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 -130:sc= -0.227 (180deg=-2.13!) USER MOD Single : A 91 MET CE :methyl -171:sc=-0.00758 (180deg=-0.178) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.0124 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.00229 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= -0.219 X(o=-0.22,f=-0.01) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 HIS : no HD1:sc= -2.49 K(o=-2.5,f=-3.3!) USER MOD Single : A 137 HIS : no HD1:sc= -5.81! C(o=-5.8!,f=-4.2!) USER MOD Single : A 139 GLN : amide:sc= -1.13 K(o=-1.1,f=-0.53) USER MOD Single : A 141 GLN : amide:sc= -0.379 X(o=-0.38,f=-0.18) USER MOD Single : A 142 GLN : amide:sc= -0.0829 X(o=-0.083,f=-0.17) USER MOD Single : A 143 LYS NZ :NH3+ -177:sc= -1.23 (180deg=-1.35) USER MOD Single : A 147 SER OG : rot 92:sc= 1.28 USER MOD Single : A 149 GLN : amide:sc= -0.0235 X(o=-0.023,f=-0.38) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 88 1.702 7.074 17.657 1.00 0.00 N ATOM 2 CA MET A 88 1.372 6.992 16.210 1.00 0.00 C ATOM 3 C MET A 88 0.918 8.344 15.671 1.00 0.00 C ATOM 4 O MET A 88 0.891 9.337 16.400 1.00 0.00 O ATOM 5 CB MET A 88 0.270 5.948 16.022 1.00 0.00 C ATOM 6 CG MET A 88 0.700 4.537 16.390 1.00 0.00 C ATOM 7 SD MET A 88 -0.584 3.624 17.267 1.00 0.00 S ATOM 8 CE MET A 88 -0.874 2.271 16.131 1.00 0.00 C ATOM 0 HA MET A 88 2.263 6.702 15.654 1.00 0.00 H new ATOM 0 HB2 MET A 88 -0.591 6.227 16.630 1.00 0.00 H new ATOM 0 HB3 MET A 88 -0.057 5.960 14.982 1.00 0.00 H new ATOM 0 HG2 MET A 88 0.970 3.996 15.483 1.00 0.00 H new ATOM 0 HG3 MET A 88 1.595 4.585 17.011 1.00 0.00 H new ATOM 0 HE1 MET A 88 -1.943 2.177 15.942 1.00 0.00 H new ATOM 0 HE2 MET A 88 -0.356 2.467 15.192 1.00 0.00 H new ATOM 0 HE3 MET A 88 -0.500 1.344 16.566 1.00 0.00 H new ATOM 20 N PHE A 89 0.561 8.378 14.391 1.00 0.00 N ATOM 21 CA PHE A 89 0.110 9.612 13.758 1.00 0.00 C ATOM 22 C PHE A 89 -0.992 9.333 12.740 1.00 0.00 C ATOM 23 O PHE A 89 -0.747 8.734 11.693 1.00 0.00 O ATOM 24 CB PHE A 89 1.283 10.317 13.076 1.00 0.00 C ATOM 25 CG PHE A 89 2.391 10.686 14.022 1.00 0.00 C ATOM 26 CD1 PHE A 89 2.385 11.909 14.674 1.00 0.00 C ATOM 27 CD2 PHE A 89 3.438 9.809 14.258 1.00 0.00 C ATOM 28 CE1 PHE A 89 3.402 12.249 15.546 1.00 0.00 C ATOM 29 CE2 PHE A 89 4.458 10.145 15.127 1.00 0.00 C ATOM 30 CZ PHE A 89 4.440 11.367 15.773 1.00 0.00 C ATOM 0 H PHE A 89 0.575 7.567 13.773 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.295 10.261 14.534 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.682 9.669 12.296 1.00 0.00 H new ATOM 0 HB3 PHE A 89 0.919 11.220 12.585 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.577 12.604 14.499 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.457 8.852 13.757 1.00 0.00 H new ATOM 0 HE1 PHE A 89 3.385 13.204 16.050 1.00 0.00 H new ATOM 0 HE2 PHE A 89 5.269 9.453 15.302 1.00 0.00 H new ATOM 0 HZ PHE A 89 5.236 11.631 16.454 1.00 0.00 H new ATOM 40 N ALA A 90 -2.206 9.775 13.055 1.00 0.00 N ATOM 41 CA ALA A 90 -3.346 9.577 12.170 1.00 0.00 C ATOM 42 C ALA A 90 -3.425 10.683 11.124 1.00 0.00 C ATOM 43 O ALA A 90 -2.591 11.588 11.099 1.00 0.00 O ATOM 44 CB ALA A 90 -4.635 9.513 12.977 1.00 0.00 C ATOM 0 H ALA A 90 -2.424 10.273 13.918 1.00 0.00 H new ATOM 0 HA ALA A 90 -3.212 8.630 11.648 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.479 9.365 12.303 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.583 8.683 13.681 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -4.768 10.446 13.525 1.00 0.00 H new ATOM 50 N MET A 91 -4.432 10.603 10.263 1.00 0.00 N ATOM 51 CA MET A 91 -4.621 11.598 9.213 1.00 0.00 C ATOM 52 C MET A 91 -5.999 11.460 8.574 1.00 0.00 C ATOM 53 O MET A 91 -6.769 10.566 8.924 1.00 0.00 O ATOM 54 CB MET A 91 -3.533 11.455 8.146 1.00 0.00 C ATOM 55 CG MET A 91 -3.039 12.784 7.596 1.00 0.00 C ATOM 56 SD MET A 91 -3.460 13.020 5.857 1.00 0.00 S ATOM 57 CE MET A 91 -2.046 12.266 5.059 1.00 0.00 C ATOM 0 H MET A 91 -5.131 9.860 10.271 1.00 0.00 H new ATOM 0 HA MET A 91 -4.549 12.587 9.666 1.00 0.00 H new ATOM 0 HB2 MET A 91 -2.689 10.911 8.571 1.00 0.00 H new ATOM 0 HB3 MET A 91 -3.919 10.853 7.324 1.00 0.00 H new ATOM 0 HG2 MET A 91 -3.467 13.597 8.183 1.00 0.00 H new ATOM 0 HG3 MET A 91 -1.957 12.842 7.714 1.00 0.00 H new ATOM 0 HE1 MET A 91 -2.079 12.472 3.989 1.00 0.00 H new ATOM 0 HE2 MET A 91 -1.129 12.677 5.480 1.00 0.00 H new ATOM 0 HE3 MET A 91 -2.068 11.188 5.221 1.00 0.00 H new ATOM 67 N TYR A 92 -6.301 12.350 7.636 1.00 0.00 N ATOM 68 CA TYR A 92 -7.585 12.327 6.945 1.00 0.00 C ATOM 69 C TYR A 92 -7.426 11.769 5.534 1.00 0.00 C ATOM 70 O TYR A 92 -6.368 11.905 4.923 1.00 0.00 O ATOM 71 CB TYR A 92 -8.186 13.734 6.887 1.00 0.00 C ATOM 72 CG TYR A 92 -7.177 14.812 6.560 1.00 0.00 C ATOM 73 CD1 TYR A 92 -6.426 15.413 7.563 1.00 0.00 C ATOM 74 CD2 TYR A 92 -6.977 15.230 5.251 1.00 0.00 C ATOM 75 CE1 TYR A 92 -5.504 16.399 7.269 1.00 0.00 C ATOM 76 CE2 TYR A 92 -6.057 16.215 4.949 1.00 0.00 C ATOM 77 CZ TYR A 92 -5.323 16.796 5.962 1.00 0.00 C ATOM 78 OH TYR A 92 -4.406 17.779 5.665 1.00 0.00 O ATOM 0 H TYR A 92 -5.674 13.097 7.336 1.00 0.00 H new ATOM 0 HA TYR A 92 -8.260 11.678 7.503 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -8.978 13.751 6.138 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -8.650 13.962 7.847 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -6.565 15.104 8.589 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -7.550 14.777 4.456 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -4.928 16.856 8.060 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -5.913 16.528 3.926 1.00 0.00 H new ATOM 0 HH TYR A 92 -4.401 17.940 4.698 1.00 0.00 H new ATOM 88 N PRO A 93 -8.478 11.128 4.995 1.00 0.00 N ATOM 89 CA PRO A 93 -8.446 10.546 3.652 1.00 0.00 C ATOM 90 C PRO A 93 -8.761 11.562 2.556 1.00 0.00 C ATOM 91 O PRO A 93 -9.391 11.226 1.552 1.00 0.00 O ATOM 92 CB PRO A 93 -9.542 9.489 3.728 1.00 0.00 C ATOM 93 CG PRO A 93 -10.547 10.059 4.672 1.00 0.00 C ATOM 94 CD PRO A 93 -9.780 10.912 5.654 1.00 0.00 C ATOM 0 HA PRO A 93 -7.460 10.161 3.392 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -9.980 9.301 2.748 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -9.152 8.538 4.091 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -11.287 10.654 4.137 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -11.088 9.266 5.188 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.291 11.855 5.848 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.663 10.409 6.614 1.00 0.00 H new ATOM 102 N ASP A 94 -8.325 12.803 2.750 1.00 0.00 N ATOM 103 CA ASP A 94 -8.567 13.859 1.771 1.00 0.00 C ATOM 104 C ASP A 94 -7.264 14.331 1.125 1.00 0.00 C ATOM 105 O ASP A 94 -7.233 15.372 0.469 1.00 0.00 O ATOM 106 CB ASP A 94 -9.279 15.042 2.435 1.00 0.00 C ATOM 107 CG ASP A 94 -10.714 15.189 1.966 1.00 0.00 C ATOM 108 OD1 ASP A 94 -11.445 14.176 1.966 1.00 0.00 O ATOM 109 OD2 ASP A 94 -11.106 16.317 1.600 1.00 0.00 O ATOM 0 H ASP A 94 -7.803 13.102 3.574 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.203 13.448 0.987 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -9.265 14.911 3.517 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -8.733 15.960 2.218 1.00 0.00 H new ATOM 114 N TRP A 95 -6.190 13.570 1.317 1.00 0.00 N ATOM 115 CA TRP A 95 -4.896 13.924 0.756 1.00 0.00 C ATOM 116 C TRP A 95 -4.821 13.571 -0.726 1.00 0.00 C ATOM 117 O TRP A 95 -5.540 12.693 -1.204 1.00 0.00 O ATOM 118 CB TRP A 95 -3.781 13.210 1.518 1.00 0.00 C ATOM 119 CG TRP A 95 -4.031 11.745 1.710 1.00 0.00 C ATOM 120 CD1 TRP A 95 -4.417 11.125 2.862 1.00 0.00 C ATOM 