920 -17.801 -10.518 1.00 74.52 O ATOM 0 H GLU A 22 8.409 -15.501 -9.599 1.00 74.32 H new ATOM 0 HA GLU A 22 6.864 -17.886 -9.142 1.00 32.23 H new ATOM 0 HB2 GLU A 22 5.958 -15.660 -9.901 1.00 53.44 H new ATOM 0 HB3 GLU A 22 6.796 -15.876 -11.425 1.00 53.44 H new ATOM 0 HG2 GLU A 22 4.752 -16.690 -12.041 1.00 44.11 H new ATOM 0 HG3 GLU A 22 5.458 -18.182 -11.452 1.00 44.11 H new ATOM 387 N LYS A 23 8.782 -17.672 -11.834 1.00 4.13 N ATOM 388 CA LYS A 23 9.456 -18.463 -12.857 1.00 4.43 C ATOM 389 C LYS A 23 8.521 -19.524 -13.428 1.00 44.31 C ATOM 390 O LYS A 23 8.948 -20.633 -13.748 1.00 62.21 O ATOM 391 CB LYS A 23 10.706 -19.128 -12.275 1.00 73.31 C ATOM 392 CG LYS A 23 10.400 -20.186 -11.229 1.00 60.42 C ATOM 393 CD LYS A 23 11.591 -21.101 -10.997 1.00 73.41 C ATOM 394 CE LYS A 23 11.169 -22.562 -10.943 1.00 1.24 C ATOM 395 NZ LYS A 23 12.340 -23.480 -10.998 1.00 5.32 N ATOM 0 H LYS A 23 8.965 -16.670 -11.888 1.00 4.13 H new ATOM 0 HA LYS A 23 9.751 -17.792 -13.664 1.00 4.43 H new ATOM 0 HB2 LYS A 23 11.276 -19.584 -13.085 1.00 73.31 H new ATOM 0 HB3 LYS A 23 11.341 -18.362 -11.830 1.00 73.31 H new ATOM 0 HG2 LYS A 23 10.123 -19.703 -10.292 1.00 60.42 H new ATOM 0 HG3 LYS A 23 9.542 -20.778 -11.549 1.00 60.42 H new ATOM 0 HD2 LYS A 23 12.320 -20.961 -11.795 1.00 73.41 H new ATOM 0 HD3 LYS A 23 12.084 -20.829 -10.064 1.00 73.41 H new ATOM 0 HE2 LYS A 23 10.608 -22.744 -10.027 1.00 1.24 H new ATOM 0 HE3 LYS A 23 10.499 -22.778 -11.775 1.00 1.24 H new ATOM 0 HZ1 LYS A 23 12.011 -24.466 -10.959 1.00 5.32 H new ATOM 0 HZ2 LYS A 23 12.862 -23.324 -11.884 1.00 5.32 H new ATOM 0 HZ3 LYS A 23 12.967 -23.292 -10.190 1.00 5.32 H new ATOM 409 N ASP A 24 7.246 -19.175 -13.555 1.00 32.23 N ATOM 410 CA ASP A 24 6.251 -20.097 -14.090 1.00 72.13 C ATOM 411 C ASP A 24 6.295 -20.118 -15.615 1.00 34.20 C ATOM 412 O ASP A 24 5.848 -21.076 -16.246 1.00 33.55 O ATOM 413 CB ASP A 24 4.852 -19.705 -13.613 1.00 53.42 C ATOM 414 CG ASP A 24 4.360 -20.581 -12.478 1.00 1.10 C ATOM 415 OD1 ASP A 24 4.668 -21.791 -12.486 1.00 73.43 O ATOM 416 OD2 ASP A 24 3.668 -20.056 -11.581 1.00 24.13 O ATOM 0 H ASP A 24 6.877 -18.260 -13.295 1.00 32.23 H new ATOM 0 HA ASP A 24 6.484 -21.097 -13.724 1.00 72.13 H new ATOM 0 HB2 ASP A 24 4.861 -18.665 -13.288 1.00 53.42 H new ATOM 0 HB3 ASP A 24 4.155 -19.772 -14.448 1.00 53.42 H new ATOM 421 N ASP A 25 6.835 -19.055 -16.201 1.00 33.32 N ATOM 422 CA ASP A 25 6.937 -18.951 -17.652 1.00 31.42 C ATOM 423 C ASP A 25 5.553 -18.921 -18.293 1.00 62.23 C ATOM 424 O ASP A 25 5.375 -19.359 -19.430 1.00 45.33 O ATOM 425 CB ASP A 25 7.747 -20.121 -18.212 1.00 62.25 C ATOM 426 CG ASP A 25 8.778 -19.676 -19.231 1.00 50.11 C ATOM 427 OD1 ASP A 25 9.356 -18.583 -19.052 1.00 62.31 O ATOM 428 OD2 ASP A 25 9.007 -20.420 -20.207 1.00 22.41 O ATOM 0 H ASP A 25 7.209 -18.253 -15.693 1.00 33.32 H new ATOM 0 HA ASP A 25 7.448 -18.018 -17.890 1.00 31.42 H new ATOM 0 HB2 ASP A 25 8.249 -20.637 -17.393 1.00 62.25 H new ATOM 0 HB3 ASP A 25 7.070 -20.840 -18.674 1.00 62.25 H new ATOM 433 N ASP A 26 4.576 -18.404 -17.557 1.00 5.54 N ATOM 434 CA ASP A 26 3.208 -18.316 -18.053 1.00 61.33 C ATOM 435 C ASP A 26 3.169 -17.644 -19.422 1.00 53.01 C ATOM 436 O ASP A 26 2.298 -17.936 -20.243 1.00 4.02 O ATOM 437 CB ASP A 26 2.333 -17.543 -17.066 1.00 11.31 C ATOM 438 CG ASP A 26 2.055 -18.329 -15.800 1.00 1.34 C ATOM 439 OD1 ASP A 26 2.301 -19.553 -15.795 1.00 23.22 O ATOM 440 OD2 ASP A 26 1.592 -17.719 -14.813 1.00 63.11 O ATOM 0 H ASP A 26 4.706 -18.039 -16.613 1.00 5.54 H new ATOM 0 HA ASP A 26 2.819 -19.329 -18.154 1.00 61.33 H new ATOM 0 HB2 ASP A 26 2.824 -16.605 -16.807 1.00 11.31 H new ATOM 0 HB3 ASP A 26 1.388 -17.287 -17.546 1.00 11.31 H new ATOM 445 N ILE A 27 4.115 -16.743 -19.660 1.00 43.43 N ATOM 446 CA ILE A 27 4.188 -16.029 -20.929 1.00 62.23 C ATOM 447 C ILE A 27 5.127 -16.734 -21.903 1.00 11.21 C ATOM 448 O ILE A 27 5.679 -17.789 -21.593 1.00 41.15 O ATOM 449 CB ILE A 27 4.665 -14.578 -20.733 1.00 25.12 C ATOM 450 CG1 ILE A 27 5.996 -14.554 -19.977 1.00 52.43 C ATOM 451 CG2 ILE A 27 3.613 -13.770 -19.989 1.00 34.53 C ATOM 452 CD1 ILE A 27 7.125 -13.925 -20.763 1.00 24.10 C ATOM 0 H ILE A 27 4.842 -16.490 -18.991 1.00 43.43 H new ATOM 0 HA ILE A 27 3.180 -16.018 -21.343 1.00 62.23 H new ATOM 0 HB ILE A 27 4.816 -14.125 -21.713 1.00 25.12 H new ATOM 0 HG12 ILE A 27 5.865 -14.007 -19.044 1.00 52.43 H new ATOM 0 HG13 ILE A 27 6.273 -15.574 -19.712 1.00 52.43 H new ATOM 0 HG21 ILE A 27 3.965 -12.747 -19.858 1.00 34.53 H new ATOM 0 HG22 ILE A 27 2.686 -13.764 -20.562 1.00 34.53 H new ATOM 0 HG23 ILE A 27 3.433 -14.219 -19.012 1.00 34.53 H new ATOM 0 HD11 ILE A 27 8.037 -13.942 -20.167 1.00 24.10 H new ATOM 0 HD12 ILE A 27 7.283 -14.486 -21.684 1.00 24.10 H new ATOM 0 HD13 ILE A 27 6.869 -12.894 -21.005 1.00 24.10 H new ATOM 1035 N THR A 64 19.295 3.609 -22.814 1.00 3.23 N ATOM 1036 CA THR A 64 17.893 3.964 -22.634 1.00 61.25 C ATOM 1037 C THR A 64 17.183 2.960 -21.733 1.00 40.13 C ATOM 1038 O THR A 64 17.564 1.790 -21.668 1.00 51.53 O ATOM 1039 CB THR A 64 17.155 4.036 -23.985 1.00 10.45 C ATOM 1040 OG1 THR A 64 15.814 4.498 -23.786 1.00 3.44 O ATOM 1041 CG2 THR A 64 17.132 2.675 -24.663 1.00 23.13 C ATOM 0 HA THR A 64 17.873 4.947 -22.164 1.00 61.25 H new ATOM 0 HB THR A 64 17.689 4.735 -24.629 1.00 10.45 H new ATOM 0 HG1 THR A 64 15.205 3.996 -24.368 1.00 3.44 H new ATOM 0 HG21 THR A 64 16.606 2.751 -25.615 1.00 23.13 H new ATOM 0 HG22 THR A 64 18.154 2.339 -24.839 1.00 23.13 H new ATOM 0 HG23 THR A 64 16.620 1.958 -24.022 1.00 23.13 H new ATOM 1049 N LEU A 65 16.149 3.423 -21.040 1.00 12.01 N ATOM 1050 CA LEU A 65 15.384 2.565 -20.142 1.00 31.40 C ATOM 1051 C LEU A 65 13.952 2.396 -20.639 1.00 34.03 C ATOM 1052 O LEU A 65 13.211 3.370 -20.771 1.00 3.25 O ATOM 1053 CB LEU A 65 15.380 3.147 -18.728 1.00 10.53 C ATOM 1054 CG LEU A 65 14.961 4.613 -18.607 1.00 2.11 C ATOM 1055 CD1 LEU A 65 14.142 4.832 -17.345 1.00 35.23 C ATOM 1056 CD2 LEU A 65 16.184 5.519 -18.615 1.00 13.42 C ATOM 0 H LEU A 65 15.821 4.388 -21.083 1.00 12.01 H new ATOM 0 HA LEU A 65 15.860 1.585 -20.123 1.00 31.40 H new ATOM 0 HB2 LEU A 65 14.711 2.547 -18.111 1.00 10.53 H new ATOM 0 HB3 LEU A 65 16.381 3.040 -18.310 1.00 10.53 H new ATOM 0 HG LEU A 65 14.340 4.866 -19.466 1.00 2.11 H new ATOM 0 HD11 LEU A 65 13.853 5.881 -17.276 1.00 35.23 H new ATOM 0 HD12 LEU A 65 13.247 4.211 -17.380 1.00 35.23 H new ATOM 0 HD13 LEU A 65 14.738 4.562 -16.473 1.00 35.23 H new ATOM 0 HD21 LEU A 65 15.867 6.558 -18.528 1.00 13.42 H new ATOM 0 HD22 LEU A 65 16.830 5.265 -17.775 1.00 13.42 H new ATOM 0 HD23 LEU A 65 16.731 5.383 -19.548 1.00 13.42 H new ATOM 1068 N MET A 66 13.568 1.153 -20.911 1.00 14.13 N ATOM 1069 CA MET A 66 12.222 0.857 -21.390 1.00 24.35 C ATOM 1070 C MET A 66 11.885 -0.617 -21.185 1.00 13.42 C ATOM 1071 O MET A 66 12.492 -1.493 -21.799 1.00 24.12 O ATOM 1072 CB MET A 66 12.093 1.221 -22.870 1.00 21.32 C ATOM 1073 CG MET A 66 10.741 0.865 -23.467 1.00 64.03 C ATOM 1074 SD MET A 66 10.665 1.169 -25.243 1.00 1.51 S ATOM 1075 CE MET A 66 9.814 2.745 -25.280 1.00 31.01 C ATOM 0 H MET A 66 14.169 0.335 -20.808 1.00 14.13 H new ATOM 0 HA MET A 66 11.517 1.456 -20.814 1.00 24.35 H new ATOM 0 HB2 MET A 66 12.263 2.291 -22.989 1.00 21.32 H new ATOM 0 HB3 MET A 66 12.875 0.710 -23.431 1.00 21.32 H new ATOM 0 HG2 MET A 66 10.528 -0.186 -23.273 1.00 64.03 H new ATOM 0 HG3 MET A 66 9.964 1.445 -22.969 1.00 64.03 H new ATOM 0 HE1 MET A 66 9.691 3.068 -26.314 1.00 31.01 H new ATOM 0 HE2 MET A 66 8.835 2.641 -24.813 1.00 31.01 H new ATOM 0 HE3 MET A 66 10.398 3.487 -24.735 1.00 31.01 H new ATOM 1085 N MET A 67 10.913 -0.882 -20.318 1.00 54.51 N ATOM 1086 CA MET A 67 10.494 -2.249 -20.034 1.00 25.41 C ATOM 1087 C MET A 67 9.056 -2.284 -19.528 1.00 31.03 C ATOM 1088 O MET A 67 8.670 -1.489 -18.671 1.00 14.30 O ATOM 1089 CB MET A 67 11.426 -2.886 -19.001 1.00 64.11 C ATOM 1090 CG MET A 67 11.353 -4.404 -18.971 1.00 20.13 C ATOM 1091 SD MET A 67 12.272 -5.116 -17.593 1.00 21.44 S ATOM 1092 CE MET A 67 13.919 -4.499 -17.929 1.00 65.34 C ATOM 0 H MET A 67 10.401 -0.168 -19.800 1.00 54.51 H new ATOM 0 HA MET A 67 10.547 -2.819 -20.962 1.00 25.41 H new ATOM 0 HB2 MET A 67 12.451 -2.584 -19.214 1.00 64.11 H new ATOM 0 HB3 MET A 67 11.178 -2.499 -18.013 1.00 64.11 H new ATOM 0 HG2 MET A 67 10.310 -4.713 -18.905 1.00 20.13 H new ATOM 0 HG3 MET A 67 11.744 -4.801 -19.908 1.00 20.13 H new ATOM 0 HE1 MET A 67 14.642 -5.305 -17.804 1.00 65.34 H new ATOM 0 HE2 MET A 67 13.966 -4.125 -18.952 1.00 65.34 H new ATOM 0 HE3 MET A 67 14.153 -3.691 -17.236 1.00 65.34 H new ATOM 1102 N PHE A 68 8.267 -3.210 -20.063 1.00 41.21 N ATOM 1103 CA PHE A 68 6.871 -3.347 -19.666 1.00 54.22 C ATOM 1104 C PHE A 68 6.536 -4.801 -19.346 1.00 4.22 C ATOM 1105 O PHE A 68 6.652 -5.679 -20.201 1.00 35.02 O ATOM 1106 CB PHE A 68 5.950 -2.833 -20.775 1.00 44.42 C ATOM 1107 CG PHE A 68 6.385 -1.515 -21.352 1.00 34.42 C ATOM 