USER MOD reduce.3.24.130724 H: found=0, std=0, add=510, rem=0, adj=7 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 180:sc= -0.932 (180deg=-0.932) USER MOD Single : A 91 MET CE :methyl 178:sc= 0 (180deg=-0.00345) 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 125:sc= 1.02 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 X(o=0,f=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 HIS : no HD1:sc= -2.89 X(o=-2.9,f=-2.6!) USER MOD Single : A 137 HIS : no HD1:sc= -0.778 X(o=-0.78,f=-0.91) USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 141 GLN : amide:sc= -0.881 X(o=-0.88,f=-0.77) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=0) 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= -0.316 K(o=-0.32,f=-2.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 88 3.001 6.539 15.496 1.00 0.00 N ATOM 2 CA MET A 88 1.590 6.530 15.026 1.00 0.00 C ATOM 3 C MET A 88 1.036 7.947 14.924 1.00 0.00 C ATOM 4 O MET A 88 1.282 8.784 15.793 1.00 0.00 O ATOM 5 CB MET A 88 0.756 5.706 16.008 1.00 0.00 C ATOM 6 CG MET A 88 0.831 6.209 17.441 1.00 0.00 C ATOM 7 SD MET A 88 -0.756 6.121 18.293 1.00 0.00 S ATOM 8 CE MET A 88 -1.269 4.456 17.879 1.00 0.00 C ATOM 0 HA MET A 88 1.545 6.087 14.031 1.00 0.00 H new ATOM 0 HB2 MET A 88 -0.284 5.713 15.683 1.00 0.00 H new ATOM 0 HB3 MET A 88 1.093 4.670 15.977 1.00 0.00 H new ATOM 0 HG2 MET A 88 1.567 5.621 17.990 1.00 0.00 H new ATOM 0 HG3 MET A 88 1.182 7.241 17.442 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.237 4.250 18.335 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.349 4.359 16.796 1.00 0.00 H new ATOM 0 HE3 MET A 88 -0.533 3.745 18.254 1.00 0.00 H new ATOM 20 N PHE A 89 0.288 8.210 13.858 1.00 0.00 N ATOM 21 CA PHE A 89 -0.300 9.527 13.644 1.00 0.00 C ATOM 22 C PHE A 89 -1.469 9.451 12.667 1.00 0.00 C ATOM 23 O PHE A 89 -1.307 9.032 11.520 1.00 0.00 O ATOM 24 CB PHE A 89 0.758 10.501 13.119 1.00 0.00 C ATOM 25 CG PHE A 89 1.290 10.133 11.762 1.00 0.00 C ATOM 26 CD1 PHE A 89 2.258 9.150 11.627 1.00 0.00 C ATOM 27 CD2 PHE A 89 0.823 10.770 10.624 1.00 0.00 C ATOM 28 CE1 PHE A 89 2.748 8.810 10.381 1.00 0.00 C ATOM 29 CE2 PHE A 89 1.309 10.434 9.376 1.00 0.00 C ATOM 30 CZ PHE A 89 2.274 9.453 9.254 1.00 0.00 C ATOM 0 H PHE A 89 0.075 7.529 13.129 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.675 9.889 14.601 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.328 11.502 13.073 1.00 0.00 H new ATOM 0 HB3 PHE A 89 1.586 10.542 13.827 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.633 8.645 12.505 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.070 11.539 10.714 1.00 0.00 H new ATOM 0 HE1 PHE A 89 3.501 8.042 10.288 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.935 10.937 8.497 1.00 0.00 H new ATOM 0 HZ PHE A 89 2.657 9.189 8.279 1.00 0.00 H new ATOM 40 N ALA A 90 -2.646 9.862 13.127 1.00 0.00 N ATOM 41 CA ALA A 90 -3.841 9.842 12.295 1.00 0.00 C ATOM 42 C ALA A 90 -3.888 11.057 11.376 1.00 0.00 C ATOM 43 O ALA A 90 -2.991 11.899 11.397 1.00 0.00 O ATOM 44 CB ALA A 90 -5.088 9.787 13.164 1.00 0.00 C ATOM 0 H ALA A 90 -2.797 10.213 14.073 1.00 0.00 H new ATOM 0 HA ALA A 90 -3.806 8.948 11.672 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.974 9.773 12.529 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -5.066 8.885 13.776 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -5.120 10.664 13.811 1.00 0.00 H new ATOM 50 N MET A 91 -4.941 11.140 10.573 1.00 0.00 N ATOM 51 CA MET A 91 -5.110 12.252 9.645 1.00 0.00 C ATOM 52 C MET A 91 -6.470 12.182 8.957 1.00 0.00 C ATOM 53 O MET A 91 -7.355 11.438 9.381 1.00 0.00 O ATOM 54 CB MET A 91 -3.988 12.246 8.603 1.00 0.00 C ATOM 55 CG MET A 91 -3.119 13.494 8.639 1.00 0.00 C ATOM 56 SD MET A 91 -1.355 13.115 8.640 1.00 0.00 S ATOM 57 CE MET A 91 -1.164 12.392 7.013 1.00 0.00 C ATOM 0 H MET A 91 -5.692 10.450 10.545 1.00 0.00 H new ATOM 0 HA MET A 91 -5.061 13.182 10.212 1.00 0.00 H new ATOM 0 HB2 MET A 91 -3.359 11.370 8.763 1.00 0.00 H new ATOM 0 HB3 MET A 91 -4.426 12.146 7.610 1.00 0.00 H new ATOM 0 HG2 MET A 91 -3.352 14.119 7.777 1.00 0.00 H new ATOM 0 HG3 MET A 91 -3.362 14.075 9.528 1.00 0.00 H new ATOM 0 HE1 MET A 91 -0.117 12.138 6.849 1.00 0.00 H new ATOM 0 HE2 MET A 91 -1.772 11.490 6.942 1.00 0.00 H new ATOM 0 HE3 MET A 91 -1.487 13.108 6.257 1.00 0.00 H new ATOM 67 N TYR A 92 -6.629 12.958 7.889 1.00 0.00 N ATOM 68 CA TYR A 92 -7.880 12.982 7.141 1.00 0.00 C ATOM 69 C TYR A 92 -7.675 12.432 5.734 1.00 0.00 C ATOM 70 O TYR A 92 -6.594 12.562 5.163 1.00 0.00 O ATOM 71 CB TYR A 92 -8.428 14.409 7.069 1.00 0.00 C ATOM 72 CG TYR A 92 -7.383 15.442 6.709 1.00 0.00 C ATOM 73 CD1 TYR A 92 -6.534 15.966 7.676 1.00 0.00 C ATOM 74 CD2 TYR A 92 -7.246 15.894 5.401 1.00 0.00 C ATOM 75 CE1 TYR A 92 -5.579 16.910 7.351 1.00 0.00 C ATOM 76 CE2 TYR A 92 -6.292 16.837 5.069 1.00 0.00 C ATOM 77 CZ TYR A 92 -5.461 17.342 6.048 1.00 0.00 C ATOM 78 OH TYR A 92 -4.510 18.281 5.720 1.00 0.00 O ATOM 0 H TYR A 92 -5.907 13.578 7.523 1.00 0.00 H new ATOM 0 HA TYR A 92 -8.601 12.351 7.660 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -9.230 14.444 6.332 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -8.868 14.669 8.032 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -6.622 15.630 8.699 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -7.896 15.502 4.632 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -4.928 17.308 8.115 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.197 17.177 4.048 1.00 0.00 H new ATOM 0 HH TYR A 92 -4.559 18.475 4.761 1.00 0.00 H new ATOM 88 N PRO A 93 -8.714 11.807 5.153 1.00 0.00 N ATOM 89 CA PRO A 93 -8.641 11.234 3.809 1.00 0.00 C ATOM 90 C PRO A 93 -8.923 12.259 2.713 1.00 0.00 C ATOM 91 O PRO A 93 -9.523 11.933 1.690 1.00 0.00 O ATOM 92 CB PRO A 93 -9.737 10.175 3.844 1.00 0.00 C ATOM 93 CG PRO A 93 -10.773 10.740 4.758 1.00 0.00 C ATOM 94 CD PRO A 93 -10.042 11.601 5.762 1.00 0.00 C ATOM 0 HA PRO A 93 -7.648 10.850 3.576 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -10.143 9.991 2.849 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -9.357 9.223 4.215 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -11.501 11.329 4.201 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -11.323 9.944 5.259 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.557 12.547 5.927 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.965 11.107 6.731 1.00 0.00 H new ATOM 102 N ASP A 94 -8.488 13.498 2.929 1.00 0.00 N ATOM 103 CA ASP A 94 -8.699 14.562 1.955 1.00 0.00 C ATOM 104 C ASP A 94 -7.379 15.032 1.345 1.00 0.00 C ATOM 105 O ASP A 94 -7.340 16.044 0.643 1.00 0.00 O ATOM 106 CB ASP A 94 -9.417 15.744 2.609 1.00 0.00 C ATOM 107 CG ASP A 94 -10.240 16.542 1.617 1.00 0.00 C ATOM 108 OD1 ASP A 94 -10.936 15.921 0.787 1.00 0.00 O ATOM 109 OD2 ASP A 94 -10.188 17.790 1.670 1.00 0.00 O ATOM 0 H ASP A 94 -7.988 13.788 3.769 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.319 14.159 1.154 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -10.067 15.376 3.403 