121 CD2 TRP A 95 -3.910 10.717 0.720 1.00 0.00 C ATOM 122 NE1 TRP A 95 -4.544 9.773 2.651 1.00 0.00 N ATOM 123 CE2 TRP A 95 -4.238 9.498 1.343 1.00 0.00 C ATOM 124 CE3 TRP A 95 -3.557 10.708 -0.633 1.00 0.00 C ATOM 125 CZ2 TRP A 95 -4.223 8.284 0.661 1.00 0.00 C ATOM 126 CZ3 TRP A 95 -3.542 9.502 -1.309 1.00 0.00 C ATOM 127 CH2 TRP A 95 -3.874 8.305 -0.661 1.00 0.00 C ATOM 0 H TRP A 95 -6.193 12.705 1.857 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.769 15.002 0.856 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.842 13.343 0.981 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.659 13.681 2.494 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -4.597 11.624 3.803 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -4.821 9.086 3.353 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -3.301 11.626 -1.141 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -4.478 7.360 1.158 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -3.270 9.482 -2.354 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.854 7.379 -1.217 1.00 0.00 H new ATOM 138 N GLN A 96 -3.942 14.260 -1.445 1.00 0.00 N ATOM 139 CA GLN A 96 -3.764 14.024 -2.873 1.00 0.00 C ATOM 140 C GLN A 96 -2.283 13.885 -3.214 1.00 0.00 C ATOM 141 O GLN A 96 -1.419 14.291 -2.437 1.00 0.00 O ATOM 142 CB GLN A 96 -4.382 15.167 -3.680 1.00 0.00 C ATOM 143 CG GLN A 96 -5.890 15.279 -3.521 1.00 0.00 C ATOM 144 CD GLN A 96 -6.381 16.710 -3.626 1.00 0.00 C ATOM 145 OE1 GLN A 96 -6.971 17.102 -4.632 1.00 0.00 O ATOM 146 NE2 GLN A 96 -6.138 17.497 -2.585 1.00 0.00 N ATOM 0 H GLN A 96 -3.340 14.988 -1.061 1.00 0.00 H new ATOM 0 HA GLN A 96 -4.269 13.094 -3.133 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -3.922 16.107 -3.374 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -4.146 15.025 -4.735 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -6.378 14.674 -4.285 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -6.182 14.868 -2.554 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -5.645 17.129 -1.771 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -6.444 18.470 -2.599 1.00 0.00 H new ATOM 155 N PRO A 97 -1.966 13.311 -4.389 1.00 0.00 N ATOM 156 CA PRO A 97 -0.578 13.125 -4.824 1.00 0.00 C ATOM 157 C PRO A 97 0.211 14.430 -4.808 1.00 0.00 C ATOM 158 O PRO A 97 -0.288 15.474 -5.228 1.00 0.00 O ATOM 159 CB PRO A 97 -0.716 12.602 -6.256 1.00 0.00 C ATOM 160 CG PRO A 97 -2.073 11.990 -6.311 1.00 0.00 C ATOM 161 CD PRO A 97 -2.931 12.799 -5.378 1.00 0.00 C ATOM 0 HA PRO A 97 -0.032 12.451 -4.163 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -0.617 13.408 -6.983 1.00 0.00 H new ATOM 0 HB3 PRO A 97 0.058 11.869 -6.485 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -2.471 12.013 -7.326 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -2.042 10.944 -6.005 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -3.440 13.609 -5.900 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -3.702 12.188 -4.909 1.00 0.00 H new ATOM 169 N ASP A 98 1.442 14.363 -4.314 1.00 0.00 N ATOM 170 CA ASP A 98 2.302 15.537 -4.237 1.00 0.00 C ATOM 171 C ASP A 98 3.719 15.204 -4.690 1.00 0.00 C ATOM 172 O ASP A 98 3.996 14.088 -5.128 1.00 0.00 O ATOM 173 CB ASP A 98 2.329 16.087 -2.807 1.00 0.00 C ATOM 174 CG ASP A 98 2.063 15.021 -1.760 1.00 0.00 C ATOM 175 OD1 ASP A 98 3.030 14.360 -1.326 1.00 0.00 O ATOM 176 OD2 ASP A 98 0.888 14.849 -1.374 1.00 0.00 O ATOM 0 H ASP A 98 1.867 13.506 -3.960 1.00 0.00 H new ATOM 0 HA ASP A 98 1.894 16.297 -4.903 1.00 0.00 H new ATOM 0 HB2 ASP A 98 3.301 16.542 -2.616 1.00 0.00 H new ATOM 0 HB3 ASP A 98 1.583 16.876 -2.712 1.00 0.00 H new ATOM 181 N ALA A 99 4.615 16.181 -4.579 1.00 0.00 N ATOM 182 CA ALA A 99 6.005 15.992 -4.974 1.00 0.00 C ATOM 183 C ALA A 99 6.757 15.153 -3.947 1.00 0.00 C ATOM 184 O ALA A 99 7.612 14.342 -4.301 1.00 0.00 O ATOM 185 CB ALA A 99 6.687 17.339 -5.162 1.00 0.00 C ATOM 0 H ALA A 99 4.402 17.111 -4.219 1.00 0.00 H new ATOM 0 HA ALA A 99 6.019 15.455 -5.923 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.725 17.183 -5.457 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.170 17.903 -5.938 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.656 17.897 -4.226 1.00 0.00 H new ATOM 191 N ASP A 100 6.431 15.353 -2.675 1.00 0.00 N ATOM 192 CA ASP A 100 7.075 14.613 -1.595 1.00 0.00 C ATOM 193 C ASP A 100 6.667 13.144 -1.625 1.00 0.00 C ATOM 194 O ASP A 100 7.427 12.269 -1.208 1.00 0.00 O ATOM 195 CB ASP A 100 6.716 15.231 -0.241 1.00 0.00 C ATOM 196 CG ASP A 100 7.864 16.022 0.356 1.00 0.00 C ATOM 197 OD1 ASP A 100 8.779 15.398 0.931 1.00 0.00 O ATOM 198 OD2 ASP A 100 7.847 17.266 0.246 1.00 0.00 O ATOM 0 H ASP A 100 5.725 16.021 -2.366 1.00 0.00 H new ATOM 0 HA ASP A 100 8.154 14.673 -1.737 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.852 15.884 -0.361 1.00 0.00 H new ATOM 0 HB3 ASP A 100 6.425 14.440 0.450 1.00 0.00 H new ATOM 203 N PHE A 101 5.461 12.879 -2.119 1.00 0.00 N ATOM 204 CA PHE A 101 4.952 11.515 -2.203 1.00 0.00 C ATOM 205 C PHE A 101 5.791 10.681 -3.165 1.00 0.00 C ATOM 206 O PHE A 101 6.342 9.646 -2.789 1.00 0.00 O ATOM 207 CB PHE A 101 3.491 11.521 -2.654 1.00 0.00 C ATOM 208 CG PHE A 101 2.812 10.188 -2.508 1.00 0.00 C ATOM 209 CD1 PHE A 101 2.922 9.466 -1.331 1.00 0.00 C ATOM 210 CD2 PHE A 101 2.067 9.658 -3.548 1.00 0.00 C ATOM 211 CE1 PHE A 101 2.301 8.241 -1.193 1.00 0.00 C ATOM 212 CE2 PHE A 101 1.442 8.432 -3.417 1.00 0.00 C ATOM 213 CZ PHE A 101 1.559 7.722 -2.237 1.00 0.00 C ATOM 0 H PHE A 101 4.819 13.591 -2.467 1.00 0.00 H new ATOM 0 HA PHE A 101 5.016 11.067 -1.211 1.00 0.00 H new ATOM 0 HB2 PHE A 101 2.943 12.264 -2.074 1.00 0.00 H new ATOM 0 HB3 PHE A 101 3.443 11.832 -3.698 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.501 9.866 -0.512 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.973 10.209 -4.472 1.00 0.00 H new ATOM 0 HE1 PHE A 101 2.395 7.689 -0.270 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.863 8.030 -4.235 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.072 6.764 -2.131 1.00 0.00 H new ATOM 223 N ILE A 102 5.886 11.140 -4.409 1.00 0.00 N ATOM 224 CA ILE A 102 6.660 10.437 -5.425 1.00 0.00 C ATOM 225 C ILE A 102 8.132 10.360 -5.034 1.00 0.00 C ATOM 226 O ILE A 102 8.797 9.352 -5.277 1.00 0.00 O ATOM 227 CB ILE A 102 6.539 11.125 -6.800 1.00 0.00 C ATOM 228 CG1 ILE A 102 5.069 11.364 -7.151 1.00 0.00 C ATOM 229 CG2 ILE A 102 7.217 10.285 -7.873 1.00 0.00 C ATOM 230 CD1 ILE A 102 4.806 12.730 -7.746 1.00 0.00 C ATOM 0 H ILE A 102 5.437 11.995 -4.737 1.00 0.00 H new ATOM 0 HA ILE A 102 6.251 9.429 -5.496 1.00 0.00 H new ATOM 0 HB ILE A 102 7.041 12.092 -6.751 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.743 10.600 -7.857 1.00 0.00 H new ATOM 0 HG13 ILE A 102 4.465 11.246 -6.252 1.00 0.00 H new ATOM 0 HG21 ILE A 102 7.124 10.783 -8.838 1.00 0.00 H new ATOM 0 HG22 ILE A 102 8.272 10.164 -7.628 1.00 0.00 H new ATOM 0 HG23 ILE A 102 6.742 9.305 -7.923 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.744 12.831 -7.971 1.00 0.00 H new ATOM 0 HD12 ILE A 102 5.101 13.500 -7.033 1.00 0.00 H new ATOM 0 HD13 ILE A 102 5.383 12.845 -8.663 1.00 0.00 H new ATOM 242 N ARG A 103 8.634 11.430 -4.428 1.00 0.00 N ATOM 243 CA ARG A 103 10.026 11.486 -4.002 1.00 0.00 C ATOM 244 C ARG A 103 10.319 10.412 -2.960 1.00 0.00 C ATOM 245 O ARG A 103 11.316 9.695 -3.055 1.00 0.00 O ATOM 246 CB ARG A 103 10.346 12.870 -3.436 1.00 0.00 C ATOM 247 CG ARG A 103 11.321 13.665 -4.290 1.00 0.00 C ATOM 248 CD ARG A 103 12.514 14.147 -3.480 1.00 0.00 C ATOM 249 NE ARG A 103 13.119 15.345 -4.056 1.00 0.00 N ATOM 250 CZ ARG A 103 13.918 16.170 -3.384 1.00 0.00 C ATOM 251 NH1 ARG A 103 14.210 15.932 -2.111 1.00 0.00 N ATOM 252 NH2 ARG A 103 14.427 17.238 -3.984 1.00 0.00 N ATOM 0 H ARG A 103 8.096 12.271 -4.221 1.00 0.00 H new ATOM 0 HA ARG A 103 10.658 11.301 -4.870 1.00 0.00 H new ATOM 0 HB2 ARG A 103 9.420 13.435 -3.335 1.00 0.00 H new ATOM 0 HB3 ARG A 103 10.761 12.757 -2.435 1.00 0.00 H new ATOM 0 HG2 ARG A 103 11.669 13.046 -5.117 1.00 0.00 H new ATOM 0 HG3 ARG A 103 10.808 14.522 -4.727 1.00 0.00 H new ATOM 0 HD2 ARG A 103 12.198 14.356 -2.458 1.00 0.00 H new ATOM 0 HD3 ARG A 103 13.260 13.354 -3.427 1.00 0.00 H new ATOM 0 HE ARG A 103 12.917 15.562 -5.032 1.00 0.00 H new ATOM 0 HH11 ARG A 103 13.821 15.113 -1.643 1.00 0.00 H new ATOM 0 HH12 ARG A 103 14.823 16.568 -1.601 1.00 0.00 H new ATOM 0 HH21 ARG A 103 14.206 17.428 -4.962 1.00 0.00 H new ATOM 0 HH22 ARG A 103 15.039 17.870 -3.468 1.00 0.00 H new ATOM 266 N LEU A 104 9.444 10.306 -1.966 1.00 0.00 N ATOM 267 CA LEU A 104 9.609 9.318 -0.905 1.00 0.00 C ATOM 268 C LEU A 104 9.436 7.903 -1.447 1.00 0.00 C ATOM 269 O LEU A 104 10.191 6.998 -1.097 1.00 0.00 O ATOM 270 CB LEU A 104 8.601 9.574 0.219 1.00 0.00 C ATOM 271 CG LEU A 104 9.131 10.413 1.384 1.00 0.00 C ATOM 272 CD1 LEU A 104 9.693 11.733 0.878 1.00 0.00 C ATOM 273 CD2 LEU A 104 8.031 10.656 2.409 1.00 0.00 C ATOM 0 H LEU A 104 8.614 10.891 -1.872 1.00 0.00 H new ATOM 0 HA LEU A 104 10.619 9.413 -0.507 1.00 0.00 H new ATOM 0 HB2 LEU A 104 7.729 10.074 -0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 104 8.261 8.614 0.607 1.00 0.00 H new ATOM 0 HG LEU A 104 9.936 9.861 1.869 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.065 12.317 1.720 1.00 0.00 H new ATOM 0 HD12 LEU A 104 10.509 11.538 0.182 1.00 0.00 H new ATOM 0 HD13 LEU A 104 8.908 12.291 0.369 1.00 0.00 H new ATOM 0 HD21 LEU A 104 8.425 11.254 3.231 1.00 0.00 H new ATOM 0 HD22 LEU A 104 7.205 11.188 1.937 1.00 0.00 H new ATOM 0 HD23 LEU A 104 7.675 9.700 2.794 1.00 0.00 H new ATOM 285 N ALA A 105 8.438 7.722 -2.305 1.00 0.00 N ATOM 286 CA ALA A 105 8.166 6.416 -2.895 1.00 0.00 C ATOM 287 C ALA A 105 9.356 5.923 -3.712 1.00 0.00 C ATOM 288 O ALA A 105 9.629 4.724 -3.769 1.00 0.00 O ATOM 289 CB ALA A 105 6.920 6.481 -3.765 1.00 0.00 C ATOM 0 H ALA A 105 7.805 8.462 -2.607 1.00 0.00 H new ATOM 0 HA ALA A 105 7.996 5.707 -2.085 1.00 0.00 H new ATOM 0 HB1 ALA A 105 6.728 5.500 -4.199 1.00 0.00 H new ATOM 0 HB2 ALA A 105 6.067 6.782 -3.157 1.00 0.00 H new ATOM 0 HB3 ALA A 105 7.071 7.208 -4.563 1.00 0.00 H new ATOM 295 N ALA A 106 10.062 6.856 -4.344 1.00 0.00 N ATOM 296 CA ALA A 106 11.222 6.514 -5.159 1.00 0.00 C ATOM 297 C ALA A 106 12.409 6.117 -4.287 1.00 0.00 C ATOM 298 O ALA A 106 13.153 5.193 -4.619 1.00 0.00 O ATOM 299 CB ALA A 106 11.592 7.684 -6.062 1.00 0.00 C ATOM 0 H ALA A 106 9.851 7.853 -4.307 1.00 0.00 H new ATOM 0 HA ALA A 106 10.962 5.657 -5.780 1.00 0.00 H new ATOM 0 HB1 ALA A 106 12.459 7.417 -6.666 1.00 0.00 H new ATOM 0 HB2 ALA A 106 10.752 7.918 -6.716 1.00 0.00 H new ATOM 0 HB3 ALA A 106 11.829 8.555 -5.451 1.00 0.00 H new ATOM 305 N LEU A 107 12.581 6.819 -3.173 1.00 0.00 N ATOM 306 CA LEU A 107 13.676 6.542 -2.254 1.00 0.00 C ATOM 307 C LEU A 107 13.332 5.369 -1.338 1.00 0.00 C ATOM 308 O LEU A 107 14.214 4.632 -0.898 1.00 0.00 O ATOM 309 CB LEU A 107 13.994 7.790 -1.425 1.00 0.00 C ATOM 310 CG LEU A 107 14.840 7.548 -0.174 1.00 0.00 C ATOM 311 CD1 LEU A 107 16.175 6.921 -0.546 1.00 0.00 C ATOM 312 CD2 LEU A 107 15.052 8.849 0.586 1.00 0.00 C ATOM 0 H LEU A 107 11.974 7.586 -2.885 1.00 0.00 H new ATOM 0 HA LEU A 107 14.556 6.271 -2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 107 14.514 8.506 -2.062 1.00 0.00 H new ATOM 0 HB3 LEU A 107 13.055 8.255 -1.124 1.00 0.00 H new ATOM 0 HG LEU A 107 14.305 6.855 0.475 1.00 0.00 H new ATOM 0 HD11 LEU A 107 16.764 6.756 0.356 1.00 0.00 H new ATOM 0 HD12 LEU A 107 16.003 5.968 -1.046 1.00 0.00 H new ATOM 0 HD13 LEU A 107 16.717 7.589 -1.215 1.00 0.00 H new ATOM 0 HD21 LEU A 107 15.656 8.658 1.473 1.00 0.00 H new ATOM 0 HD22 LEU A 107 15.566 9.565 -0.055 1.00 0.00 H new ATOM 0 HD23 LEU A 107 14.087 9.257 0.885 1.00 0.00 H new ATOM 324 N TRP A 108 12.043 5.205 -1.053 1.00 0.00 N ATOM 325 CA TRP A 108 11.583 4.125 -0.188 1.00 0.00 C ATOM 326 C TRP A 108 11.775 2.761 -0.852 1.00 0.00 C ATOM 327 O TRP A 108 11.681 1.725 -0.193 1.00 0.00 O ATOM 328 CB TRP A 108 10.108 4.326 0.170 1.00 0.00 C ATOM 329 CG TRP A 108 9.876 5.445 1.141 1.00 0.00 C ATOM 330 CD1 TRP A 108 10.825 6.167 1.808 1.00 0.00 C ATOM 331 CD2 TRP A 108 8.609 5.972 1.554 1.00 0.00 C ATOM 332 NE1 TRP A 108 10.226 7.108 2.609 1.00 0.00 N ATOM 333 CE2 TRP A 108 8.867 7.008 2.470 1.00 0.00 C ATOM 334 CE3 TRP A 108 7.282 5.668 1.236 1.00 0.00 C ATOM 335 CZ2 TRP A 108 7.846 7.741 3.072 1.00 0.00 C ATOM 336 CZ3 TRP A 108 6.270 6.396 1.834 1.00 0.00 C ATOM 337 CH2 TRP A 108 6.557 7.422 2.743 1.00 0.00 C ATOM 0 H TRP A 108 11.300 5.806 -1.409 1.00 0.00 H new ATOM 0 HA TRP A 108 12.182 4.148 0.722 1.00 0.00 H new ATOM 0 HB2 TRP A 108 9.545 4.524 -0.742 1.00 0.00 H new ATOM 0 HB3 TRP A 108 9.715 3.401 0.593 1.00 0.00 H new ATOM 0 HD1 TRP A 108 11.891 6.019 1.718 1.00 0.00 H new ATOM 0 HE1 TRP A 108 10.714 7.773 3.209 1.00 0.00 H new ATOM 0 HE3 TRP A 108 7.051 4.879 0.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 8.065 8.533 3.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 5.241 6.170 1.596 1.00 0.00 H new ATOM 0 HH2 TRP A 108 5.744 7.973 3.193 1.00 0.00 H new ATOM 348 N GLY A 109 12.048 2.765 -2.154 1.00 0.00 N ATOM 349 CA GLY A 109 12.248 1.520 -2.872 1.00 0.00 C ATOM 350 C GLY A 109 10.998 1.056 -3.592 1.00 0.00 C ATOM 351 O GLY A 109 10.663 -0.129 -3.569 1.00 0.00 O ATOM 0 H GLY A 109 12.134 3.607 -2.723 1.00 0.00 H new ATOM 0 HA2 GLY A 109 13.053 1.647 -3.595 1.00 0.00 H new ATOM 0 HA3 GLY A 109 12.567 0.748 -2.172 1.00 0.00 H new ATOM 355 N VAL A 110 10.306 1.990 -4.236 1.00 0.00 N ATOM 356 CA VAL A 110 9.086 1.670 -4.969 1.00 0.00 C ATOM 357 C VAL A 110 9.255 1.940 -6.459 1.00 0.00 C ATOM 358 O VAL A 110 9.354 3.092 -6.884 1.00 0.00 O ATOM 359 CB VAL A 110 7.885 2.479 -4.444 1.00 0.00 C ATOM 360 CG1 VAL A 110 6.589 1.964 -5.051 1.00 0.00 C ATOM 361 CG2 VAL A 110 7.827 2.429 -2.925 1.00 0.00 C ATOM 0 H VAL A 110 10.569 2.975 -4.265 1.00 0.00 H new ATOM 0 HA VAL A 110 8.893 0.608 -4.814 1.00 0.00 H new ATOM 0 HB VAL A 110 8.013 3.519 -4.744 1.00 0.00 H new ATOM 0 HG11 VAL A 110 5.751 2.547 -4.669 1.00 0.00 H new ATOM 0 HG12 VAL A 110 6.632 2.059 -6.136 1.00 0.00 H new ATOM 0 HG13 VAL A 110 6.453 0.916 -4.784 1.00 0.00 H new ATOM 0 HG21 VAL A 110 6.972 3.007 -2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 110 7.724 1.394 -2.599 1.00 0.00 H new ATOM 0 HG23 VAL A 110 8.743 2.851 -2.512 1.00 0.00 H new ATOM 371 N ALA A 111 9.287 0.872 -7.249 1.00 0.00 N ATOM 372 CA ALA A 111 9.444 0.994 -8.693 1.00 0.00 C ATOM 373 C ALA A 111 8.166 0.595 -9.421 1.00 0.00 C ATOM 374 O ALA A 111 7.655 -0.510 -9.239 1.00 0.00 O ATOM 375 CB ALA A 111 10.612 0.144 -9.170 1.00 0.00 C ATOM 0 H ALA A 111 9.206 -0.088 -6.913 1.00 0.00 H new ATOM 0 HA ALA A 111 9.650 2.039 -8.923 1.00 0.00 H new ATOM 0 HB1 ALA A 111 10.718 0.244 -10.250 1.00 0.00 H new ATOM 0 HB2 ALA A 111 11.528 0.478 -8.683 1.00 0.00 H new ATOM 0 HB3 ALA A 111 10.428 -0.901 -8.919 1.00 0.00 H new ATOM 381 N LEU A 112 7.654 1.501 -10.248 1.00 0.00 N ATOM 382 CA LEU A 112 6.435 1.244 -11.006 1.00 0.00 C ATOM 383 C LEU A 112 6.687 1.378 -12.504 1.00 0.00 C ATOM 384 O LEU A 112 7.444 2.246 -12.940 1.00 0.00 O ATOM 385 CB LEU A 112 5.327 2.208 -10.576 1.00 0.00 C ATOM 386 