1108 CD1 PHE A 68 6.696 -0.450 -20.522 1.00 61.14 C ATOM 1109 CD2 PHE A 68 6.482 -1.343 -22.723 1.00 52.21 C ATOM 1110 CE1 PHE A 68 7.095 0.763 -21.051 1.00 1.14 C ATOM 1111 CE2 PHE A 68 6.881 -0.132 -23.257 1.00 52.20 C ATOM 1112 CZ PHE A 68 7.189 0.922 -22.419 1.00 52.14 C ATOM 0 H PHE A 68 8.571 -3.877 -20.773 1.00 41.21 H new ATOM 0 HA PHE A 68 6.715 -2.750 -18.767 1.00 54.22 H new ATOM 0 HB2 PHE A 68 5.907 -3.574 -21.573 1.00 44.42 H new ATOM 0 HB3 PHE A 68 4.939 -2.732 -20.379 1.00 44.42 H new ATOM 0 HD1 PHE A 68 6.626 -0.569 -19.451 1.00 61.14 H new ATOM 0 HD2 PHE A 68 6.243 -2.164 -23.382 1.00 52.21 H new ATOM 0 HE1 PHE A 68 7.333 1.586 -20.394 1.00 1.14 H new ATOM 0 HE2 PHE A 68 6.952 -0.010 -24.328 1.00 52.20 H new ATOM 0 HZ PHE A 68 7.503 1.869 -22.833 1.00 52.14 H new ATOM 1122 N VAL A 69 6.122 -5.047 -18.107 1.00 62.50 N ATOM 1123 CA VAL A 69 5.770 -6.394 -17.672 1.00 64.04 C ATOM 1124 C VAL A 69 4.603 -6.368 -16.692 1.00 4.31 C ATOM 1125 O VAL A 69 4.421 -5.401 -15.951 1.00 51.45 O ATOM 1126 CB VAL A 69 6.968 -7.101 -17.010 1.00 12.55 C ATOM 1127 CG1 VAL A 69 6.645 -8.563 -16.743 1.00 54.20 C ATOM 1128 CG2 VAL A 69 8.210 -6.970 -17.878 1.00 21.23 C ATOM 0 H VAL A 69 6.022 -4.332 -17.387 1.00 62.50 H new ATOM 0 HA VAL A 69 5.478 -6.949 -18.564 1.00 64.04 H new ATOM 0 HB VAL A 69 7.169 -6.618 -16.054 1.00 12.55 H new ATOM 0 HG11 VAL A 69 7.503 -9.046 -16.275 1.00 54.20 H new ATOM 0 HG12 VAL A 69 5.784 -8.630 -16.078 1.00 54.20 H new ATOM 0 HG13 VAL A 69 6.416 -9.063 -17.684 1.00 54.20 H new ATOM 0 HG21 VAL A 69 9.046 -7.475 -17.395 1.00 21.23 H new ATOM 0 HG22 VAL A 69 8.024 -7.425 -18.851 1.00 21.23 H new ATOM 0 HG23 VAL A 69 8.451 -5.915 -18.011 1.00 21.23 H new ATOM 1138 N THR A 70 3.814 -7.437 -16.691 1.00 31.50 N ATOM 1139 CA THR A 70 2.663 -7.538 -15.802 1.00 4.40 C ATOM 1140 C THR A 70 2.046 -8.930 -15.857 1.00 34.00 C ATOM 1141 O THR A 70 0.987 -9.128 -16.454 1.00 44.43 O ATOM 1142 CB THR A 70 1.586 -6.496 -16.158 1.00 40.11 C ATOM 1143 OG1 THR A 70 0.382 -6.769 -15.433 1.00 73.44 O ATOM 1144 CG2 THR A 70 1.298 -6.504 -17.652 1.00 21.12 C ATOM 0 H THR A 70 3.951 -8.246 -17.297 1.00 31.50 H new ATOM 0 HA THR A 70 3.025 -7.345 -14.792 1.00 4.40 H new ATOM 0 HB THR A 70 1.960 -5.510 -15.882 1.00 40.11 H new ATOM 0 HG1 THR A 70 0.036 -7.649 -15.692 1.00 73.44 H new ATOM 0 HG21 THR A 70 0.534 -5.760 -17.879 1.00 21.12 H new ATOM 0 HG22 THR A 70 2.210 -6.267 -18.200 1.00 21.12 H new ATOM 0 HG23 THR A 70 0.943 -7.491 -17.949 1.00 21.12 H new ATOM 1152 N VAL A 71 2.713 -9.894 -15.230 1.00 14.45 N ATOM 1153 CA VAL A 71 2.228 -11.268 -15.206 1.00 34.44 C ATOM 1154 C VAL A 71 3.111 -12.148 -14.328 1.00 0.54 C ATOM 1155 O VAL A 71 4.238 -11.780 -13.998 1.00 5.30 O ATOM 1156 CB VAL A 71 2.172 -11.869 -16.623 1.00 12.41 C ATOM 1157 CG1 VAL A 71 3.566 -12.252 -17.096 1.00 32.12 C ATOM 1158 CG2 VAL A 71 1.239 -13.070 -16.656 1.00 24.11 C ATOM 0 H VAL A 71 3.591 -9.748 -14.732 1.00 14.45 H new ATOM 0 HA VAL A 71 1.220 -11.240 -14.791 1.00 34.44 H new ATOM 0 HB VAL A 71 1.778 -11.114 -17.304 1.00 12.41 H new ATOM 0 HG11 VAL A 71 3.507 -12.675 -18.099 1.00 32.12 H new ATOM 0 HG12 VAL A 71 4.201 -11.366 -17.113 1.00 32.12 H new ATOM 0 HG13 VAL A 71 3.991 -12.990 -16.416 1.00 32.12 H new ATOM 0 HG21 VAL A 71 1.212 -13.482 -17.665 1.00 24.11 H new ATOM 0 HG22 VAL A 71 1.600 -13.830 -15.963 1.00 24.11 H new ATOM 0 HG23 VAL A 71 0.236 -12.760 -16.364 1.00 24.11 H new ATOM 1168 N SER A 72 2.591 -13.312 -13.952 1.00 40.22 N ATOM 1169 CA SER A 72 3.331 -14.243 -13.109 1.00 63.21 C ATOM 1170 C SER A 72 4.230 -15.143 -13.952 1.00 51.33 C ATOM 1171 O SER A 72 3.755 -15.882 -14.814 1.00 0.25 O ATOM 1172 CB SER A 72 2.365 -15.097 -12.285 1.00 42.41 C ATOM 1173 OG SER A 72 1.264 -15.522 -13.069 1.00 64.05 O ATOM 0 H SER A 72 1.660 -13.633 -14.218 1.00 40.22 H new ATOM 0 HA SER A 72 3.958 -13.662 -12.433 1.00 63.21 H new ATOM 0 HB2 SER A 72 2.890 -15.966 -11.889 1.00 42.41 H new ATOM 0 HB3 SER A 72 2.007 -14.524 -11.430 1.00 42.41 H new ATOM 0 HG SER A 72 1.531 -16.287 -13.620 1.00 64.05 H new ATOM 1179 N GLY A 73 5.533 -15.074 -13.697 1.00 1.40 N ATOM 1180 CA GLY A 73 6.479 -15.886 -14.440 1.00 53.21 C ATOM 1181 C GLY A 73 7.323 -15.065 -15.394 1.00 64.24 C ATOM 1182 O GLY A 73 6.860 -14.674 -16.464 1.00 53.25 O ATOM 0 H GLY A 73 5.950 -14.470 -12.989 1.00 1.40 H new ATOM 0 HA2 GLY A 73 7.131 -16.410 -13.741 1.00 53.21 H new ATOM 0 HA3 GLY A 73 5.937 -16.647 -15.002 1.00 53.21 H new ATOM 1186 N ASN A 74 8.567 -14.803 -15.005 1.00 51.44 N ATOM 1187 CA ASN A 74 9.478 -14.021 -15.834 1.00 12.24 C ATOM 1188 C ASN A 74 10.864 -13.950 -15.200 1.00 51.11 C ATOM 1189 O ASN A 74 11.277 -12.921 -14.665 1.00 64.01 O ATOM 1190 CB ASN A 74 8.927 -12.609 -16.041 1.00 52.50 C ATOM 1191 CG ASN A 74 9.373 -12.001 -17.357 1.00 23.31 C ATOM 1192 OD1 ASN A 74 9.489 -12.696 -18.367 1.00 34.24 O ATOM 1193 ND2 ASN A 74 9.627 -10.698 -17.351 1.00 2.21 N ATOM 0 H ASN A 74 8.967 -15.120 -14.122 1.00 51.44 H new ATOM 0 HA ASN A 74 9.565 -14.515 -16.802 1.00 12.24 H new ATOM 0 HB2 ASN A 74 7.838 -12.639 -16.008 1.00 52.50 H new ATOM 0 HB3 ASN A 74 9.253 -11.971 -15.220 1.00 52.50 H new ATOM 0 HD21 ASN A 74 9.932 -10.234 -18.207 1.00 2.21 H new ATOM 0 HD22 ASN A 74 9.517 -10.161 -16.491 1.00 2.21 H new ATOM 1200 N PRO A 75 11.600 -15.069 -15.261 1.00 64.34 N ATOM 1201 CA PRO A 75 12.952 -15.160 -14.700 1.00 55.41 C ATOM 1202 C PRO A 75 13.963 -14.334 -15.488 1.00 31.01 C ATOM 1203 O PRO A 75 14.376 -14.718 -16.583 1.00 0.03 O ATOM 1204 CB PRO A 75 13.280 -16.651 -14.806 1.00 5.25 C ATOM 1205 CG PRO A 75 12.434 -17.147 -15.927 1.00 24.02 C ATOM 1206 CD PRO A 75 11.171 -16.333 -15.884 1.00 10.20 C ATOM 0 HA PRO A 75 12.999 -14.771 -13.683 1.00 55.41 H new ATOM 0 HB2 PRO A 75 14.339 -16.810 -15.009 1.00 5.25 H new ATOM 0 HB3 PRO A 75 13.052 -17.173 -13.877 1.00 5.25 H new ATOM 0 HG2 PRO A 75 12.943 -17.027 -16.883 1.00 24.02 H new ATOM 0 HG3 PRO A 75 12.218 -18.209 -15.812 1.00 24.02 H new ATOM 0 HD2 PRO A 75 10.763 -16.171 -16.882 1.00 10.20 H new ATOM 0 HD3 PRO A 75 10.395 -16.826 -15.299 1.00 10.20 H new ATOM 1214 N THR A 76 14.360 -13.197 -14.924 1.00 74.12 N ATOM 1215 CA THR A 76 15.322 -12.317 -15.574 1.00 42.12 C ATOM 1216 C THR A 76 16.071 -11.470 -14.551 1.00 52.04 C ATOM 1217 O THR A 76 16.257 -10.269 -14.744 1.00 72.02 O ATOM 1218 CB THR A 76 14.635 -11.386 -16.591 1.00 11.44 C ATOM 1219 OG1 THR A 76 13.424 -10.862 -16.034 1.00 75.55 O ATOM 1220 CG2 THR A 76 14.327 -12.128 -17.882 1.00 51.33 C ATOM 0 H THR A 76 14.030 -12.865 -14.018 1.00 74.12 H new ATOM 0 HA THR A 76 16.030 -12.957 -16.100 1.00 42.12 H new ATOM 0 HB THR A 76 15.315 -10.565 -16.817 1.00 11.44 H new ATOM 0 HG1 THR A 76 12.994 -10.270 -16.686 1.00 75.55 H new ATOM 0 HG21 THR A 76 13.842 -11.450 -18.585 1.00 51.33 H new ATOM 0 HG22 THR A 76 15.254 -12.500 -18.318 1.00 51.33 H new ATOM 0 HG23 THR A 76 13.663 -12.966 -17.670 1.00 51.33 H new ATOM 1228 N GLU A 77 16.498 -12.104 -13.464 1.00 65.11 N ATOM 1229 CA GLU A 77 17.227 -11.407 -12.411 1.00 2.21 C ATOM 1230 C GLU A 77 18.464 -10.712 -12.973 1.00 62.43 C ATOM 1231 O GLU A 77 18.880 -9.664 -12.480 1.00 4.01 O ATOM 1232 CB GLU A 77 17.635 -12.386 -11.308 1.00 44.13 C ATOM 1233 CG GLU A 77 18.456 -13.561 -11.811 1.00 65.34 C ATOM 1234 CD GLU A 77 19.936 -13.410 -11.514 1.00 15.24 C ATOM 1235 OE1 GLU A 77 20.467 -12.296 -11.703 1.00 41.40 O ATOM 1236 OE2 GLU A 77 20.561 -14.405 -11.092 1.00 3.54 O ATOM 0 H GLU A 77 16.352 -13.098 -13.289 1.00 65.11 H new ATOM 0 HA GLU A 77 16.567 -10.650 -11.988 1.00 2.21 H new ATOM 0 HB2 GLU A 77 18.209 -11.850 -10.552 1.00 44.13 H new ATOM 0 HB3 GLU A 77 16.737 -12.764 -10.819 1.00 44.13 H new ATOM 0 HG2 GLU A 77 18.089 -14.479 -11.351 1.00 65.34 H new ATOM 0 HG3 GLU A 77 18.314 -13.664 -12.887 1.00 65.34 H new ATOM 1243 N LYS A 78 19.048 -11.305 -14.009 1.00 65.11 N ATOM 1244 CA LYS A 78 20.237 -10.745 -14.641 1.00 24.42 C ATOM 1245 C LYS A 78 19.924 -9.406 -15.299 1.00 41.43 C ATOM 1246 O LYS A 78 20.505 -8.380 -14.946 1.00 50.00 O ATOM 1247 CB LYS A 78 20.794 -11.720 -15.682 1.00 15.42 C ATOM 1248 CG LYS A 78 22.184 -11.356 -16.173 1.00 61.32 C ATOM 1249 CD LYS A 78 22.369 -11.714 -17.638 1.00 52.24 C ATOM 1250 CE LYS A 78 23.297 -12.907 -17.808 1.00 51.12 C ATOM 1251 NZ LYS A 78 24.730 -12.503 -17.783 1.00 50.34 N ATOM 0 H LYS A 78 18.717 -12.174 -14.429 1.00 65.11 H new ATOM 0 HA LYS A 78 20.987 -10.582 -13.867 1.00 24.42 H new ATOM 0 HB2 LYS A 78 20.820 -12.721 -15.252 1.00 15.42 H new ATOM 0 HB3 LYS A 78 20.115 -11.756 -16.534 1.00 15.42 H new ATOM 0 HG2 LYS A 78 22.352 -10.288 -16.034 1.00 61.32 H new ATOM 0 HG3 LYS A 78 22.931 -11.876 -15.573 1.00 61.32 H new ATOM 0 HD2 LYS A 78 21.400 -11.939 -18.084 1.00 52.24 H new ATOM 0 HD3 LYS A 78 22.775 -10.857 -18.175 1.00 52.24 H new ATOM 0 HE2 LYS A 78 23.109 -13.629 -17.013 1.00 51.12 H new ATOM 0 HE3 LYS A 78 23.077 -13.407 -18.751 1.00 51.12 