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -8.681 16.399 3.076 1.00 0.00 H new ATOM 114 N TRP A 95 -6.298 14.301 1.611 1.00 0.00 N ATOM 115 CA TRP A 95 -4.993 14.659 1.082 1.00 0.00 C ATOM 116 C TRP A 95 -4.923 14.391 -0.417 1.00 0.00 C ATOM 117 O TRP A 95 -5.443 13.386 -0.904 1.00 0.00 O ATOM 118 CB TRP A 95 -3.895 13.880 1.808 1.00 0.00 C ATOM 119 CG TRP A 95 -4.164 12.410 1.910 1.00 0.00 C ATOM 120 CD1 TRP A 95 -4.623 11.737 3.005 1.00 0.00 C ATOM 121 CD2 TRP A 95 -3.982 11.430 0.881 1.00 0.00 C ATOM 122 NE1 TRP A 95 -4.743 10.398 2.718 1.00 0.00 N ATOM 123 CE2 TRP A 95 -4.356 10.185 1.421 1.00 0.00 C ATOM 124 CE3 TRP A 95 -3.542 11.485 -0.444 1.00 0.00 C ATOM 125 CZ2 TRP A 95 -4.302 9.006 0.681 1.00 0.00 C ATOM 126 CZ3 TRP A 95 -3.489 10.313 -1.177 1.00 0.00 C ATOM 127 CH2 TRP A 95 -3.868 9.089 -0.613 1.00 0.00 C ATOM 0 H TRP A 95 -6.305 13.460 2.189 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.839 15.725 1.248 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.950 14.032 1.287 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.775 14.289 2.811 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -4.857 12.190 3.957 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -5.067 9.680 3.365 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -3.249 12.425 -0.888 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -4.593 8.060 1.114 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -3.149 10.343 -2.202 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.817 8.192 -1.212 1.00 0.00 H new ATOM 138 N GLN A 96 -4.283 15.299 -1.145 1.00 0.00 N ATOM 139 CA GLN A 96 -4.147 15.163 -2.591 1.00 0.00 C ATOM 140 C GLN A 96 -2.713 14.804 -2.973 1.00 0.00 C ATOM 141 O GLN A 96 -1.762 15.249 -2.332 1.00 0.00 O ATOM 142 CB GLN A 96 -4.563 16.461 -3.285 1.00 0.00 C ATOM 143 CG GLN A 96 -3.870 17.695 -2.732 1.00 0.00 C ATOM 144 CD GLN A 96 -3.997 18.896 -3.648 1.00 0.00 C ATOM 145 OE1 GLN A 96 -5.091 19.420 -3.855 1.00 0.00 O ATOM 146 NE2 GLN A 96 -2.874 19.338 -4.203 1.00 0.00 N ATOM 0 H GLN A 96 -3.850 16.137 -0.758 1.00 0.00 H new ATOM 0 HA GLN A 96 -4.802 14.356 -2.919 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -4.346 16.379 -4.350 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -5.641 16.586 -3.188 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -4.294 17.939 -1.758 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -2.815 17.474 -2.574 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -1.989 18.873 -4.003 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -2.897 20.143 -4.829 1.00 0.00 H new ATOM 155 N PRO A 97 -2.537 13.990 -4.030 1.00 0.00 N ATOM 156 CA PRO A 97 -1.209 13.574 -4.493 1.00 0.00 C ATOM 157 C PRO A 97 -0.285 14.762 -4.746 1.00 0.00 C ATOM 158 O PRO A 97 -0.725 15.814 -5.210 1.00 0.00 O ATOM 159 CB PRO A 97 -1.500 12.837 -5.803 1.00 0.00 C ATOM 160 CG PRO A 97 -2.907 12.369 -5.671 1.00 0.00 C ATOM 161 CD PRO A 97 -3.616 13.412 -4.854 1.00 0.00 C ATOM 0 HA PRO A 97 -0.694 12.964 -3.751 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -1.381 13.496 -6.663 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -0.816 12.000 -5.946 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -3.374 12.256 -6.649 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -2.950 11.395 -5.183 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -4.087 14.165 -5.485 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -4.402 12.975 -4.238 1.00 0.00 H new ATOM 169 N ASP A 98 0.995 14.586 -4.438 1.00 0.00 N ATOM 170 CA ASP A 98 1.980 15.644 -4.633 1.00 0.00 C ATOM 171 C ASP A 98 3.369 15.058 -4.868 1.00 0.00 C ATOM 172 O ASP A 98 3.537 13.841 -4.936 1.00 0.00 O ATOM 173 CB ASP A 98 2.006 16.576 -3.420 1.00 0.00 C ATOM 174 CG ASP A 98 2.166 18.032 -3.815 1.00 0.00 C ATOM 175 OD1 ASP A 98 1.191 18.617 -4.331 1.00 0.00 O ATOM 176 OD2 ASP A 98 3.265 18.586 -3.606 1.00 0.00 O ATOM 0 H ASP A 98 1.375 13.721 -4.053 1.00 0.00 H new ATOM 0 HA ASP A 98 1.692 16.215 -5.515 1.00 0.00 H new ATOM 0 HB2 ASP A 98 1.083 16.455 -2.852 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.826 16.288 -2.761 1.00 0.00 H new ATOM 181 N ALA A 99 4.360 15.934 -4.994 1.00 0.00 N ATOM 182 CA ALA A 99 5.735 15.505 -5.222 1.00 0.00 C ATOM 183 C ALA A 99 6.227 14.610 -4.089 1.00 0.00 C ATOM 184 O ALA A 99 7.058 13.727 -4.299 1.00 0.00 O ATOM 185 CB ALA A 99 6.646 16.714 -5.375 1.00 0.00 C ATOM 0 H ALA A 99 4.237 16.945 -4.942 1.00 0.00 H new ATOM 0 HA ALA A 99 5.760 14.925 -6.145 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.669 16.379 -5.545 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.315 17.314 -6.223 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.607 17.316 -4.467 1.00 0.00 H new ATOM 191 N ASP A 100 5.709 14.846 -2.888 1.00 0.00 N ATOM 192 CA ASP A 100 6.097 14.063 -1.721 1.00 0.00 C ATOM 193 C ASP A 100 5.787 12.584 -1.930 1.00 0.00 C ATOM 194 O ASP A 100 6.497 11.714 -1.427 1.00 0.00 O ATOM 195 CB ASP A 100 5.374 14.575 -0.474 1.00 0.00 C ATOM 196 CG ASP A 100 5.619 16.050 -0.229 1.00 0.00 C ATOM 197 OD1 ASP A 100 5.203 16.870 -1.074 1.00 0.00 O ATOM 198 OD2 ASP A 100 6.228 16.387 0.809 1.00 0.00 O ATOM 0 H ASP A 100 5.020 15.573 -2.698 1.00 0.00 H new ATOM 0 HA ASP A 100 7.172 14.175 -1.581 1.00 0.00 H new ATOM 0 HB2 ASP A 100 4.303 14.400 -0.581 1.00 0.00 H new ATOM 0 HB3 ASP A 100 5.705 14.005 0.394 1.00 0.00 H new ATOM 203 N PHE A 101 4.723 12.308 -2.676 1.00 0.00 N ATOM 204 CA PHE A 101 4.320 10.934 -2.952 1.00 0.00 C ATOM 205 C PHE A 101 5.418 10.184 -3.699 1.00 0.00 C ATOM 206 O PHE A 101 5.843 9.107 -3.282 1.00 0.00 O ATOM 207 CB PHE A 101 3.024 10.916 -3.768 1.00 0.00 C ATOM 208 CG PHE A 101 1.997 9.954 -3.241 1.00 0.00 C ATOM 209 CD1 PHE A 101 2.225 8.589 -3.275 1.00 0.00 C ATOM 210 CD2 PHE A 101 0.803 10.418 -2.710 1.00 0.00 C ATOM 211 CE1 PHE A 101 1.282 7.702 -2.790 1.00 0.00 C ATOM 212 CE2 PHE A 101 -0.143 9.537 -2.224 1.00 0.00 C ATOM 213 CZ PHE A 101 0.097 8.177 -2.264 1.00 0.00 C ATOM 0 H PHE A 101 4.125 13.017 -3.100 1.00 0.00 H new ATOM 0 HA PHE A 101 4.148 10.433 -2.000 1.00 0.00 H new ATOM 0 HB2 PHE A 101 2.598 11.919 -3.780 1.00 0.00 H new ATOM 0 HB3 PHE A 101 3.258 10.656 -4.800 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.150 8.213 -3.685 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.611 11.480 -2.676 1.00 0.00 H new ATOM 0 HE1 PHE A 101 1.472 6.639 -2.822 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -1.069 9.911 -1.813 1.00 0.00 H new ATOM 0 HZ PHE A 101 -0.641 7.486 -1.884 1.00 0.00 H new ATOM 223 N ILE A 102 5.875 10.763 -4.805 1.00 0.00 N ATOM 224 CA ILE A 102 6.925 10.151 -5.610 1.00 0.00 C ATOM 225 C ILE A 102 8.279 10.256 -4.915 1.00 0.00 C ATOM 226 O ILE A 102 9.141 9.393 -5.082 1.00 0.00 O ATOM 227 CB ILE A 102 7.022 10.806 -7.001 1.00 0.00 C ATOM 228 CG1 ILE A 102 5.642 10.861 -7.660 1.00 0.00 C ATOM 229 CG2 ILE A 102 8.003 10.044 -7.880 1.00 0.00 C ATOM 230 CD1 ILE A 102 5.533 11.908 -8.748 1.00 0.00 C ATOM 0 H ILE A 102 5.534 11.655 -5.164 1.00 0.00 H new ATOM 0 HA ILE A 102 6.660 9.101 -5.731 1.00 