CG LEU A 112 4.720 1.922 -9.199 1.00 0.00 C ATOM 387 CD1 LEU A 112 5.223 2.928 -8.173 1.00 0.00 C ATOM 388 CD2 LEU A 112 3.200 1.947 -9.270 1.00 0.00 C ATOM 0 H LEU A 112 8.065 2.420 -10.410 1.00 0.00 H new ATOM 0 HA LEU A 112 6.118 0.222 -10.798 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.727 3.222 -10.577 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.531 2.179 -11.320 1.00 0.00 H new ATOM 0 HG LEU A 112 5.034 0.926 -8.886 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.781 2.709 -7.201 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.309 2.862 -8.101 1.00 0.00 H new ATOM 0 HD13 LEU A 112 4.940 3.934 -8.481 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.786 1.742 -8.283 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.868 2.929 -9.606 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.856 1.188 -9.972 1.00 0.00 H new ATOM 400 N ARG A 113 6.050 0.515 -13.287 1.00 0.00 N ATOM 401 CA ARG A 113 6.206 0.537 -14.737 1.00 0.00 C ATOM 402 C ARG A 113 5.326 1.616 -15.362 1.00 0.00 C ATOM 403 O ARG A 113 5.673 2.196 -16.390 1.00 0.00 O ATOM 404 CB ARG A 113 5.861 -0.831 -15.329 1.00 0.00 C ATOM 405 CG ARG A 113 7.002 -1.457 -16.118 1.00 0.00 C ATOM 406 CD ARG A 113 7.226 -2.908 -15.722 1.00 0.00 C ATOM 407 NE ARG A 113 8.644 -3.256 -15.704 1.00 0.00 N ATOM 408 CZ ARG A 113 9.137 -4.328 -15.087 1.00 0.00 C ATOM 409 NH1 ARG A 113 8.330 -5.157 -14.436 1.00 0.00 N ATOM 410 NH2 ARG A 113 10.440 -4.573 -15.120 1.00 0.00 N ATOM 0 H ARG A 113 5.420 -0.209 -12.942 1.00 0.00 H new ATOM 0 HA ARG A 113 7.247 0.769 -14.963 1.00 0.00 H new ATOM 0 HB2 ARG A 113 5.575 -1.506 -14.522 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.993 -0.728 -15.980 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.782 -1.400 -17.184 1.00 0.00 H new ATOM 0 HG3 ARG A 113 7.916 -0.888 -15.950 1.00 0.00 H new ATOM 0 HD2 ARG A 113 6.796 -3.085 -14.736 1.00 0.00 H new ATOM 0 HD3 ARG A 113 6.701 -3.560 -16.420 1.00 0.00 H new ATOM 0 HE ARG A 113 9.295 -2.642 -16.193 1.00 0.00 H new ATOM 0 HH11 ARG A 113 7.327 -4.974 -14.407 1.00 0.00 H new ATOM 0 HH12 ARG A 113 8.713 -5.977 -13.965 1.00 0.00 H new ATOM 0 HH21 ARG A 113 11.066 -3.940 -15.618 1.00 0.00 H new ATOM 0 HH22 ARG A 113 10.817 -5.394 -14.647 1.00 0.00 H new ATOM 424 N GLU A 114 4.185 1.881 -14.733 1.00 0.00 N ATOM 425 CA GLU A 114 3.255 2.890 -15.227 1.00 0.00 C ATOM 426 C GLU A 114 2.749 3.770 -14.086 1.00 0.00 C ATOM 427 O GLU A 114 2.784 3.371 -12.922 1.00 0.00 O ATOM 428 CB GLU A 114 2.075 2.221 -15.938 1.00 0.00 C ATOM 429 CG GLU A 114 2.034 2.493 -17.433 1.00 0.00 C ATOM 430 CD GLU A 114 0.708 3.075 -17.885 1.00 0.00 C ATOM 431 OE1 GLU A 114 -0.343 2.496 -17.538 1.00 0.00 O ATOM 432 OE2 GLU A 114 0.721 4.108 -18.587 1.00 0.00 O ATOM 0 H GLU A 114 3.882 1.411 -13.880 1.00 0.00 H new ATOM 0 HA GLU A 114 3.786 3.522 -15.938 1.00 0.00 H new ATOM 0 HB2 GLU A 114 2.125 1.145 -15.774 1.00 0.00 H new ATOM 0 HB3 GLU A 114 1.145 2.569 -15.488 1.00 0.00 H new ATOM 0 HG2 GLU A 114 2.837 3.182 -17.695 1.00 0.00 H new ATOM 0 HG3 GLU A 114 2.222 1.565 -17.973 1.00 0.00 H new ATOM 439 N PRO A 115 2.272 4.985 -14.407 1.00 0.00 N ATOM 440 CA PRO A 115 1.759 5.922 -13.402 1.00 0.00 C ATOM 441 C PRO A 115 0.706 5.285 -12.501 1.00 0.00 C ATOM 442 O PRO A 115 0.381 4.106 -12.646 1.00 0.00 O ATOM 443 CB PRO A 115 1.136 7.040 -14.243 1.00 0.00 C ATOM 444 CG PRO A 115 1.864 6.987 -15.541 1.00 0.00 C ATOM 445 CD PRO A 115 2.195 5.539 -15.772 1.00 0.00 C ATOM 0 HA PRO A 115 2.543 6.264 -12.727 1.00 0.00 H new ATOM 0 HB2 PRO A 115 0.067 6.882 -14.382 1.00 0.00 H new ATOM 0 HB3 PRO A 115 1.255 8.011 -13.762 1.00 0.00 H new ATOM 0 HG2 PRO A 115 1.248 7.380 -16.350 1.00 0.00 H new ATOM 0 HG3 PRO A 115 2.769 7.593 -15.506 1.00 0.00 H new ATOM 0 HD2 PRO A 115 1.428 5.041 -16.365 1.00 0.00 H new ATOM 0 HD3 PRO A 115 3.138 5.422 -16.307 1.00 0.00 H new ATOM 453 N VAL A 116 0.176 6.072 -11.571 1.00 0.00 N ATOM 454 CA VAL A 116 -0.840 5.585 -10.646 1.00 0.00 C ATOM 455 C VAL A 116 -2.243 5.901 -11.157 1.00 0.00 C ATOM 456 O VAL A 116 -2.466 6.933 -11.790 1.00 0.00 O ATOM 457 CB VAL A 116 -0.661 6.195 -9.241 1.00 0.00 C ATOM 458 CG1 VAL A 116 -0.784 7.711 -9.293 1.00 0.00 C ATOM 459 CG2 VAL A 116 -1.668 5.602 -8.267 1.00 0.00 C ATOM 0 H VAL A 116 0.433 7.050 -11.438 1.00 0.00 H new ATOM 0 HA VAL A 116 -0.717 4.504 -10.579 1.00 0.00 H new ATOM 0 HB VAL A 116 0.340 5.949 -8.886 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -0.655 8.121 -8.291 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -0.017 8.116 -9.953 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -1.769 7.983 -9.672 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -1.525 6.045 -7.281 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -2.679 5.812 -8.616 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -1.522 4.524 -8.204 1.00 0.00 H new ATOM 469 N THR A 117 -3.185 5.007 -10.877 1.00 0.00 N ATOM 470 CA THR A 117 -4.566 5.191 -11.307 1.00 0.00 C ATOM 471 C THR A 117 -5.463 5.537 -10.123 1.00 0.00 C ATOM 472 O THR A 117 -5.071 5.380 -8.967 1.00 0.00 O ATOM 473 CB THR A 117 -5.079 3.927 -12.001 1.00 0.00 C ATOM 474 OG1 THR A 117 -4.363 2.787 -11.558 1.00 0.00 O ATOM 475 CG2 THR A 117 -4.965 3.984 -13.508 1.00 0.00 C ATOM 0 H THR A 117 -3.017 4.147 -10.354 1.00 0.00 H new ATOM 0 HA THR A 117 -4.593 6.020 -12.014 1.00 0.00 H new ATOM 0 HB THR A 117 -6.134 3.859 -11.736 1.00 0.00 H new ATOM 0 HG1 THR A 117 -4.706 1.989 -12.011 1.00 0.00 H new ATOM 0 HG21 THR A 117 -5.346 3.057 -13.937 1.00 0.00 H new ATOM 0 HG22 THR A 117 -5.547 4.825 -13.885 1.00 0.00 H new ATOM 0 HG23 THR A 117 -3.920 4.111 -13.789 1.00 0.00 H new ATOM 483 N THR A 118 -6.670 6.008 -10.420 1.00 0.00 N ATOM 484 CA THR A 118 -7.624 6.378 -9.380 1.00 0.00 C ATOM 485 C THR A 118 -7.960 5.179 -8.499 1.00 0.00 C ATOM 486 O THR A 118 -8.158 5.319 -7.292 1.00 0.00 O ATOM 487 CB THR A 118 -8.900 6.939 -10.006 1.00 0.00 C ATOM 488 OG1 THR A 118 -9.335 6.121 -11.077 1.00 0.00 O ATOM 489 CG2 THR A 118 -8.735 8.346 -10.540 1.00 0.00 C ATOM 0 H THR A 118 -7.011 6.143 -11.372 1.00 0.00 H new ATOM 0 HA THR A 118 -7.165 7.146 -8.757 1.00 0.00 H new ATOM 0 HB THR A 118 -9.634 6.957 -9.200 1.00 0.00 H new ATOM 0 HG1 THR A 118 -10.154 6.496 -11.463 1.00 0.00 H new ATOM 0 HG21 THR A 118 -9.677 8.684 -10.971 1.00 0.00 H new ATOM 0 HG22 THR A 118 -8.448 9.012 -9.727 1.00 0.00 H new ATOM 0 HG23 THR A 118 -7.961 8.355 -11.307 1.00 0.00 H new ATOM 497 N GLU A 119 -8.025 4.001 -9.110 1.00 0.00 N ATOM 498 CA GLU A 119 -8.337 2.776 -8.381 1.00 0.00 C ATOM 499 C GLU A 119 -7.282 2.493 -7.317 1.00 0.00 C ATOM 500 O GLU A 119 -7.581 1.924 -6.268 1.00 0.00 O ATOM 501 CB GLU A 119 -8.436 1.593 -9.345 1.00 0.00 C ATOM 502 CG GLU A 119 -7.183 1.385 -10.181 1.00 0.00 C ATOM 503 CD GLU A 119 -6.874 -0.082 -10.412 1.00 0.00 C ATOM 504 OE1 GLU A 119 -7.827 -0.887 -10.470 1.00 0.00 O ATOM 505 OE2 GLU A 119 -5.679 -0.424 -10.535 1.00 0.00 O ATOM 0 H GLU A 119 -7.866 3.868 -10.109 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.299 2.913 -7.887 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.638 0.686 -8.775 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.286 1.747 -10.010 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.306 1.883 -11.143 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -6.336 1.857 -9.683 1.00 0.00 H new ATOM 512 N GLU A 120 -6.046 2.896 -7.594 1.00 0.00 N ATOM 513 CA GLU A 120 -4.946 2.686 -6.661 1.00 0.00 C ATOM 514 C GLU A 120 -5.104 3.571 -5.429 1.00 0.00 C ATOM 515 O GLU A 120 -5.000 3.101 -4.297 1.00 0.00 O ATOM 516 CB GLU A 120 -3.608 2.977 -7.344 1.00 0.00 C ATOM 517 CG GLU A 120 -2.486 2.053 -6.901 1.00 0.00 C ATOM 518 CD GLU A 120 -1.314 2.057 -7.863 1.00 0.00 C ATOM 519 OE1 GLU A 120 -0.604 3.082 -7.930 1.00 0.00 O ATOM 520 OE2 GLU A 120 -1.107 1.034 -8.550 1.00 0.00 O ATOM 0 H GLU A 120 -5.782 3.370 -8.458 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.964 1.643 -6.343 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.734 2.891 -8.423 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.321 4.008 -7.138 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.141 2.355 -5.912 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -2.872 1.038 -6.808 1.00 0.00 H new ATOM 527 N LEU A 121 -5.358 4.856 -5.659 1.00 0.00 N ATOM 528 CA LEU A 121 -5.532 5.808 -4.568 1.00 0.00 C ATOM 529 C LEU A 121 -6.826 5.531 -3.809 1.00 0.00 C ATOM 530 O LEU A 121 -6.861 5.587 -2.580 1.00 0.00 O ATOM 531 CB LEU A 121 -5.535 7.240 -5.110 1.00 0.00 C ATOM 532 CG LEU A 121 -4.338 8.093 -4.690 1.00 0.00 C ATOM 533 CD1 LEU A 121 -3.040 7.477 -5.190 1.00 0.00 C ATOM 534 CD2 LEU A 121 -4.490 9.516 -5.210 1.00 0.00 C ATOM 0 H LEU A 121 -5.448 5.261 -6.591 1.00 0.00 H new ATOM 0 HA LEU A 121 -4.697 5.693 -3.877 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -5.569 7.200 -6.199 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -6.448 7.735 -4.780 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.304 8.126 -3.601 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -2.200 8.099 -4.881 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -2.926 6.478 -4.770 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -3.063 7.413 -6.278 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.629 10.110 -4.902 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.550 9.501 -6.298 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -5.400 9.957 -4.802 1.00 0.00 H new ATOM 546 N ALA A 122 -7.888 5.230 -4.549 1.00 0.00 N ATOM 547 CA ALA A 122 -9.184 4.942 -3.946 1.00 0.00 C ATOM 548 C ALA A 122 -9.109 3.712 -3.048 1.00 0.00 C ATOM 549 O ALA A 122 -9.711 3.677 -1.976 1.00 0.00 O ATOM 550 CB ALA A 122 -10.237 4.746 -5.028 1.00 0.00 C ATOM 0 H ALA A 122 -7.876 5.179 -5.568 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.468 5.794 -3.328 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -11.200 4.532 -4.564 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.317 5.653 -5.627 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.949 3.912 -5.669 1.00 0.00 H new ATOM 556 N SER A 123 -8.363 2.706 -3.493 1.00 0.00 N ATOM 557 CA SER A 123 -8.208 1.474 -2.728 1.00 0.00 C ATOM 558 C SER A 123 -7.470 1.738 -1.419 1.00 0.00 C ATOM 559 O SER A 123 -7.919 1.328 -0.349 1.00 0.00 O ATOM 560 CB SER A 123 -7.452 0.430 -3.552 1.00 0.00 C ATOM 561 OG SER A 123 -8.349 -0.395 -4.276 1.00 0.00 O ATOM 0 H SER A 123 -7.857 2.720 -4.378 1.00 0.00 H new ATOM 0 HA SER A 123 -9.202 1.092 -2.494 1.00 0.00 H new ATOM 0 HB2 SER A 123 -6.774 0.930 -4.244 1.00 0.00 H new ATOM 0 HB3 SER A 123 -6.839 -0.185 -2.892 1.00 0.00 H new ATOM 0 HG SER A 123 -7.841 -1.053 -4.796 1.00 0.00 H new ATOM 567 N PHE A 124 -6.337 2.425 -1.512 1.00 0.00 N ATOM 568 CA PHE A 124 -5.537 2.745 -0.336 1.00 0.00 C ATOM 569 C PHE A 124 -6.337 3.586 0.653 1.00 0.00 C ATOM 570 O PHE A 124 -6.338 3.318 1.854 1.00 0.00 O ATOM 571 CB PHE A 124 -4.264 3.489 -0.745 1.00 0.00 C ATOM 572 CG PHE A 124 -3.237 3.571 0.347 1.00 0.00 C ATOM 573 CD1 PHE A 124 -2.592 2.429 0.797 1.00 0.00 C ATOM 574 CD2 PHE A 124 -2.916 4.789 0.924 1.00 0.00 C ATOM 575 CE1 PHE A 124 -1.647 2.503 1.802 1.00 0.00 C ATOM 576 CE2 PHE A 124 -1.970 4.868 1.928 1.00 0.00 C ATOM 577 CZ PHE A 124 -1.335 3.723 2.368 1.00 0.00 C ATOM 0 H PHE A 124 -5.952 2.771 -2.391 1.00 0.00 H new ATOM 0 HA PHE A 124 -5.261 1.809 0.150 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -3.824 2.991 -1.609 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -4.529 4.498 -1.060 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -2.831 1.472 0.357 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -3.411 5.687 0.585 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -1.152 1.606 2.145 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -1.727 5.824 2.368 1.00 0.00 H new ATOM 0 HZ PHE A 124 -0.596 3.782 3.153 1.00 0.00 H new ATOM 587 N ILE A 125 -7.018 4.606 0.137 1.00 0.00 N ATOM 588 CA ILE A 125 -7.824 5.487 0.973 1.00 0.00 C ATOM 589 C ILE A 125 -9.052 4.759 1.510 1.00 0.00 C ATOM 590 O ILE A 125 -9.512 5.032 2.619 1.00 0.00 O ATOM 591 CB ILE A 125 -8.279 6.738 0.195 1.00 0.00 C ATOM 592 CG1 ILE A 125 -7.080 7.421 -0.465 1.00 0.00 C ATOM 593 CG2 ILE A 125 -9.001 7.706 1.122 1.00 0.00 C ATOM 594 CD1 ILE A 125 -7.427 8.139 -1.751 1.00 0.00 C ATOM 0 H ILE A 125 -7.027 4.842 -0.855 1.00 0.00 H new ATOM 0 HA ILE A 125 -7.195 5.798 1.807 1.00 0.00 H new ATOM 0 HB ILE A 125 -8.972 6.427 -0.587 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -6.648 8.136 0.236 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -6.314 6.673 -0.671 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -9.316 8.584 0.558 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -9.876 7.216 1.549 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -8.329 8.012 1.924 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -6.530 8.600 -2.164 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -7.831 7.425 -2.469 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -8.170 8.910 -1.548 1.00 0.00 H new ATOM 606 N ALA A 126 -9.577 3.831 0.718 1.00 0.00 N ATOM 607 CA ALA A 126 -10.752 3.063 1.113 1.00 0.00 C ATOM 608 C ALA A 126 -10.491 2.286 2.399 1.00 0.00 C ATOM 609 O ALA A 126 -11.238 2.402 3.370 1.00 0.00 O ATOM 610 CB ALA A 126 -11.163 2.116 -0.003 1.00 0.00 C ATOM 0 H ALA A 126 -9.207 3.592 -0.202 1.00 0.00 H new ATOM 0 HA ALA A 126 -11.567 3.762 1.300 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -12.041 1.549 0.306 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -11.398 2.690 -0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -10.344 1.429 -0.217 1.00 0.00 H new ATOM 616 N TYR A 127 -9.424 1.493 2.399 1.00 0.00 N ATOM 617 CA TYR A 127 -9.064 0.696 3.566 1.00 0.00 C ATOM 618 C TYR A 127 -8.617 1.591 4.717 1.00 0.00 C ATOM 619 O TYR A 127 -8.852 1.282 5.885 1.00 0.00 O ATOM 620 CB TYR A 127 -7.952 -0.292 3.210 1.00 0.00 C ATOM 621 CG TYR A 127 -8.115 -1.649 3.859 1.00 0.00 C ATOM 622 CD1 TYR A 127 -7.590 -1.905 5.120 1.00 0.00 C ATOM 623 CD2 TYR A 127 -8.794 -2.673 3.211 1.00 0.00 C ATOM 624 CE1 TYR A 127 -7.737 -3.142 5.716 1.00 0.00 C ATOM 625 CE2 TYR A 127 -8.946 -3.914 3.801 1.00 0.00 C ATOM 626 CZ TYR A 127 -8.415 -4.143 5.053 1.00 0.00 C ATOM 627 OH TYR A 127 -8.564 -5.376 5.644 1.00 0.00 O ATOM 0 H TYR A 127 -8.794 1.385 1.604 1.00 0.00 H new ATOM 0 HA TYR A 127 -9.946 0.140 3.883 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -7.922 -0.418 2.128 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -6.993 0.131 3.508 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -7.058 -1.124 5.643 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -9.210 -2.497 2.230 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -7.323 -3.324 6.697 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -9.477 -4.700 3.284 1.00 0.00 H new ATOM 0 HH TYR A 127 -9.067 -5.967 5.045 1.00 0.00 H new ATOM 637 N TRP A 128 -7.970 2.702 4.379 1.00 0.00 N ATOM 638 CA TRP A 128 -7.489 3.643 5.384 1.00 0.00 C ATOM 639 C TRP A 128 -8.658 4.326 6.090 1.00 0.00 C ATOM 640 O TRP A 128 -8.624 4.537 7.303 1.00 0.00 O ATOM 641 CB TRP A 128 -6.578 4.689 4.732 1.00 0.00 C ATOM 642 CG TRP A 128 -6.198 5.816 5.645 1.00 0.00 C ATOM 643 CD1 TRP A 128 -6.192 7.148 5.341 1.00 0.00 C ATOM 644 CD2 TRP A 128 -5.769 5.714 7.008 1.00 0.00 C ATOM 645 NE1 TRP A 128 -5.786 7.878 6.432 1.00 0.00 N ATOM 646 CE2 TRP A 128 -5.521 7.021 7.467 1.00 0.00 C ATOM 647 CE3 TRP A 128 -5.571 4.643 7.886 1.00 0.00 C ATOM 648 CZ2 TRP A 128 -5.086 7.286 8.764 1.00 0.00 C ATOM 649 CZ3 TRP A 128 -5.139 4.908 9.173 1.00 0.00 C ATOM 650 CH2 TRP A 128 -4.902 6.220 9.600 1.00 0.00 C ATOM 0 H TRP A 128 -7.767 2.973 3.417 1.00 0.00 H new ATOM 0 HA TRP A 128 -6.917 3.090 6.129 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -5.671 4.198 4.380 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -7.080 5.098 3.855 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -6.466 7.566 4.384 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -5.696 8.894 6.466 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -5.752 3.628 7.