H new ATOM 0 HZ1 LYS A 78 25.330 -13.344 -17.902 1.00 50.34 H new ATOM 0 HZ2 LYS A 78 24.915 -11.833 -18.557 1.00 50.34 H new ATOM 0 HZ3 LYS A 78 24.947 -12.049 -16.873 1.00 50.34 H new ATOM 1265 N GLU A 79 19.002 -9.423 -16.256 1.00 53.14 N ATOM 1266 CA GLU A 79 18.612 -8.208 -16.963 1.00 31.23 C ATOM 1267 C GLU A 79 18.168 -7.127 -15.982 1.00 34.24 C ATOM 1268 O GLU A 79 18.318 -5.933 -16.244 1.00 61.52 O ATOM 1269 CB GLU A 79 17.485 -8.507 -17.954 1.00 30.34 C ATOM 1270 CG GLU A 79 17.967 -8.709 -19.381 1.00 12.34 C ATOM 1271 CD GLU A 79 16.824 -8.860 -20.366 1.00 43.32 C ATOM 1272 OE1 GLU A 79 15.887 -9.631 -20.073 1.00 14.21 O ATOM 1273 OE2 GLU A 79 16.868 -8.208 -21.430 1.00 52.41 O ATOM 0 H GLU A 79 18.511 -10.264 -16.560 1.00 53.14 H new ATOM 0 HA GLU A 79 19.480 -7.843 -17.511 1.00 31.23 H new ATOM 0 HB2 GLU A 79 16.954 -9.402 -17.629 1.00 30.34 H new ATOM 0 HB3 GLU A 79 16.768 -7.686 -17.934 1.00 30.34 H new ATOM 0 HG2 GLU A 79 18.586 -7.861 -19.675 1.00 12.34 H new ATOM 0 HG3 GLU A 79 18.599 -9.596 -19.425 1.00 12.34 H new ATOM 1280 N THR A 80 17.618 -7.554 -14.849 1.00 22.04 N ATOM 1281 CA THR A 80 17.150 -6.624 -13.829 1.00 21.45 C ATOM 1282 C THR A 80 18.262 -5.674 -13.399 1.00 54.43 C ATOM 1283 O THR A 80 18.105 -4.455 -13.458 1.00 54.43 O ATOM 1284 CB THR A 80 16.621 -7.370 -12.589 1.00 30.30 C ATOM 1285 OG1 THR A 80 15.610 -8.307 -12.976 1.00 32.53 O ATOM 1286 CG2 THR A 80 16.051 -6.393 -11.572 1.00 25.14 C ATOM 0 H THR A 80 17.486 -8.538 -14.615 1.00 22.04 H new ATOM 0 HA THR A 80 16.337 -6.050 -14.274 1.00 21.45 H new ATOM 0 HB THR A 80 17.454 -7.903 -12.130 1.00 30.30 H new ATOM 0 HG1 THR A 80 16.019 -9.038 -13.484 1.00 32.53 H new ATOM 0 HG21 THR A 80 15.684 -6.943 -10.705 1.00 25.14 H new ATOM 0 HG22 THR A 80 16.830 -5.699 -11.258 1.00 25.14 H new ATOM 0 HG23 THR A 80 15.230 -5.836 -12.023 1.00 25.14 H new ATOM 1294 N GLU A 81 19.385 -6.240 -12.968 1.00 53.54 N ATOM 1295 CA GLU A 81 20.522 -5.440 -12.529 1.00 64.13 C ATOM 1296 C GLU A 81 20.935 -4.442 -13.608 1.00 31.33 C ATOM 1297 O GLU A 81 21.318 -3.312 -13.307 1.00 63.45 O ATOM 1298 CB GLU A 81 21.705 -6.345 -12.178 1.00 32.44 C ATOM 1299 CG GLU A 81 22.822 -5.628 -11.439 1.00 20.02 C ATOM 1300 CD GLU A 81 23.899 -6.576 -10.948 1.00 2.43 C ATOM 1301 OE1 GLU A 81 23.628 -7.339 -9.997 1.00 63.44 O ATOM 1302 OE2 GLU A 81 25.012 -6.554 -11.513 1.00 3.50 O ATOM 0 H GLU A 81 19.531 -7.248 -12.914 1.00 53.54 H new ATOM 0 HA GLU A 81 20.221 -4.885 -11.641 1.00 64.13 H new ATOM 0 HB2 GLU A 81 21.349 -7.173 -11.565 1.00 32.44 H new ATOM 0 HB3 GLU A 81 22.106 -6.776 -13.095 1.00 32.44 H new ATOM 0 HG2 GLU A 81 23.270 -4.885 -12.098 1.00 20.02 H new ATOM 0 HG3 GLU A 81 22.403 -5.089 -10.589 1.00 20.02 H new ATOM 1309 N GLU A 82 20.853 -4.870 -14.864 1.00 2.02 N ATOM 1310 CA GLU A 82 21.219 -4.015 -15.987 1.00 3.44 C ATOM 1311 C GLU A 82 20.360 -2.754 -16.013 1.00 75.23 C ATOM 1312 O GLU A 82 20.753 -1.734 -16.580 1.00 74.11 O ATOM 1313 CB GLU A 82 21.070 -4.775 -17.306 1.00 31.22 C ATOM 1314 CG GLU A 82 22.394 -5.077 -17.987 1.00 72.54 C ATOM 1315 CD GLU A 82 23.090 -6.289 -17.398 1.00 71.04 C ATOM 1316 OE1 GLU A 82 22.773 -6.653 -16.247 1.00 34.14 O ATOM 1317 OE2 GLU A 82 23.952 -6.873 -18.088 1.00 55.33 O ATOM 0 H GLU A 82 20.537 -5.803 -15.129 1.00 2.02 H new ATOM 0 HA GLU A 82 22.261 -3.721 -15.862 1.00 3.44 H new ATOM 0 HB2 GLU A 82 20.545 -5.712 -17.119 1.00 31.22 H new ATOM 0 HB3 GLU A 82 20.447 -4.191 -17.984 1.00 31.22 H new ATOM 0 HG2 GLU A 82 22.222 -5.243 -19.050 1.00 72.54 H new ATOM 0 HG3 GLU A 82 23.048 -4.210 -17.901 1.00 72.54 H new ATOM 1324 N ILE A 83 19.185 -2.833 -15.397 1.00 71.32 N ATOM 1325 CA ILE A 83 18.270 -1.700 -15.350 1.00 11.43 C ATOM 1326 C ILE A 83 18.829 -0.578 -14.480 1.00 74.24 C ATOM 1327 O ILE A 83 18.669 0.603 -14.791 1.00 72.44 O ATOM 1328 CB ILE A 83 16.889 -2.113 -14.809 1.00 35.41 C ATOM 1329 CG1 ILE A 83 16.369 -3.341 -15.561 1.00 11.52 C ATOM 1330 CG2 ILE A 83 15.906 -0.958 -14.927 1.00 12.04 C ATOM 1331 CD1 ILE A 83 15.069 -3.882 -15.008 1.00 61.04 C ATOM 0 H ILE A 83 18.845 -3.670 -14.924 1.00 71.32 H new ATOM 0 HA ILE A 83 18.158 -1.343 -16.374 1.00 11.43 H new ATOM 0 HB ILE A 83 16.991 -2.371 -13.755 1.00 35.41 H new ATOM 0 HG12 ILE A 83 16.228 -3.082 -16.610 1.00 11.52 H new ATOM 0 HG13 ILE A 83 17.124 -4.126 -15.525 1.00 11.52 H new ATOM 0 HG21 ILE A 83 14.935 -1.266 -14.540 1.00 12.04 H new ATOM 0 HG22 ILE A 83 16.273 -0.108 -14.352 1.00 12.04 H new ATOM 0 HG23 ILE A 83 15.806 -0.671 -15.974 1.00 12.04 H new ATOM 0 HD11 ILE A 83 14.760 -4.751 -15.589 1.00 61.04 H new ATOM 0 HD12 ILE A 83 15.209 -4.173 -13.967 1.00 61.04 H new ATOM 0 HD13 ILE A 83 14.299 -3.113 -15.069 1.00 61.04 H new ATOM 1343 N THR A 84 19.487 -0.955 -13.389 1.00 22.13 N ATOM 1344 CA THR A 84 20.071 0.018 -12.474 1.00 71.11 C ATOM 1345 C THR A 84 20.935 1.026 -13.222 1.00 41.44 C ATOM 1346 O THR A 84 20.994 2.200 -12.857 1.00 12.24 O ATOM 1347 CB THR A 84 20.925 -0.670 -11.392 1.00 53.21 C ATOM 1348 OG1 THR A 84 20.103 -1.526 -10.591 1.00 22.31 O ATOM 1349 CG2 THR A 84 21.608 0.361 -10.506 1.00 34.34 C ATOM 0 H THR A 84 19.629 -1.928 -13.117 1.00 22.13 H new ATOM 0 HA THR A 84 19.242 0.539 -11.995 1.00 71.11 H new ATOM 0 HB THR A 84 21.692 -1.264 -11.888 1.00 53.21 H new ATOM 0 HG1 THR A 84 19.171 -1.226 -10.642 1.00 22.31 H new ATOM 0 HG21 THR A 84 22.205 -0.148 -9.750 1.00 34.34 H new ATOM 0 HG22 THR A 84 22.255 0.993 -11.115 1.00 34.34 H new ATOM 0 HG23 THR A 84 20.854 0.978 -10.018 1.00 34.34 H new ATOM 1357 N SER A 85 21.604 0.561 -14.273 1.00 3.35 N ATOM 1358 CA SER A 85 22.468 1.423 -15.071 1.00 24.20 C ATOM 1359 C SER A 85 21.643 2.408 -15.893 1.00 62.35 C ATOM 1360 O SER A 85 21.889 3.615 -15.868 1.00 34.50 O ATOM 1361 CB SER A 85 23.349 0.581 -15.996 1.00 63.20 C ATOM 1362 OG SER A 85 24.589 1.222 -16.242 1.00 71.44 O ATOM 0 H SER A 85 21.564 -0.407 -14.591 1.00 3.35 H new ATOM 0 HA SER A 85 23.104 1.989 -14.390 1.00 24.20 H new ATOM 0 HB2 SER A 85 23.524 -0.396 -15.546 1.00 63.20 H new ATOM 0 HB3 SER A 85 22.831 0.409 -16.940 1.00 63.20 H new ATOM 0 HG SER A 85 25.134 0.663 -16.834 1.00 71.44 H new ATOM 1368 N LEU A 86 20.664 1.885 -16.623 1.00 32.43 N ATOM 1369 CA LEU A 86 19.801 2.716 -17.454 1.00 53.50 C ATOM 1370 C LEU A 86 19.211 3.867 -16.645 1.00 53.44 C ATOM 1371 O LEU A 86 18.984 4.957 -17.172 1.00 73.52 O ATOM 1372 CB LEU A 86 18.676 1.874 -18.059 1.00 2.11 C ATOM 1373 CG LEU A 86 19.093 0.532 -18.661 1.00 33.40 C ATOM 1374 CD1 LEU A 86 17.908 -0.141 -19.337 1.00 51.31 C ATOM 1375 CD2 LEU A 86 20.235 0.721 -19.648 1.00 42.30 C ATOM 0 H LEU A 86 20.448 0.889 -16.656 1.00 32.43 H new ATOM 0 HA LEU A 86 20.406 3.134 -18.259 1.00 53.50 H new ATOM 0 HB2 LEU A 86 17.932 1.687 -17.284 1.00 2.11 H new ATOM 0 HB3 LEU A 86 18.186 2.462 -18.836 1.00 2.11 H new ATOM 0 HG LEU A 86 19.440 -0.114 -17.854 1.00 33.40 H new ATOM 0 HD11 LEU A 86 18.224 -1.095 -19.760 1.00 51.31 H new ATOM 0 HD12 LEU A 86 17.120 -0.312 -18.604 1.00 51.31 H new ATOM 0 HD13 LEU A 86 17.530 0.501 -20.133 1.00 51.31 H new ATOM 0 HD21 LEU A 86 20.518 -0.245 -20.066 1.00 42.30 H new ATOM 0 HD22 LEU A 86 19.915 1.385 -20.452 1.00 42.30 H new ATOM 0 HD23 LEU A 86 21.091 1.159 -19.135 1.00 42.30 H new ATOM 1387 N TRP A 87 18.967 3.619 -15.364 1.00 20.22 N ATOM 1388 CA TRP A 87 18.405 4.636 -14.482 1.00 25.54 C ATOM 1389 C TRP A 87 19.204 5.932 -14.567 1.00 70.40 C ATOM 1390 O TRP A 87 18.632 7.020 -14.627 1.00 21.41 O ATOM 1391 CB TRP A 87 18.382 4.131 -13.038 1.00 31.21 C ATOM 1392 CG TRP A 87 18.017 5.191 -12.044 1.00 12.32 C ATOM 1393 CD1 TRP A 87 17.194 6.261 -12.252 1.00 35.04 C ATOM 1394 CD2 TRP A 87 18.464 5.285 -10.687 1.00 23.40 C ATOM 1395 NE1 TRP A 87 17.102 7.014 -11.106 1.00 23.34 N ATOM 1396 CE2 TRP A 87 17.872 6.435 -10.131 1.00 51.41 C ATOM 1397 CE3 TRP A 87 19.306 4.507 -9.887 1.00 11.10 C ATOM 1398 CZ2 TRP A 87 18.097 6.826 -8.814 1.00 33.54 C ATOM 1399 CZ3 TRP A 87 19.528 4.896 -8.580 1.00 23.23 C ATOM 1400 CH2 TRP A 87 18.925 6.046 -8.053 1.00 62.11 C ATOM 0 H TRP A 87 19.149 2.723 -14.912 1.00 20.22 H new ATOM 0 HA TRP A 87 17.384 4.838 -14.806 1.00 25.54 H new ATOM 0 HB2 TRP A 87 17.671 3.309 -12.959 1.00 31.21 H new ATOM 0 HB3 TRP A 87 19.363 3.729 -12.786 1.00 31.21 H new ATOM 0 HD1 TRP A 87 16.690 6.483 -13.181 1.00 35.04 H new ATOM 0 HE1 TRP A 87 16.550 7.865 -10.999 1.00 23.34 H new ATOM 0 HE3 TRP A 87 19.774 3.618 -10.283 1.00 11.10 H new ATOM 0 HZ2 TRP A 87 17.635 7.713 -8.407 1.00 33.54 H new ATOM 0 HZ3 TRP A 87 20.178 4.303 -7.953 1.00 23.23 H new ATOM 0 HH2 TRP A 87 19.117 6.322 -7.027 1.00 62.11 H new ATOM 1411 N GLN A 88 20.527 5.807 -14.572 1.00 42.25 N ATOM 1412 CA GLN A 88 21.403 6.970 -14.650 1.00 40.32 C ATOM 1413 C GLN A 88 20.970 7.903 -15.776 1.00 42.33 C ATOM 1414 O GLN A 88 21.079 9.123 -15.661 1.00 53.45 O ATOM 1415 CB GLN A 88 22.852 6.530 -14.865 1.00 43.50 C ATOM 1416 CG GLN A 88 23.499 5.939 -13.623 1.00 72.41 