USER MOD reduce.3.24.130724 H: found=0, std=0, add=510, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 513 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 88 MET CE :methyl -173:sc= -1.06 (180deg=-1.44!) USER MOD Single : A 91 MET CE :methyl 153:sc= -1.09 (180deg=-1.36) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.536 K(o=-0.54,f=-2) USER MOD Single : A 117 THR OG1 : rot -170:sc= -0.976 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -0.0282 X(o=-0.028,f=-0.16) USER MOD Single : A 133 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0407) USER MOD Single : A 136 HIS : no HD1:sc= -3.69 K(o=-3.7,f=-4.5!) USER MOD Single : A 137 HIS : no HD1:sc= -5.72! C(o=-5.7!,f=-6.9!) USER MOD Single : A 139 GLN : amide:sc= -0.0533 K(o=-0.053,f=-0.72) USER MOD Single : A 141 GLN : amide:sc= -0.578 K(o=-0.58,f=-0.0092) USER MOD Single : A 142 GLN : amide:sc= -0.926 K(o=-0.93,f=-0.33) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 149 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.015) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 88 1.844 6.243 17.898 1.00 0.00 N ATOM 2 CA MET A 88 1.411 6.244 16.475 1.00 0.00 C ATOM 3 C MET A 88 1.043 7.650 16.012 1.00 0.00 C ATOM 4 O MET A 88 1.197 8.619 16.755 1.00 0.00 O ATOM 5 CB MET A 88 0.209 5.308 16.331 1.00 0.00 C ATOM 6 CG MET A 88 0.542 3.847 16.583 1.00 0.00 C ATOM 7 SD MET A 88 -0.914 2.785 16.530 1.00 0.00 S ATOM 8 CE MET A 88 -1.969 3.595 17.728 1.00 0.00 C ATOM 0 HA MET A 88 2.234 5.898 15.850 1.00 0.00 H new ATOM 0 HB2 MET A 88 -0.569 5.620 17.027 1.00 0.00 H new ATOM 0 HB3 MET A 88 -0.202 5.410 15.327 1.00 0.00 H new ATOM 0 HG2 MET A 88 1.261 3.508 15.838 1.00 0.00 H new ATOM 0 HG3 MET A 88 1.022 3.750 17.557 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.857 2.987 17.900 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.427 3.719 18.665 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.266 4.573 17.349 1.00 0.00 H new ATOM 20 N PHE A 89 0.556 7.753 14.780 1.00 0.00 N ATOM 21 CA PHE A 89 0.166 9.041 14.218 1.00 0.00 C ATOM 22 C PHE A 89 -0.991 8.878 13.237 1.00 0.00 C ATOM 23 O PHE A 89 -0.816 8.356 12.137 1.00 0.00 O ATOM 24 CB PHE A 89 1.356 9.697 13.516 1.00 0.00 C ATOM 25 CG PHE A 89 2.232 10.494 14.440 1.00 0.00 C ATOM 26 CD1 PHE A 89 1.711 11.546 15.174 1.00 0.00 C ATOM 27 CD2 PHE A 89 3.578 10.191 14.572 1.00 0.00 C ATOM 28 CE1 PHE A 89 2.514 12.283 16.024 1.00 0.00 C ATOM 29 CE2 PHE A 89 4.387 10.923 15.421 1.00 0.00 C ATOM 30 CZ PHE A 89 3.854 11.970 16.148 1.00 0.00 C ATOM 0 H PHE A 89 0.422 6.961 14.152 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.162 9.682 15.036 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.956 8.924 13.036 1.00 0.00 H new ATOM 0 HB3 PHE A 89 0.986 10.350 12.725 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.664 11.794 15.081 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.000 9.374 14.005 1.00 0.00 H new ATOM 0 HE1 PHE A 89 2.095 13.102 16.590 1.00 0.00 H new ATOM 0 HE2 PHE A 89 5.434 10.677 15.516 1.00 0.00 H new ATOM 0 HZ PHE A 89 4.484 12.543 16.812 1.00 0.00 H new ATOM 40 N ALA A 90 -2.173 9.328 13.645 1.00 0.00 N ATOM 41 CA ALA A 90 -3.359 9.234 12.804 1.00 0.00 C ATOM 42 C ALA A 90 -3.493 10.456 11.902 1.00 0.00 C ATOM 43 O ALA A 90 -3.876 11.534 12.353 1.00 0.00 O ATOM 44 CB ALA A 90 -4.604 9.072 13.663 1.00 0.00 C ATOM 0 H ALA A 90 -2.334 9.762 14.554 1.00 0.00 H new ATOM 0 HA ALA A 90 -3.252 8.356 12.167 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.482 9.003 13.021 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.519 8.164 14.260 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -4.704 9.933 14.324 1.00 0.00 H new ATOM 50 N MET A 91 -3.173 10.279 10.624 1.00 0.00 N ATOM 51 CA MET A 91 -3.257 11.367 9.657 1.00 0.00 C ATOM 52 C MET A 91 -4.687 11.533 9.150 1.00 0.00 C ATOM 53 O MET A 91 -5.624 10.963 9.709 1.00 0.00 O ATOM 54 CB MET A 91 -2.309 11.105 8.483 1.00 0.00 C ATOM 55 CG MET A 91 -2.709 9.913 7.628 1.00 0.00 C ATOM 56 SD MET A 91 -1.356 9.311 6.599 1.00 0.00 S ATOM 57 CE MET A 91 -1.820 9.978 5.003 1.00 0.00 C ATOM 0 H MET A 91 -2.853 9.392 10.234 1.00 0.00 H new ATOM 0 HA MET A 91 -2.960 12.290 10.154 1.00 0.00 H new ATOM 0 HB2 MET A 91 -2.269 11.995 7.854 1.00 0.00 H new ATOM 0 HB3 MET A 91 -1.303 10.942 8.869 1.00 0.00 H new ATOM 0 HG2 MET A 91 -3.055 9.107 8.275 1.00 0.00 H new ATOM 0 HG3 MET A 91 -3.548 10.193 6.991 1.00 0.00 H new ATOM 0 HE1 MET A 91 -0.926 10.124 4.396 1.00 0.00 H new ATOM 0 HE2 MET A 91 -2.491 9.282 4.499 1.00 0.00 H new ATOM 0 HE3 MET A 91 -2.325 10.934 5.141 1.00 0.00 H new ATOM 67 N TYR A 92 -4.847 12.313 8.086 1.00 0.00 N ATOM 68 CA TYR A 92 -6.161 12.551 7.502 1.00 0.00 C ATOM 69 C TYR A 92 -6.216 12.018 6.074 1.00 0.00 C ATOM 70 O TYR A 92 -5.232 12.094 5.343 1.00 0.00 O ATOM 71 CB TYR A 92 -6.484 14.047 7.513 1.00 0.00 C ATOM 72 CG TYR A 92 -5.385 14.907 6.931 1.00 0.00 C ATOM 73 CD1 TYR A 92 -4.275 15.258 7.690 1.00 0.00 C ATOM 74 CD2 TYR A 92 -5.458 15.370 5.623 1.00 0.00 C ATOM 75 CE1 TYR A 92 -3.269 16.045 7.162 1.00 0.00 C ATOM 76 CE2 TYR A 92 -4.455 16.157 5.088 1.00 0.00 C ATOM 77 CZ TYR A 92 -3.364 16.491 5.861 1.00 0.00 C ATOM 78 OH TYR A 92 -2.364 17.274 5.332 1.00 0.00 O ATOM 0 H TYR A 92 -4.082 12.791 7.611 1.00 0.00 H new ATOM 0 HA TYR A 92 -6.903 12.024 8.101 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -7.403 14.216 6.951 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -6.675 14.361 8.539 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -4.197 14.910 8.709 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -6.312 15.111 5.015 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -2.413 16.309 7.765 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -4.526 16.508 4.069 1.00 0.00 H new ATOM 0 HH TYR A 92 -2.584 17.503 4.405 1.00 0.00 H new ATOM 88 N PRO A 93 -7.367 11.463 5.657 1.00 0.00 N ATOM 89 CA PRO A 93 -7.538 10.911 4.313 1.00 0.00 C ATOM 90 C PRO A 93 -7.927 11.967 3.279 1.00 0.00 C ATOM 91 O PRO A 93 -8.646 11.674 2.325 1.00 0.00 O ATOM 92 CB PRO A 93 -8.676 9.915 4.511 1.00 0.00 C ATOM 93 CG PRO A 93 -9.521 10.524 5.578 1.00 0.00 C ATOM 94 CD PRO A 93 -8.594 11.320 6.465 1.00 0.00 C ATOM 0 HA PRO A 93 -6.616 10.478 3.925 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -9.242 9.770 3.591 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -8.300 8.937 4.812 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -10.288 11.166 5.145 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -10.037 9.753 6.150 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -9.020 12.290 6.720 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -8.396 10.802 7.404 1.00 0.00 H new ATOM 102 N ASP A 94 -7.451 13.193 3.473 1.00 0.00 N ATOM 103 CA ASP A 94 -7.754 14.284 2.552 1.00 0.00 C ATOM 104 C ASP A 94 -6.502 14.750 1.811 1.00 0.00 C ATOM 105 O ASP A 94 -6.465 15.859 1.278 1.00 0.00 O ATOM 106 CB ASP A 94 -8.379 15.457 3.311 1.00 0.00 C ATOM 107 CG ASP A 94 -9.881 15.536 3.117 1.00 0.00 C ATOM 108 OD1 ASP A 94 -10.557 14.502 3.296 1.00 0.00 O ATOM 109 OD2 ASP A 94 -10.380 16.631 2.783 1.00 0.00 O ATOM 0 H ASP A 94 -6.855 13.456 4.258 1.00 0.00 H new ATOM 0 HA ASP A 94 -8.465 13.912 1.814 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -8.157 15.358 4.374 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -7.922 16.388 2.975 1.00 0.00 H new ATOM 114 N TRP A 95 -5.479 13.901 1.779 1.00 0.00 N ATOM 115 CA TRP A 95 -4.233 14.235 1.104 1.00 0.00 C ATOM 116 C TRP A 95 -4.376 14.096 -0.408 1.00 0.00 C ATOM 117 O TRP A 95 -5.046 13.186 -0.897 1.00 0.00 O ATOM 118 CB TRP A 95 -3.101 