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.901 8.297 9.097 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -4.982 4.089 9.860 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -4.567 6.394 10.612 1.00 0.00 H new ATOM 661 N GLN A 129 -9.689 4.670 5.325 1.00 0.00 N ATOM 662 CA GLN A 129 -10.866 5.327 5.881 1.00 0.00 C ATOM 663 C GLN A 129 -11.743 4.331 6.631 1.00 0.00 C ATOM 664 O GLN A 129 -12.352 4.667 7.647 1.00 0.00 O ATOM 665 CB GLN A 129 -11.674 6.000 4.770 1.00 0.00 C ATOM 666 CG GLN A 129 -12.734 6.959 5.287 1.00 0.00 C ATOM 667 CD GLN A 129 -13.473 7.669 4.169 1.00 0.00 C ATOM 668 OE1 GLN A 129 -13.974 7.036 3.239 1.00 0.00 O ATOM 669 NE2 GLN A 129 -13.543 8.992 4.254 1.00 0.00 N ATOM 0 H GLN A 129 -9.733 4.505 4.319 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.527 6.087 6.585 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -10.993 6.543 4.114 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -12.155 5.232 4.165 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.449 6.409 5.898 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -12.264 7.699 5.935 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -13.113 9.476 5.043 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -14.026 9.525 3.531 1.00 0.00 H new ATOM 678 N ALA A 130 -11.802 3.103 6.125 1.00 0.00 N ATOM 679 CA ALA A 130 -12.603 2.058 6.749 1.00 0.00 C ATOM 680 C ALA A 130 -11.919 1.514 7.998 1.00 0.00 C ATOM 681 O ALA A 130 -12.581 1.100 8.950 1.00 0.00 O ATOM 682 CB ALA A 130 -12.867 0.934 5.757 1.00 0.00 C ATOM 0 H ALA A 130 -11.304 2.808 5.285 1.00 0.00 H new ATOM 0 HA ALA A 130 -13.555 2.494 7.050 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -13.466 0.160 6.236 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -13.405 1.328 4.895 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -11.919 0.508 5.429 1.00 0.00 H new ATOM 688 N GLU A 131 -10.590 1.519 7.987 1.00 0.00 N ATOM 689 CA GLU A 131 -9.813 1.026 9.119 1.00 0.00 C ATOM 690 C GLU A 131 -10.011 1.916 10.343 1.00 0.00 C ATOM 691 O GLU A 131 -10.216 1.424 11.453 1.00 0.00 O ATOM 692 CB GLU A 131 -8.329 0.961 8.755 1.00 0.00 C ATOM 693 CG GLU A 131 -7.882 -0.407 8.267 1.00 0.00 C ATOM 694 CD GLU A 131 -7.236 -1.233 9.362 1.00 0.00 C ATOM 695 OE1 GLU A 131 -6.415 -0.676 10.121 1.00 0.00 O ATOM 696 OE2 GLU A 131 -7.552 -2.437 9.461 1.00 0.00 O ATOM 0 H GLU A 131 -10.028 1.859 7.206 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.165 0.023 9.361 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.121 1.700 7.981 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.737 1.238 9.627 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.742 -0.946 7.870 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -7.176 -0.283 7.446 1.00 0.00 H new ATOM 703 N GLY A 132 -9.947 3.226 10.133 1.00 0.00 N ATOM 704 CA GLY A 132 -10.120 4.162 11.229 1.00 0.00 C ATOM 705 C GLY A 132 -9.090 3.967 12.324 1.00 0.00 C ATOM 706 O GLY A 132 -9.387 4.153 13.504 1.00 0.00 O ATOM 0 H GLY A 132 -9.778 3.657 9.224 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -10.052 5.181 10.847 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -11.119 4.045 11.649 1.00 0.00 H new ATOM 710 N LYS A 133 -7.876 3.590 11.932 1.00 0.00 N ATOM 711 CA LYS A 133 -6.799 3.369 12.887 1.00 0.00 C ATOM 712 C LYS A 133 -5.721 4.441 12.747 1.00 0.00 C ATOM 713 O LYS A 133 -5.950 5.486 12.138 1.00 0.00 O ATOM 714 CB LYS A 133 -6.191 1.978 12.682 1.00 0.00 C ATOM 715 CG LYS A 133 -5.977 1.209 13.977 1.00 0.00 C ATOM 716 CD LYS A 133 -5.788 -0.276 13.716 1.00 0.00 C ATOM 717 CE LYS A 133 -7.063 -1.057 13.991 1.00 0.00 C ATOM 718 NZ LYS A 133 -6.907 -2.504 13.677 1.00 0.00 N ATOM 0 H LYS A 133 -7.615 3.432 10.959 1.00 0.00 H new ATOM 0 HA LYS A 133 -7.214 3.431 13.893 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -6.843 1.398 12.029 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -5.235 2.081 12.168 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -5.103 1.603 14.495 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -6.832 1.358 14.636 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -5.483 -0.429 12.681 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -4.984 -0.658 14.345 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -7.341 -0.941 15.039 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -7.878 -0.643 13.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -7.798 -3.001 13.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -6.667 -2.617 12.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -6.147 -2.906 14.262 1.00 0.00 H new ATOM 732 N VAL A 134 -4.549 4.176 13.313 1.00 0.00 N ATOM 733 CA VAL A 134 -3.438 5.116 13.251 1.00 0.00 C ATOM 734 C VAL A 134 -2.141 4.407 12.876 1.00 0.00 C ATOM 735 O VAL A 134 -1.889 3.283 13.311 1.00 0.00 O ATOM 736 CB VAL A 134 -3.240 5.848 14.594 1.00 0.00 C ATOM 737 CG1 VAL A 134 -2.366 7.077 14.410 1.00 0.00 C ATOM 738 CG2 VAL A 134 -4.583 6.229 15.202 1.00 0.00 C ATOM 0 H VAL A 134 -4.344 3.316 13.821 1.00 0.00 H new ATOM 0 HA VAL A 134 -3.687 5.848 12.483 1.00 0.00 H new ATOM 0 HB VAL A 134 -2.735 5.170 15.282 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -2.238 7.580 15.369 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -1.392 6.776 14.025 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -2.840 7.758 13.704 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -4.421 6.744 16.149 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -5.119 6.887 14.518 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -5.172 5.329 15.375 1.00 0.00 H new ATOM 748 N PHE A 135 -1.321 5.069 12.066 1.00 0.00 N ATOM 749 CA PHE A 135 -0.049 4.500 11.635 1.00 0.00 C ATOM 750 C PHE A 135 1.093 5.486 11.857 1.00 0.00 C ATOM 751 O PHE A 135 0.867 6.683 12.033 1.00 0.00 O ATOM 752 CB PHE A 135 -0.114 4.107 10.157 1.00 0.00 C ATOM 753 CG PHE A 135 -1.336 3.312 9.795 1.00 0.00 C ATOM 754 CD1 PHE A 135 -1.788 2.293 10.619 1.00 0.00 C ATOM 755 CD2 PHE A 135 -2.034 3.582 8.628 1.00 0.00 C ATOM 756 CE1 PHE A 135 -2.911 1.560 10.288 1.00 0.00 C ATOM 757 CE2 PHE A 135 -3.158 2.852 8.291 1.00 0.00 C ATOM 758 CZ PHE A 135 -3.596 1.840 9.122 1.00 0.00 C ATOM 0 H PHE A 135 -1.514 5.999 11.695 1.00 0.00 H new ATOM 0 HA PHE A 135 0.140 3.609 12.234 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -0.087 5.011 9.549 1.00 0.00 H new ATOM 0 HB3 PHE A 135 0.774 3.526 9.906 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -1.255 2.069 11.531 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -1.695 4.372 7.974 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -3.253 0.770 10.940 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -3.693 3.073 