C ATOM 1417 CD GLN A 88 24.349 6.944 -12.872 1.00 50.31 C ATOM 1418 OE1 GLN A 88 25.578 6.897 -12.924 1.00 23.01 O ATOM 1419 NE2 GLN A 88 23.697 7.862 -12.168 1.00 42.41 N ATOM 0 H GLN A 88 21.016 4.913 -14.523 1.00 42.25 H new ATOM 0 HA GLN A 88 21.331 7.511 -13.707 1.00 40.32 H new ATOM 0 HB2 GLN A 88 22.884 5.793 -15.667 1.00 43.50 H new ATOM 0 HB3 GLN A 88 23.438 7.387 -15.197 1.00 43.50 H new ATOM 0 HG2 GLN A 88 22.722 5.559 -12.960 1.00 72.41 H new ATOM 0 HG3 GLN A 88 24.118 5.089 -13.910 1.00 72.41 H new ATOM 0 HE21 GLN A 88 22.677 7.864 -12.153 1.00 42.41 H new ATOM 0 HE22 GLN A 88 24.216 8.565 -11.642 1.00 42.41 H new ATOM 1428 N GLY A 89 20.479 7.320 -16.866 1.00 1.32 N ATOM 1429 CA GLY A 89 20.038 8.115 -17.997 1.00 72.54 C ATOM 1430 C GLY A 89 18.765 8.884 -17.704 1.00 44.43 C ATOM 1431 O GLY A 89 18.720 10.104 -17.861 1.00 51.52 O ATOM 0 H GLY A 89 20.379 6.312 -16.986 1.00 1.32 H new ATOM 0 HA2 GLY A 89 20.826 8.815 -18.274 1.00 72.54 H new ATOM 0 HA3 GLY A 89 19.875 7.462 -18.855 1.00 72.54 H new ATOM 1435 N SER A 90 17.728 8.170 -17.279 1.00 2.32 N ATOM 1436 CA SER A 90 16.447 8.793 -16.969 1.00 11.55 C ATOM 1437 C SER A 90 16.626 9.939 -15.976 1.00 71.44 C ATOM 1438 O SER A 90 15.907 10.938 -16.027 1.00 31.41 O ATOM 1439 CB SER A 90 15.476 7.757 -16.399 1.00 4.03 C ATOM 1440 OG SER A 90 14.556 8.358 -15.504 1.00 24.31 O ATOM 0 H SER A 90 17.750 7.160 -17.141 1.00 2.32 H new ATOM 0 HA SER A 90 16.035 9.197 -17.894 1.00 11.55 H new ATOM 0 HB2 SER A 90 14.934 7.275 -17.213 1.00 4.03 H new ATOM 0 HB3 SER A 90 16.034 6.977 -15.882 1.00 4.03 H new ATOM 0 HG SER A 90 13.643 8.223 -15.834 1.00 24.31 H new ATOM 1446 N LEU A 91 17.589 9.786 -15.075 1.00 4.43 N ATOM 1447 CA LEU A 91 17.865 10.807 -14.069 1.00 53.14 C ATOM 1448 C LEU A 91 18.014 12.181 -14.715 1.00 70.00 C ATOM 1449 O LEU A 91 17.464 13.170 -14.230 1.00 33.33 O ATOM 1450 CB LEU A 91 19.134 10.456 -13.292 1.00 22.32 C ATOM 1451 CG LEU A 91 19.019 10.490 -11.767 1.00 53.14 C ATOM 1452 CD1 LEU A 91 20.068 9.591 -11.132 1.00 71.02 C ATOM 1453 CD2 LEU A 91 19.154 11.916 -11.254 1.00 44.33 C ATOM 0 H LEU A 91 18.192 8.965 -15.020 1.00 4.43 H new ATOM 0 HA LEU A 91 17.022 10.839 -13.379 1.00 53.14 H new ATOM 0 HB2 LEU A 91 19.454 9.458 -13.590 1.00 22.32 H new ATOM 0 HB3 LEU A 91 19.922 11.146 -13.592 1.00 22.32 H new ATOM 0 HG LEU A 91 18.034 10.116 -11.488 1.00 53.14 H new ATOM 0 HD11 LEU A 91 19.971 9.628 -10.047 1.00 71.02 H new ATOM 0 HD12 LEU A 91 19.924 8.566 -11.474 1.00 71.02 H new ATOM 0 HD13 LEU A 91 21.062 9.933 -11.419 1.00 71.02 H new ATOM 0 HD21 LEU A 91 19.070 11.921 -10.167 1.00 44.33 H new ATOM 0 HD22 LEU A 91 20.125 12.317 -11.545 1.00 44.33 H new ATOM 0 HD23 LEU A 91 18.364 12.533 -11.682 1.00 44.33 H new ATOM 1465 N PHE A 92 18.760 12.235 -15.813 1.00 62.03 N ATOM 1466 CA PHE A 92 18.981 13.487 -16.527 1.00 10.52 C ATOM 1467 C PHE A 92 17.703 13.951 -17.220 1.00 1.12 C ATOM 1468 O PHE A 92 17.467 15.149 -17.373 1.00 32.35 O ATOM 1469 CB PHE A 92 20.101 13.322 -17.556 1.00 4.44 C ATOM 1470 CG PHE A 92 20.543 14.618 -18.174 1.00 60.11 C ATOM 1471 CD1 PHE A 92 19.816 15.192 -19.204 1.00 40.51 C ATOM 1472 CD2 PHE A 92 21.686 15.261 -17.726 1.00 33.22 C ATOM 1473 CE1 PHE A 92 20.219 16.385 -19.775 1.00 64.22 C ATOM 1474 CE2 PHE A 92 22.094 16.453 -18.293 1.00 14.43 C ATOM 1475 CZ PHE A 92 21.360 17.015 -19.319 1.00 44.45 C ATOM 0 H PHE A 92 19.222 11.426 -16.228 1.00 62.03 H new ATOM 0 HA PHE A 92 19.274 14.244 -15.799 1.00 10.52 H new ATOM 0 HB2 PHE A 92 20.957 12.847 -17.077 1.00 4.44 H new ATOM 0 HB3 PHE A 92 19.763 12.649 -18.344 1.00 4.44 H new ATOM 0 HD1 PHE A 92 18.924 14.702 -19.565 1.00 40.51 H new ATOM 0 HD2 PHE A 92 22.264 14.825 -16.925 1.00 33.22 H new ATOM 0 HE1 PHE A 92 19.642 16.823 -20.576 1.00 64.22 H new ATOM 0 HE2 PHE A 92 22.986 16.945 -17.934 1.00 14.43 H new ATOM 0 HZ PHE A 92 21.678 17.946 -19.764 1.00 44.45 H new ATOM 1485 N ASN A 93 16.883 12.993 -17.638 1.00 34.32 N ATOM 1486 CA ASN A 93 15.629 13.302 -18.316 1.00 31.31 C ATOM 1487 C ASN A 93 14.733 14.168 -17.435 1.00 63.14 C ATOM 1488 O ASN A 93 14.376 15.286 -17.806 1.00 30.35 O ATOM 1489 CB ASN A 93 14.898 12.012 -18.694 1.00 31.23 C ATOM 1490 CG ASN A 93 13.976 12.197 -19.883 1.00 52.13 C ATOM 1491 OD1 ASN A 93 14.292 11.782 -20.998 1.00 73.43 O ATOM 1492 ND2 ASN A 93 12.828 12.824 -19.650 1.00 65.14 N ATOM 0 H ASN A 93 17.064 11.996 -17.519 1.00 34.32 H new ATOM 0 HA ASN A 93 15.863 13.858 -19.224 1.00 31.31 H new ATOM 0 HB2 ASN A 93 15.629 11.237 -18.922 1.00 31.23 H new ATOM 0 HB3 ASN A 93 14.319 11.662 -17.840 1.00 31.23 H new ATOM 0 HD21 ASN A 93 12.167 12.978 -20.412 1.00 65.14 H new ATOM 0 HD22 ASN A 93 12.607 13.151 -18.709 1.00 65.14 H new ATOM 1499 N ALA A 94 14.375 13.643 -16.268 1.00 50.31 N ATOM 1500 CA ALA A 94 13.524 14.369 -15.334 1.00 33.05 C ATOM 1501 C ALA A 94 13.957 14.124 -13.892 1.00 62.02 C ATOM 1502 O ALA A 94 14.584 14.979 -13.269 1.00 1.51 O ATOM 1503 CB ALA A 94 12.068 13.968 -15.524 1.00 65.15 C ATOM 0 H ALA A 94 14.661 12.718 -15.947 1.00 50.31 H new ATOM 0 HA ALA A 94 13.626 15.434 -15.541 1.00 33.05 H new ATOM 0 HB1 ALA A 94 11.444 14.518 -14.820 1.00 65.15 H new ATOM 0 HB2 ALA A 94 11.757 14.200 -16.543 1.00 65.15 H new ATOM 0 HB3 ALA A 94 11.959 12.898 -15.346 1.00 65.15 H new ATOM 1509 N ASN A 95 13.618 12.950 -13.369 1.00 1.45 N ATOM 1510 CA ASN A 95 13.972 12.594 -11.999 1.00 74.33 C ATOM 1511 C ASN A 95 13.466 11.196 -11.653 1.00 40.44 C ATOM 1512 O ASN A 95 12.642 11.028 -10.754 1.00 53.04 O ATOM 1513 CB ASN A 95 13.392 13.615 -11.018 1.00 44.14 C ATOM 1514 CG ASN A 95 12.010 14.088 -11.425 1.00 60.10 C ATOM 1515 OD1 ASN A 95 11.116 13.281 -11.680 1.00 31.12 O ATOM 1516 ND2 ASN A 95 11.829 15.402 -11.488 1.00 20.12 N ATOM 0 H ASN A 95 13.099 12.230 -13.872 1.00 1.45 H new ATOM 0 HA ASN A 95 15.059 12.599 -11.918 1.00 74.33 H new ATOM 0 HB2 ASN A 95 13.343 13.172 -10.023 1.00 44.14 H new ATOM 0 HB3 ASN A 95 14.062 14.472 -10.952 1.00 44.14 H new ATOM 0 HD21 ASN A 95 10.920 15.779 -11.756 1.00 20.12 H new ATOM 0 HD22 ASN A 95 12.599 16.034 -11.268 1.00 20.12 H new ATOM 1523 N TYR A 96 13.966 10.198 -12.372 1.00 71.25 N ATOM 1524 CA TYR A 96 13.564 8.815 -12.143 1.00 40.04 C ATOM 1525 C TYR A 96 12.076 8.627 -12.420 1.00 55.34 C ATOM 1526 O TYR A 96 11.231 8.955 -11.587 1.00 2.43 O ATOM 1527 CB TYR A 96 13.883 8.401 -10.706 1.00 32.22 C ATOM 1528 CG TYR A 96 13.724 6.918 -10.453 1.00 51.54 C ATOM 1529 CD1 TYR A 96 14.148 5.985 -11.391 1.00 60.12 C ATOM 1530 CD2 TYR A 96 13.149 6.451 -9.278 1.00 52.41 C ATOM 1531 CE1 TYR A 96 14.004 4.630 -11.165 1.00 63.44 C ATOM 1532 CE2 TYR A 96 13.002 5.098 -9.043 1.00 44.02 C ATOM 1533 CZ TYR A 96 13.431 4.191 -9.990 1.00 4.12 C ATOM 1534 OH TYR A 96 13.286 2.842 -9.760 1.00 41.22 O ATOM 0 H TYR A 96 14.650 10.320 -13.118 1.00 71.25 H new ATOM 0 HA TYR A 96 14.125 8.182 -12.830 1.00 40.04 H new ATOM 0 HB2 TYR A 96 14.907 8.693 -10.471 1.00 32.22 H new ATOM 0 HB3 TYR A 96 13.231 8.949 -10.026 1.00 32.22 H new ATOM 0 HD1 TYR A 96 14.598 6.325 -12.312 1.00 60.12 H new ATOM 0 HD2 TYR A 96 12.811 7.158 -8.535 1.00 52.41 H new ATOM 0 HE1 TYR A 96 14.339 3.918 -11.905 1.00 63.44 H new ATOM 0 HE2 TYR A 96 12.554 4.752 -8.123 1.00 44.02 H new ATOM 0 HH TYR A 96 14.002 2.353 -10.216 1.00 41.22 H new ATOM 1544 N ASP A 97 11.762 8.096 -13.597 1.00 41.41 N ATOM 1545 CA ASP A 97 10.376 7.862 -13.985 1.00 41.45 C ATOM 1546 C ASP A 97 10.092 6.369 -14.111 1.00 72.15 C ATOM 1547 O ASP A 97 9.778 5.875 -15.195 1.00 3.12 O ATOM 1548 CB ASP A 97 10.069 8.566 -15.308 1.00 51.03 C ATOM 1549 CG ASP A 97 9.635 10.005 -15.111 1.00 43.34 C ATOM 1550 OD1 ASP A 97 8.499 10.223 -14.641 1.00 42.24 O ATOM 1551 OD2 ASP A 97 10.432 10.914 -15.428 1.00 73.11 O ATOM 0 H ASP A 97 12.449 7.820 -14.299 1.00 41.41 H new ATOM 0 HA ASP A 97 9.732 8.271 -13.207 1.00 41.45 H new ATOM 0 HB2 ASP A 97 10.954 8.540 -15.944 1.00 51.03 H new ATOM 0 HB3 ASP A 97 9.284 8.021 -15.832 1.00 51.03 H new ATOM 1556 N VAL A 98 10.205 5.654 -12.997 1.00 33.05 N ATOM 1557 CA VAL A 98 9.960 4.217 -12.982 1.00 30.32 C ATOM 1558 C VAL A 98 8.999 3.834 -11.862 1.00 1.33 C ATOM 1559 O VAL A 98 9.061 4.386 -10.763 1.00 55.14 O ATOM 1560 CB VAL A 98 11.271 3.426 -12.811 1.00 73.13 C ATOM 1561 CG1 VAL A 98 11.001 1.930 -12.852 1.00 71.54 C ATOM 1562 CG2 VAL A 98 12.276 3.824 -13.881 1.00 52.34 C ATOM 0 H VAL A 98 10.465 6.047 -12.092 1.00 33.05 H new ATOM 0 HA VAL A 98 9.513 3.963 -13.943 1.00 30.32 H new ATOM 0 HB VAL A 98 11.697 3.668 -11.837 1.00 73.13 H new ATOM 0 HG11 VAL A 98 11.939 1.388 -12.730 1.00 71.54 H new ATOM 0 HG12 VAL A 98 10.318 1.661 -12.046 1.00 71.54 H new ATOM 0 HG13 VAL A 98 10.552 1.667 -13.810 1.00 71.54 H new ATOM 0 HG21 VAL A 98 13.196 3.256 -13.745 1.00 52.34 H new ATOM 0 HG22 VAL A 98 11.861 3.613 -14.867 1.00 52.34 H new ATOM 0 HG23 VAL A 98 12.492 4.889 -13.799 1.00 52.34 H new ATOM 1572 N GLN A 99 8.113 2.886 -12.148 