0.00 H new ATOM 0 HB ILE A 102 7.389 11.825 -6.880 1.00 0.00 H new ATOM 0 HG12 ILE A 102 5.411 9.883 -8.083 1.00 0.00 H new ATOM 0 HG13 ILE A 102 4.891 11.063 -6.896 1.00 0.00 H new ATOM 0 HG21 ILE A 102 8.060 10.520 -8.859 1.00 0.00 H new ATOM 0 HG22 ILE A 102 8.989 10.051 -7.415 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.664 9.015 -7.996 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.528 11.890 -9.171 1.00 0.00 H new ATOM 0 HD12 ILE A 102 5.732 12.893 -8.326 1.00 0.00 H new ATOM 0 HD13 ILE A 102 6.260 11.695 -9.532 1.00 0.00 H new ATOM 242 N ARG A 103 8.458 11.317 -4.134 1.00 0.00 N ATOM 243 CA ARG A 103 9.705 11.533 -3.413 1.00 0.00 C ATOM 244 C ARG A 103 9.934 10.435 -2.378 1.00 0.00 C ATOM 245 O ARG A 103 10.992 9.808 -2.347 1.00 0.00 O ATOM 246 CB ARG A 103 9.689 12.904 -2.730 1.00 0.00 C ATOM 247 CG ARG A 103 10.689 13.888 -3.317 1.00 0.00 C ATOM 248 CD ARG A 103 11.648 14.411 -2.259 1.00 0.00 C ATOM 249 NE ARG A 103 13.010 14.542 -2.771 1.00 0.00 N ATOM 250 CZ ARG A 103 13.773 13.507 -3.117 1.00 0.00 C ATOM 251 NH1 ARG A 103 13.313 12.267 -3.006 1.00 0.00 N ATOM 252 NH2 ARG A 103 15.001 13.713 -3.574 1.00 0.00 N ATOM 0 H ARG A 103 7.754 12.040 -3.985 1.00 0.00 H new ATOM 0 HA ARG A 103 10.524 11.502 -4.132 1.00 0.00 H new ATOM 0 HB2 ARG A 103 8.687 13.327 -2.807 1.00 0.00 H new ATOM 0 HB3 ARG A 103 9.900 12.774 -1.668 1.00 0.00 H new ATOM 0 HG2 ARG A 103 11.254 13.402 -4.113 1.00 0.00 H new ATOM 0 HG3 ARG A 103 10.155 14.724 -3.770 1.00 0.00 H new ATOM 0 HD2 ARG A 103 11.300 15.380 -1.902 1.00 0.00 H new ATOM 0 HD3 ARG A 103 11.646 13.737 -1.403 1.00 0.00 H new ATOM 0 HE ARG A 103 13.399 15.480 -2.869 1.00 0.00 H new ATOM 0 HH11 ARG A 103 12.370 12.103 -2.654 1.00 0.00 H new ATOM 0 HH12 ARG A 103 13.903 11.479 -3.273 1.00 0.00 H new ATOM 0 HH21 ARG A 103 15.360 14.664 -3.660 1.00 0.00 H new ATOM 0 HH22 ARG A 103 15.586 12.921 -3.839 1.00 0.00 H new ATOM 266 N LEU A 104 8.932 10.207 -1.533 1.00 0.00 N ATOM 267 CA LEU A 104 9.023 9.185 -0.498 1.00 0.00 C ATOM 268 C LEU A 104 9.091 7.791 -1.116 1.00 0.00 C ATOM 269 O LEU A 104 9.918 6.968 -0.724 1.00 0.00 O ATOM 270 CB LEU A 104 7.824 9.281 0.450 1.00 0.00 C ATOM 271 CG LEU A 104 8.071 10.087 1.727 1.00 0.00 C ATOM 272 CD1 LEU A 104 8.592 11.475 1.389 1.00 0.00 C ATOM 273 CD2 LEU A 104 6.798 10.179 2.555 1.00 0.00 C ATOM 0 H LEU A 104 8.049 10.717 -1.546 1.00 0.00 H new ATOM 0 HA LEU A 104 9.938 9.356 0.069 1.00 0.00 H new ATOM 0 HB2 LEU A 104 6.989 9.729 -0.089 1.00 0.00 H new ATOM 0 HB3 LEU A 104 7.519 8.272 0.728 1.00 0.00 H new ATOM 0 HG LEU A 104 8.828 9.572 2.319 1.00 0.00 H new ATOM 0 HD11 LEU A 104 8.762 12.034 2.309 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.529 11.388 0.839 1.00 0.00 H new ATOM 0 HD13 LEU A 104 7.859 12.000 0.776 1.00 0.00 H new ATOM 0 HD21 LEU A 104 6.993 10.756 3.459 1.00 0.00 H new ATOM 0 HD22 LEU A 104 6.019 10.671 1.972 1.00 0.00 H new ATOM 0 HD23 LEU A 104 6.468 9.177 2.828 1.00 0.00 H new ATOM 285 N ALA A 105 8.217 7.535 -2.083 1.00 0.00 N ATOM 286 CA ALA A 105 8.177 6.242 -2.755 1.00 0.00 C ATOM 287 C ALA A 105 9.482 5.966 -3.495 1.00 0.00 C ATOM 288 O ALA A 105 9.908 4.817 -3.615 1.00 0.00 O ATOM 289 CB ALA A 105 7.002 6.186 -3.719 1.00 0.00 C ATOM 0 H ALA A 105 7.526 8.206 -2.419 1.00 0.00 H new ATOM 0 HA ALA A 105 8.050 5.470 -1.996 1.00 0.00 H new ATOM 0 HB1 ALA A 105 6.984 5.215 -4.214 1.00 0.00 H new ATOM 0 HB2 ALA A 105 6.072 6.330 -3.168 1.00 0.00 H new ATOM 0 HB3 ALA A 105 7.107 6.973 -4.466 1.00 0.00 H new ATOM 295 N ALA A 106 10.112 7.026 -3.990 1.00 0.00 N ATOM 296 CA ALA A 106 11.368 6.898 -4.718 1.00 0.00 C ATOM 297 C ALA A 106 12.540 6.701 -3.763 1.00 0.00 C ATOM 298 O ALA A 106 13.508 6.012 -4.085 1.00 0.00 O ATOM 299 CB ALA A 106 11.597 8.121 -5.592 1.00 0.00 C ATOM 0 H ALA A 106 9.773 7.984 -3.900 1.00 0.00 H new ATOM 0 HA ALA A 106 11.302 6.016 -5.355 1.00 0.00 H new ATOM 0 HB1 ALA A 106 12.539 8.012 -6.130 1.00 0.00 H new ATOM 0 HB2 ALA A 106 10.779 8.216 -6.307 1.00 0.00 H new ATOM 0 HB3 ALA A 106 11.637 9.013 -4.967 1.00 0.00 H new ATOM 305 N LEU A 107 12.444 7.309 -2.585 1.00 0.00 N ATOM 306 CA LEU A 107 13.495 7.200 -1.581 1.00 0.00 C ATOM 307 C LEU A 107 13.363 5.893 -0.802 1.00 0.00 C ATOM 308 O LEU A 107 14.357 5.324 -0.352 1.00 0.00 O ATOM 309 CB LEU A 107 13.434 8.398 -0.626 1.00 0.00 C ATOM 310 CG LEU A 107 14.200 8.230 0.687 1.00 0.00 C ATOM 311 CD1 LEU A 107 15.679 8.000 0.418 1.00 0.00 C ATOM 312 CD2 LEU A 107 14.000 9.446 1.579 1.00 0.00 C ATOM 0 H LEU A 107 11.649 7.882 -2.303 1.00 0.00 H new ATOM 0 HA LEU A 107 14.460 7.200 -2.087 1.00 0.00 H new ATOM 0 HB2 LEU A 107 13.823 9.274 -1.144 1.00 0.00 H new ATOM 0 HB3 LEU A 107 12.389 8.603 -0.394 1.00 0.00 H new ATOM 0 HG LEU A 107 13.807 7.355 1.205 1.00 0.00 H new ATOM 0 HD11 LEU A 107 16.207 7.883 1.364 1.00 0.00 H new ATOM 0 HD12 LEU A 107 15.804 7.098 -0.181 1.00 0.00 H new ATOM 0 HD13 LEU A 107 16.088 8.854 -0.122 1.00 0.00 H new ATOM 0 HD21 LEU A 107 14.552 9.310 2.509 1.00 0.00 H new ATOM 0 HD22 LEU A 107 14.365 10.337 1.067 1.00 0.00 H new ATOM 0 HD23 LEU A 107 12.939 9.564 1.801 1.00 0.00 H new ATOM 324 N TRP A 108 12.129 5.424 -0.650 1.00 0.00 N ATOM 325 CA TRP A 108 11.866 4.185 0.074 1.00 0.00 C ATOM 326 C TRP A 108 12.257 2.964 -0.758 1.00 0.00 C ATOM 327 O TRP A 108 12.344 1.852 -0.237 1.00 0.00 O ATOM 328 CB TRP A 108 10.387 4.100 0.458 1.00 0.00 C ATOM 329 CG TRP A 108 9.952 5.187 1.392 1.00 0.00 C ATOM 330 CD1 TRP A 108 10.751 5.952 2.193 1.00 0.00 C ATOM 331 CD2 TRP A 108 8.609 5.631 1.625 1.00 0.00 C ATOM 332 NE1 TRP A 108 9.988 6.844 2.908 1.00 0.00 N ATOM 333 CE2 TRP A 108 8.670 6.667 2.576 1.00 0.00 C ATOM 334 CE3 TRP A 108 7.362 5.253 1.119 1.00 0.00 C ATOM 335 CZ2 TRP A 108 7.532 7.327 3.031 1.00 0.00 C ATOM 336 CZ3 TRP A 108 6.232 5.910 1.572 1.00 0.00 C ATOM 337 CH2 TRP A 108 6.325 6.937 2.519 1.00 0.00 C ATOM 0 H TRP A 108 11.296 5.883 -1.018 1.00 0.00 H new ATOM 0 HA TRP A 108 12.474 4.191 0.979 1.00 0.00 H new ATOM 0 HB2 TRP A 108 9.781 4.145 -0.447 1.00 0.00 H new ATOM 0 HB3 TRP A 108 10.195 3.133 0.923 1.00 0.00 H new ATOM 0 HD1 TRP A 108 11.826 5.868 2.255 1.00 0.00 H new ATOM 0 HE1 TRP A 108 10.345 7.527 3.577 1.00 0.00 H new ATOM 0 HE3 TRP A 108 7.282 4.462 0.388 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 7.600 8.119 3.762 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 5.263 5.626 1.189 1.00 0.00 H new ATOM 0 HH2 TRP A 108 5.425 7.432 2.852 1.00 0.00 H new ATOM 348 N GLY A 109 12.494 3.175 -2.051 1.00 0.00 N ATOM 349 CA GLY A 109 12.873 2.077 -2.921 1.00 0.00 C ATOM 350 C GLY A 109 11.689 1.488 -3.663 1.00 0.00 C ATOM 351 O GLY A 109 11.633 0.280 -3.895 1.00 0.00 O ATOM 0 H GLY A 109 12.430 4.084 -2.509 1.00 0.00 H new ATOM 0 HA2 GLY A 109 13.612 2.427 -3.642 1.00 0.00 H new ATOM 0 HA3 GLY A 109 13.351 1.297 -2.329 1.00 0.00 H new ATOM 355 N VAL A 110 10.741 2.341 -4.036 1.00 0.00 N ATOM 356 CA VAL A 110 9.554 1.897 -4.756 1.00 0.00 C ATOM 357 C VAL A 110 9.544 2.436 -6.183 1.00 0.00 C ATOM 358 O VAL A 110 9.378 3.635 -6.403 