7.379 1.00 0.00 H new ATOM 0 HZ PHE A 135 -4.474 1.268 8.860 1.00 0.00 H new ATOM 768 N HIS A 136 2.319 4.975 11.846 1.00 0.00 N ATOM 769 CA HIS A 136 3.498 5.809 12.045 1.00 0.00 C ATOM 770 C HIS A 136 4.127 6.181 10.706 1.00 0.00 C ATOM 771 O HIS A 136 3.648 5.771 9.650 1.00 0.00 O ATOM 772 CB HIS A 136 4.523 5.084 12.918 1.00 0.00 C ATOM 773 CG HIS A 136 4.448 5.458 14.365 1.00 0.00 C ATOM 774 ND1 HIS A 136 4.910 6.660 14.858 1.00 0.00 N ATOM 775 CD2 HIS A 136 3.961 4.779 15.431 1.00 0.00 C ATOM 776 CE1 HIS A 136 4.711 6.704 16.164 1.00 0.00 C ATOM 777 NE2 HIS A 136 4.137 5.575 16.535 1.00 0.00 N ATOM 0 H HIS A 136 2.522 3.986 11.701 1.00 0.00 H new ATOM 0 HA HIS A 136 3.186 6.723 12.550 1.00 0.00 H new ATOM 0 HB2 HIS A 136 4.375 4.009 12.821 1.00 0.00 H new ATOM 0 HB3 HIS A 136 5.524 5.302 12.546 1.00 0.00 H new ATOM 0 HD2 HIS A 136 3.517 3.795 15.415 1.00 0.00 H new ATOM 0 HE1 HIS A 136 4.973 7.524 16.816 1.00 0.00 H new ATOM 0 HE2 HIS A 136 3.868 5.333 17.489 1.00 0.00 H new ATOM 786 N HIS A 137 5.203 6.960 10.758 1.00 0.00 N ATOM 787 CA HIS A 137 5.893 7.382 9.544 1.00 0.00 C ATOM 788 C HIS A 137 6.576 6.195 8.870 1.00 0.00 C ATOM 789 O HIS A 137 6.442 5.997 7.662 1.00 0.00 O ATOM 790 CB HIS A 137 6.917 8.476 9.860 1.00 0.00 C ATOM 791 CG HIS A 137 7.998 8.048 10.804 1.00 0.00 C ATOM 792 ND1 HIS A 137 9.325 7.958 10.437 1.00 0.00 N ATOM 793 CD2 HIS A 137 7.949 7.698 12.112 1.00 0.00 C ATOM 794 CE1 HIS A 137 10.042 7.570 11.476 1.00 0.00 C ATOM 795 NE2 HIS A 137 9.232 7.405 12.504 1.00 0.00 N ATOM 0 H HIS A 137 5.614 7.310 11.623 1.00 0.00 H new ATOM 0 HA HIS A 137 5.152 7.788 8.856 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.374 8.811 8.929 1.00 0.00 H new ATOM 0 HB3 HIS A 137 6.396 9.334 10.286 1.00 0.00 H new ATOM 0 HD2 HIS A 137 7.065 7.657 12.731 1.00 0.00 H new ATOM 0 HE1 HIS A 137 11.111 7.414 11.483 1.00 0.00 H new ATOM 0 HE2 HIS A 137 9.513 7.108 13.438 1.00 0.00 H new ATOM 804 N VAL A 138 7.297 5.402 9.657 1.00 0.00 N ATOM 805 CA VAL A 138 7.987 4.231 9.130 1.00 0.00 C ATOM 806 C VAL A 138 6.989 3.158 8.713 1.00 0.00 C ATOM 807 O VAL A 138 7.187 2.462 7.717 1.00 0.00 O ATOM 808 CB VAL A 138 8.962 3.633 10.163 1.00 0.00 C ATOM 809 CG1 VAL A 138 9.759 2.491 9.549 1.00 0.00 C ATOM 810 CG2 VAL A 138 9.891 4.706 10.707 1.00 0.00 C ATOM 0 H VAL A 138 7.418 5.549 10.659 1.00 0.00 H new ATOM 0 HA VAL A 138 8.555 4.562 8.261 1.00 0.00 H new ATOM 0 HB VAL A 138 8.379 3.234 10.993 1.00 0.00 H new ATOM 0 HG11 VAL A 138 10.442 2.082 10.294 1.00 0.00 H new ATOM 0 HG12 VAL A 138 9.077 1.710 9.214 1.00 0.00 H new ATOM 0 HG13 VAL A 138 10.330 2.862 8.698 1.00 0.00 H new ATOM 0 HG21 VAL A 138 10.571 4.263 11.435 1.00 0.00 H new ATOM 0 HG22 VAL A 138 10.466 5.138 9.888 1.00 0.00 H new ATOM 0 HG23 VAL A 138 9.302 5.487 11.189 1.00 0.00 H new ATOM 820 N GLN A 139 5.913 3.030 9.483 1.00 0.00 N ATOM 821 CA GLN A 139 4.880 2.042 9.199 1.00 0.00 C ATOM 822 C GLN A 139 4.110 2.406 7.934 1.00 0.00 C ATOM 823 O GLN A 139 3.727 1.533 7.156 1.00 0.00 O ATOM 824 CB GLN A 139 3.917 1.928 10.382 1.00 0.00 C ATOM 825 CG GLN A 139 3.136 0.625 10.410 1.00 0.00 C ATOM 826 CD GLN A 139 4.034 -0.596 10.341 1.00 0.00 C ATOM 827 OE1 GLN A 139 4.446 -1.137 11.366 1.00 0.00 O ATOM 828 NE2 GLN A 139 4.341 -1.035 9.126 1.00 0.00 N ATOM 0 H GLN A 139 5.734 3.600 10.310 1.00 0.00 H new ATOM 0 HA GLN A 139 5.366 1.080 9.040 1.00 0.00 H new ATOM 0 HB2 GLN A 139 4.482 2.023 11.309 1.00 0.00 H new ATOM 0 HB3 GLN A 139 3.215 2.761 10.350 1.00 0.00 H new ATOM 0 HG2 GLN A 139 2.541 0.582 11.322 1.00 0.00 H new ATOM 0 HG3 GLN A 139 2.438 0.606 9.573 1.00 0.00 H new ATOM 0 HE21 GLN A 139 3.977 -0.555 8.303 1.00 0.00 H new ATOM 0 HE22 GLN A 139 4.941 -1.852 9.016 1.00 0.00 H new ATOM 837 N TRP A 140 3.887 3.700 7.736 1.00 0.00 N ATOM 838 CA TRP A 140 3.162 4.181 6.565 1.00 0.00 C ATOM 839 C TRP A 140 3.956 3.923 5.290 1.00 0.00 C ATOM 840 O TRP A 140 3.408 3.463 4.288 1.00 0.00 O ATOM 841 CB TRP A 140 2.865 5.675 6.698 1.00 0.00 C ATOM 842 CG TRP A 140 1.777 6.149 5.784 1.00 0.00 C ATOM 843 CD1 TRP A 140 0.431 6.008 5.969 1.00 0.00 C ATOM 844 CD2 TRP A 140 1.940 6.837 4.539 1.00 0.00 C ATOM 845 NE1 TRP A 140 -0.250 6.568 4.917 1.00 0.00 N ATOM 846 CE2 TRP A 140 0.653 7.083 4.025 1.00 0.00 C ATOM 847 CE3 TRP A 140 3.052 7.271 3.809 1.00 0.00 C ATOM 848 CZ2 TRP A 140 0.448 7.743 2.816 1.00 0.00 C ATOM 849 CZ3 TRP A 140 2.846 7.925 2.609 1.00 0.00 C ATOM 850 CH2 TRP A 140 1.552 8.156 2.123 1.00 0.00 C ATOM 0 H TRP A 140 4.198 4.435 8.371 1.00 0.00 H new ATOM 0 HA TRP A 140 2.221 3.635 6.504 1.00 0.00 H new ATOM 0 HB2 TRP A 140 2.584 5.892 7.729 1.00 0.00 H new ATOM 0 HB3 TRP A 140 3.775 6.239 6.491 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -0.030 5.526 6.819 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -1.265 6.596 4.816 1.00 0.00 H new ATOM 0 HE3 TRP A 140 4.053 7.098 4.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -0.548 7.922 2.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 3.697 8.264 2.036 1.00 0.00 H new ATOM 0 HH2 TRP A 140 1.424 8.671 1.182 1.00 0.00 H new ATOM 861 N GLN A 141 5.250 4.224 5.331 1.00 0.00 N ATOM 862 CA GLN A 141 6.117 4.026 4.176 1.00 0.00 C ATOM 863 C GLN A 141 6.350 2.541 3.914 1.00 0.00 C ATOM 864 O GLN A 141 6.555 2.127 2.772 1.00 0.00 O ATOM 865 CB GLN A 141 7.456 4.731 4.392 1.00 0.00 C ATOM 866 CG GLN A 141 8.205 4.251 5.625 1.00 0.00 C ATOM 867 CD GLN A 141 9.579 4.879 5.754 1.00 0.00 C ATOM 868 OE1 GLN A 141 10.571 4.189 5.985 1.00 0.00 O ATOM 869 NE2 GLN A 141 9.643 6.197 5.605 1.00 0.00 N ATOM 0 H GLN A 141 5.721 4.606 6.151 1.00 0.00 H new ATOM 0 HA GLN A 141 5.621 4.456 3.306 1.00 0.00 H new ATOM 0 HB2 GLN A 141 8.083 4.578 3.514 1.00 0.00 H new ATOM 0 HB3 GLN A 141 7.283 5.804 4.477 1.00 0.00 H new ATOM 0 HG2 GLN A 141 7.619 4.482 6.514 1.00 0.00 H new ATOM 0 HG3 GLN A 141 8.308 3.167 5.584 1.00 0.00 H new ATOM 0 HE21 GLN A 141 8.795 6.730 5.414 1.00 0.00 H new ATOM 0 HE22 GLN A 141 10.540 6.676 5.681 1.00 0.00 H new ATOM 878 N GLN A 142 6.321 1.745 4.977 1.00 0.00 N ATOM 879 CA GLN A 142 6.534 0.307 4.860 1.00 0.00 C ATOM 880 C GLN A 142 5.279 -0.398 4.355 1.00 0.00 C ATOM 881 O GLN A 142 5.344 -1.215 3.437 1.00 0.00 O ATOM 882 CB GLN A 142 6.951 -0.277 6.211 1.00 0.00 C ATOM 883 CG GLN A 142 8.388 0.038 6.594 1.00 0.00 C ATOM 884 CD GLN A 142 9.395 -0.631 5.680 1.00 0.00 C ATOM 885 OE1 GLN A 142 9.323 -1.835 5.434 1.00 0.00 O ATOM 886 NE2 GLN A 142 10.343 0.148 5.172 1.00 0.00 N ATOM 0 H GLN A 142 6.152 2.071 5.929 1.00 0.00 H new ATOM 0 HA GLN A 142 7.332 0.144 4.135 1.00 0.00 H new ATOM 0 HB2 GLN A 142 6.285 0.107 6.984 1.00 0.00 H new ATOM 0 HB3 GLN A 142 6.820 -1.359 6.186 1.00 0.00 H new ATOM 0 HG2 GLN A 142 8.539 1.117 6.567 1.00 0.00 H new ATOM 0 HG3 GLN A 142 8.565 -0.283 7.620 1.00 0.00 H new ATOM 0 HE21 GLN A 142 10.365 1.141 5.403 1.00 0.00 H new ATOM 0 HE22 GLN A 142 11.049 -0.247 4.551 1.00 0.00 H new ATOM 895 N LYS A 143 4.140 -0.082 4.963 1.00 0.00 N ATOM 896 CA LYS A 143 2.873 -0.694 4.574 1.00 0.00 C ATOM 897 C LYS A 143 2.494 -0.313 3.146 1.00 0.00 C ATOM 898 O LYS A 143 2.012 -1.147 2.380 1.00 0.00 O ATOM 899 CB LYS A 143 1.762 -0.279 5.541 1.00 0.00 C ATOM 900 CG LYS A 143 1.514 1.220 5.582 1.00 0.00 C ATOM 901 CD LYS A 143 0.388 1.624 4.646 1.00 0.00 C ATOM 902 CE LYS A 143 -0.963 1.569 5.343 1.00 0.00 C ATOM 903 NZ LYS A 143 -1.159 0.286 6.073 1.00 0.00 N ATOM 0 H LYS A 143 4.068 0.592 5.725 1.00 0.00 H new ATOM 0 HA LYS A 143 2.996 -1.776 4.617 1.00 0.00 H new ATOM 0 HB2 LYS A 143 0.838 -0.783 5.257 1.00 0.00 H new ATOM 0 HB3 LYS A 143 2.018 -0.623 6.543 1.00 0.00 H new ATOM 0 HG2 LYS A 143 1.268 1.521 6.600 1.00 0.00 H new ATOM 0 HG3 LYS A 143 2.426 1.748 5.305 1.00 0.00 H new ATOM 0 HD2 LYS A 143 0.566 2.633 4.275 1.00 0.00 H new ATOM 0 HD3 LYS A 143 0.379 0.963 3.780 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -1.045 2.401 6.043 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -1.757 1.693 4.