1.00 11.02 N ATOM 1573 CA GLN A 99 7.138 2.430 -11.164 1.00 24.13 C ATOM 1574 C GLN A 99 7.139 0.908 -11.062 1.00 0.21 C ATOM 1575 O GLN A 99 7.336 0.210 -12.056 1.00 63.14 O ATOM 1576 CB GLN A 99 5.740 2.928 -11.531 1.00 75.33 C ATOM 1577 CG GLN A 99 5.702 4.392 -11.939 1.00 24.24 C ATOM 1578 CD GLN A 99 5.788 4.582 -13.440 1.00 44.21 C ATOM 1579 OE1 GLN A 99 6.922 5.091 -13.909 1.00 44.54 O flip ATOM 1580 NE2 GLN A 99 4.846 4.275 -14.171 1.00 30.04 N flip ATOM 0 H GLN A 99 8.050 2.419 -13.052 1.00 11.02 H new ATOM 0 HA GLN A 99 7.419 2.841 -10.194 1.00 24.13 H new ATOM 0 HB2 GLN A 99 5.351 2.322 -12.349 1.00 75.33 H new ATOM 0 HB3 GLN A 99 5.076 2.780 -10.680 1.00 75.33 H new ATOM 0 HG2 GLN A 99 4.781 4.844 -11.572 1.00 24.24 H new ATOM 0 HG3 GLN A 99 6.528 4.920 -11.462 1.00 24.24 H new ATOM 0 HE21 GLN A 99 3.993 3.887 -13.768 1.00 30.04 H new ATOM 0 HE22 GLN A 99 4.919 4.409 -15.180 1.00 30.04 H new ATOM 1589 N ARG A 100 6.917 0.401 -9.854 1.00 24.23 N ATOM 1590 CA ARG A 100 6.894 -1.038 -9.622 1.00 21.41 C ATOM 1591 C ARG A 100 5.637 -1.446 -8.860 1.00 14.03 C ATOM 1592 O ARG A 100 5.151 -0.708 -8.002 1.00 50.24 O ATOM 1593 CB ARG A 100 8.138 -1.471 -8.844 1.00 31.43 C ATOM 1594 CG ARG A 100 8.421 -2.962 -8.928 1.00 33.42 C ATOM 1595 CD ARG A 100 8.906 -3.514 -7.596 1.00 54.51 C ATOM 1596 NE ARG A 100 7.873 -3.443 -6.566 1.00 33.40 N ATOM 1597 CZ ARG A 100 8.129 -3.497 -5.264 1.00 12.34 C ATOM 1598 NH1 ARG A 100 9.377 -3.620 -4.835 1.00 3.33 N ATOM 1599 NH2 ARG A 100 7.135 -3.426 -4.387 1.00 71.54 N ATOM 0 H ARG A 100 6.751 0.965 -9.021 1.00 24.23 H new ATOM 0 HA ARG A 100 6.888 -1.537 -10.591 1.00 21.41 H new ATOM 0 HB2 ARG A 100 9.001 -0.924 -9.223 1.00 31.43 H new ATOM 0 HB3 ARG A 100 8.017 -1.191 -7.797 1.00 31.43 H new ATOM 0 HG2 ARG A 100 7.517 -3.488 -9.233 1.00 33.42 H new ATOM 0 HG3 ARG A 100 9.173 -3.148 -9.695 1.00 33.42 H new ATOM 0 HD2 ARG A 100 9.219 -4.550 -7.725 1.00 54.51 H new ATOM 0 HD3 ARG A 100 9.783 -2.955 -7.269 1.00 54.51 H new ATOM 0 HE ARG A 100 6.902 -3.347 -6.863 1.00 33.40 H new ATOM 0 HH11 ARG A 100 10.144 -3.673 -5.505 1.00 3.33 H new ATOM 0 HH12 ARG A 100 9.571 -3.661 -3.834 1.00 3.33 H new ATOM 0 HH21 ARG A 100 6.173 -3.330 -4.713 1.00 71.54 H new ATOM 0 HH22 ARG A 100 7.333 -3.468 -3.387 1.00 71.54 H new ATOM 1613 N PHE A 101 5.114 -2.625 -9.179 1.00 31.44 N ATOM 1614 CA PHE A 101 3.912 -3.131 -8.525 1.00 41.13 C ATOM 1615 C PHE A 101 3.982 -4.645 -8.354 1.00 25.44 C ATOM 1616 O PHE A 101 4.227 -5.379 -9.312 1.00 53.43 O ATOM 1617 CB PHE A 101 2.669 -2.755 -9.335 1.00 65.22 C ATOM 1618 CG PHE A 101 1.388 -2.892 -8.564 1.00 53.42 C ATOM 1619 CD1 PHE A 101 1.279 -2.383 -7.280 1.00 53.41 C ATOM 1620 CD2 PHE A 101 0.292 -3.528 -9.124 1.00 33.44 C ATOM 1621 CE1 PHE A 101 0.101 -2.508 -6.568 1.00 53.53 C ATOM 1622 CE2 PHE A 101 -0.889 -3.656 -8.417 1.00 13.13 C ATOM 1623 CZ PHE A 101 -0.985 -3.144 -7.138 1.00 10.23 C ATOM 0 H PHE A 101 5.503 -3.248 -9.886 1.00 31.44 H new ATOM 0 HA PHE A 101 3.846 -2.674 -7.537 1.00 41.13 H new ATOM 0 HB2 PHE A 101 2.768 -1.726 -9.680 1.00 65.22 H new ATOM 0 HB3 PHE A 101 2.619 -3.386 -10.223 1.00 65.22 H new ATOM 0 HD1 PHE A 101 2.124 -1.883 -6.830 1.00 53.41 H new ATOM 0 HD2 PHE A 101 0.361 -3.928 -10.125 1.00 33.44 H new ATOM 0 HE1 PHE A 101 0.030 -2.109 -5.567 1.00 53.53 H new ATOM 0 HE2 PHE A 101 -1.736 -4.156 -8.864 1.00 13.13 H new ATOM 0 HZ PHE A 101 -1.907 -3.241 -6.584 1.00 10.23 H new ATOM 1633 N ILE A 102 3.767 -5.106 -7.126 1.00 65.20 N ATOM 1634 CA ILE A 102 3.806 -6.533 -6.828 1.00 52.44 C ATOM 1635 C ILE A 102 2.564 -6.967 -6.058 1.00 12.03 C ATOM 1636 O ILE A 102 2.299 -6.478 -4.959 1.00 71.14 O ATOM 1637 CB ILE A 102 5.058 -6.904 -6.013 1.00 3.02 C ATOM 1638 CG1 ILE A 102 6.325 -6.521 -6.780 1.00 44.31 C ATOM 1639 CG2 ILE A 102 5.058 -8.391 -5.689 1.00 11.50 C ATOM 1640 CD1 ILE A 102 7.593 -6.677 -5.969 1.00 40.55 C ATOM 0 H ILE A 102 3.564 -4.512 -6.322 1.00 65.20 H new ATOM 0 HA ILE A 102 3.838 -7.055 -7.785 1.00 52.44 H new ATOM 0 HB ILE A 102 5.041 -6.348 -5.076 1.00 3.02 H new ATOM 0 HG12 ILE A 102 6.398 -7.138 -7.676 1.00 44.31 H new ATOM 0 HG13 ILE A 102 6.240 -5.486 -7.112 1.00 44.31 H new ATOM 0 HG21 ILE A 102 5.950 -8.638 -5.112 1.00 11.50 H new ATOM 0 HG22 ILE A 102 4.170 -8.637 -5.107 1.00 11.50 H new ATOM 0 HG23 ILE A 102 5.055 -8.965 -6.615 1.00 11.50 H new ATOM 0 HD11 ILE A 102 8.451 -6.388 -6.576 1.00 40.55 H new ATOM 0 HD12 ILE A 102 7.541 -6.039 -5.087 1.00 40.55 H new ATOM 0 HD13 ILE A 102 7.701 -7.717 -5.660 1.00 40.55 H new ATOM 1652 N VAL A 103 1.805 -7.890 -6.640 1.00 64.32 N ATOM 1653 CA VAL A 103 0.592 -8.394 -6.007 1.00 42.33 C ATOM 1654 C VAL A 103 0.317 -9.836 -6.416 1.00 61.41 C ATOM 1655 O VAL A 103 0.271 -10.159 -7.603 1.00 5.44 O ATOM 1656 CB VAL A 103 -0.630 -7.528 -6.367 1.00 44.24 C ATOM 1657 CG1 VAL A 103 -1.890 -8.089 -5.727 1.00 23.31 C ATOM 1658 CG2 VAL A 103 -0.403 -6.085 -5.943 1.00 11.35 C ATOM 0 H VAL A 103 2.009 -8.304 -7.550 1.00 64.32 H new ATOM 0 HA VAL A 103 0.755 -8.350 -4.930 1.00 42.33 H new ATOM 0 HB VAL A 103 -0.762 -7.548 -7.449 1.00 44.24 H new ATOM 0 HG11 VAL A 103 -2.742 -7.464 -5.993 1.00 23.31 H new ATOM 0 HG12 VAL A 103 -2.059 -9.104 -6.085 1.00 23.31 H new ATOM 0 HG13 VAL A 103 -1.773 -8.101 -4.643 1.00 23.31 H new ATOM 0 HG21 VAL A 103 -1.276 -5.487 -6.205 1.00 11.35 H new ATOM 0 HG22 VAL A 103 -0.244 -6.043 -4.865 1.00 11.35 H new ATOM 0 HG23 VAL A 103 0.474 -5.689 -6.454 1.00 11.35 H new ATOM 1668 N GLY A 104 0.134 -10.702 -5.424 1.00 33.41 N ATOM 1669 CA GLY A 104 -0.135 -12.101 -5.701 1.00 33.44 C ATOM 1670 C GLY A 104 1.100 -12.849 -6.163 1.00 12.15 C ATOM 1671 O GLY A 104 2.161 -12.749 -5.546 1.00 73.33 O ATOM 0 H GLY A 104 0.167 -10.460 -4.434 1.00 33.41 H new ATOM 0 HA2 GLY A 104 -0.529 -12.577 -4.803 1.00 33.44 H new ATOM 0 HA3 GLY A 104 -0.908 -12.175 -6.466 1.00 33.44 H new ATOM 1675 N SER A 105 0.962 -13.601 -7.250 1.00 22.44 N ATOM 1676 CA SER A 105 2.075 -14.374 -7.791 1.00 13.54 C ATOM 1677 C SER A 105 2.609 -13.735 -9.069 1.00 55.40 C ATOM 1678 O SER A 105 3.490 -14.284 -9.729 1.00 63.24 O ATOM 1679 CB SER A 105 1.636 -15.812 -8.071 1.00 20.24 C ATOM 1680 OG SER A 105 2.170 -16.705 -7.108 1.00 40.31 O ATOM 0 H SER A 105 0.091 -13.692 -7.774 1.00 22.44 H new ATOM 0 HA SER A 105 2.874 -14.384 -7.049 1.00 13.54 H new ATOM 0 HB2 SER A 105 0.548 -15.871 -8.063 1.00 20.24 H new ATOM 0 HB3 SER A 105 1.964 -16.108 -9.067 1.00 20.24 H new ATOM 0 HG SER A 105 3.014 -17.076 -7.439 1.00 40.31 H new ATOM 1686 N ASP A 106 2.068 -12.571 -9.412 1.00 15.35 N ATOM 1687 CA ASP A 106 2.489 -11.855 -10.610 1.00 50.21 C ATOM 1688 C ASP A 106 2.950 -10.442 -10.265 1.00 71.14 C ATOM 1689 O ASP A 106 2.337 -9.762 -9.442 1.00 71.12 O ATOM 1690 CB ASP A 106 1.346 -11.798 -11.625 1.00 31.43 C ATOM 1691 CG ASP A 106 0.062 -11.265 -11.021 1.00 35.41 C ATOM 1692 OD1 ASP A 106 -0.042 -10.034 -10.840 1.00 74.41 O ATOM 1693 OD2 ASP A 106 -0.839 -12.080 -10.728 1.00 54.51 O ATOM 0 H ASP A 106 1.337 -12.103 -8.877 1.00 15.35 H new ATOM 0 HA ASP A 106 3.328 -12.395 -11.049 1.00 50.21 H new ATOM 0 HB2 ASP A 106 1.639 -11.166 -12.463 1.00 31.43 H new ATOM 0 HB3 ASP A 106 1.169 -12.796 -12.025 1.00 31.43 H new ATOM 1698 N ARG A 107 4.034 -10.007 -10.900 1.00 31.53 N ATOM 1699 CA ARG A 107 4.578 -8.677 -10.658 1.00 43.34 C ATOM 1700 C ARG A 107 4.701 -7.895 -11.963 1.00 11.31 C ATOM 1701 O ARG A 107 4.945 -8.471 -13.023 1.00 11.43 O ATOM 1702 CB ARG A 107 5.946 -8.777 -9.981 1.00 22.20 C ATOM 1703 CG ARG A 107 5.976 -9.745 -8.810 1.00 22.24 C ATOM 1704 CD ARG A 107 7.356 -9.807 -8.173 1.00 12.32 C ATOM 1705 NE ARG A 107 7.355 -10.588 -6.939 1.00 32.00 N ATOM 1706 CZ ARG A 107 7.214 -11.908 -6.905 1.00 63.54 C ATOM 1707 NH1 ARG A 107 7.065 -12.591 -8.032 1.00 32.41 N ATOM 1708 NH2 ARG A 107 7.224 -12.549 -5.743 1.00 52.41 N ATOM 0 H ARG A 107 4.552 -10.557 -11.586 1.00 31.53 H new ATOM 0 HA ARG A 107 3.892 -8.146 -9.998 1.00 43.34 H new ATOM 0 HB2 ARG A 107 6.685 -9.089 -10.719 1.00 22.20 H new ATOM 0 HB3 ARG A 107 6.242 -7.788 -9.632 1.00 22.20 H new ATOM 0 HG2 ARG A 107 5.243 -9.438 -8.064 1.00 22.24 H new ATOM 0 HG3 ARG A 107 5.686 -10.739 -9.151 1.00 22.24 H new ATOM 0 HD2 ARG A 107 8.062 -10.245 -8.879 1.00 12.32 H new ATOM 0 HD3 ARG A 107 7.703 -8.796 -7.962 1.00 12.32 H new ATOM 0 HE ARG A 107 7.469 -10.092 -6.055 1.00 32.00 H new ATOM 0 HH11 ARG A 107 7.059 -12.102 -8.927 1.00 32.41 H new ATOM 0 HH12 ARG A 107 6.957 -13.605 -8.003 1.00 32.41 H new ATOM 0 HH21 ARG A 107 7.340 -12.028 -4.874 1.00 52.41 H new ATOM 0 HH22 ARG A 107 7.116 -13.563 -5.719 1.00 52.41 H new ATOM 1722 N ALA A 108 4.529 -6.580 -11.877 1.00 4.32 N ATOM 1723 CA ALA A 108 4.622 -5.719 -13.049 1.00 43.24 C ATOM 1724 C ALA A 108 5.729 -4.683 -12.883 1.00 53.34 C ATOM 1725 O ALA A 108 5.973 -4.193 -11.780 1.00 71.13 O ATOM 1726 CB ALA A 108 3.289 -5.033 -13.308 1.00 32.13 C ATOM 0 H ALA A 108 4.324 -6.088 -11.007 1.00 