13.337 1.606 1.00 0.00 C ATOM 119 CG TRP A 95 -3.478 11.891 1.703 1.00 0.00 C ATOM 120 CD1 TRP A 95 -3.812 11.205 2.835 1.00 0.00 C ATOM 121 CD2 TRP A 95 -3.558 10.950 0.626 1.00 0.00 C ATOM 122 NE1 TRP A 95 -4.096 9.896 2.528 1.00 0.00 N ATOM 123 CE2 TRP A 95 -3.947 9.715 1.178 1.00 0.00 C ATOM 124 CE3 TRP A 95 -3.338 11.032 -0.753 1.00 0.00 C ATOM 125 CZ2 TRP A 95 -4.121 8.573 0.400 1.00 0.00 C ATOM 126 CZ3 TRP A 95 -3.512 9.898 -1.524 1.00 0.00 C ATOM 127 CH2 TRP A 95 -3.900 8.683 -0.945 1.00 0.00 C ATOM 0 H TRP A 95 -5.490 12.978 2.213 1.00 0.00 H new ATOM 0 HA TRP A 95 -3.993 15.273 1.332 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.246 13.436 0.937 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -2.780 13.686 2.587 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -3.848 11.629 3.827 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -4.373 9.177 3.196 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -3.038 11.965 -1.207 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -4.420 7.634 0.843 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -3.346 9.950 -2.590 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -4.027 7.815 -1.574 1.00 0.00 H new ATOM 138 N GLN A 96 -3.741 15.003 -1.142 1.00 0.00 N ATOM 139 CA GLN A 96 -3.795 14.982 -2.600 1.00 0.00 C ATOM 140 C GLN A 96 -2.440 14.597 -3.186 1.00 0.00 C ATOM 141 O GLN A 96 -1.409 14.726 -2.527 1.00 0.00 O ATOM 142 CB GLN A 96 -4.226 16.349 -3.133 1.00 0.00 C ATOM 143 CG GLN A 96 -5.730 16.559 -3.122 1.00 0.00 C ATOM 144 CD GLN A 96 -6.360 16.340 -4.483 1.00 0.00 C ATOM 145 OE1 GLN A 96 -5.775 16.677 -5.514 1.00 0.00 O ATOM 146 NE2 GLN A 96 -7.560 15.772 -4.495 1.00 0.00 N ATOM 0 H GLN A 96 -3.183 15.762 -0.752 1.00 0.00 H new ATOM 0 HA GLN A 96 -4.528 14.235 -2.904 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -3.754 17.128 -2.534 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -3.859 16.464 -4.153 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -6.183 15.877 -2.402 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -5.949 17.572 -2.783 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -8.008 15.509 -3.618 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -8.033 15.599 -5.382 1.00 0.00 H new ATOM 155 N PRO A 97 -2.423 14.116 -4.442 1.00 0.00 N ATOM 156 CA PRO A 97 -1.185 13.713 -5.115 1.00 0.00 C ATOM 157 C PRO A 97 -0.264 14.897 -5.389 1.00 0.00 C ATOM 158 O PRO A 97 -0.721 15.986 -5.735 1.00 0.00 O ATOM 159 CB PRO A 97 -1.674 13.098 -6.430 1.00 0.00 C ATOM 160 CG PRO A 97 -3.013 13.708 -6.663 1.00 0.00 C ATOM 161 CD PRO A 97 -3.607 13.931 -5.301 1.00 0.00 C ATOM 0 HA PRO A 97 -0.595 13.028 -4.505 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -0.990 13.321 -7.249 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -1.741 12.012 -6.358 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -2.925 14.647 -7.209 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -3.643 13.050 -7.261 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -4.257 14.806 -5.284 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -4.208 13.080 -4.980 1.00 0.00 H new ATOM 169 N ASP A 98 1.037 14.675 -5.232 1.00 0.00 N ATOM 170 CA ASP A 98 2.024 15.723 -5.461 1.00 0.00 C ATOM 171 C ASP A 98 3.419 15.130 -5.630 1.00 0.00 C ATOM 172 O ASP A 98 3.585 13.910 -5.662 1.00 0.00 O ATOM 173 CB ASP A 98 2.019 16.721 -4.301 1.00 0.00 C ATOM 174 CG ASP A 98 2.235 18.148 -4.765 1.00 0.00 C ATOM 175 OD1 ASP A 98 3.392 18.504 -5.073 1.00 0.00 O ATOM 176 OD2 ASP A 98 1.247 18.910 -4.821 1.00 0.00 O ATOM 0 H ASP A 98 1.432 13.779 -4.947 1.00 0.00 H new ATOM 0 HA ASP A 98 1.756 16.244 -6.380 1.00 0.00 H new ATOM 0 HB2 ASP A 98 1.068 16.654 -3.772 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.800 16.451 -3.590 1.00 0.00 H new ATOM 181 N ALA A 99 4.417 16.000 -5.738 1.00 0.00 N ATOM 182 CA ALA A 99 5.798 15.563 -5.904 1.00 0.00 C ATOM 183 C ALA A 99 6.262 14.742 -4.705 1.00 0.00 C ATOM 184 O ALA A 99 7.078 13.830 -4.843 1.00 0.00 O ATOM 185 CB ALA A 99 6.710 16.762 -6.109 1.00 0.00 C ATOM 0 H ALA A 99 4.295 17.012 -5.714 1.00 0.00 H new ATOM 0 HA ALA A 99 5.848 14.927 -6.788 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.738 16.421 -6.231 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.400 17.307 -7.001 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.647 17.420 -5.242 1.00 0.00 H new ATOM 191 N ASP A 100 5.737 15.071 -3.529 1.00 0.00 N ATOM 192 CA ASP A 100 6.099 14.364 -2.305 1.00 0.00 C ATOM 193 C ASP A 100 5.769 12.879 -2.416 1.00 0.00 C ATOM 194 O ASP A 100 6.505 12.030 -1.911 1.00 0.00 O ATOM 195 CB ASP A 100 5.368 14.972 -1.106 1.00 0.00 C ATOM 196 CG ASP A 100 6.173 16.065 -0.432 1.00 0.00 C ATOM 197 OD1 ASP A 100 7.275 15.766 0.071 1.00 0.00 O ATOM 198 OD2 ASP A 100 5.699 17.221 -0.407 1.00 0.00 O ATOM 0 H ASP A 100 5.060 15.822 -3.397 1.00 0.00 H new ATOM 0 HA ASP A 100 7.174 14.469 -2.159 1.00 0.00 H new ATOM 0 HB2 ASP A 100 4.412 15.379 -1.435 1.00 0.00 H new ATOM 0 HB3 ASP A 100 5.148 14.187 -0.382 1.00 0.00 H new ATOM 203 N PHE A 101 4.661 12.572 -3.081 1.00 0.00 N ATOM 204 CA PHE A 101 4.235 11.188 -3.259 1.00 0.00 C ATOM 205 C PHE A 101 5.269 10.400 -4.055 1.00 0.00 C ATOM 206 O PHE A 101 5.657 9.297 -3.669 1.00 0.00 O ATOM 207 CB PHE A 101 2.878 11.136 -3.967 1.00 0.00 C ATOM 208 CG PHE A 101 1.895 10.208 -3.312 1.00 0.00 C ATOM 209 CD1 PHE A 101 2.031 8.835 -3.437 1.00 0.00 C ATOM 210 CD2 PHE A 101 0.836 10.709 -2.573 1.00 0.00 C ATOM 211 CE1 PHE A 101 1.129 7.978 -2.837 1.00 0.00 C ATOM 212 CE2 PHE A 101 -0.071 9.858 -1.971 1.00 0.00 C ATOM 213 CZ PHE A 101 0.076 8.490 -2.102 1.00 0.00 C ATOM 0 H PHE A 101 4.041 13.262 -3.506 1.00 0.00 H new ATOM 0 HA PHE A 101 4.139 10.733 -2.273 1.00 0.00 H new ATOM 0 HB2 PHE A 101 2.454 12.140 -3.996 1.00 0.00 H new ATOM 0 HB3 PHE A 101 3.028 10.823 -5.000 1.00 0.00 H new ATOM 0 HD1 PHE A 101 2.852 8.430 -4.010 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.718 11.777 -2.466 1.00 0.00 H new ATOM 0 HE1 PHE A 101 1.246 6.910 -2.942 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -0.894 10.261 -1.399 1.00 0.00 H new ATOM 0 HZ PHE A 101 -0.630 7.822 -1.631 1.00 0.00 H new ATOM 223 N ILE A 102 5.714 10.974 -5.169 1.00 0.00 N ATOM 224 CA ILE A 102 6.705 10.326 -6.019 1.00 0.00 C ATOM 225 C ILE A 102 8.092 10.387 -5.388 1.00 0.00 C ATOM 226 O ILE A 102 8.917 9.496 -5.593 1.00 0.00 O ATOM 227 CB ILE A 102 6.760 10.976 -7.414 1.00 0.00 C ATOM 228 CG1 ILE A 102 5.350 11.115 -7.993 1.00 0.00 C ATOM 229 CG2 ILE A 102 7.643 10.158 -8.345 1.00 0.00 C ATOM 230 CD1 ILE A 102 5.317 11.773 -9.355 1.00 0.00 C ATOM 0 H ILE A 102 5.404 11.886 -5.503 1.00 0.00 H new ATOM 0 HA ILE A 102 6.400 9.285 -6.124 1.00 0.00 H new ATOM 0 HB ILE A 102 7.192 11.972 -7.317 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.897 10.126 -8.065 1.00 0.00 H new ATOM 0 HG13 ILE A 102 4.738 11.696 -7.303 1.00 0.00 H new ATOM 0 HG21 ILE A 102 7.672 10.630 -9.327 1.00 0.00 H new ATOM 0 HG22 ILE A 102 8.653 10.107 -7.937 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.238 9.150 -8.439 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.286 11.838 -9.703 1.00 0.00 H new ATOM 0 HD12 ILE A 102 5.740 12.775 -9.285 1.00 0.00 H new ATOM 0 HD13 ILE A 102 5.901 11.181 -10.059 1.00 0.00 H new ATOM 242 N ARG A 103 8.341 11.441 -4.618 1.00 0.00 N ATOM 243 CA ARG A 103 9.627 11.619 -3.957 1.00 0.00 C ATOM 244 C ARG A 103 9.836 10.554 -2.884 1.00 0.00 C ATOM 245 O ARG A 103 10.856 9.865 -2.869 1.00 0.00 O ATOM 246 CB ARG A 103 9.709 13.014 -3.337 1.00 0.00 C ATOM 247 CG ARG A 103 10.690 13.936 -4.045 1.00 0.00 