1.00 0.00 O ATOM 359 CB VAL A 110 8.263 2.342 -4.044 1.00 0.00 C ATOM 360 CG1 VAL A 110 7.046 1.704 -4.696 1.00 0.00 C ATOM 361 CG2 VAL A 110 8.325 1.999 -2.563 1.00 0.00 C ATOM 0 H VAL A 110 10.772 3.344 -3.851 1.00 0.00 H new ATOM 0 HA VAL A 110 9.589 0.808 -4.780 1.00 0.00 H new ATOM 0 HB VAL A 110 8.172 3.424 -4.139 1.00 0.00 H new ATOM 0 HG11 VAL A 110 6.143 2.030 -4.179 1.00 0.00 H new ATOM 0 HG12 VAL A 110 6.994 2.005 -5.742 1.00 0.00 H new ATOM 0 HG13 VAL A 110 7.127 0.619 -4.634 1.00 0.00 H new ATOM 0 HG21 VAL A 110 7.404 2.321 -2.076 1.00 0.00 H new ATOM 0 HG22 VAL A 110 8.441 0.922 -2.444 1.00 0.00 H new ATOM 0 HG23 VAL A 110 9.174 2.508 -2.107 1.00 0.00 H new ATOM 371 N ALA A 111 9.724 1.541 -7.148 1.00 0.00 N ATOM 372 CA ALA A 111 9.736 1.925 -8.555 1.00 0.00 C ATOM 373 C ALA A 111 8.633 1.209 -9.329 1.00 0.00 C ATOM 374 O ALA A 111 8.493 -0.011 -9.244 1.00 0.00 O ATOM 375 CB ALA A 111 11.096 1.630 -9.170 1.00 0.00 C ATOM 0 H ALA A 111 9.864 0.544 -6.982 1.00 0.00 H new ATOM 0 HA ALA A 111 9.548 2.997 -8.617 1.00 0.00 H new ATOM 0 HB1 ALA A 111 11.091 1.921 -10.220 1.00 0.00 H new ATOM 0 HB2 ALA A 111 11.865 2.193 -8.641 1.00 0.00 H new ATOM 0 HB3 ALA A 111 11.308 0.564 -9.090 1.00 0.00 H new ATOM 381 N LEU A 112 7.853 1.975 -10.083 1.00 0.00 N ATOM 382 CA LEU A 112 6.762 1.415 -10.871 1.00 0.00 C ATOM 383 C LEU A 112 7.151 1.315 -12.344 1.00 0.00 C ATOM 384 O LEU A 112 8.062 2.003 -12.803 1.00 0.00 O ATOM 385 CB LEU A 112 5.504 2.272 -10.722 1.00 0.00 C ATOM 386 CG LEU A 112 5.036 2.491 -9.282 1.00 0.00 C ATOM 387 CD1 LEU A 112 5.638 3.768 -8.714 1.00 0.00 C ATOM 388 CD2 LEU A 112 3.518 2.542 -9.217 1.00 0.00 C ATOM 0 H LEU A 112 7.956 2.986 -10.165 1.00 0.00 H new ATOM 0 HA LEU A 112 6.556 0.412 -10.498 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.689 3.244 -11.180 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.695 1.804 -11.283 1.00 0.00 H new ATOM 0 HG LEU A 112 5.378 1.651 -8.677 1.00 0.00 H new ATOM 0 HD11 LEU A 112 5.294 3.908 -7.689 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.725 3.694 -8.725 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.326 4.618 -9.320 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.203 2.698 -8.185 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.155 3.363 -9.836 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.106 1.602 -9.583 1.00 0.00 H new ATOM 400 N ARG A 113 6.451 0.457 -13.078 1.00 0.00 N ATOM 401 CA ARG A 113 6.722 0.268 -14.498 1.00 0.00 C ATOM 402 C ARG A 113 5.704 1.019 -15.351 1.00 0.00 C ATOM 403 O ARG A 113 6.054 1.622 -16.365 1.00 0.00 O ATOM 404 CB ARG A 113 6.705 -1.221 -14.848 1.00 0.00 C ATOM 405 CG ARG A 113 8.090 -1.831 -14.979 1.00 0.00 C ATOM 406 CD ARG A 113 8.113 -3.272 -14.496 1.00 0.00 C ATOM 407 NE ARG A 113 7.855 -4.216 -15.581 1.00 0.00 N ATOM 408 CZ ARG A 113 8.162 -5.511 -15.526 1.00 0.00 C ATOM 409 NH1 ARG A 113 8.739 -6.018 -14.444 1.00 0.00 N ATOM 410 NH2 ARG A 113 7.891 -6.300 -16.556 1.00 0.00 N ATOM 0 H ARG A 113 5.692 -0.118 -12.713 1.00 0.00 H new ATOM 0 HA ARG A 113 7.712 0.671 -14.711 1.00 0.00 H new ATOM 0 HB2 ARG A 113 6.151 -1.760 -14.079 1.00 0.00 H new ATOM 0 HB3 ARG A 113 6.166 -1.359 -15.785 1.00 0.00 H new ATOM 0 HG2 ARG A 113 8.409 -1.790 -16.020 1.00 0.00 H new ATOM 0 HG3 ARG A 113 8.804 -1.242 -14.403 1.00 0.00 H new ATOM 0 HD2 ARG A 113 9.083 -3.489 -14.049 1.00 0.00 H new ATOM 0 HD3 ARG A 113 7.365 -3.405 -13.714 1.00 0.00 H new ATOM 0 HE ARG A 113 7.414 -3.863 -16.430 1.00 0.00 H new ATOM 0 HH11 ARG A 113 8.950 -5.415 -13.649 1.00 0.00 H new ATOM 0 HH12 ARG A 113 8.972 -7.010 -14.408 1.00 0.00 H new ATOM 0 HH21 ARG A 113 7.448 -5.915 -17.390 1.00 0.00 H new ATOM 0 HH22 ARG A 113 8.126 -7.292 -16.514 1.00 0.00 H new ATOM 424 N GLU A 114 4.443 0.979 -14.932 1.00 0.00 N ATOM 425 CA GLU A 114 3.375 1.656 -15.657 1.00 0.00 C ATOM 426 C GLU A 114 2.631 2.631 -14.748 1.00 0.00 C ATOM 427 O GLU A 114 2.698 2.523 -13.523 1.00 0.00 O ATOM 428 CB GLU A 114 2.397 0.633 -16.239 1.00 0.00 C ATOM 429 CG GLU A 114 2.682 0.275 -17.688 1.00 0.00 C ATOM 430 CD GLU A 114 1.417 0.037 -18.488 1.00 0.00 C ATOM 431 OE1 GLU A 114 0.707 1.021 -18.785 1.00 0.00 O ATOM 432 OE2 GLU A 114 1.134 -1.135 -18.818 1.00 0.00 O ATOM 0 H GLU A 114 4.136 0.485 -14.094 1.00 0.00 H new ATOM 0 HA GLU A 114 3.826 2.222 -16.472 1.00 0.00 H new ATOM 0 HB2 GLU A 114 2.432 -0.274 -15.636 1.00 0.00 H new ATOM 0 HB3 GLU A 114 1.384 1.028 -16.163 1.00 0.00 H new ATOM 0 HG2 GLU A 114 3.255 1.078 -18.151 1.00 0.00 H new ATOM 0 HG3 GLU A 114 3.303 -0.620 -17.722 1.00 0.00 H new ATOM 439 N PRO A 115 1.909 3.599 -15.337 1.00 0.00 N ATOM 440 CA PRO A 115 1.150 4.594 -14.573 1.00 0.00 C ATOM 441 C PRO A 115 -0.058 3.985 -13.868 1.00 0.00 C ATOM 442 O PRO A 115 -0.903 3.352 -14.499 1.00 0.00 O ATOM 443 CB PRO A 115 0.698 5.595 -15.640 1.00 0.00 C ATOM 444 CG PRO A 115 0.666 4.809 -16.905 1.00 0.00 C ATOM 445 CD PRO A 115 1.774 3.798 -16.793 1.00 0.00 C ATOM 0 HA PRO A 115 1.749 5.040 -13.779 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -0.283 6.008 -15.405 1.00 0.00 H new ATOM 0 HB3 PRO A 115 1.389 6.435 -15.713 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -0.298 4.318 -17.035 1.00 0.00 H new ATOM 0 HG3 PRO A 115 0.814 5.456 -17.770 1.00 0.00 H new ATOM 0 HD2 PRO A 115 1.523 2.869 -17.304 1.00 0.00 H new ATOM 0 HD3 PRO A 115 2.700 4.165 -17.236 1.00 0.00 H new ATOM 453 N VAL A 116 -0.132 4.183 -12.556 1.00 0.00 N ATOM 454 CA VAL A 116 -1.237 3.653 -11.766 1.00 0.00 C ATOM 455 C VAL A 116 -2.506 4.470 -11.983 1.00 0.00 C ATOM 456 O VAL A 116 -2.448 5.625 -12.403 1.00 0.00 O ATOM 457 CB VAL A 116 -0.898 3.638 -10.262 1.00 0.00 C ATOM 458 CG1 VAL A 116 -1.997 2.939 -9.473 1.00 0.00 C ATOM 459 CG2 VAL A 116 0.447 2.968 -10.022 1.00 0.00 C ATOM 0 H VAL A 116 0.559 4.706 -12.018 1.00 0.00 H new ATOM 0 HA VAL A 116 -1.404 2.629 -12.101 1.00 0.00 H new ATOM 0 HB VAL A 116 -0.831 4.669 -9.915 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -1.740 2.938 -8.414 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -2.940 3.466 -9.617 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -2.099 1.912 -9.822 1.00 0.00 H new ATOM 0 HG21 VAL A 116 0.668 2.968 -8.955 1.00 0.00 H new ATOM 0 HG22 VAL A 116 0.412 1.941 -10.386 1.00 0.00 H new ATOM 0 HG23 VAL A 116 1.226 3.515 -10.553 1.00 0.00 H new ATOM 469 N THR A 117 -3.653 3.863 -11.694 1.00 0.00 N ATOM 470 CA THR A 117 -4.936 4.537 -11.858 1.00 0.00 C ATOM 471 C THR A 117 -5.486 4.996 -10.513 1.00 0.00 C ATOM 472 O THR A 117 -4.961 4.635 -9.459 1.00 0.00 O ATOM 473 CB THR A 117 -5.940 3.608 -12.542 1.00 0.00 C ATOM 474 OG1 THR A 117 -5.272 2.600 -13.279 1.00 0.00 O ATOM 475 CG2 THR A 117 -6.871 4.330 -13.492 1.00 0.00 C ATOM 0 H THR A 117 -3.720 2.907 -11.345 1.00 0.00 H new ATOM 0 HA THR A 117 -4.779 5.415 -12.484 1.00 0.00 H new ATOM 0 HB THR A 117 -6.532 3.178 -11.734 1.00 0.00 H new ATOM 0 HG1 THR A 117 -5.584 1.719 -12.985 1.00 0.00 H new ATOM 0 HG21 THR A 117 -7.557 3.614 -13.943 1.00 0.00 H new ATOM 0 HG22 THR A 117 -7.439 