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -2.111 0.267 6.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -1.056 -0.509 5.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -0.447 0.203 6.827 1.00 0.00 H new ATOM 917 N LEU A 144 2.712 0.950 2.793 1.00 0.00 N ATOM 918 CA LEU A 144 2.390 1.434 1.455 1.00 0.00 C ATOM 919 C LEU A 144 3.337 0.840 0.417 1.00 0.00 C ATOM 920 O LEU A 144 2.900 0.344 -0.622 1.00 0.00 O ATOM 921 CB LEU A 144 2.461 2.961 1.411 1.00 0.00 C ATOM 922 CG LEU A 144 1.494 3.626 0.432 1.00 0.00 C ATOM 923 CD1 LEU A 144 1.317 5.098 0.773 1.00 0.00 C ATOM 924 CD2 LEU A 144 1.989 3.464 -0.997 1.00 0.00 C ATOM 0 H LEU A 144 3.109 1.655 3.413 1.00 0.00 H new ATOM 0 HA LEU A 144 1.375 1.117 1.217 1.00 0.00 H new ATOM 0 HB2 LEU A 144 2.264 3.348 2.411 1.00 0.00 H new ATOM 0 HB3 LEU A 144 3.478 3.255 1.150 1.00 0.00 H new ATOM 0 HG LEU A 144 0.524 3.135 0.518 1.00 0.00 H new ATOM 0 HD11 LEU A 144 0.625 5.555 0.065 1.00 0.00 H new ATOM 0 HD12 LEU A 144 0.918 5.192 1.783 1.00 0.00 H new ATOM 0 HD13 LEU A 144 2.281 5.603 0.715 1.00 0.00 H new ATOM 0 HD21 LEU A 144 1.289 3.943 -1.681 1.00 0.00 H new ATOM 0 HD22 LEU A 144 2.970 3.929 -1.097 1.00 0.00 H new ATOM 0 HD23 LEU A 144 2.064 2.404 -1.238 1.00 0.00 H new ATOM 936 N ALA A 145 4.632 0.893 0.704 1.00 0.00 N ATOM 937 CA ALA A 145 5.638 0.362 -0.208 1.00 0.00 C ATOM 938 C ALA A 145 5.439 -1.133 -0.439 1.00 0.00 C ATOM 939 O ALA A 145 5.284 -1.579 -1.575 1.00 0.00 O ATOM 940 CB ALA A 145 7.034 0.630 0.334 1.00 0.00 C ATOM 0 H ALA A 145 5.010 1.298 1.560 1.00 0.00 H new ATOM 0 HA ALA A 145 5.526 0.869 -1.166 1.00 0.00 H new ATOM 0 HB1 ALA A 145 7.776 0.228 -0.356 1.00 0.00 H new ATOM 0 HB2 ALA A 145 7.183 1.704 0.441 1.00 0.00 H new ATOM 0 HB3 ALA A 145 7.145 0.149 1.306 1.00 0.00 H new ATOM 946 N ARG A 146 5.445 -1.901 0.646 1.00 0.00 N ATOM 947 CA ARG A 146 5.268 -3.345 0.560 1.00 0.00 C ATOM 948 C ARG A 146 3.916 -3.696 -0.056 1.00 0.00 C ATOM 949 O ARG A 146 3.770 -4.733 -0.703 1.00 0.00 O ATOM 950 CB ARG A 146 5.386 -3.979 1.948 1.00 0.00 C ATOM 951 CG ARG A 146 6.814 -4.325 2.338 1.00 0.00 C ATOM 952 CD ARG A 146 6.939 -4.567 3.834 1.00 0.00 C ATOM 953 NE ARG A 146 6.400 -5.868 4.225 1.00 0.00 N ATOM 954 CZ ARG A 146 6.285 -6.273 5.488 1.00 0.00 C ATOM 955 NH1 ARG A 146 6.668 -5.483 6.483 1.00 0.00 N ATOM 956 NH2 ARG A 146 5.783 -7.471 5.757 1.00 0.00 N ATOM 0 H ARG A 146 5.571 -1.547 1.594 1.00 0.00 H new ATOM 0 HA ARG A 146 6.054 -3.741 -0.083 1.00 0.00 H new ATOM 0 HB2 ARG A 146 4.972 -3.294 2.688 1.00 0.00 H new ATOM 0 HB3 ARG A 146 4.780 -4.885 1.978 1.00 0.00 H new ATOM 0 HG2 ARG A 146 7.135 -5.215 1.796 1.00 0.00 H new ATOM 0 HG3 ARG A 146 7.480 -3.514 2.042 1.00 0.00 H new ATOM 0 HD2 ARG A 146 7.988 -4.507 4.125 1.00 0.00 H new ATOM 0 HD3 ARG A 146 6.413 -3.780 4.374 1.00 0.00 H new ATOM 0 HE ARG A 146 6.094 -6.503 3.487 1.00 0.00 H new ATOM 0 HH11 ARG A 146 7.053 -4.560 6.282 1.00 0.00 H new ATOM 0 HH12 ARG A 146 6.577 -5.799 7.449 1.00 0.00 H new ATOM 0 HH21 ARG A 146 5.485 -8.082 4.996 1.00 0.00 H new ATOM 0 HH22 ARG A 146 5.695 -7.781 6.725 1.00 0.00 H new ATOM 970 N SER A 147 2.931 -2.829 0.154 1.00 0.00 N ATOM 971 CA SER A 147 1.591 -3.053 -0.380 1.00 0.00 C ATOM 972 C SER A 147 1.589 -2.981 -1.903 1.00 0.00 C ATOM 973 O SER A 147 1.110 -3.893 -2.577 1.00 0.00 O ATOM 974 CB SER A 147 0.613 -2.024 0.192 1.00 0.00 C ATOM 975 OG SER A 147 0.105 -2.444 1.445 1.00 0.00 O ATOM 0 H SER A 147 3.034 -1.967 0.689 1.00 0.00 H new ATOM 0 HA SER A 147 1.273 -4.052 -0.083 1.00 0.00 H new ATOM 0 HB2 SER A 147 1.116 -1.063 0.304 1.00 0.00 H new ATOM 0 HB3 SER A 147 -0.211 -1.874 -0.506 1.00 0.00 H new ATOM 0 HG SER A 147 0.668 -2.085 2.163 1.00 0.00 H new ATOM 981 N LEU A 148 2.125 -1.890 -2.441 1.00 0.00 N ATOM 982 CA LEU A 148 2.183 -1.700 -3.886 1.00 0.00 C ATOM 983 C LEU A 148 3.082 -2.745 -4.539 1.00 0.00 C ATOM 984 O LEU A 148 2.882 -3.117 -5.696 1.00 0.00 O ATOM 985 CB LEU A 148 2.690 -0.296 -4.219 1.00 0.00 C ATOM 986 CG LEU A 148 1.644 0.815 -4.104 1.00 0.00 C ATOM 987 CD1 LEU A 148 2.279 2.173 -4.358 1.00 0.00 C ATOM 988 CD2 LEU A 148 0.500 0.570 -5.076 1.00 0.00 C ATOM 0 H LEU A 148 2.525 -1.125 -1.898 1.00 0.00 H new ATOM 0 HA LEU A 148 1.174 -1.818 -4.281 1.00 0.00 H new ATOM 0 HB2 LEU A 148 3.522 -0.060 -3.556 1.00 0.00 H new ATOM 0 HB3 LEU A 148 3.083 -0.300 -5.236 1.00 0.00 H new ATOM 0 HG LEU A 148 1.243 0.808 -3.091 1.00 0.00 H new ATOM 0 HD11 LEU A 148 1.521 2.951 -4.272 1.00 0.00 H new ATOM 0 HD12 LEU A 148 3.065 2.350 -3.624 1.00 0.00 H new ATOM 0 HD13 LEU A 148 2.707 2.193 -5.360 1.00 0.00 H new ATOM 0 HD21 LEU A 148 -0.235 1.369 -4.981 1.00 0.00 H new ATOM 0 HD22 LEU A 148 0.886 0.551 -6.095 1.00 0.00 H new ATOM 0 HD23 LEU A 148 0.028 -0.386 -4.849 1.00 0.00 H new ATOM 1000 N GLN A 149 4.076 -3.215 -3.792 1.00 0.00 N ATOM 1001 CA GLN A 149 5.007 -4.216 -4.300 1.00 0.00 C ATOM 1002 C GLN A 149 4.308 -5.556 -4.513 1.00 0.00 C ATOM 1003 O GLN A 149 4.414 -6.159 -5.581 1.00 0.00 O ATOM 1004 CB GLN A 149 6.179 -4.388 -3.332 1.00 0.00 C ATOM 1005 CG GLN A 149 7.228 -3.293 -3.446 1.00 0.00 C ATOM 1006 CD GLN A 149 8.590 -3.738 -2.951 1.00 0.00 C ATOM 1007 OE1 GLN A 149 9.067 -4.818 -3.296 1.00 0.00 O ATOM 1008 NE2 GLN A 149 9.225 -2.903 -2.136 1.00 0.00 N ATOM 0 H GLN A 149 4.257 -2.919 -2.833 1.00 0.00 H new ATOM 0 HA GLN A 149 5.384 -3.869 -5.262 1.00 0.00 H new ATOM 0 HB2 GLN A 149 5.797 -4.408 -2.311 1.00 0.00 H new ATOM 0 HB3 GLN A 149 6.652 -5.353 -3.515 1.00 0.00 H new ATOM 0 HG2 GLN A 149 7.308 -2.979 -4.487 1.00 0.00 H new ATOM 0 HG3 GLN A 149 6.904 -2.423 -2.874 1.00 0.00 H new ATOM 0 HE21 GLN A 149 8.792 -2.017 -1.876 1.00 0.00 H new ATOM 0 HE22 GLN A 149 10.145 -3.148 -1.771 1.00 0.00 H new ATOM 1017 N ILE A 150 3.596 -6.015 -3.490 1.00 0.00 N ATOM 1018 CA ILE A 150 2.883 -7.285 -3.565 1.00 0.00 C ATOM 1019 C ILE A 150 1.697 -7.196 -4.514 1.00 0.00 C ATOM 1020 O ILE A 150 1.336 -8.171 -5.174 1.00 0.00 O ATOM 1021 CB ILE A 150 2.383 -7.730 -2.178 1.00 0.00 C ATOM 1022 CG1 ILE A 150 1.436 -6.681 -1.590 1.00 0.00 C ATOM 1023 CG2 ILE A 150 3.560 -7.975 -1.245 1.00 0.00 C ATOM 1024 CD1 ILE A 150 0.910 -7.042 -0.217 1.00 0.00 C ATOM 0 H ILE A 150 3.497 -5.527 -2.600 1.00 0.00 H new ATOM 0 HA ILE A 150 3.591 -8.022 -3.943 1.00 0.00 H new ATOM 0 HB ILE A 150 1.832 -8.664 -2.289 1.00 0.00 H new ATOM 0 HG12 ILE A 150 1.957 -5.726 -1.531 1.00 0.00 H new ATOM 0 HG13 ILE A 150 0.594 -6.543 -2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 150 3.191 -8.289 -0.269 1.00 0.00 H new ATOM 0 HG22 ILE A 150 4.197 -8.756 -1.660 1.00 0.00 H new ATOM 0 HG23 ILE A 150 4.136 -7.056 -1.137 1.00 0.00 H new ATOM 0 HD11 ILE A 150 0.246 -6.254 0.137 1.00 0.00 H new ATOM 0 HD12 ILE A 150 0.360 -7.981 -0.273 1.00 0.00 H new ATOM 0 HD13 ILE A 150 1.745 -7.151 0.475 1.00 0.00 H new ATOM 1036 N GLY A 151 1.098 -6.018 -4.577 1.00 0.00 N ATOM 1037 CA GLY A 151 -0.045 -5.807 -5.445 1.00 0.00 C ATOM 1038 C GLY A 151 0.307 -5.955 -6.912 1.00 0.00 C ATOM 1039 O GLY A 151 -0.326 -6.726 -7.635 1.00 0.00 O ATOM 0 H GLY A 151 1.383 -5.199 -4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -0.829 -6.520 -5.189 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -0.451 -4.811 -5.271 1.00 0.00 H new