C ATOM 248 CD ARG A 103 11.688 14.545 -3.073 1.00 0.00 C ATOM 249 NE ARG A 103 12.999 14.745 -3.686 1.00 0.00 N ATOM 250 CZ ARG A 103 13.925 15.572 -3.205 1.00 0.00 C ATOM 251 NH1 ARG A 103 13.689 16.276 -2.105 1.00 0.00 N ATOM 252 NH2 ARG A 103 15.091 15.693 -3.825 1.00 0.00 N ATOM 0 H ARG A 103 7.668 12.185 -4.437 1.00 0.00 H new ATOM 0 HA ARG A 103 10.415 11.514 -4.703 1.00 0.00 H new ATOM 0 HB2 ARG A 103 8.719 13.469 -3.353 1.00 0.00 H new ATOM 0 HB3 ARG A 103 10.000 12.921 -2.291 1.00 0.00 H new ATOM 0 HG2 ARG A 103 11.224 13.378 -4.814 1.00 0.00 H new ATOM 0 HG3 ARG A 103 10.142 14.731 -4.551 1.00 0.00 H new ATOM 0 HD2 ARG A 103 11.307 15.501 -2.714 1.00 0.00 H new ATOM 0 HD3 ARG A 103 11.790 13.895 -2.204 1.00 0.00 H new ATOM 0 HE ARG A 103 13.218 14.220 -4.533 1.00 0.00 H new ATOM 0 HH11 ARG A 103 12.794 16.185 -1.623 1.00 0.00 H new ATOM 0 HH12 ARG A 103 14.402 16.908 -1.741 1.00 0.00 H new ATOM 0 HH21 ARG A 103 15.278 15.153 -4.670 1.00 0.00 H new ATOM 0 HH22 ARG A 103 15.801 16.326 -3.457 1.00 0.00 H new ATOM 266 N LEU A 104 8.862 10.425 -1.989 1.00 0.00 N ATOM 267 CA LEU A 104 8.938 9.443 -0.913 1.00 0.00 C ATOM 268 C LEU A 104 8.900 8.024 -1.470 1.00 0.00 C ATOM 269 O LEU A 104 9.587 7.133 -0.972 1.00 0.00 O ATOM 270 CB LEU A 104 7.788 9.650 0.077 1.00 0.00 C ATOM 271 CG LEU A 104 8.152 10.442 1.334 1.00 0.00 C ATOM 272 CD1 LEU A 104 8.781 11.776 0.961 1.00 0.00 C ATOM 273 CD2 LEU A 104 6.920 10.657 2.201 1.00 0.00 C ATOM 0 H LEU A 104 8.011 10.988 -1.987 1.00 0.00 H new ATOM 0 HA LEU A 104 9.885 9.583 -0.391 1.00 0.00 H new ATOM 0 HB2 LEU A 104 6.975 10.164 -0.436 1.00 0.00 H new ATOM 0 HB3 LEU A 104 7.408 8.674 0.378 1.00 0.00 H new ATOM 0 HG LEU A 104 8.881 9.867 1.905 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.033 12.326 1.868 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.686 11.602 0.379 1.00 0.00 H new ATOM 0 HD13 LEU A 104 8.075 12.358 0.369 1.00 0.00 H new ATOM 0 HD21 LEU A 104 7.196 11.222 3.091 1.00 0.00 H new ATOM 0 HD22 LEU A 104 6.170 11.212 1.637 1.00 0.00 H new ATOM 0 HD23 LEU A 104 6.510 9.691 2.497 1.00 0.00 H new ATOM 285 N ALA A 105 8.092 7.820 -2.505 1.00 0.00 N ATOM 286 CA ALA A 105 7.965 6.509 -3.129 1.00 0.00 C ATOM 287 C ALA A 105 9.289 6.059 -3.737 1.00 0.00 C ATOM 288 O ALA A 105 9.692 4.906 -3.587 1.00 0.00 O ATOM 289 CB ALA A 105 6.875 6.533 -4.190 1.00 0.00 C ATOM 0 H ALA A 105 7.515 8.546 -2.929 1.00 0.00 H new ATOM 0 HA ALA A 105 7.689 5.792 -2.356 1.00 0.00 H new ATOM 0 HB1 ALA A 105 6.791 5.547 -4.648 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.924 6.801 -3.729 1.00 0.00 H new ATOM 0 HB3 ALA A 105 7.127 7.268 -4.954 1.00 0.00 H new ATOM 295 N ALA A 106 9.962 6.977 -4.425 1.00 0.00 N ATOM 296 CA ALA A 106 11.239 6.673 -5.057 1.00 0.00 C ATOM 297 C ALA A 106 12.362 6.599 -4.028 1.00 0.00 C ATOM 298 O ALA A 106 13.328 5.856 -4.200 1.00 0.00 O ATOM 299 CB ALA A 106 11.561 7.715 -6.118 1.00 0.00 C ATOM 0 H ALA A 106 9.643 7.937 -4.558 1.00 0.00 H new ATOM 0 HA ALA A 106 11.156 5.696 -5.533 1.00 0.00 H new ATOM 0 HB1 ALA A 106 12.518 7.477 -6.583 1.00 0.00 H new ATOM 0 HB2 ALA A 106 10.779 7.715 -6.877 1.00 0.00 H new ATOM 0 HB3 ALA A 106 11.618 8.700 -5.655 1.00 0.00 H new ATOM 305 N LEU A 107 12.229 7.376 -2.958 1.00 0.00 N ATOM 306 CA LEU A 107 13.232 7.400 -1.900 1.00 0.00 C ATOM 307 C LEU A 107 13.038 6.225 -0.945 1.00 0.00 C ATOM 308 O LEU A 107 14.001 5.709 -0.376 1.00 0.00 O ATOM 309 CB LEU A 107 13.158 8.726 -1.138 1.00 0.00 C ATOM 310 CG LEU A 107 13.868 8.743 0.217 1.00 0.00 C ATOM 311 CD1 LEU A 107 15.356 8.485 0.045 1.00 0.00 C ATOM 312 CD2 LEU A 107 13.633 10.068 0.925 1.00 0.00 C ATOM 0 H LEU A 107 11.436 7.998 -2.801 1.00 0.00 H new ATOM 0 HA LEU A 107 14.219 7.309 -2.354 1.00 0.00 H new ATOM 0 HB2 LEU A 107 13.586 9.510 -1.763 1.00 0.00 H new ATOM 0 HB3 LEU A 107 12.109 8.979 -0.983 1.00 0.00 H new ATOM 0 HG LEU A 107 13.452 7.946 0.833 1.00 0.00 H new ATOM 0 HD11 LEU A 107 15.843 8.501 1.020 1.00 0.00 H new ATOM 0 HD12 LEU A 107 15.505 7.510 -0.419 1.00 0.00 H new ATOM 0 HD13 LEU A 107 15.788 9.259 -0.589 1.00 0.00 H new ATOM 0 HD21 LEU A 107 14.145 10.062 1.887 1.00 0.00 H new ATOM 0 HD22 LEU A 107 14.021 10.882 0.312 1.00 0.00 H new ATOM 0 HD23 LEU A 107 12.564 10.211 1.084 1.00 0.00 H new ATOM 324 N TRP A 108 11.788 5.807 -0.771 1.00 0.00 N ATOM 325 CA TRP A 108 11.470 4.695 0.117 1.00 0.00 C ATOM 326 C TRP A 108 11.883 3.358 -0.499 1.00 0.00 C ATOM 327 O TRP A 108 11.925 2.338 0.189 1.00 0.00 O ATOM 328 CB TRP A 108 9.973 4.681 0.433 1.00 0.00 C ATOM 329 CG TRP A 108 9.552 5.756 1.390 1.00 0.00 C ATOM 330 CD1 TRP A 108 10.368 6.544 2.151 1.00 0.00 C ATOM 331 CD2 TRP A 108 8.211 6.161 1.689 1.00 0.00 C ATOM 332 NE1 TRP A 108 9.616 7.413 2.904 1.00 0.00 N ATOM 333 CE2 TRP A 108 8.290 7.198 2.637 1.00 0.00 C ATOM 334 CE3 TRP A 108 6.951 5.747 1.244 1.00 0.00 C ATOM 335 CZ2 TRP A 108 7.156 7.825 3.149 1.00 0.00 C ATOM 336 CZ3 TRP A 108 5.828 6.371 1.754 1.00 0.00 C ATOM 337 CH2 TRP A 108 5.937 7.400 2.697 1.00 0.00 C ATOM 0 H TRP A 108 10.979 6.222 -1.233 1.00 0.00 H new ATOM 0 HA TRP A 108 12.032 4.834 1.041 1.00 0.00 H new ATOM 0 HB2 TRP A 108 9.413 4.793 -0.495 1.00 0.00 H new ATOM 0 HB3 TRP A 108 9.707 3.710 0.851 1.00 0.00 H new ATOM 0 HD1 TRP A 108 11.447 6.492 2.160 1.00 0.00 H new ATOM 0 HE1 TRP A 108 9.985 8.105 3.556 1.00 0.00 H new ATOM 0 HE3 TRP A 108 6.857 4.955 0.516 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 7.237 8.619 3.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 4.850 6.059 1.419 1.00 0.00 H new ATOM 0 HH2 TRP A 108 5.040 7.868 3.075 1.00 0.00 H new ATOM 348 N GLY A 109 12.188 3.367 -1.795 1.00 0.00 N ATOM 349 CA GLY A 109 12.593 2.146 -2.467 1.00 0.00 C ATOM 350 C GLY A 109 11.509 1.595 -3.373 1.00 0.00 C ATOM 351 O GLY A 109 11.443 0.388 -3.609 1.00 0.00 O ATOM 0 H GLY A 109 12.162 4.196 -2.389 1.00 0.00 H new ATOM 0 HA2 GLY A 109 13.490 2.339 -3.055 1.00 0.00 H new ATOM 0 HA3 GLY A 109 12.856 1.395 -1.722 1.00 0.00 H new ATOM 355 N VAL A 110 10.657 2.479 -3.881 1.00 0.00 N ATOM 356 CA VAL A 110 9.572 2.072 -4.768 1.00 0.00 C ATOM 357 C VAL A 110 9.693 2.747 -6.129 1.00 0.00 C ATOM 358 O VAL A 110 9.511 3.959 -6.251 1.00 0.00 O ATOM 359 CB VAL A 110 8.196 2.408 -4.162 1.00 0.00 C ATOM 360 CG1 VAL A 110 7.082 1.795 -4.997 1.00 0.00 C ATOM 361 CG2 VAL A 110 8.115 1.930 -2.720 1.00 0.00 C ATOM 0 H VAL A 110 10.696 3.481 -3.694 1.00 0.00 H new ATOM 0 HA VAL A 110 9.653 0.992 -4.892 1.00 0.00 H new ATOM 0 HB VAL A 110 8.071 3.491 -4.168 1.00 0.00 H new ATOM 0 HG11 VAL A 110 6.117 2.042 -4.554 1.00 0.00 H new ATOM 0 HG12 VAL A 110 7.128 2.191 -6.012 1.00 0.00 H new ATOM 0 HG13 VAL A 110 7.202 0.712 -5.024 1.00 0.00 H new ATOM 0 HG21 VAL A 110 7.136 2.176 -2.309 1.00 0.00 H new ATOM 0 HG22 VAL A 110 8.262 0.850 -2.686 1.00 0.00 H new ATOM 0 HG23 VAL A 110 8.890 2.420 -2.130 1.00 0.00 H new ATOM 371 N ALA A 111 10.001 1.955 -7.151 1.00 0.00 N ATOM 372 CA ALA A 111 10.148 2.475 -8.505 1.00 0.00 C ATOM 373 C ALA A 111 9.116 1.861 -9.444 1.00 0.00 C ATOM 374 O ALA A 111 9.300 0.752 -9.945 1.00 0.00 O ATOM 375 CB ALA A 111 11.555 2.213 -9.021 1.00 0.00 C ATOM 0 H ALA A 111 10.154 0.950 -7.067 1.00 0.00 H new ATOM 0 HA ALA A 111 9.978 3.551 -8.475 1.00 0.00 H new ATOM 0 HB1 ALA A 111 11.651 2.606 -10.033 1.00 0.00 H new ATOM 0 HB2 ALA A 111 12.278 2.705 -8.371 1.00 0.00 H new ATOM 0 HB3 ALA A 111 11.745 1.140 -9.030 1.00 0.00 H new ATOM 381 N LEU A 112 8.029 2.590 -9.680 1.00 0.00 N ATOM 382 CA LEU A 112 6.967 2.117 -10.560 1.00 0.00 C ATOM 383 C LEU A 112 7.174 2.630 -11.983 1.00 0.00 C ATOM 384 O LEU A 112 7.215 