5.081 -12.944 1.00 0.00 H new ATOM 0 HG23 THR A 117 -6.288 4.816 -14.274 1.00 0.00 H new ATOM 483 N THR A 118 -6.549 5.793 -10.556 1.00 0.00 N ATOM 484 CA THR A 118 -7.174 6.303 -9.341 1.00 0.00 C ATOM 485 C THR A 118 -7.710 5.162 -8.479 1.00 0.00 C ATOM 486 O THR A 118 -7.879 5.314 -7.269 1.00 0.00 O ATOM 487 CB THR A 118 -8.309 7.266 -9.694 1.00 0.00 C ATOM 488 OG1 THR A 118 -9.298 6.614 -10.470 1.00 0.00 O ATOM 489 CG2 THR A 118 -7.845 8.480 -10.468 1.00 0.00 C ATOM 0 H THR A 118 -6.996 6.100 -11.420 1.00 0.00 H new ATOM 0 HA THR A 118 -6.415 6.837 -8.770 1.00 0.00 H new ATOM 0 HB THR A 118 -8.713 7.598 -8.738 1.00 0.00 H new ATOM 0 HG1 THR A 118 -10.016 7.246 -10.684 1.00 0.00 H new ATOM 0 HG21 THR A 118 -8.699 9.121 -10.686 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.118 9.034 -9.874 1.00 0.00 H new ATOM 0 HG23 THR A 118 -7.383 8.161 -11.402 1.00 0.00 H new ATOM 497 N GLU A 119 -7.975 4.020 -9.108 1.00 0.00 N ATOM 498 CA GLU A 119 -8.493 2.855 -8.396 1.00 0.00 C ATOM 499 C GLU A 119 -7.604 2.497 -7.208 1.00 0.00 C ATOM 500 O GLU A 119 -8.095 2.200 -6.119 1.00 0.00 O ATOM 501 CB GLU A 119 -8.601 1.659 -9.345 1.00 0.00 C ATOM 502 CG GLU A 119 -7.258 1.179 -9.871 1.00 0.00 C ATOM 503 CD GLU A 119 -7.393 0.315 -11.110 1.00 0.00 C ATOM 504 OE1 GLU A 119 -8.297 -0.547 -11.138 1.00 0.00 O ATOM 505 OE2 GLU A 119 -6.594 0.499 -12.052 1.00 0.00 O ATOM 0 H GLU A 119 -7.840 3.876 -10.109 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.485 3.105 -8.019 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -9.094 0.837 -8.826 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.236 1.930 -10.188 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -6.632 2.042 -10.100 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -6.748 0.613 -9.092 1.00 0.00 H new ATOM 512 N GLU A 120 -6.293 2.527 -7.427 1.00 0.00 N ATOM 513 CA GLU A 120 -5.335 2.206 -6.376 1.00 0.00 C ATOM 514 C GLU A 120 -5.388 3.242 -5.256 1.00 0.00 C ATOM 515 O GLU A 120 -5.467 2.893 -4.078 1.00 0.00 O ATOM 516 CB GLU A 120 -3.919 2.133 -6.952 1.00 0.00 C ATOM 517 CG GLU A 120 -3.560 0.765 -7.511 1.00 0.00 C ATOM 518 CD GLU A 120 -2.586 0.011 -6.627 1.00 0.00 C ATOM 519 OE1 GLU A 120 -1.758 0.666 -5.962 1.00 0.00 O ATOM 520 OE2 GLU A 120 -2.653 -1.236 -6.600 1.00 0.00 O ATOM 0 H GLU A 120 -5.870 2.770 -8.323 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.602 1.234 -5.961 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.818 2.877 -7.742 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.204 2.397 -6.172 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -4.469 0.175 -7.629 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -3.126 0.885 -8.504 1.00 0.00 H new ATOM 527 N LEU A 121 -5.342 4.515 -5.632 1.00 0.00 N ATOM 528 CA LEU A 121 -5.384 5.602 -4.660 1.00 0.00 C ATOM 529 C LEU A 121 -6.677 5.561 -3.851 1.00 0.00 C ATOM 530 O LEU A 121 -6.654 5.619 -2.622 1.00 0.00 O ATOM 531 CB LEU A 121 -5.252 6.953 -5.367 1.00 0.00 C ATOM 532 CG LEU A 121 -3.816 7.442 -5.564 1.00 0.00 C ATOM 533 CD1 LEU A 121 -3.788 8.669 -6.461 1.00 0.00 C ATOM 534 CD2 LEU A 121 -3.169 7.746 -4.222 1.00 0.00 C ATOM 0 H LEU A 121 -5.276 4.820 -6.603 1.00 0.00 H new ATOM 0 HA LEU A 121 -4.545 5.475 -3.975 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -5.733 6.884 -6.342 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -5.799 7.701 -4.794 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.246 6.650 -6.049 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -2.758 9.002 -6.590 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -4.212 8.419 -7.433 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -4.373 9.467 -6.004 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -2.148 8.093 -4.381 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -3.740 8.521 -3.710 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.155 6.843 -3.612 1.00 0.00 H new ATOM 546 N ALA A 122 -7.804 5.463 -4.549 1.00 0.00 N ATOM 547 CA ALA A 122 -9.106 5.414 -3.894 1.00 0.00 C ATOM 548 C ALA A 122 -9.202 4.222 -2.948 1.00 0.00 C ATOM 549 O ALA A 122 -9.869 4.287 -1.916 1.00 0.00 O ATOM 550 CB ALA A 122 -10.216 5.356 -4.933 1.00 0.00 C ATOM 0 H ALA A 122 -7.842 5.416 -5.567 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.222 6.322 -3.303 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -11.183 5.320 -4.431 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.169 6.242 -5.566 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -10.093 4.464 -5.548 1.00 0.00 H new ATOM 556 N SER A 123 -8.529 3.133 -3.308 1.00 0.00 N ATOM 557 CA SER A 123 -8.537 1.926 -2.491 1.00 0.00 C ATOM 558 C SER A 123 -7.820 2.159 -1.165 1.00 0.00 C ATOM 559 O SER A 123 -8.277 1.714 -0.112 1.00 0.00 O ATOM 560 CB SER A 123 -7.879 0.770 -3.247 1.00 0.00 C ATOM 561 OG SER A 123 -8.774 -0.319 -3.396 1.00 0.00 O ATOM 0 H SER A 123 -7.972 3.063 -4.160 1.00 0.00 H new ATOM 0 HA SER A 123 -9.574 1.668 -2.279 1.00 0.00 H new ATOM 0 HB2 SER A 123 -7.552 1.113 -4.229 1.00 0.00 H new ATOM 0 HB3 SER A 123 -6.988 0.442 -2.711 1.00 0.00 H new ATOM 0 HG SER A 123 -8.329 -1.043 -3.884 1.00 0.00 H new ATOM 567 N PHE A 124 -6.691 2.859 -1.224 1.00 0.00 N ATOM 568 CA PHE A 124 -5.908 3.150 -0.028 1.00 0.00 C ATOM 569 C PHE A 124 -6.663 4.092 0.904 1.00 0.00 C ATOM 570 O PHE A 124 -6.757 3.846 2.107 1.00 0.00 O ATOM 571 CB PHE A 124 -4.561 3.766 -0.411 1.00 0.00 C ATOM 572 CG PHE A 124 -3.550 3.731 0.699 1.00 0.00 C ATOM 573 CD1 PHE A 124 -3.627 4.629 1.752 1.00 0.00 C ATOM 574 CD2 PHE A 124 -2.522 2.801 0.690 1.00 0.00 C ATOM 575 CE1 PHE A 124 -2.699 4.598 2.776 1.00 0.00 C ATOM 576 CE2 PHE A 124 -1.591 2.766 1.710 1.00 0.00 C ATOM 577 CZ PHE A 124 -1.680 3.667 2.754 1.00 0.00 C ATOM 0 H PHE A 124 -6.298 3.235 -2.087 1.00 0.00 H new ATOM 0 HA PHE A 124 -5.735 2.211 0.497 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -4.160 3.235 -1.274 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -4.717 4.800 -0.717 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -4.421 5.361 1.773 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -2.448 2.095 -0.124 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -2.771 5.301 3.592 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -0.795 2.036 1.692 1.00 0.00 H new ATOM 0 HZ PHE A 124 -0.953 3.643 3.552 1.00 0.00 H new ATOM 587 N ILE A 125 -7.199 5.171 0.342 1.00 0.00 N ATOM 588 CA ILE A 125 -7.944 6.149 1.127 1.00 0.00 C ATOM 589 C ILE A 125 -9.150 5.504 1.803 1.00 0.00 C ATOM 590 O ILE A 125 -9.421 5.751 2.977 1.00 0.00 O ATOM 591 CB ILE A 125 -8.421 7.327 0.252 1.00 0.00 C ATOM 592 CG1 ILE A 125 -7.235 7.979 -0.459 1.00 0.00 C ATOM 593 CG2 ILE A 125 -9.163 8.355 1.096 1.00 0.00 C ATOM 594 CD1 ILE A 125 -7.635 8.848 -1.630 1.00 0.00 C ATOM 0 H ILE A 125 -7.132 5.390 -0.652 1.00 0.00 H new ATOM 0 HA ILE A 125 -7.265 6.529 1.890 1.00 0.00 H new ATOM 0 HB ILE A 125 -9.107 6.939 -0.501 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -6.680 8.583 0.258 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -6.559 7.199 -0.810 