4.32 H new ATOM 0 HA ALA A 108 4.870 -6.343 -13.908 1.00 43.24 H new ATOM 0 HB1 ALA A 108 3.374 -4.393 -14.186 1.00 32.13 H new ATOM 0 HB2 ALA A 108 2.520 -5.786 -13.480 1.00 32.13 H new ATOM 0 HB3 ALA A 108 3.017 -4.428 -12.443 1.00 32.13 H new ATOM 1732 N ILE A 109 6.395 -4.354 -13.985 1.00 51.20 N ATOM 1733 CA ILE A 109 7.475 -3.375 -13.960 1.00 61.44 C ATOM 1734 C ILE A 109 7.369 -2.409 -15.135 1.00 74.34 C ATOM 1735 O ILE A 109 7.150 -2.822 -16.275 1.00 23.03 O ATOM 1736 CB ILE A 109 8.855 -4.059 -13.996 1.00 32.11 C ATOM 1737 CG1 ILE A 109 9.965 -3.028 -13.781 1.00 73.03 C ATOM 1738 CG2 ILE A 109 9.050 -4.789 -15.316 1.00 44.14 C ATOM 1739 CD1 ILE A 109 10.219 -2.709 -12.325 1.00 3.51 C ATOM 0 H ILE A 109 6.206 -4.751 -14.905 1.00 51.20 H new ATOM 0 HA ILE A 109 7.377 -2.820 -13.027 1.00 61.44 H new ATOM 0 HB ILE A 109 8.903 -4.790 -13.189 1.00 32.11 H new ATOM 0 HG12 ILE A 109 10.887 -3.399 -14.229 1.00 73.03 H new ATOM 0 HG13 ILE A 109 9.703 -2.109 -14.306 1.00 73.03 H new ATOM 0 HG21 ILE A 109 10.030 -5.267 -15.326 1.00 44.14 H new ATOM 0 HG22 ILE A 109 8.275 -5.547 -15.431 1.00 44.14 H new ATOM 0 HG23 ILE A 109 8.985 -4.077 -16.139 1.00 44.14 H new ATOM 0 HD11 ILE A 109 11.018 -1.972 -12.248 1.00 3.51 H new ATOM 0 HD12 ILE A 109 9.310 -2.308 -11.877 1.00 3.51 H new ATOM 0 HD13 ILE A 109 10.512 -3.618 -11.799 1.00 3.51 H new ATOM 1751 N PHE A 110 7.526 -1.121 -14.851 1.00 10.20 N ATOM 1752 CA PHE A 110 7.448 -0.095 -15.884 1.00 45.33 C ATOM 1753 C PHE A 110 8.502 0.986 -15.658 1.00 32.20 C ATOM 1754 O PHE A 110 8.510 1.653 -14.624 1.00 32.43 O ATOM 1755 CB PHE A 110 6.053 0.534 -15.905 1.00 65.54 C ATOM 1756 CG PHE A 110 5.945 1.722 -16.818 1.00 31.15 C ATOM 1757 CD1 PHE A 110 6.250 2.994 -16.360 1.00 34.54 C ATOM 1758 CD2 PHE A 110 5.538 1.567 -18.133 1.00 13.21 C ATOM 1759 CE1 PHE A 110 6.151 4.089 -17.196 1.00 41.25 C ATOM 1760 CE2 PHE A 110 5.438 2.659 -18.974 1.00 72.04 C ATOM 1761 CZ PHE A 110 5.744 3.922 -18.505 1.00 73.44 C ATOM 0 H PHE A 110 7.708 -0.762 -13.914 1.00 10.20 H new ATOM 0 HA PHE A 110 7.639 -0.569 -16.846 1.00 45.33 H new ATOM 0 HB2 PHE A 110 5.328 -0.219 -16.214 1.00 65.54 H new ATOM 0 HB3 PHE A 110 5.785 0.838 -14.893 1.00 65.54 H new ATOM 0 HD1 PHE A 110 6.569 3.131 -15.337 1.00 34.54 H new ATOM 0 HD2 PHE A 110 5.296 0.582 -18.505 1.00 13.21 H new ATOM 0 HE1 PHE A 110 6.392 5.075 -16.826 1.00 41.25 H new ATOM 0 HE2 PHE A 110 5.121 2.525 -19.998 1.00 72.04 H new ATOM 0 HZ PHE A 110 5.665 4.777 -19.161 1.00 73.44 H new ATOM 1771 N MET A 111 9.389 1.152 -16.633 1.00 65.20 N ATOM 1772 CA MET A 111 10.447 2.151 -16.541 1.00 3.51 C ATOM 1773 C MET A 111 10.569 2.936 -17.844 1.00 23.54 C ATOM 1774 O MET A 111 10.601 2.354 -18.929 1.00 45.32 O ATOM 1775 CB MET A 111 11.782 1.483 -16.207 1.00 44.04 C ATOM 1776 CG MET A 111 12.363 0.678 -17.359 1.00 3.14 C ATOM 1777 SD MET A 111 13.091 -0.881 -16.818 1.00 44.55 S ATOM 1778 CE MET A 111 14.404 -1.076 -18.022 1.00 12.05 C ATOM 0 H MET A 111 9.396 0.608 -17.496 1.00 65.20 H new ATOM 0 HA MET A 111 10.187 2.846 -15.742 1.00 3.51 H new ATOM 0 HB2 MET A 111 12.499 2.249 -15.912 1.00 44.04 H new ATOM 0 HB3 MET A 111 11.646 0.826 -15.348 1.00 44.04 H new ATOM 0 HG2 MET A 111 11.578 0.475 -18.088 1.00 3.14 H new ATOM 0 HG3 MET A 111 13.123 1.273 -17.866 1.00 3.14 H new ATOM 0 HE1 MET A 111 15.066 -1.884 -17.711 1.00 12.05 H new ATOM 0 HE2 MET A 111 13.973 -1.314 -18.995 1.00 12.05 H new ATOM 0 HE3 MET A 111 14.973 -0.149 -18.094 1.00 12.05 H new ATOM 1788 N LEU A 112 10.636 4.257 -17.729 1.00 44.32 N ATOM 1789 CA LEU A 112 10.755 5.121 -18.899 1.00 13.55 C ATOM 1790 C LEU A 112 11.508 6.403 -18.555 1.00 34.31 C ATOM 1791 O LEU A 112 11.448 6.885 -17.424 1.00 24.35 O ATOM 1792 CB LEU A 112 9.368 5.463 -19.447 1.00 62.33 C ATOM 1793 CG LEU A 112 9.128 5.127 -20.919 1.00 74.35 C ATOM 1794 CD1 LEU A 112 10.229 5.714 -21.788 1.00 23.01 C ATOM 1795 CD2 LEU A 112 9.038 3.620 -21.115 1.00 11.21 C ATOM 0 H LEU A 112 10.610 4.754 -16.839 1.00 44.32 H new ATOM 0 HA LEU A 112 11.319 4.584 -19.662 1.00 13.55 H new ATOM 0 HB2 LEU A 112 8.623 4.938 -18.849 1.00 62.33 H new ATOM 0 HB3 LEU A 112 9.196 6.530 -19.306 1.00 62.33 H new ATOM 0 HG LEU A 112 8.179 5.570 -21.222 1.00 74.35 H new ATOM 0 HD11 LEU A 112 10.041 5.464 -22.832 1.00 23.01 H new ATOM 0 HD12 LEU A 112 10.246 6.798 -21.671 1.00 23.01 H new ATOM 0 HD13 LEU A 112 11.191 5.302 -21.484 1.00 23.01 H new ATOM 0 HD21 LEU A 112 8.867 3.400 -22.169 1.00 11.21 H new ATOM 0 HD22 LEU A 112 9.970 3.155 -20.794 1.00 11.21 H new ATOM 0 HD23 LEU A 112 8.212 3.225 -20.523 1.00 11.21 H new ATOM 1807 N ARG A 113 12.213 6.950 -19.539 1.00 1.40 N ATOM 1808 CA ARG A 113 12.977 8.176 -19.341 1.00 13.51 C ATOM 1809 C ARG A 113 12.047 9.372 -19.153 1.00 71.32 C ATOM 1810 O ARG A 113 12.338 10.281 -18.376 1.00 41.55 O ATOM 1811 CB ARG A 113 13.906 8.422 -20.531 1.00 71.32 C ATOM 1812 CG ARG A 113 13.173 8.584 -21.853 1.00 11.23 C ATOM 1813 CD ARG A 113 13.871 7.829 -22.973 1.00 51.53 C ATOM 1814 NE ARG A 113 13.269 8.103 -24.275 1.00 52.14 N ATOM 1815 CZ ARG A 113 13.408 7.309 -25.331 1.00 43.01 C ATOM 1816 NH1 ARG A 113 14.125 6.198 -25.239 1.00 23.44 N ATOM 1817 NH2 ARG A 113 12.830 7.626 -26.482 1.00 75.13 N ATOM 0 H ARG A 113 12.271 6.564 -20.481 1.00 1.40 H new ATOM 0 HA ARG A 113 13.577 8.058 -18.439 1.00 13.51 H new ATOM 0 HB2 ARG A 113 14.497 9.318 -20.341 1.00 71.32 H new ATOM 0 HB3 ARG A 113 14.606 7.590 -20.613 1.00 71.32 H new ATOM 0 HG2 ARG A 113 12.150 8.221 -21.750 1.00 11.23 H new ATOM 0 HG3 ARG A 113 13.111 9.642 -22.109 1.00 11.23 H new ATOM 0 HD2 ARG A 113 14.925 8.106 -22.995 1.00 51.53 H new ATOM 0 HD3 ARG A 113 13.827 6.759 -22.771 1.00 51.53 H new ATOM 0 HE ARG A 113 12.711 8.951 -24.379 1.00 52.14 H new ATOM 0 HH11 ARG A 113 14.572 5.951 -24.356 1.00 23.44 H new ATOM 0 HH12 ARG A 113 14.230 5.590 -26.051 1.00 23.44 H new ATOM 0 HH21 ARG A 113 12.278 8.480 -26.557 1.00 75.13 H new ATOM 0 HH22 ARG A 113 12.938 7.015 -27.292 1.00 75.13 H new ATOM 1831 N ASP A 114 10.928 9.363 -19.870 1.00 22.55 N ATOM 1832 CA ASP A 114 9.955 10.445 -19.782 1.00 2.22 C ATOM 1833 C ASP A 114 9.047 10.263 -18.570 1.00 21.24 C ATOM 1834 O ASP A 114 9.071 11.065 -17.637 1.00 71.02 O ATOM 1835 CB ASP A 114 9.115 10.510 -21.059 1.00 24.55 C ATOM 1836 CG ASP A 114 9.844 11.198 -22.196 1.00 74.33 C ATOM 1837 OD1 ASP A 114 10.816 10.613 -22.718 1.00 44.42 O ATOM 1838 OD2 ASP A 114 9.440 12.320 -22.566 1.00 2.15 O ATOM 0 H ASP A 114 10.673 8.618 -20.518 1.00 22.55 H new ATOM 0 HA ASP A 114 10.500 11.382 -19.667 1.00 2.22 H new ATOM 0 HB2 ASP A 114 8.844 9.499 -21.364 1.00 24.55 H new ATOM 0 HB3 ASP A 114 8.186 11.041 -20.853 1.00 24.55 H new ATOM 1843 N GLY A 115 8.246 9.202 -18.591 1.00 30.33 N ATOM 1844 CA GLY A 115 7.340 8.934 -17.489 1.00 25.13 C ATOM 1845 C GLY A 115 5.891 9.187 -17.854 1.00 44.44 C ATOM 1846 O GLY A 115 5.226 8.320 -18.420 1.00 32.24 O ATOM 0 H GLY A 115 8.208 8.523 -19.351 1.00 30.33 H new ATOM 0 HA2 GLY A 115 7.456 7.898 -17.172 1.00 25.13 H new ATOM 0 HA3 GLY A 115 7.612 9.560 -16.639 1.00 25.13 H new ATOM 1850 N SER A 116 5.401 10.379 -17.530 1.00 14.32 N ATOM 1851 CA SER A 116 4.019 10.743 -17.823 1.00 21.42 C ATOM 1852 C SER A 116 3.690 10.488 -19.291 1.00 1.33 C ATOM 1853 O SER A 116 2.592 10.043 -19.624 1.00 71.52 O ATOM 1854 CB SER A 116 3.773 12.213 -17.481 1.00 13.25 C ATOM 1855 OG SER A 116 2.833 12.341 -16.427 1.00 42.23 O ATOM 0 H SER A 116 5.940 11.109 -17.065 1.00 14.32 H new ATOM 0 HA SER A 116 3.367 10.121 -17.209 1.00 21.42 H new ATOM 0 HB2 SER A 116 4.713 12.685 -17.194 1.00 13.25 H new ATOM 0 HB3 SER A 116 3.409 12.739 -18.363 1.00 13.25 H new ATOM 0 HG SER A 116 2.694 13.290 -16.226 1.00 42.23 H new ATOM 1861 N TYR A 117 4.649 10.775 -20.164 1.00 4.15 N ATOM 1862 CA TYR A 117 4.462 10.580 -21.596 1.00 43.44 C ATOM 1863 C TYR A 117 3.973 9.167 -21.895 1.00 35.33 C ATOM 1864 O TYR A 117 2.893 8.977 -22.455 1.00 24.12 O ATOM 1865 CB TYR A 117 5.770 10.847 -22.344 1.00 11.53 C ATOM 1866 CG TYR A 117 5.606 10.914 -23.845 1.00 44.13 C ATOM 1867 CD1 TYR A 117 5.025 12.020 -24.452 1.00 44.44 C ATOM 1868 CD2 TYR A 117 6.034 9.871 -24.657 1.00 62.42 C ATOM 1869 CE1 TYR A 117 4.873 12.085 -25.824 1.00 24.01 C ATOM 1870 CE2 TYR A 117 5.888 9.927 -26.030 1.00 14.23 C ATOM 1871 CZ TYR A 117 5.306 11.036 -26.608 1.00 42.12 C ATOM 1872 OH TYR A 117 5.158 11.097 -27.975 1.00 11.31 O ATOM 0 H TYR A 117 5.564 11.144 -19.905 1.00 4.15 H new ATOM 0 HA TYR A 117 3.705 11.287 -21.936 1.00 43.44 H new ATOM 0 HB2 TYR A 117 6.195 11.787 -21.991 1.00 11.53 H new ATOM 0 HB3 TYR A 117 6.485 10.062 -22.100 1.00 11.53 H new ATOM 0 HD1 TYR A 117 4.686 12.844 -23.841 1.00 44.44 H new ATOM 0 HD2 TYR A 117 6.489 9.001 -24.207 1.00 62.42 H new ATOM 0 HE1 TYR A 117 4.418 12.952 -26.280 1.00 24.01 H new ATOM 0 HE2 TYR A 117 6.227 9.108 -26.647 1.00 14.23 H new ATOM 0 HH TYR A 117 5.515 10.279 -28.380 1.00 11.31 H new ATOM 1882 