3.837 -12.217 1.00 0.00 O ATOM 385 CB LEU A 112 5.602 2.566 -10.034 1.00 0.00 C ATOM 386 CG LEU A 112 4.860 1.527 -9.191 1.00 0.00 C ATOM 387 CD1 LEU A 112 3.785 2.193 -8.346 1.00 0.00 C ATOM 388 CD2 LEU A 112 4.252 0.455 -10.082 1.00 0.00 C ATOM 0 H LEU A 112 7.861 3.510 -9.274 1.00 0.00 H new ATOM 0 HA LEU A 112 6.999 1.028 -10.577 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.738 3.467 -9.436 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.974 2.839 -10.882 1.00 0.00 H new ATOM 0 HG LEU A 112 5.577 1.052 -8.521 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.268 1.438 -7.753 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.246 2.924 -7.681 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.070 2.695 -8.997 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.728 -0.276 -9.466 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.549 0.915 -10.777 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.043 -0.043 -10.643 1.00 0.00 H new ATOM 400 N ARG A 113 7.303 1.704 -12.927 1.00 0.00 N ATOM 401 CA ARG A 113 7.505 2.063 -14.326 1.00 0.00 C ATOM 402 C ARG A 113 6.203 2.544 -14.958 1.00 0.00 C ATOM 403 O ARG A 113 6.195 3.486 -15.749 1.00 0.00 O ATOM 404 CB ARG A 113 8.057 0.867 -15.106 1.00 0.00 C ATOM 405 CG ARG A 113 9.494 1.056 -15.571 1.00 0.00 C ATOM 406 CD ARG A 113 9.670 0.666 -17.032 1.00 0.00 C ATOM 407 NE ARG A 113 10.624 -0.429 -17.193 1.00 0.00 N ATOM 408 CZ ARG A 113 11.945 -0.277 -17.127 1.00 0.00 C ATOM 409 NH1 ARG A 113 12.472 0.921 -16.903 1.00 0.00 N ATOM 410 NH2 ARG A 113 12.741 -1.325 -17.286 1.00 0.00 N ATOM 0 H ARG A 113 7.271 0.700 -12.749 1.00 0.00 H new ATOM 0 HA ARG A 113 8.228 2.878 -14.366 1.00 0.00 H new ATOM 0 HB2 ARG A 113 8.000 -0.023 -14.479 1.00 0.00 H new ATOM 0 HB3 ARG A 113 7.423 0.686 -15.974 1.00 0.00 H new ATOM 0 HG2 ARG A 113 9.786 2.097 -15.435 1.00 0.00 H new ATOM 0 HG3 ARG A 113 10.159 0.454 -14.951 1.00 0.00 H new ATOM 0 HD2 ARG A 113 8.706 0.372 -17.448 1.00 0.00 H new ATOM 0 HD3 ARG A 113 10.011 1.531 -17.600 1.00 0.00 H new ATOM 0 HE ARG A 113 10.256 -1.365 -17.366 1.00 0.00 H new ATOM 0 HH11 ARG A 113 11.864 1.731 -16.780 1.00 0.00 H new ATOM 0 HH12 ARG A 113 13.485 1.031 -16.853 1.00 0.00 H new ATOM 0 HH21 ARG A 113 12.341 -2.247 -17.459 1.00 0.00 H new ATOM 0 HH22 ARG A 113 13.753 -1.209 -17.236 1.00 0.00 H new ATOM 424 N GLU A 114 5.100 1.891 -14.602 1.00 0.00 N ATOM 425 CA GLU A 114 3.793 2.253 -15.136 1.00 0.00 C ATOM 426 C GLU A 114 3.039 3.157 -14.161 1.00 0.00 C ATOM 427 O GLU A 114 3.088 2.951 -12.949 1.00 0.00 O ATOM 428 CB GLU A 114 2.970 0.995 -15.422 1.00 0.00 C ATOM 429 CG GLU A 114 2.079 1.117 -16.648 1.00 0.00 C ATOM 430 CD GLU A 114 0.614 1.275 -16.292 1.00 0.00 C ATOM 431 OE1 GLU A 114 0.323 1.823 -15.207 1.00 0.00 O ATOM 432 OE2 GLU A 114 -0.242 0.852 -17.096 1.00 0.00 O ATOM 0 H GLU A 114 5.087 1.109 -13.947 1.00 0.00 H new ATOM 0 HA GLU A 114 3.946 2.799 -16.067 1.00 0.00 H new ATOM 0 HB2 GLU A 114 3.647 0.151 -15.557 1.00 0.00 H new ATOM 0 HB3 GLU A 114 2.350 0.771 -14.554 1.00 0.00 H new ATOM 0 HG2 GLU A 114 2.399 1.974 -17.241 1.00 0.00 H new ATOM 0 HG3 GLU A 114 2.204 0.232 -17.272 1.00 0.00 H new ATOM 439 N PRO A 115 2.326 4.174 -14.679 1.00 0.00 N ATOM 440 CA PRO A 115 1.560 5.106 -13.842 1.00 0.00 C ATOM 441 C PRO A 115 0.594 4.385 -12.909 1.00 0.00 C ATOM 442 O PRO A 115 0.016 3.360 -13.270 1.00 0.00 O ATOM 443 CB PRO A 115 0.789 5.952 -14.858 1.00 0.00 C ATOM 444 CG PRO A 115 1.588 5.865 -16.112 1.00 0.00 C ATOM 445 CD PRO A 115 2.207 4.496 -16.114 1.00 0.00 C ATOM 0 HA PRO A 115 2.208 5.690 -13.188 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -0.221 5.570 -15.005 1.00 0.00 H new ATOM 0 HB3 PRO A 115 0.693 6.984 -14.521 1.00 0.00 H new ATOM 0 HG2 PRO A 115 0.956 6.009 -16.988 1.00 0.00 H new ATOM 0 HG3 PRO A 115 2.354 6.640 -16.141 1.00 0.00 H new ATOM 0 HD2 PRO A 115 1.582 3.773 -16.638 1.00 0.00 H new ATOM 0 HD3 PRO A 115 3.178 4.495 -16.608 1.00 0.00 H new ATOM 453 N VAL A 116 0.424 4.927 -11.708 1.00 0.00 N ATOM 454 CA VAL A 116 -0.474 4.334 -10.724 1.00 0.00 C ATOM 455 C VAL A 116 -1.933 4.556 -11.109 1.00 0.00 C ATOM 456 O VAL A 116 -2.322 5.655 -11.504 1.00 0.00 O ATOM 457 CB VAL A 116 -0.225 4.915 -9.317 1.00 0.00 C ATOM 458 CG1 VAL A 116 -0.509 6.410 -9.293 1.00 0.00 C ATOM 459 CG2 VAL A 116 -1.067 4.187 -8.279 1.00 0.00 C ATOM 0 H VAL A 116 0.896 5.775 -11.393 1.00 0.00 H new ATOM 0 HA VAL A 116 -0.267 3.264 -10.707 1.00 0.00 H new ATOM 0 HB VAL A 116 0.826 4.767 -9.067 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -0.327 6.799 -8.291 1.00 0.00 H new ATOM 0 HG12 VAL A 116 0.145 6.916 -10.003 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -1.549 6.587 -9.568 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -0.877 4.612 -7.293 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -2.123 4.298 -8.524 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -0.805 3.129 -8.275 1.00 0.00 H new ATOM 469 N THR A 117 -2.737 3.504 -10.992 1.00 0.00 N ATOM 470 CA THR A 117 -4.153 3.582 -11.328 1.00 0.00 C ATOM 471 C THR A 117 -4.948 4.216 -10.190 1.00 0.00 C ATOM 472 O THR A 117 -4.577 4.104 -9.022 1.00 0.00 O ATOM 473 CB THR A 117 -4.705 2.190 -11.638 1.00 0.00 C ATOM 474 OG1 THR A 117 -4.421 1.289 -10.581 1.00 0.00 O ATOM 475 CG2 THR A 117 -4.147 1.595 -12.914 1.00 0.00 C ATOM 0 H THR A 117 -2.431 2.587 -10.667 1.00 0.00 H new ATOM 0 HA THR A 117 -4.256 4.210 -12.213 1.00 0.00 H new ATOM 0 HB THR A 117 -5.779 2.327 -11.760 1.00 0.00 H new ATOM 0 HG1 THR A 117 -4.639 0.376 -10.862 1.00 0.00 H new ATOM 0 HG21 THR A 117 -4.580 0.608 -13.075 1.00 0.00 H new ATOM 0 HG22 THR A 117 -4.395 2.241 -13.756 1.00 0.00 H new ATOM 0 HG23 THR A 117 -3.064 1.507 -12.831 1.00 0.00 H new ATOM 483 N THR A 118 -6.044 4.883 -10.541 1.00 0.00 N ATOM 484 CA THR A 118 -6.892 5.536 -9.549 1.00 0.00 C ATOM 485 C THR A 118 -7.510 4.512 -8.602 1.00 0.00 C ATOM 486 O THR A 118 -7.778 4.812 -7.438 1.00 0.00 O ATOM 487 CB THR A 118 -7.993 6.340 -10.240 1.00 0.00 C ATOM 488 OG1 THR A 118 -8.894 6.877 -9.287 1.00 0.00 O ATOM 489 CG2 THR A 118 -8.800 5.525 -11.226 1.00 0.00 C ATOM 0 H THR A 118 -6.365 4.985 -11.504 1.00 0.00 H new ATOM 0 HA THR A 118 -6.270 6.214 -8.965 1.00 0.00 H new ATOM 0 HB THR A 118 -7.476 7.130 -10.784 1.00 0.00 H new ATOM 0 HG1 THR A 118 -9.591 7.389 -9.748 1.00 0.00 H new ATOM 0 HG21 THR A 118 -9.564 6.156 -11.680 1.00 0.00 H new ATOM 0 HG22 THR A 118 -8.141 5.137 -12.003 1.00 0.00 H new ATOM 0 HG23 THR A 118 -9.278 4.694 -10.707 1.00 0.00 H new ATOM 497 N GLU A 119 -7.738 3.304 -9.108 1.00 0.00 N ATOM 498 CA GLU A 119 -8.327 2.237 -8.307 1.00 0.00 C ATOM 499 C GLU A 119 -7.485 1.956 -7.067 1.00 0.00 C ATOM 500 O GLU A 119 -8.018 1.693 -5.989 1.00 0.00 O ATOM 501 CB GLU A 119 -8.465 0.962 -9.142 1.00 0.00 C ATOM 502 CG GLU A 119 -7.156 0.488 -9.751 1.00 0.00 C ATOM 503 CD GLU A 119 -7.364 -0.491 -10.890 1.00 0.00 C ATOM 504 OE1 GLU A 119 -7.897 -0.074 -11.940 1.00 0.00 O ATOM 505 OE2 GLU A 119 -6.992 -1.673 -10.733 1.00 0.00 O ATOM 0 H GLU A 119 -7.524 3.040 -10.070 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.316 2.563 -7.985 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.872 0.169 -8.514 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.185 1.137 -9.941 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -6.596 1.349 -10.115 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -6.549 0.017 -8.978 1.00 0.00 H new ATOM 512 N GLU A 120 -6.166 2.013 -7.226 1.00 0.00 N ATOM 513 CA GLU A 120 -5.251 1.764 -6.118 1.00 0.00 C ATOM 514 C GLU A 120 -5.348 2.874 -5.075 1.00 0.00 C ATOM 515 O GLU A 