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -9.492 9.178 0.461 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -10.031 7.886 1.561 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -8.499 8.737 1.871 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -6.743 9.278 -2.086 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -8.164 8.244 -2.367 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -8.287 9.650 -1.282 1.00 0.00 H new ATOM 606 N ALA A 126 -9.871 4.676 1.053 1.00 0.00 N ATOM 607 CA ALA A 126 -11.048 3.997 1.582 1.00 0.00 C ATOM 608 C ALA A 126 -10.686 3.127 2.780 1.00 0.00 C ATOM 609 O ALA A 126 -11.373 3.144 3.802 1.00 0.00 O ATOM 610 CB ALA A 126 -11.704 3.157 0.496 1.00 0.00 C ATOM 0 H ALA A 126 -9.661 4.460 0.079 1.00 0.00 H new ATOM 0 HA ALA A 126 -11.756 4.755 1.917 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -12.581 2.655 0.904 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -12.006 3.801 -0.330 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -10.995 2.412 0.135 1.00 0.00 H new ATOM 616 N TYR A 127 -9.604 2.368 2.649 1.00 0.00 N ATOM 617 CA TYR A 127 -9.151 1.491 3.723 1.00 0.00 C ATOM 618 C TYR A 127 -8.656 2.303 4.916 1.00 0.00 C ATOM 619 O TYR A 127 -8.839 1.908 6.066 1.00 0.00 O ATOM 620 CB TYR A 127 -8.037 0.570 3.222 1.00 0.00 C ATOM 621 CG TYR A 127 -7.964 -0.749 3.958 1.00 0.00 C ATOM 622 CD1 TYR A 127 -9.007 -1.664 3.888 1.00 0.00 C ATOM 623 CD2 TYR A 127 -6.853 -1.079 4.724 1.00 0.00 C ATOM 624 CE1 TYR A 127 -8.945 -2.870 4.559 1.00 0.00 C ATOM 625 CE2 TYR A 127 -6.783 -2.283 5.398 1.00 0.00 C ATOM 626 CZ TYR A 127 -7.831 -3.175 5.313 1.00 0.00 C ATOM 627 OH TYR A 127 -7.765 -4.374 5.983 1.00 0.00 O ATOM 0 H TYR A 127 -9.024 2.342 1.810 1.00 0.00 H new ATOM 0 HA TYR A 127 -9.998 0.885 4.045 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -8.188 0.376 2.160 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -7.081 1.084 3.319 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -9.881 -1.429 3.299 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -6.030 -0.383 4.794 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -9.765 -3.570 4.494 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.912 -2.524 5.989 1.00 0.00 H new ATOM 0 HH TYR A 127 -6.914 -4.433 6.465 1.00 0.00 H new ATOM 637 N TRP A 128 -8.029 3.440 4.631 1.00 0.00 N ATOM 638 CA TRP A 128 -7.508 4.308 5.682 1.00 0.00 C ATOM 639 C TRP A 128 -8.646 4.895 6.513 1.00 0.00 C ATOM 640 O TRP A 128 -8.644 4.799 7.741 1.00 0.00 O ATOM 641 CB TRP A 128 -6.663 5.430 5.070 1.00 0.00 C ATOM 642 CG TRP A 128 -6.250 6.486 6.053 1.00 0.00 C ATOM 643 CD1 TRP A 128 -6.233 7.835 5.845 1.00 0.00 C ATOM 644 CD2 TRP A 128 -5.795 6.281 7.397 1.00 0.00 C ATOM 645 NE1 TRP A 128 -5.797 8.482 6.976 1.00 0.00 N ATOM 646 CE2 TRP A 128 -5.521 7.551 7.942 1.00 0.00 C ATOM 647 CE3 TRP A 128 -5.592 5.150 8.193 1.00 0.00 C ATOM 648 CZ2 TRP A 128 -5.056 7.718 9.244 1.00 0.00 C ATOM 649 CZ3 TRP A 128 -5.131 5.318 9.485 1.00 0.00 C ATOM 650 CH2 TRP A 128 -4.868 6.593 10.000 1.00 0.00 C ATOM 0 H TRP A 128 -7.869 3.782 3.683 1.00 0.00 H new ATOM 0 HA TRP A 128 -6.877 3.711 6.340 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -5.769 4.995 4.622 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -7.228 5.899 4.264 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -6.520 8.323 4.925 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -5.695 9.492 7.079 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -5.792 4.162 7.805 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.851 8.700 9.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -4.971 4.451 10.108 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -4.510 6.691 11.014 1.00 0.00 H new ATOM 661 N GLN A 129 -9.616 5.502 5.838 1.00 0.00 N ATOM 662 CA GLN A 129 -10.759 6.102 6.516 1.00 0.00 C ATOM 663 C GLN A 129 -11.680 5.028 7.086 1.00 0.00 C ATOM 664 O GLN A 129 -12.339 5.239 8.104 1.00 0.00 O ATOM 665 CB GLN A 129 -11.537 7.001 5.553 1.00 0.00 C ATOM 666 CG GLN A 129 -12.071 6.268 4.332 1.00 0.00 C ATOM 667 CD GLN A 129 -13.511 6.627 4.020 1.00 0.00 C ATOM 668 OE1 GLN A 129 -14.396 5.771 4.043 1.00 0.00 O ATOM 669 NE2 GLN A 129 -13.753 7.900 3.726 1.00 0.00 N ATOM 0 H GLN A 129 -9.634 5.591 4.822 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.383 6.707 7.341 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -12.371 7.455 6.087 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -10.889 7.813 5.224 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -11.447 6.503 3.470 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -11.996 5.193 4.496 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -12.989 8.576 3.719 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -14.703 8.201 3.508 1.00 0.00 H new ATOM 678 N ALA A 130 -11.722 3.876 6.423 1.00 0.00 N ATOM 679 CA ALA A 130 -12.562 2.770 6.864 1.00 0.00 C ATOM 680 C ALA A 130 -11.970 2.086 8.092 1.00 0.00 C ATOM 681 O ALA A 130 -12.694 1.712 9.015 1.00 0.00 O ATOM 682 CB ALA A 130 -12.749 1.767 5.736 1.00 0.00 C ATOM 0 H ALA A 130 -11.183 3.685 5.578 1.00 0.00 H new ATOM 0 HA ALA A 130 -13.536 3.174 7.141 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -13.379 0.946 6.080 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -13.225 2.258 4.887 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -11.778 1.377 5.432 1.00 0.00 H new ATOM 688 N GLU A 131 -10.651 1.922 8.095 1.00 0.00 N ATOM 689 CA GLU A 131 -9.963 1.280 9.210 1.00 0.00 C ATOM 690 C GLU A 131 -10.196 2.048 10.508 1.00 0.00 C ATOM 691 O GLU A 131 -10.378 1.452 11.568 1.00 0.00 O ATOM 692 CB GLU A 131 -8.464 1.180 8.925 1.00 0.00 C ATOM 693 CG GLU A 131 -8.066 -0.096 8.201 1.00 0.00 C ATOM 694 CD GLU A 131 -6.620 -0.480 8.447 1.00 0.00 C ATOM 695 OE1 GLU A 131 -6.268 -0.750 9.614 1.00 0.00 O ATOM 696 OE2 GLU A 131 -5.839 -0.511 7.472 1.00 0.00 O ATOM 0 H GLU A 131 -10.037 2.224 7.338 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.370 0.276 9.324 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.158 2.038 8.326 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.919 1.238 9.867 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.714 -0.910 8.525 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -8.227 0.033 7.131 1.00 0.00 H new ATOM 703 N GLY A 132 -10.186 3.373 10.415 1.00 0.00 N ATOM 704 CA GLY A 132 -10.397 4.200 11.589 1.00 0.00 C ATOM 705 C GLY A 132 -9.360 3.950 12.666 1.00 0.00 C ATOM 706 O GLY A 132 -9.678 3.954 13.856 1.00 0.00 O ATOM 0 H GLY A 132 -10.036 3.889 9.548 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -10.370 5.251 11.300 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -11.391 4.006 11.993 1.00 0.00 H new ATOM 710 N LYS A 133 -8.118 3.733 12.249 1.00 0.00 N ATOM 711 CA LYS A 133 -7.029 3.480 13.185 1.00 0.00 C ATOM 712 C LYS A 133 -5.881 4.461 12.960 1.00 0.00 C ATOM 713 O LYS A 133 -6.042 5.475 12.282 1.00 0.00 O ATOM 714 CB LYS A 133 -6.529 2.040 13.039 1.00 0.00 C ATOM 715 CG LYS A 133 -6.346 1.322 14.365 1.00 0.00 C ATOM 716 CD LYS A 133 -5.720 -0.051 14.175 1.00 0.00 C ATOM 717 CE LYS A 133 -4.207 0.002 14.314 1.00 0.00 C ATOM 718 NZ LYS A 133 -3.752 -0.521 15.633 1.00 0.00 N ATOM 0 H LYS A 133 -7.840 3.727 11.268 1.00 0.00 H new ATOM 0 HA LYS A 133 -7.408 3.622 14.197 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -7.235 1.480 12.426 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -5.579 2.047 12.505 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -5.716 1.923 15.021 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -7.312 1.217 14.859 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -6.130 -0.744 14.910 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -5.983 -0.439 13.191 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -3.748 -0.580 13.515 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -3.867 1.031 14.