N ALA A 118 4.775 8.177 -21.515 1.00 53.33 N ATOM 1883 CA ALA A 118 4.423 6.780 -21.739 1.00 3.51 C ATOM 1884 C ALA A 118 3.270 6.353 -20.837 1.00 42.42 C ATOM 1885 O ALA A 118 2.483 5.477 -21.194 1.00 52.01 O ATOM 1886 CB ALA A 118 5.634 5.888 -21.509 1.00 1.31 C ATOM 0 H ALA A 118 5.672 8.317 -21.051 1.00 53.33 H new ATOM 0 HA ALA A 118 4.098 6.674 -22.774 1.00 3.51 H new ATOM 0 HB1 ALA A 118 5.357 4.848 -21.680 1.00 1.31 H new ATOM 0 HB2 ALA A 118 6.430 6.170 -22.199 1.00 1.31 H new ATOM 0 HB3 ALA A 118 5.984 6.007 -20.484 1.00 1.31 H new ATOM 1892 N TRP A 119 3.177 6.977 -19.668 1.00 64.04 N ATOM 1893 CA TRP A 119 2.120 6.660 -18.715 1.00 50.11 C ATOM 1894 C TRP A 119 0.752 6.699 -19.387 1.00 12.32 C ATOM 1895 O TRP A 119 -0.162 5.973 -18.996 1.00 3.41 O ATOM 1896 CB TRP A 119 2.154 7.639 -17.541 1.00 15.53 C ATOM 1897 CG TRP A 119 1.128 7.341 -16.489 1.00 51.52 C ATOM 1898 CD1 TRP A 119 -0.217 7.567 -16.569 1.00 22.51 C ATOM 1899 CD2 TRP A 119 1.365 6.766 -15.200 1.00 34.40 C ATOM 1900 NE1 TRP A 119 -0.830 7.165 -15.407 1.00 12.23 N ATOM 1901 CE2 TRP A 119 0.118 6.669 -14.551 1.00 51.43 C ATOM 1902 CE3 TRP A 119 2.508 6.320 -14.531 1.00 72.22 C ATOM 1903 CZ2 TRP A 119 -0.015 6.147 -13.267 1.00 44.35 C ATOM 1904 CZ3 TRP A 119 2.375 5.802 -13.257 1.00 13.21 C ATOM 1905 CH2 TRP A 119 1.121 5.719 -12.636 1.00 63.41 C ATOM 0 H TRP A 119 3.821 7.705 -19.358 1.00 64.04 H new ATOM 0 HA TRP A 119 2.292 5.650 -18.342 1.00 50.11 H new ATOM 0 HB2 TRP A 119 3.145 7.618 -17.088 1.00 15.53 H new ATOM 0 HB3 TRP A 119 1.997 8.650 -17.916 1.00 15.53 H new ATOM 0 HD1 TRP A 119 -0.724 7.998 -17.420 1.00 22.51 H new ATOM 0 HE1 TRP A 119 -1.829 7.226 -15.213 1.00 12.23 H new ATOM 0 HE3 TRP A 119 3.478 6.379 -15.002 1.00 72.22 H new ATOM 0 HZ2 TRP A 119 -0.980 6.082 -12.787 1.00 44.35 H new ATOM 0 HZ3 TRP A 119 3.252 5.455 -12.731 1.00 13.21 H new ATOM 0 HH2 TRP A 119 1.050 5.309 -11.639 1.00 63.41 H new ATOM 1916 N GLU A 120 0.618 7.551 -20.399 1.00 21.22 N ATOM 1917 CA GLU A 120 -0.640 7.684 -21.124 1.00 32.55 C ATOM 1918 C GLU A 120 -1.043 6.357 -21.762 1.00 1.22 C ATOM 1919 O GLU A 120 -2.104 5.810 -21.463 1.00 34.54 O ATOM 1920 CB GLU A 120 -0.523 8.765 -22.199 1.00 52.15 C ATOM 1921 CG GLU A 120 -1.758 9.642 -22.317 1.00 51.45 C ATOM 1922 CD GLU A 120 -1.637 10.675 -23.421 1.00 61.14 C ATOM 1923 OE1 GLU A 120 -0.666 10.597 -24.203 1.00 54.41 O ATOM 1924 OE2 GLU A 120 -2.514 11.561 -23.503 1.00 62.43 O ATOM 0 H GLU A 120 1.365 8.159 -20.735 1.00 21.22 H new ATOM 0 HA GLU A 120 -1.412 7.974 -20.411 1.00 32.55 H new ATOM 0 HB2 GLU A 120 0.339 9.394 -21.977 1.00 52.15 H new ATOM 0 HB3 GLU A 120 -0.332 8.290 -23.161 1.00 52.15 H new ATOM 0 HG2 GLU A 120 -2.628 9.014 -22.506 1.00 51.45 H new ATOM 0 HG3 GLU A 120 -1.931 10.149 -21.368 1.00 51.45 H new ATOM 1931 N ILE A 121 -0.188 5.848 -22.642 1.00 73.44 N ATOM 1932 CA ILE A 121 -0.454 4.586 -23.322 1.00 53.24 C ATOM 1933 C ILE A 121 -0.353 3.410 -22.358 1.00 24.52 C ATOM 1934 O ILE A 121 -1.091 2.431 -22.474 1.00 42.01 O ATOM 1935 CB ILE A 121 0.521 4.361 -24.493 1.00 54.33 C ATOM 1936 CG1 ILE A 121 0.471 5.545 -25.461 1.00 42.32 C ATOM 1937 CG2 ILE A 121 0.189 3.065 -25.217 1.00 24.53 C ATOM 1938 CD1 ILE A 121 1.823 6.175 -25.715 1.00 71.24 C ATOM 0 H ILE A 121 0.694 6.289 -22.901 1.00 73.44 H new ATOM 0 HA ILE A 121 -1.470 4.646 -23.712 1.00 53.24 H new ATOM 0 HB ILE A 121 1.533 4.283 -24.094 1.00 54.33 H new ATOM 0 HG12 ILE A 121 0.051 5.211 -26.410 1.00 42.32 H new ATOM 0 HG13 ILE A 121 -0.204 6.302 -25.062 1.00 42.32 H new ATOM 0 HG21 ILE A 121 0.887 2.920 -26.042 1.00 24.53 H new ATOM 0 HG22 ILE A 121 0.270 2.229 -24.522 1.00 24.53 H new ATOM 0 HG23 ILE A 121 -0.828 3.116 -25.607 1.00 24.53 H new ATOM 0 HD11 ILE A 121 1.712 7.007 -26.410 1.00 71.24 H new ATOM 0 HD12 ILE A 121 2.237 6.540 -24.775 1.00 71.24 H new ATOM 0 HD13 ILE A 121 2.496 5.432 -26.143 1.00 71.24 H new ATOM 1950 N LYS A 122 0.566 3.512 -21.403 1.00 61.24 N ATOM 1951 CA LYS A 122 0.764 2.458 -20.415 1.00 12.31 C ATOM 1952 C LYS A 122 -0.556 2.082 -19.749 1.00 51.13 C ATOM 1953 O LYS A 122 -0.750 0.939 -19.336 1.00 73.45 O ATOM 1954 CB LYS A 122 1.772 2.908 -19.355 1.00 31.31 C ATOM 1955 CG LYS A 122 1.872 1.962 -18.171 1.00 34.14 C ATOM 1956 CD LYS A 122 2.343 0.582 -18.597 1.00 75.34 C ATOM 1957 CE LYS A 122 2.738 -0.268 -17.399 1.00 50.51 C ATOM 1958 NZ LYS A 122 3.330 -1.570 -17.813 1.00 51.33 N ATOM 0 H LYS A 122 1.186 4.315 -21.293 1.00 61.24 H new ATOM 0 HA LYS A 122 1.154 1.580 -20.930 1.00 12.31 H new ATOM 0 HB2 LYS A 122 2.755 3.003 -19.817 1.00 31.31 H new ATOM 0 HB3 LYS A 122 1.491 3.898 -18.996 1.00 31.31 H new ATOM 0 HG2 LYS A 122 2.563 2.372 -17.434 1.00 34.14 H new ATOM 0 HG3 LYS A 122 0.899 1.882 -17.686 1.00 34.14 H new ATOM 0 HD2 LYS A 122 1.550 0.082 -19.153 1.00 75.34 H new ATOM 0 HD3 LYS A 122 3.194 0.679 -19.272 1.00 75.34 H new ATOM 0 HE2 LYS A 122 3.455 0.279 -16.787 1.00 50.51 H new ATOM 0 HE3 LYS A 122 1.861 -0.449 -16.777 1.00 50.51 H new ATOM 0 HZ1 LYS A 122 3.586 -2.119 -16.968 1.00 51.33 H new ATOM 0 HZ2 LYS A 122 2.637 -2.103 -18.376 1.00 51.33 H new ATOM 0 HZ3 LYS A 122 4.181 -1.398 -18.385 1.00 51.33 H new ATOM 1972 N ASP A 123 -1.460 3.050 -19.650 1.00 12.33 N ATOM 1973 CA ASP A 123 -2.763 2.820 -19.037 1.00 31.25 C ATOM 1974 C ASP A 123 -3.447 1.604 -19.654 1.00 50.35 C ATOM 1975 O ASP A 123 -3.850 0.680 -18.948 1.00 64.43 O ATOM 1976 CB ASP A 123 -3.651 4.055 -19.195 1.00 3.24 C ATOM 1977 CG ASP A 123 -4.796 4.076 -18.201 1.00 40.25 C ATOM 1978 OD1 ASP A 123 -5.818 3.406 -18.459 1.00 62.24 O ATOM 1979 OD2 ASP A 123 -4.670 4.762 -17.166 1.00 12.31 O ATOM 0 H ASP A 123 -1.315 4.002 -19.986 1.00 12.33 H new ATOM 0 HA ASP A 123 -2.608 2.628 -17.975 1.00 31.25 H new ATOM 0 HB2 ASP A 123 -3.046 4.953 -19.067 1.00 3.24 H new ATOM 0 HB3 ASP A 123 -4.053 4.083 -20.208 1.00 3.24 H new ATOM 1984 N PHE A 124 -3.576 1.613 -20.977 1.00 51.11 N ATOM 1985 CA PHE A 124 -4.213 0.512 -21.690 1.00 54.44 C ATOM 1986 C PHE A 124 -3.339 -0.738 -21.655 1.00 0.44 C ATOM 1987 O PHE A 124 -3.842 -1.862 -21.681 1.00 4.11 O ATOM 1988 CB PHE A 124 -4.494 0.911 -23.141 1.00 2.02 C ATOM 1989 CG PHE A 124 -5.736 0.283 -23.706 1.00 0.25 C ATOM 1990 CD1 PHE A 124 -5.685 -0.962 -24.311 1.00 30.35 C ATOM 1991 CD2 PHE A 124 -6.955 0.938 -23.631 1.00 4.31 C ATOM 1992 CE1 PHE A 124 -6.826 -1.542 -24.832 1.00 14.33 C ATOM 1993 CE2 PHE A 124 -8.100 0.364 -24.150 1.00 24.40 C ATOM 1994 CZ PHE A 124 -8.035 -0.879 -24.750 1.00 53.42 C ATOM 0 H PHE A 124 -3.248 2.370 -21.577 1.00 51.11 H new ATOM 0 HA PHE A 124 -5.156 0.288 -21.192 1.00 54.44 H new ATOM 0 HB2 PHE A 124 -4.586 1.996 -23.200 1.00 2.02 H new ATOM 0 HB3 PHE A 124 -3.641 0.629 -23.758 1.00 2.02 H new ATOM 0 HD1 PHE A 124 -4.743 -1.486 -24.376 1.00 30.35 H new ATOM 0 HD2 PHE A 124 -7.011 1.909 -23.161 1.00 4.31 H new ATOM 0 HE1 PHE A 124 -6.772 -2.513 -25.303 1.00 14.33 H new ATOM 0 HE2 PHE A 124 -9.043 0.886 -24.087 1.00 24.40 H new ATOM 0 HZ PHE A 124 -8.928 -1.332 -25.154 1.00 53.42 H new ATOM 2004 N LEU A 125 -2.028 -0.533 -21.595 1.00 63.31 N ATOM 2005 CA LEU A 125 -1.082 -1.643 -21.556 1.00 45.03 C ATOM 2006 C LEU A 125 -1.259 -2.466 -20.284 1.00 75.05 C ATOM 2007 O LEU A 125 -1.553 -3.660 -20.341 1.00 64.43 O ATOM 2008 CB LEU A 125 0.353 -1.119 -21.642 1.00 1.13 C ATOM 2009 CG LEU A 125 1.211 -1.692 -22.770 1.00 21.30 C ATOM 2010 CD1 LEU A 125 0.873 -1.020 -24.092 1.00 23.32 C ATOM 2011 CD2 LEU A 125 2.690 -1.531 -22.450 1.00 40.11 C ATOM 0 H LEU A 125 -1.596 0.391 -21.572 1.00 63.31 H new ATOM 0 HA LEU A 125 -1.280 -2.286 -22.413 1.00 45.03 H new ATOM 0 HB2 LEU A 125 0.317 -0.035 -21.755 1.00 1.13 H new ATOM 0 HB3 LEU A 125 0.851 -1.324 -20.694 1.00 1.13 H new ATOM 0 HG LEU A 125 0.994 -2.756 -22.861 1.00 21.30 H new ATOM 0 HD11 LEU A 125 1.494 -1.441 -24.883 1.00 23.32 H new ATOM 0 HD12 LEU A 125 -0.178 -1.188 -24.327 1.00 23.32 H new ATOM 0 HD13 LEU A 125 1.061 0.051 -24.014 1.00 23.32 H new ATOM 0 HD21 LEU A 125 3.285 -1.944 -23.264 1.00 40.11 H new ATOM 0 HD22 LEU A 125 2.923 -0.473 -22.331 1.00 40.11 H new ATOM 0 HD23 LEU A 125 2.922 -2.060 -21.526 1.00 40.11 H new ATOM 2023 N VAL A 126 -1.082 -1.819 -19.137 1.00 52.31 N ATOM 2024 CA VAL A 126 -1.226 -2.490 -17.851 1.00 15.44 C ATOM 2025 C VAL A 126 -2.589 -3.163 -17.732 1.00 11.13 C ATOM 2026 O VAL A 126 -2.734 -4.178 -17.051 1.00 62.42 O ATOM 2027 CB VAL A 126 -1.049 -1.504 -16.681 1.00 14.35 C ATOM 2028 CG1 VAL A 126 -2.136 -0.440 -16.709 1.00 51.24 C ATOM 2029 CG2 VAL A 126 -1.054 -2.247 -15.353 1.00 52.31 C ATOM 0 H VAL A 126 -0.839 -0.831 -19.072 1.00 52.31 H new ATOM 0 HA VAL A 126 -0.444 -3.248 -17.800 1.00 15.44 H new ATOM 0 HB VAL A 126 -0.085 -1.007 -16.791 1.00 14.35 H new ATOM 0 HG11 VAL A 126 -1.994 0.247 -15.875 1.00 51.24 H new ATOM 0 HG12 VAL A 126 -2.081 0.112 -17.647 1.00 51.24 H new ATOM 0 HG13 VAL A 126 -3.113 -0.916 -16.625 1.00 51.24 H new ATOM 0 HG21 VAL A 126 -0.928 -1.535 -14.537 1.00 52.31 H new ATOM 0 HG22 VAL A 126 -2.002 -2.772 -15.233 1.00 52.31 H new ATOM 0 HG23 VAL A 126 -0.236 -2.967 -15.336 1.00 52.31 H new ATOM 2039 N SER A 127 -3.586 -2.591 -18.399 1.00 11.42 N ATOM 2040 CA SER A 127 -4.939 -3.133 -18.366 1.00 31.55 C ATOM 2041 C SER A 127 -4.937 -4.619 -18.715 1.00 12.34 C ATOM 2042 O SER A 127 -5.781 -5.379 -18.241 1.00 11.21 O ATOM 2043 CB SER A 127 -5.841 -2.371 -19.337 1.00 54.34 C ATOM 2044 OG SER A 127 -7.094 -2.075 -18.745 1.00 33.20 O ATOM 0 H SER A 127 -3.482 -1.752 -18.969 1.00 11.42 H new ATOM 0 HA SER A 127 -5.326 -3.015 -17.354 1.00 31.55 H new ATOM 0 HB2 SER A 127 -5.352 -1.446 -19.642 1.00 54.34 H new ATOM 0 HB3 SER A 127 -5.993 -2.964 -20.239 1.00 54.34 H new ATOM 0 HG SER A 127 -7.651 -1.586 -19.386 1.00 33.20 H new ATOM 2050 N GLN A 128 -3.983 -5.023 -19.546 1.00 63.43 N ATOM 2051 CA GLN A 128 -3.871 -6.417 -19.960 1.00 20.12 C ATOM 2052 C GLN A 128 -3.663 -7.328 -18.754 1.00 54.31 C ATOM 2053 O GLN A 128 -4.278 -8.390 -18.653 1.00 10.42 O ATOM 2054 CB GLN A 128 -2.715 -6.587 -20.947 1.00 70.12 C ATOM 2055 CG GLN A 128 -2.946 -7.687 -21.970 1.00 64.43 C ATOM 2056 CD GLN A 128 -3.534 -7.165 -23.266 1.00 65.25 C ATOM 2057 OE1 GLN A 128 -3.251 -6.041 -23.681 1.00 44.04 O ATOM 2058 NE2 GLN A 128 -4.357 -7.981 -23.914 1.00 51.03 N ATOM 0 H GLN A 128 -3.276 -4.406 -19.946 1.00 63.43 H new ATOM 0 HA GLN A 128 -4.803 -6.700 -20.450 1.00 20.12 H new ATOM 0 HB2 GLN A 128 -2.553 -5.644 -21.470 1.00 70.12 H new ATOM 0 HB3 GLN A 128 -1.803 -6.805 -20.391 1.00 70.12 H new ATOM 0 HG2 GLN A 128 -2.000 -8.187 -22.180 1.00 64.43 H new ATOM 0 HG3 GLN A 128 -3.616 -8.436 -21.547 1.00 64.43 H new ATOM 0 HE21 GLN A 128 -4.564 -8.905 -23.533 1.00 51.03 H new ATOM 0 HE22 GLN A 128 -4.782 -7.684 -24.792 1.00 51.03 H new ATOM 2067 N ASP A 129 -2.794 -6.905 -17.843 1.00 21.40 N ATOM 2068 CA ASP A 129 -2.506 -7.683 -16.643 1.00 44.41 C ATOM 2069 C ASP A 129 -1.873 -9.023 -17.003 1.00 72.41 C ATOM 2070 O ASP A 129 -1.863 -9.953 -16.196 1.00 2.44 O ATOM 2071 CB ASP A 129 -3.785 -7.908 -15.836 1.00 71.42 C ATOM 2072 CG ASP A 129 -3.503 -8.393 -14.428 1.00 13.45 C ATOM 2073 OD1 ASP A 129 -2.334 -8.315 -13.996 1.00 1.43 O ATOM 2074 OD2 ASP A 129 -4.452 -8.849 -13.756 1.00 53.25 O ATOM 0 H ASP A 129 -2.277 -6.029 -17.912 1.00 21.40 H new ATOM 0 HA ASP A 129 -1.798 -7.119 -16.036 1.00 44.41 H new ATOM 0 HB2 ASP A 129 -4.351 -6.977 -15.790 1.00 71.42 H new ATOM 0 HB3 ASP A 129 -4.412 -8.637 -16.350 1.00 71.42 H new ATOM 2079 N ARG A 130 -1.348 -9.116 -18.220 1.00 61.34 N ATOM 2080 CA ARG A 130 -0.716 -10.344 -18.688 1.00 42.00 C ATOM 2081 C ARG A 130 0.142 -10.078 -19.921 1.00 44.13 C ATOM 2082 O ARG A 130 -0.209 -10.477 -21.032 1.00 62.42 O ATOM 2083 CB ARG A 130 -1.776 -11.398 -19.009 1.00 74.54 C ATOM 2084 CG ARG A 130 -2.091 -12.321 -17.843 1.00 70.12 C ATOM 2085 CD ARG A 130 -1.993 -13.784 -18.248 1.00 12.32 C ATOM 2086 NE ARG A 130 -2.949 -14.126 -19.297 1.00 71.44 N ATOM 2087 CZ ARG A 130 -4.244 -14.323 -19.076 1.00 51.03 C ATOM 2088 NH1 ARG A 130 -4.735 -14.211 -17.850 1.00 11.11 N ATOM 2089 NH2 ARG A 130 -5.051 -14.632 -20.083 1.00 41.14 N ATOM 0 H ARG A 130 -1.348 -8.356 -18.900 1.00 61.34 H new ATOM 0 HA ARG A 130 -0.072 -10.717 -17.892 1.00 42.00 H new ATOM 0 HB2 ARG A 130 -2.692 -10.896 -19.322 1.00 74.54 H new ATOM 0 HB3 ARG A 130 -1.436 -11.997 -19.854 1.00 74.54 H new ATOM 0 HG2 ARG A 130 -1.400 -12.122 -17.023 1.00 70.12 H new ATOM 0 HG3 ARG A 130 -3.094 -12.111 -17.472 1.00 70.12 H new ATOM 0 HD2 ARG A 130 -0.982 -13.997 -18.595 1.00 12.32 H new ATOM 0 HD3 ARG A 130 -2.170 -14.414 -17.376 1.00 12.32 H new ATOM 0 HE ARG A 130 -2.604 -14.219 -20.252 1.00 71.44 H new ATOM 0 HH11 ARG A 130 -4.118 -13.973 -17.073 1.00 11.11 H new ATOM 0 HH12 ARG A 130 -5.730 -14.363 -17.683 1.00 11.11 H new ATOM 0 HH21 ARG A 130 -4.677 -14.719 -21.028 1.00 41.14 H new ATOM 0 HH22 ARG A 130 -6.045 -14.783 -19.912 1.00 41.14 H new ATOM 2103 N CYS A 131 1.267 -9.401 -19.718 1.00 62.20 N ATOM 2104 CA CYS A 131 2.175 -9.080 -20.814 1.00 22.44 C ATOM 2105 C CYS A 131 3.616 -8.997 -20.319 1.00 73.43 C ATOM 2106 O CYS A 131 3.873 -8.559 -19.199 1.00 25.44 O ATOM 2107 CB CYS A 131 1.771 -7.759 -21.468 1.00 52.32 C ATOM 2108 SG CYS A 131 1.783 -7.796 -23.276 1.00 21.21 S ATOM 0 H CYS A 131 1.572 -9.064 -18.805 1.00 62.20 H new ATOM 0 HA CYS A 131 2.109 -9.878 -21.554 1.00 22.44 H new ATOM 0 HB2 CYS A 131 0.772 -7.488 -21.127 1.00 52.32 H new ATOM 0 HB3 CYS A 131 2.447 -6.975 -21.127 1.00 52.32 H new ATOM 0 HG CYS A 131 1.425 -6.634 -23.736 1.00 21.21 H new ATOM 2114 N ALA A 132 4.551 -9.422 -21.163 1.00 34.53 N ATOM 2115 CA ALA A 132 5.965 -9.396 -20.812 1.00 1.12 C ATOM 2116 C ALA A 132 6.814 -8.925 -21.988 1.00 72.21 C ATOM 2117 O ALA A 132 6.937 -9.623 -22.994 1.00 22.00 O ATOM 2118 CB ALA A 132 6.420 -10.772 -20.348 1.00 13.23 C ATOM 0 H ALA A 132 4.354 -9.788 -22.094 1.00 34.53 H new ATOM 0 HA ALA A 132 6.098 -8.687 -19.995 1.00 1.12 H new ATOM 0 HB1 ALA A 132 7.478 -10.737 -20.089 1.00 13.23 H new ATOM 0 HB2 ALA A 132 5.842 -11.070 -19.473 1.00 13.23 H new ATOM 0 HB3 ALA A 132 6.266 -11.495 -21.149 1.00 13.23 H new ATOM 2124 N GLU A 133 7.396 -7.737 -21.854 1.00 73.53 N ATOM 2125 CA GLU A 133 8.231 -7.174 -22.908 1.00 44.00 C ATOM 2126 C GLU A 133 9.338 -6.305 -22.318 1.00 42.42 C ATOM 2127 O GLU A 133 9.143 -5.634 -21.304 1.00 72.51 O ATOM 2128 CB GLU A 133 7.382 -6.349 -23.877 1.00 72.32 C ATOM 2129 CG GLU A 133 6.749 -7.174 -24.985 1.00 73.21 C ATOM 2130 CD GLU A 133 5.686 -6.408 -25.749 1.00 4.31 C ATOM 2131 OE1 GLU A 133 5.946 -5.244 -26.121 1.00 34.31 O ATOM 2132 OE2 GLU A 133 4.595 -6.972 -25.975 1.00 25.33 O ATOM 0 H GLU A 133 7.305 -7.147 -21.027 1.00 73.53 H new ATOM 0 HA GLU A 133 8.691 -7.999 -23.452 1.00 44.00 H new ATOM 0 HB2 GLU A 133 6.595 -5.843 -23.317 1.00 72.32 H new ATOM 0 HB3 GLU A 133 8.005 -5.574 -24.323 1.00 72.32 H new ATOM 0 HG2 GLU A 133 7.524 -7.501 -25.678 1.00 73.21 H new ATOM 0 HG3 GLU A 133 6.306 -8.073 -24.556 1.00 73.21 H new ATOM 2139 N VAL A 134 10.502 -6.321 -22.961 1.00 33.32 N ATOM 2140 CA VAL A 134 11.640 -5.535 -22.501 1.00 42.24 C ATOM 2141 C VAL A 134 12.352 -4.864 -23.671 1.00 2.25 C ATOM 2142 O VAL A 134 12.439 -5.424 -24.764 1.00 55.41 O ATOM 2143 CB VAL A 134 12.650 -6.406 -21.731 1.00 61.23 C ATOM 2144 CG1 VAL A 134 13.122 -7.566 -22.595 1.00 5.03 C ATOM 2145 CG2 VAL A 134 13.828 -5.566 -21.261 1.00 62.42 C ATOM 0 H VAL A 134 10.681 -6.870 -23.802 1.00 33.32 H new ATOM 0 HA VAL A 134 11.247 -4.770 -21.831 1.00 42.24 H new ATOM 0 HB VAL A 134 12.154 -6.817 -20.852 1.00 61.23 H new ATOM 0 HG11 VAL A 134 13.835 -8.171 -22.035 1.00 5.03 H new ATOM 0 HG12 VAL A 134 12.267 -8.181 -22.877 1.00 5.03 H new ATOM 0 HG13 VAL A 134 13.602 -7.179 -23.494 1.00 5.03 H new ATOM 0 HG21 VAL A 134 14.532 -6.197 -20.719 1.00 62.42 H new ATOM 0 HG22 VAL A 134 14.327 -5.124 -22.124 1.00 62.42 H new ATOM 0 HG23 VAL A 134 13.470 -4.774 -20.603 1.00 62.42 H new ATOM 2155 N THR A 135 12.863 -3.659 -23.433 1.00 73.41 N ATOM 2156 CA THR A 135 13.567 -2.911 -24.466 1.00 43.31 C ATOM 2157 C THR A 135 14.835 -2.269 -23.913 1.00 34.54 C ATOM 2158 O THR A 135 14.779 -1.454 -22.991 1.00 72.10 O ATOM 2159 CB THR A 135 12.673 -1.813 -25.073 1.00 21.01 C ATOM 2160 OG1 THR A 135 11.507 -2.401 -25.661 1.00 42.52 O ATOM 2161 CG2 THR A 135 13.432 -1.017 -26.124 1.00 55.02 C ATOM 0 H THR A 135 12.802 -3.181 -22.534 1.00 73.41 H new ATOM 0 HA THR A 135 13.834 -3.624 -25.246 1.00 43.31 H new ATOM 0 HB THR A 135 12.374 -1.135 -24.274 1.00 21.01 H new ATOM 0 HG1 THR A 135 10.943 -1.697 -26.043 1.00 42.52 H new ATOM 0 HG21 THR A 135 12.781 -0.248 -26.538 1.00 55.02 H new ATOM 0 HG22 THR A 135 14.303 -0.547 -25.666 1.00 55.02 H new ATOM 0 HG23 THR A 135 13.758 -1.685 -26.921 1.00 55.02 H new ATOM 2169 N LEU A 136 15.977 -2.642 -24.480 1.00 54.31 N ATOM 2170 CA LEU A 136 17.260 -2.102 -24.044 1.00 14.44 C ATOM 2171 C LEU A 136 18.254 -2.059 -25.199 1.00 50.24 C ATOM 2172 O LEU A 136 18.584 -3.090 -25.785 1.00 11.43 O ATOM 2173 CB LEU A 136 17.827 -2.943 -22.899 1.00 34.20 C ATOM 2174 CG LEU A 136 18.014 -4.433 -23.190 1.00 44.50 C ATOM 2175 CD1 LEU A 136 19.473 -4.737 -23.494 1.00 70.21 C ATOM 2176 CD2 LEU A 136 17.526 -5.271 -22.018 1.00 14.22 C ATOM 0 H LEU A 136 16.041 -3.316 -25.243 1.00 54.31 H new ATOM 0 HA LEU A 136 17.096 -1.083 -23.692 1.00 14.44 H new ATOM 0 HB2 LEU A 136 18.792 -2.525 -22.611 1.00 34.20 H new ATOM 0 HB3 LEU A 136 17.166 -2.841 -22.038 1.00 34.20 H new ATOM 0 HG LEU A 136 17.419 -4.690 -24.067 1.00 44.50 H new ATOM 0 HD11 LEU A 136 19.588 -5.801 -23.699 1.00 70.21 H new ATOM 0 HD12 LEU A 136 19.790 -4.164 -24.365 1.00 70.21 H new ATOM 0 HD13 LEU A 136 20.088 -4.464 -22.636 1.00 70.21 H new ATOM 0 HD21 LEU A 136 17.667 -6.328 -22.243 1.00 14.22 H new ATOM 0 HD22 LEU A 136 18.093 -5.012 -21.124 1.00 14.22 H new ATOM 0 HD23 LEU A 136 16.468 -5.075 -21.846 1.00 14.22 H new