120 -5.371 2.610 -3.874 1.00 0.00 O ATOM 516 CB GLU A 120 -3.814 1.652 -6.634 1.00 0.00 C ATOM 517 CG GLU A 120 -3.204 0.274 -6.439 1.00 0.00 C ATOM 518 CD GLU A 120 -1.817 0.160 -7.044 1.00 0.00 C ATOM 519 OE1 GLU A 120 -1.114 1.189 -7.113 1.00 0.00 O ATOM 520 OE2 GLU A 120 -1.437 -0.959 -7.447 1.00 0.00 O ATOM 0 H GLU A 120 -5.708 2.229 -8.111 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.534 0.823 -5.646 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.797 1.901 -7.695 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.195 2.390 -6.124 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -3.151 0.051 -5.373 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -3.856 -0.475 -6.889 1.00 0.00 H new ATOM 527 N LEU A 121 -5.406 4.116 -5.545 1.00 0.00 N ATOM 528 CA LEU A 121 -5.500 5.267 -4.656 1.00 0.00 C ATOM 529 C LEU A 121 -6.838 5.278 -3.920 1.00 0.00 C ATOM 530 O LEU A 121 -6.887 5.452 -2.703 1.00 0.00 O ATOM 531 CB LEU A 121 -5.327 6.564 -5.449 1.00 0.00 C ATOM 532 CG LEU A 121 -3.913 7.144 -5.441 1.00 0.00 C ATOM 533 CD1 LEU A 121 -3.524 7.584 -4.039 1.00 0.00 C ATOM 534 CD2 LEU A 121 -2.917 6.128 -5.979 1.00 0.00 C ATOM 0 H LEU A 121 -5.389 4.351 -6.538 1.00 0.00 H new ATOM 0 HA LEU A 121 -4.702 5.193 -3.917 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -5.623 6.382 -6.482 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -6.012 7.311 -5.048 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.896 8.019 -6.091 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -2.514 7.994 -4.053 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -4.220 8.347 -3.691 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -3.558 6.727 -3.366 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -1.916 6.558 -5.966 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -2.936 5.234 -5.355 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.185 5.863 -7.002 1.00 0.00 H new ATOM 546 N ALA A 122 -7.920 5.089 -4.669 1.00 0.00 N ATOM 547 CA ALA A 122 -9.258 5.078 -4.089 1.00 0.00 C ATOM 548 C ALA A 122 -9.417 3.930 -3.098 1.00 0.00 C ATOM 549 O ALA A 122 -10.021 4.092 -2.037 1.00 0.00 O ATOM 550 CB ALA A 122 -10.307 4.979 -5.186 1.00 0.00 C ATOM 0 H ALA A 122 -7.896 4.942 -5.678 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.401 6.013 -3.548 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -11.301 4.972 -4.739 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.216 5.835 -5.855 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -10.157 4.059 -5.751 1.00 0.00 H new ATOM 556 N SER A 123 -8.872 2.770 -3.450 1.00 0.00 N ATOM 557 CA SER A 123 -8.954 1.595 -2.590 1.00 0.00 C ATOM 558 C SER A 123 -8.185 1.817 -1.291 1.00 0.00 C ATOM 559 O SER A 123 -8.642 1.436 -0.214 1.00 0.00 O ATOM 560 CB SER A 123 -8.407 0.365 -3.317 1.00 0.00 C ATOM 561 OG SER A 123 -9.427 -0.291 -4.048 1.00 0.00 O ATOM 0 H SER A 123 -8.369 2.619 -4.324 1.00 0.00 H new ATOM 0 HA SER A 123 -10.003 1.427 -2.346 1.00 0.00 H new ATOM 0 HB2 SER A 123 -7.606 0.665 -3.993 1.00 0.00 H new ATOM 0 HB3 SER A 123 -7.972 -0.325 -2.594 1.00 0.00 H new ATOM 0 HG SER A 123 -9.051 -1.072 -4.505 1.00 0.00 H new ATOM 567 N PHE A 124 -7.014 2.436 -1.403 1.00 0.00 N ATOM 568 CA PHE A 124 -6.179 2.710 -0.240 1.00 0.00 C ATOM 569 C PHE A 124 -6.902 3.624 0.745 1.00 0.00 C ATOM 570 O PHE A 124 -7.008 3.314 1.932 1.00 0.00 O ATOM 571 CB PHE A 124 -4.859 3.352 -0.673 1.00 0.00 C ATOM 572 CG PHE A 124 -3.687 2.938 0.170 1.00 0.00 C ATOM 573 CD1 PHE A 124 -3.397 3.603 1.350 1.00 0.00 C ATOM 574 CD2 PHE A 124 -2.874 1.886 -0.220 1.00 0.00 C ATOM 575 CE1 PHE A 124 -2.318 3.226 2.128 1.00 0.00 C ATOM 576 CE2 PHE A 124 -1.794 1.504 0.552 1.00 0.00 C ATOM 577 CZ PHE A 124 -1.515 2.174 1.728 1.00 0.00 C ATOM 0 H PHE A 124 -6.622 2.757 -2.288 1.00 0.00 H new ATOM 0 HA PHE A 124 -5.969 1.763 0.256 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -4.660 3.089 -1.712 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -4.961 4.436 -0.632 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -4.021 4.426 1.666 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -3.087 1.359 -1.138 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -2.103 3.752 3.046 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -1.168 0.682 0.237 1.00 0.00 H new ATOM 0 HZ PHE A 124 -0.672 1.876 2.333 1.00 0.00 H new ATOM 587 N ILE A 125 -7.397 4.751 0.244 1.00 0.00 N ATOM 588 CA ILE A 125 -8.109 5.710 1.080 1.00 0.00 C ATOM 589 C ILE A 125 -9.433 5.132 1.570 1.00 0.00 C ATOM 590 O ILE A 125 -9.892 5.451 2.667 1.00 0.00 O ATOM 591 CB ILE A 125 -8.383 7.024 0.322 1.00 0.00 C ATOM 592 CG1 ILE A 125 -7.087 7.571 -0.280 1.00 0.00 C ATOM 593 CG2 ILE A 125 -9.017 8.052 1.247 1.00 0.00 C ATOM 594 CD1 ILE A 125 -7.308 8.448 -1.493 1.00 0.00 C ATOM 0 H ILE A 125 -7.318 5.022 -0.736 1.00 0.00 H new ATOM 0 HA ILE A 125 -7.468 5.922 1.936 1.00 0.00 H new ATOM 0 HB ILE A 125 -9.081 6.816 -0.489 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -6.556 8.143 0.480 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -6.444 6.736 -0.558 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -9.203 8.973 0.694 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -9.960 7.663 1.632 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -8.343 8.258 2.079 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -6.347 8.800 -1.867 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -7.812 7.873 -2.270 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -7.925 9.303 -1.216 1.00 0.00 H new ATOM 606 N ALA A 126 -10.042 4.281 0.753 1.00 0.00 N ATOM 607 CA ALA A 126 -11.312 3.659 1.105 1.00 0.00 C ATOM 608 C ALA A 126 -11.182 2.830 2.378 1.00 0.00 C ATOM 609 O ALA A 126 -12.008 2.933 3.285 1.00 0.00 O ATOM 610 CB ALA A 126 -11.813 2.794 -0.042 1.00 0.00 C ATOM 0 H ALA A 126 -9.676 4.006 -0.159 1.00 0.00 H new ATOM 0 HA ALA A 126 -12.037 4.451 1.291 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -12.762 2.336 0.235 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -11.954 3.412 -0.929 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -11.082 2.014 -0.255 1.00 0.00 H new ATOM 616 N TYR A 127 -10.140 2.008 2.438 1.00 0.00 N ATOM 617 CA TYR A 127 -9.901 1.159 3.599 1.00 0.00 C ATOM 618 C TYR A 127 -9.336 1.972 4.759 1.00 0.00 C ATOM 619 O TYR A 127 -9.575 1.658 5.926 1.00 0.00 O ATOM 620 CB TYR A 127 -8.938 0.027 3.238 1.00 0.00 C ATOM 621 CG TYR A 127 -9.058 -1.182 4.139 1.00 0.00 C ATOM 622 CD1 TYR A 127 -10.298 -1.736 4.429 1.00 0.00 C ATOM 623 CD2 TYR A 127 -7.930 -1.769 4.698 1.00 0.00 C ATOM 624 CE1 TYR A 127 -10.412 -2.841 5.252 1.00 0.00 C ATOM 625 CE2 TYR A 127 -8.035 -2.874 5.521 1.00 0.00 C ATOM 626 CZ TYR A 127 -9.278 -3.406 5.795 1.00 0.00 C ATOM 627 OH TYR A 127 -9.386 -4.506 6.615 1.00 0.00 O ATOM 0 H TYR A 127 -9.447 1.912 1.696 1.00 0.00 H new ATOM 0 HA TYR A 127 -10.854 0.731 3.909 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -9.120 -0.279 2.208 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -7.916 0.403 3.283 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -11.188 -1.296 4.004 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -6.955 -1.355 4.486 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -11.384 -3.259 5.468 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -7.148 -3.319 5.948 1.00 0.00 H new ATOM 0 HH TYR A 127 -8.494 -4.781 6.913 1.00 0.00 H new ATOM 637 N TRP A 128 -8.583 3.018 4.431 1.00 0.00 N ATOM 638 CA TRP A 128 -7.981 3.876 5.446 1.00 0.00 C ATOM 639 C TRP A 128 -9.046 4.714 6.149 1.00 0.00 C ATOM 640 O TRP A 128 -9.002 4.896 7.366 1.00 0.00 O ATOM 641 