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -2.715 -0.468 15.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -4.169 0.050 16.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -4.054 -1.511 15.737 1.00 0.00 H new ATOM 732 N VAL A 134 -4.723 4.152 13.534 1.00 0.00 N ATOM 733 CA VAL A 134 -3.550 5.003 13.398 1.00 0.00 C ATOM 734 C VAL A 134 -2.320 4.186 13.017 1.00 0.00 C ATOM 735 O VAL A 134 -2.135 3.066 13.493 1.00 0.00 O ATOM 736 CB VAL A 134 -3.259 5.773 14.700 1.00 0.00 C ATOM 737 CG1 VAL A 134 -2.171 6.810 14.476 1.00 0.00 C ATOM 738 CG2 VAL A 134 -4.527 6.424 15.231 1.00 0.00 C ATOM 0 H VAL A 134 -4.573 3.316 14.099 1.00 0.00 H new ATOM 0 HA VAL A 134 -3.768 5.718 12.605 1.00 0.00 H new ATOM 0 HB VAL A 134 -2.903 5.064 15.447 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -1.980 7.343 15.407 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -1.258 6.314 14.148 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -2.494 7.517 13.712 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -4.301 6.963 16.151 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -4.917 7.120 14.489 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -5.273 5.656 15.434 1.00 0.00 H new ATOM 748 N PHE A 135 -1.481 4.753 12.155 1.00 0.00 N ATOM 749 CA PHE A 135 -0.269 4.076 11.711 1.00 0.00 C ATOM 750 C PHE A 135 0.953 4.973 11.885 1.00 0.00 C ATOM 751 O PHE A 135 0.834 6.197 11.934 1.00 0.00 O ATOM 752 CB PHE A 135 -0.399 3.654 10.246 1.00 0.00 C ATOM 753 CG PHE A 135 -1.726 3.031 9.912 1.00 0.00 C ATOM 754 CD1 PHE A 135 -2.300 2.097 10.757 1.00 0.00 C ATOM 755 CD2 PHE A 135 -2.396 3.381 8.751 1.00 0.00 C ATOM 756 CE1 PHE A 135 -3.520 1.522 10.452 1.00 0.00 C ATOM 757 CE2 PHE A 135 -3.616 2.811 8.440 1.00 0.00 C ATOM 758 CZ PHE A 135 -4.178 1.881 9.291 1.00 0.00 C ATOM 0 H PHE A 135 -1.619 5.679 11.751 1.00 0.00 H new ATOM 0 HA PHE A 135 -0.137 3.187 12.328 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -0.247 4.527 9.611 1.00 0.00 H new ATOM 0 HB3 PHE A 135 0.395 2.946 10.009 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -1.789 1.814 11.665 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -1.960 4.108 8.081 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -3.957 0.794 11.119 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -4.129 3.093 7.532 1.00 0.00 H new ATOM 0 HZ PHE A 135 -5.131 1.434 9.050 1.00 0.00 H new ATOM 768 N HIS A 136 2.125 4.354 11.976 1.00 0.00 N ATOM 769 CA HIS A 136 3.370 5.096 12.143 1.00 0.00 C ATOM 770 C HIS A 136 3.951 5.492 10.790 1.00 0.00 C ATOM 771 O HIS A 136 3.466 5.058 9.745 1.00 0.00 O ATOM 772 CB HIS A 136 4.386 4.259 12.923 1.00 0.00 C ATOM 773 CG HIS A 136 3.871 3.755 14.234 1.00 0.00 C ATOM 774 ND1 HIS A 136 4.629 3.745 15.387 1.00 0.00 N ATOM 775 CD2 HIS A 136 2.665 3.239 14.575 1.00 0.00 C ATOM 776 CE1 HIS A 136 3.913 3.246 16.379 1.00 0.00 C ATOM 777 NE2 HIS A 136 2.719 2.931 15.912 1.00 0.00 N ATOM 0 H HIS A 136 2.239 3.341 11.937 1.00 0.00 H new ATOM 0 HA HIS A 136 3.151 6.004 12.705 1.00 0.00 H new ATOM 0 HB2 HIS A 136 4.689 3.409 12.311 1.00 0.00 H new ATOM 0 HB3 HIS A 136 5.278 4.859 13.100 1.00 0.00 H new ATOM 0 HD2 HIS A 136 1.820 3.097 13.918 1.00 0.00 H new ATOM 0 HE1 HIS A 136 4.247 3.118 17.398 1.00 0.00 H new ATOM 0 HE2 HIS A 136 1.959 2.524 16.457 1.00 0.00 H new ATOM 786 N HIS A 137 4.993 6.315 10.817 1.00 0.00 N ATOM 787 CA HIS A 137 5.641 6.766 9.590 1.00 0.00 C ATOM 788 C HIS A 137 6.335 5.606 8.886 1.00 0.00 C ATOM 789 O HIS A 137 6.218 5.444 7.671 1.00 0.00 O ATOM 790 CB HIS A 137 6.654 7.871 9.898 1.00 0.00 C ATOM 791 CG HIS A 137 6.024 9.148 10.362 1.00 0.00 C ATOM 792 ND1 HIS A 137 5.663 10.165 9.503 1.00 0.00 N ATOM 793 CD2 HIS A 137 5.689 9.570 11.605 1.00 0.00 C ATOM 794 CE1 HIS A 137 5.135 11.157 10.196 1.00 0.00 C ATOM 795 NE2 HIS A 137 5.138 10.821 11.473 1.00 0.00 N ATOM 0 H HIS A 137 5.407 6.683 11.673 1.00 0.00 H new ATOM 0 HA HIS A 137 4.872 7.164 8.927 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.344 7.517 10.664 1.00 0.00 H new ATOM 0 HB3 HIS A 137 7.245 8.071 9.004 1.00 0.00 H new ATOM 0 HD2 HIS A 137 5.829 9.025 12.527 1.00 0.00 H new ATOM 0 HE1 HIS A 137 4.764 12.085 9.788 1.00 0.00 H new ATOM 0 HE2 HIS A 137 4.788 11.398 12.238 1.00 0.00 H new ATOM 804 N VAL A 138 7.055 4.799 9.658 1.00 0.00 N ATOM 805 CA VAL A 138 7.767 3.650 9.110 1.00 0.00 C ATOM 806 C VAL A 138 6.792 2.585 8.623 1.00 0.00 C ATOM 807 O VAL A 138 7.064 1.877 7.654 1.00 0.00 O ATOM 808 CB VAL A 138 8.713 3.026 10.153 1.00 0.00 C ATOM 809 CG1 VAL A 138 9.590 1.962 9.509 1.00 0.00 C ATOM 810 CG2 VAL A 138 9.563 4.100 10.815 1.00 0.00 C ATOM 0 H VAL A 138 7.161 4.919 10.665 1.00 0.00 H new ATOM 0 HA VAL A 138 8.357 4.013 8.268 1.00 0.00 H new ATOM 0 HB VAL A 138 8.109 2.548 10.924 1.00 0.00 H new ATOM 0 HG11 VAL A 138 10.252 1.532 10.261 1.00 0.00 H new ATOM 0 HG12 VAL A 138 8.961 1.178 9.088 1.00 0.00 H new ATOM 0 HG13 VAL A 138 10.186 2.413 8.716 1.00 0.00 H new ATOM 0 HG21 VAL A 138 10.225 3.639 11.549 1.00 0.00 H new ATOM 0 HG22 VAL A 138 10.159 4.610 10.058 1.00 0.00 H new ATOM 0 HG23 VAL A 138 8.915 4.821 11.313 1.00 0.00 H new ATOM 820 N GLN A 139 5.655 2.477 9.302 1.00 0.00 N ATOM 821 CA GLN A 139 4.637 1.498 8.939 1.00 0.00 C ATOM 822 C GLN A 139 3.947 1.893 7.638 1.00 0.00 C ATOM 823 O GLN A 139 3.642 1.043 6.801 1.00 0.00 O ATOM 824 CB GLN A 139 3.604 1.366 10.059 1.00 0.00 C ATOM 825 CG GLN A 139 3.039 -0.039 10.203 1.00 0.00 C ATOM 826 CD GLN A 139 3.933 -0.944 11.027 1.00 0.00 C ATOM 827 OE1 GLN A 139 4.616 -1.817 10.490 1.00 0.00 O ATOM 828 NE2 GLN A 139 3.931 -0.742 12.339 1.00 0.00 N ATOM 0 H GLN A 139 5.415 3.056 10.107 1.00 0.00 H new ATOM 0 HA GLN A 139 5.127 0.535 8.793 1.00 0.00 H new ATOM 0 HB2 GLN A 139 4.063 1.663 11.002 1.00 0.00 H new ATOM 0 HB3 GLN A 139 2.785 2.060 9.871 1.00 0.00 H new ATOM 0 HG2 GLN A 139 2.055 0.015 10.668 1.00 0.00 H new ATOM 0 HG3 GLN A 139 2.900 -0.474 9.213 1.00 0.00 H new ATOM 0 HE21 GLN A 139 3.349 -0.007 12.741 1.00 0.00 H new ATOM 0 HE22 GLN A 139 4.511 -1.322 12.945 1.00 0.00 H new ATOM 837 N TRP A 140 3.705 3.187 7.475 1.00 0.00 N ATOM 838 CA TRP A 140 3.051 3.699 6.277 1.00 0.00 C ATOM 839 C TRP A 140 3.928 3.486 5.048 1.00 