CB TRP A 128 -6.926 4.785 4.807 1.00 0.00 C ATOM 642 CG TRP A 128 -6.398 5.843 5.730 1.00 0.00 C ATOM 643 CD1 TRP A 128 -6.165 7.154 5.424 1.00 0.00 C ATOM 644 CD2 TRP A 128 -6.033 5.681 7.106 1.00 0.00 C ATOM 645 NE1 TRP A 128 -5.680 7.817 6.525 1.00 0.00 N ATOM 646 CE2 TRP A 128 -5.591 6.935 7.571 1.00 0.00 C ATOM 647 CE3 TRP A 128 -6.040 4.600 7.993 1.00 0.00 C ATOM 648 CZ2 TRP A 128 -5.159 7.136 8.879 1.00 0.00 C ATOM 649 CZ3 TRP A 128 -5.611 4.801 9.292 1.00 0.00 C ATOM 650 CH2 TRP A 128 -5.176 6.061 9.724 1.00 0.00 C ATOM 0 H TRP A 128 -8.375 3.292 3.471 1.00 0.00 H new ATOM 0 HA TRP A 128 -7.499 3.243 6.191 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -6.095 4.172 4.459 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -7.358 5.265 3.929 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -6.337 7.604 4.457 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -5.427 8.805 6.559 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -6.375 3.625 7.669 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.823 8.106 9.214 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -5.611 3.973 9.985 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -4.847 6.186 10.745 1.00 0.00 H new ATOM 661 N GLN A 129 -10.002 5.219 5.377 1.00 0.00 N ATOM 662 CA GLN A 129 -11.076 6.038 5.927 1.00 0.00 C ATOM 663 C GLN A 129 -12.124 5.169 6.616 1.00 0.00 C ATOM 664 O GLN A 129 -12.757 5.592 7.583 1.00 0.00 O ATOM 665 CB GLN A 129 -11.730 6.869 4.822 1.00 0.00 C ATOM 666 CG GLN A 129 -11.929 8.329 5.196 1.00 0.00 C ATOM 667 CD GLN A 129 -13.318 8.835 4.857 1.00 0.00 C ATOM 668 OE1 GLN A 129 -14.321 8.215 5.210 1.00 0.00 O ATOM 669 NE2 GLN A 129 -13.382 9.969 4.168 1.00 0.00 N ATOM 0 H GLN A 129 -10.055 5.076 4.369 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.644 6.710 6.668 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -11.114 6.813 3.924 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -12.697 6.431 4.573 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -11.752 8.454 6.264 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -11.188 8.937 4.677 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -12.524 10.450 3.896 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -14.289 10.359 3.911 1.00 0.00 H new ATOM 678 N ALA A 130 -12.303 3.954 6.110 1.00 0.00 N ATOM 679 CA ALA A 130 -13.276 3.026 6.676 1.00 0.00 C ATOM 680 C ALA A 130 -12.782 2.450 7.999 1.00 0.00 C ATOM 681 O ALA A 130 -13.562 2.247 8.929 1.00 0.00 O ATOM 682 CB ALA A 130 -13.572 1.907 5.689 1.00 0.00 C ATOM 0 H ALA A 130 -11.788 3.588 5.309 1.00 0.00 H new ATOM 0 HA ALA A 130 -14.196 3.577 6.872 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -14.299 1.221 6.124 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -13.977 2.330 4.770 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -12.652 1.366 5.465 1.00 0.00 H new ATOM 688 N GLU A 131 -11.481 2.187 8.077 1.00 0.00 N ATOM 689 CA GLU A 131 -10.884 1.633 9.287 1.00 0.00 C ATOM 690 C GLU A 131 -10.807 2.686 10.388 1.00 0.00 C ATOM 691 O GLU A 131 -11.168 2.425 11.535 1.00 0.00 O ATOM 692 CB GLU A 131 -9.487 1.088 8.988 1.00 0.00 C ATOM 693 CG GLU A 131 -9.494 -0.317 8.410 1.00 0.00 C ATOM 694 CD GLU A 131 -8.403 -1.194 8.994 1.00 0.00 C ATOM 695 OE1 GLU A 131 -7.216 -0.823 8.875 1.00 0.00 O ATOM 696 OE2 GLU A 131 -8.735 -2.252 9.569 1.00 0.00 O ATOM 0 H GLU A 131 -10.820 2.349 7.317 1.00 0.00 H new ATOM 0 HA GLU A 131 -11.518 0.817 9.634 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.987 1.757 8.288 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -8.900 1.091 9.907 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -10.464 -0.778 8.597 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -9.370 -0.261 7.328 1.00 0.00 H new ATOM 703 N GLY A 132 -10.331 3.875 10.032 1.00 0.00 N ATOM 704 CA GLY A 132 -10.214 4.946 11.004 1.00 0.00 C ATOM 705 C GLY A 132 -9.242 4.611 12.117 1.00 0.00 C ATOM 706 O GLY A 132 -9.390 5.084 13.244 1.00 0.00 O ATOM 0 H GLY A 132 -10.025 4.116 9.089 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -9.887 5.856 10.501 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -11.195 5.154 11.432 1.00 0.00 H new ATOM 710 N LYS A 133 -8.243 3.792 11.801 1.00 0.00 N ATOM 711 CA LYS A 133 -7.242 3.393 12.781 1.00 0.00 C ATOM 712 C LYS A 133 -6.086 4.390 12.807 1.00 0.00 C ATOM 713 O LYS A 133 -6.232 5.533 12.373 1.00 0.00 O ATOM 714 CB LYS A 133 -6.726 1.987 12.459 1.00 0.00 C ATOM 715 CG LYS A 133 -6.559 1.106 13.686 1.00 0.00 C ATOM 716 CD LYS A 133 -6.892 -0.345 13.380 1.00 0.00 C ATOM 717 CE LYS A 133 -8.315 -0.687 13.789 1.00 0.00 C ATOM 718 NZ LYS A 133 -8.454 -0.815 15.267 1.00 0.00 N ATOM 0 H LYS A 133 -8.106 3.392 10.873 1.00 0.00 H new ATOM 0 HA LYS A 133 -7.705 3.383 13.768 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -7.416 1.505 11.767 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -5.767 2.069 11.947 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -5.534 1.176 14.049 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -7.205 1.468 14.486 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -6.764 -0.532 12.314 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -6.194 -0.998 13.904 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -8.992 0.086 13.426 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -8.614 -1.621 13.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -9.381 -1.227 15.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -7.702 -1.432 15.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -8.376 0.125 15.706 1.00 0.00 H new ATOM 732 N VAL A 134 -4.938 3.954 13.319 1.00 0.00 N ATOM 733 CA VAL A 134 -3.764 4.811 13.399 1.00 0.00 C ATOM 734 C VAL A 134 -2.494 4.038 13.056 1.00 0.00 C ATOM 735 O VAL A 134 -2.350 2.870 13.421 1.00 0.00 O ATOM 736 CB VAL A 134 -3.611 5.427 14.804 1.00 0.00 C ATOM 737 CG1 VAL A 134 -2.556 6.521 14.798 1.00 0.00 C ATOM 738 CG2 VAL A 134 -4.945 5.966 15.301 1.00 0.00 C ATOM 0 H VAL A 134 -4.798 3.012 13.684 1.00 0.00 H new ATOM 0 HA VAL A 134 -3.908 5.611 12.673 1.00 0.00 H new ATOM 0 HB VAL A 134 -3.284 4.644 15.488 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -2.463 6.943 15.799 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -1.598 6.101 14.491 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -2.849 7.305 14.100 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -4.816 6.397 16.294 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -5.305 6.734 14.616 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -5.670 5.154 15.349 1.00 0.00 H new ATOM 748 N PHE A 135 -1.577 4.695 12.353 1.00 0.00 N ATOM 749 CA PHE A 135 -0.320 4.068 11.960 1.00 0.00 C ATOM 750 C PHE A 135 0.862 4.984 12.259 1.00 0.00 C ATOM 751 O PHE A 135 0.684 6.151 12.608 1.00 0.00 O ATOM 752 CB PHE A 135 -0.338 3.717 10.471 1.00 0.00 C ATOM 753 CG PHE A 135 -1.622 3.086 10.012 1.00 0.00 C ATOM 754 CD1 PHE A 135 -2.199 2.053 10.732 1.00 0.00 C ATOM 755 CD2 PHE A 135 -2.250 3.526 8.858 1.00 0.00 C ATOM 756 CE1 PHE A 135 -3.380 1.471 10.310 1.00 0.00 C ATOM 757 CE2 PHE A 135 -3.431 2.950 8.431 1.00 0.00 C ATOM 758 CZ PHE A 135 -3.996 1.920 9.158 1.00 0.00 C ATOM 0 H PHE A 135 -1.681 5.661 12.044 1.00 0.00 H new ATOM 0 HA PHE A 135 -0.207 3.152 12.540 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -0.162 4.623 9.892 1.00 0.00 H new ATOM 0 HB3 PHE A 135 0.487 3.037 10.258 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -1.721 1.698 11.633 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -1.811 4.329 8.285 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -3.820 0.666 10.880 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -3.911 3.304 7.531 1.00 0.00 H new ATOM 0 HZ PHE A 135 -4.918 1.466 8.826 1.00 0.00 H new ATOM 768 N HIS A 136 2.071 4.449 12.114 1.00 0.00 N ATOM 769 CA HIS A 136 3.284 5.218 12.363 1.00 0.00 C ATOM 770 C HIS A 136 3.929 5.647 11.049 1.00 0.00 C ATOM 771 O HIS A 136 3.466 5.277 9.970 1.00 0.00 O ATOM 772 CB HIS A 136 4.276 4.394 13.187 1.00 0.00 C ATOM 773 CG HIS A 136 4.299 4.760 14.639 1.00 0.00 C ATOM 774 ND1 HIS A 136 4.748 5.979 15.101 1.00 0.00 N ATOM 775 CD2 HIS A 136 3.926 4.058 15.736 1.00 0.00 C ATOM 776 CE1 HIS A 136 4.651 6.013 16.418 1.00 0.00 C ATOM 777 NE2 HIS A 136 4.154 4.860 16.828 1.00 0.00 N ATOM 0 H HIS A 136 2.236 3.485 11.825 1.00 0.00 H new ATOM 0 HA HIS A 136 3.012 6.111 12.925 1.00 0.00 H new ATOM 0 HB2 HIS A 136 4.026 3.337 13.091 1.00 0.00 H new ATOM 0 HB3 HIS A 136 5.276 4.524 12.772 1.00 0.00 H new ATOM 0 HD2 HIS A 136 3.525 3.055 15.750 1.00 0.00 H new ATOM 0 HE1 HIS A 136 4.930 6.842 17.051 1.00 0.00 H new ATOM 0 HE2 HIS A 136 3.969 4.606 17.798 1.00 0.00 H new ATOM 786 N HIS A 137 5.000 6.428 11.145 1.00 0.00 N ATOM 787 CA HIS A 137 5.706 6.901 9.960 1.00 0.00 C ATOM 788 C HIS A 137 6.349 5.737 9.213 1.00 0.00 C ATOM 789 O HIS A 137 6.150 5.573 8.008 1.00 0.00 O ATOM 790 CB HIS A 137 6.767 7.936 10.341 1.00 0.00 C ATOM 791 CG HIS A 137 7.691 7.483 11.430 1.00 0.00 C ATOM 792 ND1 HIS A 137 7.358 7.524 12.768 1.00 0.00 N ATOM 793 CD2 HIS A 137 8.948 6.980 11.373 1.00 0.00 C ATOM 794 CE1 HIS A 137 8.368 7.066 13.486 1.00 0.00 C ATOM 795 NE2 HIS A 137 9.345 6.730 12.664 1.00 0.00 N ATOM 0 H HIS A 137 5.397 6.746 12.029 1.00 0.00 H new ATOM 0 HA HIS A 137 4.979 7.375 9.301 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.355 8.182 9.457 1.00 0.00 H new ATOM 0 HB3 HIS A 137 6.270 8.853 10.657 1.00 0.00 H new ATOM 0 HD2 HIS A 137 9.529 6.808 10.479 1.00 0.00 H new ATOM 0 HE1 HIS A 137 8.391 6.981 14.562 1.00 0.00 H new ATOM 0 HE2 HIS A 137 10.248 6.347 12.943 1.00 0.00 H new ATOM 804 N VAL A 138 7.113 4.923 9.936 1.00 0.00 N ATOM 805 CA VAL A 138 7.774 3.770 9.340 1.00 0.00 C ATOM 806 C VAL A 138 6.750 2.755 8.845 1.00 0.00 C ATOM 807 O VAL A 138 6.961 2.082 7.836 1.00 0.00 O ATOM 808 CB VAL A 138 8.721 3.080 10.340 1.00 0.00 C ATOM 809 CG1 VAL A 138 9.521 1.984 9.654 1.00 0.00 C ATOM 810 CG2 VAL A 138 9.647 4.098 10.988 1.00 0.00 C ATOM 0 H VAL A 138 7.288 5.042 10.934 1.00 0.00 H new ATOM 0 HA VAL A 138 8.360 4.140 8.498 1.00 0.00 H new ATOM 0 HB VAL A 138 8.117 2.620 11.122 1.00 0.00 H new ATOM 0 HG11 VAL A 138 10.183 1.510 10.378 1.00 0.00 H new ATOM 0 HG12 VAL A 138 8.840 1.239 9.243 1.00 0.00 H new ATOM 0 HG13 VAL A 138 10.114 2.417 8.848 1.00 0.00 H new ATOM 0 HG21 VAL A 138 10.309 3.592 11.691 1.00 0.00 H new ATOM 0 HG22 VAL A 138 10.243 4.590 10.219 1.00 0.00 H new ATOM 0 HG23 VAL A 138 9.054 4.843 11.519 1.00 0.00 H new ATOM 820 N GLN A 139 5.636 2.653 9.564 1.00 0.00 N ATOM 821 CA GLN A 139 4.573 1.724 9.199 1.00 0.00 C ATOM 822 C GLN A 139 4.008 2.064 7.826 1.00 0.00 C ATOM 823 O GLN A 139 3.998 1.230 6.923 1.00 0.00 O ATOM 824 CB GLN A 139 3.460 1.750 10.250 1.00 0.00 C ATOM 825 CG GLN A 139 3.269 0.423 10.965 1.00 0.00 C ATOM 826 CD GLN A 139 4.260 0.221 12.095 1.00 0.00 C ATOM 827 OE1 GLN A 139 4.156 0.851 13.147 1.00 0.00 O ATOM 828 NE2 GLN A 139 5.229 -0.660 11.881 1.00 0.00 N ATOM 0 H GLN A 139 5.447 3.202 10.402 1.00 0.00 H new ATOM 0 HA GLN A 139 4.995 0.720 9.159 1.00 0.00 H new ATOM 0 HB2 GLN A 139 3.685 2.521 10.987 1.00 0.00 H new ATOM 0 HB3 GLN A 139 2.524 2.032 9.769 1.00 0.00 H new ATOM 0 HG2 GLN A 139 2.255 0.371 11.362 1.00 0.00 H new ATOM 0 HG3 GLN A 139 3.372 -0.390 10.247 1.00 0.00 H new ATOM 0 HE21 GLN A 139 5.277 -1.160 10.993 1.00 0.00 H new ATOM 0 HE22 GLN A 139 5.926 -0.837 12.604 1.00 0.00 H new ATOM 837 N TRP A 140 3.543 3.297 7.681 1.00 0.00 N ATOM 838 CA TRP A 140 2.977 3.760 6.418 1.00 0.00 C ATOM 839 C TRP A 140 3.998 3.638 5.292 1.00 0.00 C ATOM 840 O TRP A 140 3.644 3.382 4.142 1.00 0.00 O ATOM 841 CB TRP A 140 2.514 5.213 6.547 1.00 0.00 C ATOM 842 CG TRP A 140 1.425 5.581 5.587 1.00 0.00 C ATOM 843 CD1 TRP A 140 0.100 5.266 5.689 1.00 0.00 C ATOM 844 CD2 TRP A 140 1.566 6.335 4.377 1.00 0.00 C ATOM 845 NE1 TRP A 140 -0.591 5.777 4.618 1.00 0.00 N ATOM 846 CE2 TRP A 140 0.286 6.439 3.798 1.00 0.00 C ATOM 847 CE3 TRP A 140 2.649 6.933 3.727 1.00 0.00 C ATOM 848 CZ2 TRP A 140 0.062 7.116 2.602 1.00 0.00 C ATOM 849 CZ3 TRP A 140 2.425 7.605 2.539 1.00 0.00 C ATOM 850 CH2 TRP A 140 1.141 7.692 1.989 1.00 0.00 C ATOM 0 H TRP A 140 3.546 3.997 8.423 1.00 0.00 H new ATOM 0 HA TRP A 140 2.119 3.132 6.178 1.00 0.00 H new ATOM 0 HB2 TRP A 140 2.164 5.385 7.565 1.00 0.00 H new ATOM 0 HB3 TRP A 140 3.367 5.873 6.387 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -0.340 4.698 6.495 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -1.594 5.680 4.458 1.00 0.00 H new ATOM 0 HE3 TRP A 140 3.643 6.872 4.145 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -0.927 7.184 2.174 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 3.255 8.070 2.027 1.00 0.00 H new ATOM 0 HH2 TRP A 140 0.999 8.225 1.061 1.00 0.00 H new ATOM 861 N GLN A 141 5.267 3.827 5.636 1.00 0.00 N ATOM 862 CA GLN A 141 6.347 3.741 4.660 1.00 0.00 C ATOM 863 C GLN A 141 6.496 2.318 4.127 1.00 0.00 C ATOM 864 O GLN A 141 6.514 2.098 2.916 1.00 0.00 O ATOM 865 CB GLN A 141 7.662 4.206 5.294 1.00 0.00 C ATOM 866 CG GLN A 141 8.879 4.019 4.400 1.00 0.00 C ATOM 867 CD GLN A 141 10.133 4.629 4.992 1.00 0.00 C ATOM 868 OE1 GLN A 141 11.165 3.967 5.107 1.00 0.00 O ATOM 869 NE2 GLN A 141 10.052 5.899 5.371 1.00 0.00 N ATOM 0 H GLN A 141 5.573 4.041 6.585 1.00 0.00 H new ATOM 0 HA GLN A 141 6.101 4.392 3.821 1.00 0.00 H new ATOM 0 HB2 GLN A 141 7.575 5.260 5.556 1.00 0.00 H new ATOM 0 HB3 GLN A 141 7.819 3.659 6.224 1.00 0.00 H new ATOM 0 HG2 GLN A 141 9.042 2.955 4.231 1.00 0.00 H new ATOM 0 HG3 GLN A 141 8.684 4.470 3.427 1.00 0.00 H new ATOM 0 HE21 GLN A 141 9.177 6.410 5.257 1.00 0.00 H new ATOM 0 HE22 GLN A 141 10.865 6.363 5.776 1.00 0.00 H new ATOM 878 N GLN A 142 6.609 1.358 5.039 1.00 0.00 N ATOM 879 CA GLN A 142 6.765 -0.043 4.660 1.00 0.00 C ATOM 880 C GLN A 142 5.484 -0.601 4.048 1.00 0.00 C ATOM 881 O GLN A 142 5.526 -1.346 3.070 1.00 0.00 O ATOM 882 CB GLN A 142 7.164 -0.878 5.878 1.00 0.00 C ATOM 883 CG GLN A 142 8.481 -0.448 6.504 1.00 0.00 C ATOM 884 CD GLN A 142 8.739 -1.121 7.838 1.00 0.00 C ATOM 885 OE1 GLN A 142 9.741 -1.813 8.014 1.00 0.00 O ATOM 886 NE2 GLN A 142 7.832 -0.920 8.786 1.00 0.00 N ATOM 0 H GLN A 142 6.596 1.524 6.045 1.00 0.00 H new ATOM 0 HA GLN A 142 7.552 -0.098 3.908 1.00 0.00 H new ATOM 0 HB2 GLN A 142 6.376 -0.812 6.628 1.00 0.00 H new ATOM 0 HB3 GLN A 142 7.236 -1.925 5.583 1.00 0.00 H new ATOM 0 HG2 GLN A 142 9.297 -0.680 5.820 1.00 0.00 H new ATOM 0 HG3 GLN A 142 8.478 0.633 6.641 1.00 0.00 H new ATOM 0 HE21 GLN A 142 7.016 -0.338 8.596 1.00 0.00 H new ATOM 0 HE22 GLN A 142 7.951 -1.347 9.705 1.00 0.00 H new ATOM 895 N LYS A 143 4.345 -0.240 4.631 1.00 0.00 N ATOM 896 CA LYS A 143 3.053 -0.713 4.143 1.00 0.00 C ATOM 897 C LYS A 143 2.852 -0.353 2.674 1.00 0.00 C ATOM 898 O LYS A 143 2.575 -1.219 1.845 1.00 0.00 O ATOM 899 CB LYS A 143 1.918 -0.124 4.986 1.00 0.00 C ATOM 900 CG LYS A 143 1.256 -1.137 5.906 1.00 0.00 C ATOM 901 CD LYS A 143 1.902 -1.145 7.283 1.00 0.00 C ATOM 902 CE LYS A 143 1.059 -0.391 8.298 1.00 0.00 C ATOM 903 NZ LYS A 143 0.054 -1.274 8.954 1.00 0.00 N ATOM 0 H LYS A 143 4.290 0.378 5.441 1.00 0.00 H new ATOM 0 HA LYS A 143 3.039 -1.799 4.233 1.00 0.00 H new ATOM 0 HB2 LYS A 143 2.310 0.697 5.586 1.00 0.00 H new ATOM 0 HB3 LYS A 143 1.164 0.298 4.321 1.00 0.00 H new ATOM 0 HG2 LYS A 143 0.195 -0.904 6.002 1.00 0.00 H new ATOM 0 HG3 LYS A 143 1.326 -2.131 5.464 1.00 0.00 H new ATOM 0 HD2 LYS A 143 2.040 -2.174 7.615 1.00 0.00 H new ATOM 0 HD3 LYS A 143 2.892 -0.694 7.224 1.00 0.00 H new ATOM 0 HE2 LYS A 143 1.709 0.045 9.057 1.00 0.00 H new ATOM 0 HE3 LYS A 143 0.548 0.435 7.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -0.500 -0.721 9.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -0.583 -1.670 8.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 0.542 -2.048 9.448 1.00 0.00 H new ATOM 917 N LEU A 144 2.992 0.931 2.358 1.00 0.00 N ATOM 918 CA LEU A 144 2.823 1.402 0.989 1.00 0.00 C ATOM 919 C LEU A 144 3.853 0.767 0.059 1.00 0.00 C ATOM 920 O LEU A 144 3.527 0.352 -1.053 1.00 0.00 O ATOM 921 CB LEU A 144 2.938 2.927 0.935 1.00 0.00 C ATOM 922 CG LEU A 144 1.833 3.628 0.139 1.00 0.00 C ATOM 923 CD1 LEU A 144 0.828 4.280 1.075 1.00 0.00 C ATOM 924 CD2 LEU A 144 2.428 4.659 -0.809 1.00 0.00 C ATOM 0 H LEU A 144 3.222 1.662 3.031 1.00 0.00 H new ATOM 0 HA LEU A 144 1.830 1.107 0.651 1.00 0.00 H new ATOM 0 HB2 LEU A 144 2.933 3.314 1.954 1.00 0.00 H new ATOM 0 HB3 LEU A 144 3.902 3.189 0.499 1.00 0.00 H new ATOM 0 HG LEU A 144 1.311 2.877 -0.454 1.00 0.00 H new ATOM 0 HD11 LEU A 144 0.052 4.772 0.489 1.00 0.00 H new ATOM 0 HD12 LEU A 144 0.375 3.519 1.710 1.00 0.00 H new ATOM 0 HD13 LEU A 144 1.335 5.017 1.697 1.00 0.00 H new ATOM 0 HD21 LEU A 144 1.627 5.146 -1.366 1.00 0.00 H new ATOM 0 HD22 LEU A 144 2.978 5.405 -0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 144 3.105 4.165 -1.505 1.00 0.00 H new ATOM 936 N ALA A 145 5.097 0.697 0.521 1.00 0.00 N ATOM 937 CA ALA A 145 6.174 0.116 -0.271 1.00 0.00 C ATOM 938 C ALA A 145 5.918 -1.361 -0.555 1.00 0.00 C ATOM 939 O ALA A 145 6.161 -1.841 -1.662 1.00 0.00 O ATOM 940 CB ALA A 145 7.506 0.294 0.441 1.00 0.00 C ATOM 0 H ALA A 145 5.384 1.035 1.439 1.00 0.00 H new ATOM 0 HA ALA A 145 6.210 0.640 -1.226 1.00 0.00 H new ATOM 0 HB1 ALA A 145 8.302 -0.144 -0.161 1.00 0.00 H new ATOM 0 HB2 ALA A 145 7.703 1.356 0.585 1.00 0.00 H new ATOM 0 HB3 ALA A 145 7.469 -0.202 1.411 1.00 0.00 H new ATOM 946 N ARG A 146 5.429 -2.077 0.452 1.00 0.00 N ATOM 947 CA ARG A 146 5.144 -3.501 0.310 1.00 0.00 C ATOM 948 C ARG A 146 3.862 -3.730 -0.487 1.00 0.00 C ATOM 949 O ARG A 146 3.689 -4.777 -1.112 1.00 0.00 O ATOM 950 CB ARG A 146 5.029 -4.158 1.687 1.00 0.00 C ATOM 951 CG ARG A 146 6.258 -4.961 2.083 1.00 0.00 C ATOM 952 CD ARG A 146 6.688 -4.659 3.509 1.00 0.00 C ATOM 953 NE ARG A 146 5.680 -5.071 4.483 1.00 0.00 N ATOM 954 CZ ARG A 146 5.842 -4.983 5.801 1.00 0.00 C ATOM 955 NH1 ARG A 146 6.971 -4.500 6.307 1.00 0.00 N ATOM 956 NH2 ARG A 146 4.874 -5.378 6.616 1.00 0.00 N ATOM 0 H ARG A 146 5.222 -1.695 1.375 1.00 0.00 H new ATOM 0 HA ARG A 146 5.970 -3.956 -0.236 1.00 0.00 H new ATOM 0 HB2 ARG A 146 4.854 -3.385 2.435 1.00 0.00 H new ATOM 0 HB3 ARG A 146 4.158 -4.814 1.696 1.00 0.00 H new ATOM 0 HG2 ARG A 146 6.045 -6.025 1.984 1.00 0.00 H new ATOM 0 HG3 ARG A 146 7.077 -4.735 1.400 1.00 0.00 H new ATOM 0 HD2 ARG A 146 7.627 -5.170 3.721 1.00 0.00 H new ATOM 0 HD3 ARG A 146 6.877 -3.590 3.612 1.00 0.00 H new ATOM 0 HE ARG A 146 4.800 -5.449 4.132 1.00 0.00 H new ATOM 0 HH11 ARG A 146 7.719 -4.194 5.685 1.00 0.00 H new ATOM 0 HH12 ARG A 146 7.090 -4.435 7.318 1.00 0.00 H new ATOM 0 HH21 ARG A 146 4.005 -5.750 6.233 1.00 0.00 H new ATOM 0 HH22 ARG A 146 4.998 -5.310 7.626 1.00 0.00 H new ATOM 970 N SER A 147 2.966 -2.748 -0.462 1.00 0.00 N ATOM 971 CA SER A 147 1.702 -2.852 -1.182 1.00 0.00 C ATOM 972 C SER A 147 1.919 -2.743 -2.688 1.00 0.00 C ATOM 973 O SER A 147 1.309 -3.476 -3.467 1.00 0.00 O ATOM 974 CB SER A 147 0.732 -1.763 -0.715 1.00 0.00 C ATOM 975 OG SER A 147 -0.584 -2.271 -0.590 1.00 0.00 O ATOM 0 H SER A 147 3.092 -1.873 0.048 1.00 0.00 H new ATOM 0 HA SER A 147 1.272 -3.830 -0.966 1.00 0.00 H new ATOM 0 HB2 SER A 147 1.063 -1.363 0.243 1.00 0.00 H new ATOM 0 HB3 SER A 147 0.740 -0.936 -1.425 1.00 0.00 H new ATOM 0 HG SER A 147 -1.183 -1.556 -0.289 1.00 0.00 H new ATOM 981 N LEU A 148 2.786 -1.822 -3.092 1.00 0.00 N ATOM 982 CA LEU A 148 3.080 -1.616 -4.505 1.00 0.00 C ATOM 983 C LEU A 148 3.989 -2.717 -5.044 1.00 0.00 C ATOM 984 O LEU A 148 3.809 -3.189 -6.167 1.00 0.00 O ATOM 985 CB LEU A 148 3.733 -0.249 -4.718 1.00 0.00 C ATOM 986 CG LEU A 148 2.892 0.946 -4.267 1.00 0.00 C ATOM 987 CD1 LEU A 148 3.712 2.226 -4.317 1.00 0.00 C ATOM 988 CD2 LEU A 148 1.645 1.077 -5.130 1.00 0.00 C ATOM 0 H LEU A 148 3.298 -1.206 -2.461 1.00 0.00 H new ATOM 0 HA LEU A 148 2.138 -1.651 -5.052 1.00 0.00 H new ATOM 0 HB2 LEU A 148 4.682 -0.229 -4.182 1.00 0.00 H new ATOM 0 HB3 LEU A 148 3.962 -0.134 -5.777 1.00 0.00 H new ATOM 0 HG LEU A 148 2.581 0.777 -3.236 1.00 0.00 H new ATOM 0 HD11 LEU A 148 3.097 3.065 -3.993 1.00 0.00 H new ATOM 0 HD12 LEU A 148 4.574 2.132 -3.657 1.00 0.00 H new ATOM 0 HD13 LEU A 148 4.054 2.400 -5.337 1.00 0.00 H new ATOM 0 HD21 LEU A 148 1.059 1.932 -4.795 1.00 0.00 H new ATOM 0 HD22 LEU A 148 1.936 1.222 -6.170 1.00 0.00 H new ATOM 0 HD23 LEU A 148 1.046 0.170 -5.044 1.00 0.00 H new ATOM 1000 N GLN A 149 4.965 -3.123 -4.238 1.00 0.00 N ATOM 1001 CA GLN A 149 5.899 -4.168 -4.638 1.00 0.00 C ATOM 1002 C GLN A 149 5.203 -5.524 -4.711 1.00 0.00 C ATOM 1003 O GLN A 149 5.224 -6.189 -5.747 1.00 0.00 O ATOM 1004 CB GLN A 149 7.074 -4.235 -3.658 1.00 0.00 C ATOM 1005 CG GLN A 149 8.384 -3.732 -4.245 1.00 0.00 C ATOM 1006 CD GLN A 149 8.964 -4.683 -5.274 1.00 0.00 C ATOM 1007 OE1 GLN A 149 9.259 -4.288 -6.403 1.00 0.00 O ATOM 1008 NE2 GLN A 149 9.128 -5.943 -4.891 1.00 0.00 N ATOM 0 H GLN A 149 5.129 -2.744 -3.305 1.00 0.00 H new ATOM 0 HA GLN A 149 6.277 -3.921 -5.630 1.00 0.00 H new ATOM 0 HB2 GLN A 149 6.832 -3.647 -2.773 1.00 0.00 H new ATOM 0 HB3 GLN A 149 7.204 -5.266 -3.330 1.00 0.00 H new ATOM 0 HG2 GLN A 149 8.221 -2.758 -4.707 1.00 0.00 H new ATOM 0 HG3 GLN A 149 9.106 -3.587 -3.442 1.00 0.00 H new ATOM 0 HE21 GLN A 149 8.870 -6.226 -3.946 1.00 0.00 H new ATOM 0 HE22 GLN A 149 9.512 -6.628 -5.542 1.00 0.00 H new ATOM 1017 N ILE A 150 4.587 -5.929 -3.605 1.00 0.00 N ATOM 1018 CA ILE A 150 3.885 -7.205 -3.544 1.00 0.00 C ATOM 1019 C ILE A 150 2.562 -7.150 -4.302 1.00 0.00 C ATOM 1020 O ILE A 150 2.013 -8.182 -4.687 1.00 0.00 O ATOM 1021 CB ILE A 150 3.613 -7.629 -2.087 1.00 0.00 C ATOM 1022 CG1 ILE A 150 4.882 -7.485 -1.245 1.00 0.00 C ATOM 1023 CG2 ILE A 150 3.095 -9.060 -2.037 1.00 0.00 C ATOM 1024 CD1 ILE A 150 4.696 -7.882 0.202 1.00 0.00 C ATOM 0 H ILE A 150 4.560 -5.391 -2.739 1.00 0.00 H new ATOM 0 HA ILE A 150 4.536 -7.942 -4.015 1.00 0.00 H new ATOM 0 HB ILE A 150 2.848 -6.973 -1.671 1.00 0.00 H new ATOM 0 HG12 ILE A 150 5.670 -8.098 -1.683 1.00 0.00 H new ATOM 0 HG13 ILE A 150 5.221 -6.450 -1.288 1.00 0.00 H new ATOM 0 HG21 ILE A 150 2.908 -9.343 -1.001 1.00 0.00 H new ATOM 0 HG22 ILE A 150 2.168 -9.131 -2.606 1.00 0.00 H new ATOM 0 HG23 ILE A 150 3.838 -9.731 -2.468 1.00 0.00 H new ATOM 0 HD11 ILE A 150 5.636 -7.754 0.738 1.00 0.00 H new ATOM 0 HD12 ILE A 150 3.931 -7.253 0.656 1.00 0.00 H new ATOM 0 HD13 ILE A 150 4.386 -8.926 0.256 1.00 0.00 H new ATOM 1036 N GLY A 151 2.057 -5.940 -4.514 1.00 0.00 N ATOM 1037 CA GLY A 151 0.803 -5.776 -5.227 1.00 0.00 C ATOM 1038 C GLY A 151 0.948 -6.006 -6.718 1.00 0.00 C ATOM 1039 O GLY A 151 0.102 -6.650 -7.339 1.00 0.00 O ATOM 0 H GLY A 151 2.492 -5.071 -4.206 1.00 0.00 H new ATOM 0 HA2 GLY A 151 0.067 -6.472 -4.825 1.00 0.00 H new ATOM 0 HA3 GLY A 151 0.419 -4.771 -5.053 1.00 0.00 H new