0.00 C ATOM 840 O TRP A 140 3.449 3.063 3.996 1.00 0.00 O ATOM 841 CB TRP A 140 2.736 5.187 6.439 1.00 0.00 C ATOM 842 CG TRP A 140 1.691 5.681 5.486 1.00 0.00 C ATOM 843 CD1 TRP A 140 0.337 5.648 5.666 1.00 0.00 C ATOM 844 CD2 TRP A 140 1.913 6.279 4.204 1.00 0.00 C ATOM 845 NE1 TRP A 140 -0.296 6.191 4.573 1.00 0.00 N ATOM 846 CE2 TRP A 140 0.649 6.585 3.663 1.00 0.00 C ATOM 847 CE3 TRP A 140 3.056 6.587 3.462 1.00 0.00 C ATOM 848 CZ2 TRP A 140 0.500 7.183 2.414 1.00 0.00 C ATOM 849 CZ3 TRP A 140 2.906 7.181 2.223 1.00 0.00 C ATOM 850 CH2 TRP A 140 1.637 7.473 1.710 1.00 0.00 C ATOM 0 H TRP A 140 3.952 3.903 8.158 1.00 0.00 H new ATOM 0 HA TRP A 140 2.120 3.150 6.138 1.00 0.00 H new ATOM 0 HB2 TRP A 140 2.402 5.371 7.460 1.00 0.00 H new ATOM 0 HB3 TRP A 140 3.650 5.762 6.294 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -0.163 5.253 6.538 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -1.305 6.285 4.458 1.00 0.00 H new ATOM 0 HE3 TRP A 140 4.039 6.365 3.850 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -0.478 7.410 2.015 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 3.783 7.424 1.641 1.00 0.00 H new ATOM 0 HH2 TRP A 140 1.553 7.937 0.738 1.00 0.00 H new ATOM 861 N GLN A 141 5.216 3.781 5.188 1.00 0.00 N ATOM 862 CA GLN A 141 6.163 3.623 4.091 1.00 0.00 C ATOM 863 C GLN A 141 6.422 2.148 3.799 1.00 0.00 C ATOM 864 O GLN A 141 6.475 1.735 2.640 1.00 0.00 O ATOM 865 CB GLN A 141 7.480 4.325 4.423 1.00 0.00 C ATOM 866 CG GLN A 141 8.137 3.815 5.695 1.00 0.00 C ATOM 867 CD GLN A 141 9.447 4.516 5.998 1.00 0.00 C ATOM 868 OE1 GLN A 141 10.476 3.872 6.198 1.00 0.00 O ATOM 869 NE2 GLN A 141 9.414 5.843 6.035 1.00 0.00 N ATOM 0 H GLN A 141 5.628 4.132 6.053 1.00 0.00 H new ATOM 0 HA GLN A 141 5.727 4.079 3.202 1.00 0.00 H new ATOM 0 HB2 GLN A 141 8.171 4.196 3.590 1.00 0.00 H new ATOM 0 HB3 GLN A 141 7.297 5.395 4.522 1.00 0.00 H new ATOM 0 HG2 GLN A 141 7.453 3.953 6.533 1.00 0.00 H new ATOM 0 HG3 GLN A 141 8.316 2.744 5.603 1.00 0.00 H new ATOM 0 HE21 GLN A 141 8.538 6.336 5.863 1.00 0.00 H new ATOM 0 HE22 GLN A 141 10.265 6.369 6.235 1.00 0.00 H new ATOM 878 N GLN A 142 6.585 1.361 4.857 1.00 0.00 N ATOM 879 CA GLN A 142 6.843 -0.067 4.714 1.00 0.00 C ATOM 880 C GLN A 142 5.672 -0.776 4.039 1.00 0.00 C ATOM 881 O GLN A 142 5.856 -1.522 3.080 1.00 0.00 O ATOM 882 CB GLN A 142 7.111 -0.696 6.083 1.00 0.00 C ATOM 883 CG GLN A 142 8.545 -0.523 6.561 1.00 0.00 C ATOM 884 CD GLN A 142 9.273 -1.845 6.714 1.00 0.00 C ATOM 885 OE1 GLN A 142 9.840 -2.369 5.755 1.00 0.00 O ATOM 886 NE2 GLN A 142 9.261 -2.391 7.925 1.00 0.00 N ATOM 0 H GLN A 142 6.543 1.688 5.822 1.00 0.00 H new ATOM 0 HA GLN A 142 7.724 -0.186 4.083 1.00 0.00 H new ATOM 0 HB2 GLN A 142 6.436 -0.253 6.816 1.00 0.00 H new ATOM 0 HB3 GLN A 142 6.878 -1.760 6.037 1.00 0.00 H new ATOM 0 HG2 GLN A 142 9.086 0.106 5.854 1.00 0.00 H new ATOM 0 HG3 GLN A 142 8.545 0.000 7.517 1.00 0.00 H new ATOM 0 HE21 GLN A 142 8.778 -1.922 8.691 1.00 0.00 H new ATOM 0 HE22 GLN A 142 9.734 -3.280 8.089 1.00 0.00 H new ATOM 895 N LYS A 143 4.468 -0.542 4.552 1.00 0.00 N ATOM 896 CA LYS A 143 3.269 -1.164 4.003 1.00 0.00 C ATOM 897 C LYS A 143 3.086 -0.810 2.529 1.00 0.00 C ATOM 898 O LYS A 143 2.948 -1.692 1.683 1.00 0.00 O ATOM 899 CB LYS A 143 2.036 -0.730 4.798 1.00 0.00 C ATOM 900 CG LYS A 143 0.969 -1.809 4.903 1.00 0.00 C ATOM 901 CD LYS A 143 0.547 -2.042 6.346 1.00 0.00 C ATOM 902 CE LYS A 143 1.240 -3.258 6.943 1.00 0.00 C ATOM 903 NZ LYS A 143 0.264 -4.278 7.414 1.00 0.00 N ATOM 0 H LYS A 143 4.297 0.074 5.347 1.00 0.00 H new ATOM 0 HA LYS A 143 3.388 -2.245 4.082 1.00 0.00 H new ATOM 0 HB2 LYS A 143 2.345 -0.438 5.801 1.00 0.00 H new ATOM 0 HB3 LYS A 143 1.603 0.153 4.328 1.00 0.00 H new ATOM 0 HG2 LYS A 143 0.100 -1.521 4.311 1.00 0.00 H new ATOM 0 HG3 LYS A 143 1.349 -2.739 4.480 1.00 0.00 H new ATOM 0 HD2 LYS A 143 0.782 -1.160 6.941 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -0.533 -2.179 6.392 1.00 0.00 H new ATOM 0 HE2 LYS A 143 1.899 -3.703 6.197 1.00 0.00 H new ATOM 0 HE3 LYS A 143 1.868 -2.945 7.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 0.776 -5.090 7.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -0.348 -3.861 8.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -0.319 -4.596 6.614 1.00 0.00 H new ATOM 917 N LEU A 144 3.081 0.485 2.230 1.00 0.00 N ATOM 918 CA LEU A 144 2.907 0.952 0.857 1.00 0.00 C ATOM 919 C LEU A 144 3.984 0.380 -0.062 1.00 0.00 C ATOM 920 O LEU A 144 3.692 -0.054 -1.177 1.00 0.00 O ATOM 921 CB LEU A 144 2.938 2.483 0.812 1.00 0.00 C ATOM 922 CG LEU A 144 1.626 3.142 0.382 1.00 0.00 C ATOM 923 CD1 LEU A 144 1.409 4.445 1.135 1.00 0.00 C ATOM 924 CD2 LEU A 144 1.619 3.386 -1.120 1.00 0.00 C ATOM 0 H LEU A 144 3.195 1.229 2.918 1.00 0.00 H new ATOM 0 HA LEU A 144 1.938 0.602 0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 144 3.208 2.856 1.800 1.00 0.00 H new ATOM 0 HB3 LEU A 144 3.726 2.796 0.127 1.00 0.00 H new ATOM 0 HG LEU A 144 0.807 2.465 0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 144 0.471 4.898 0.815 1.00 0.00 H new ATOM 0 HD12 LEU A 144 1.368 4.244 2.206 1.00 0.00 H new ATOM 0 HD13 LEU A 144 2.232 5.128 0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 144 0.678 3.855 -1.408 1.00 0.00 H new ATOM 0 HD22 LEU A 144 2.448 4.042 -1.386 1.00 0.00 H new ATOM 0 HD23 LEU A 144 1.726 2.436 -1.643 1.00 0.00 H new ATOM 936 N ALA A 145 5.226 0.388 0.407 1.00 0.00 N ATOM 937 CA ALA A 145 6.342 -0.125 -0.380 1.00 0.00 C ATOM 938 C ALA A 145 6.232 -1.633 -0.586 1.00 0.00 C ATOM 939 O ALA A 145 6.162 -2.110 -1.717 1.00 0.00 O ATOM 940 CB ALA A 145 7.662 0.222 0.292 1.00 0.00 C ATOM 0 H ALA A 145 5.486 0.743 1.327 1.00 0.00 H new ATOM 0 HA ALA A 145 6.307 0.349 -1.361 1.00 0.00 H new ATOM 0 HB1 ALA A 145 8.487 -0.166 -0.305 1.00 0.00 H new ATOM 0 HB2 ALA A 145 7.753 1.305 0.377 1.00 0.00 H new ATOM 0 HB3 ALA A 145 7.692 -0.224 1.286 1.00 0.00 H new ATOM 946 N ARG A 146 6.224 -2.377 0.515 1.00 0.00 N ATOM 947 CA ARG A 146 6.128 -3.831 0.453 1.00 0.00 C ATOM 948 C ARG A 146 4.857 -4.269 -0.270 1.00 0.00 C ATOM 949 O ARG A 146 4.826 -5.323 -0.904 1.00 0.00 O ATOM 950 CB ARG A 146 6.156 -4.426 1.863 1.00 0.00 C ATOM 951 CG ARG A 146 7.543 -4.854 2.314 1.00 0.00 C ATOM 952 CD ARG A 146 7.813 -6.311 1.974 1.00 0.00 C ATOM 953 NE ARG A 146 8.749 -6.928 2.912 1.00 0.00 N ATOM 954 CZ ARG A 146 10.063 -6.723 2.890 1.00 0.00 C ATOM 955 NH1 ARG A 146 10.602 -5.918 1.982 1.00 0.00 N ATOM 956 NH2 ARG A 146 10.844 -7.324 3.779 1.00 0.00 N ATOM 0 H ARG A 146 6.283 -1.998 1.460 1.00 0.00 H new ATOM 0 HA ARG A 146 6.986 -4.199 -0.109 1.00 0.00 H new ATOM 0 HB2 ARG A 146 5.765 -3.691 2.567 1.00 0.00 H new ATOM 0 HB3 ARG A 146 5.489 -5.288 1.898 1.00 0.00 H new ATOM 0 HG2 ARG A 146 8.293 -4.223 1.837 1.00 0.00 H new ATOM 0 HG3 ARG A 146 7.639 -4.706 3.390 1.00 0.00 H new ATOM 0 HD2 ARG A 146 6.874 -6.865 1.981 1.00 0.00 H new ATOM 0 HD3 ARG A 146 8.215 -6.379 0.963 1.00 0.00 H new ATOM 0 HE ARG A 146 8.372 -7.552 3.625 1.00 0.00 H new ATOM 0 HH11 ARG A 146 10.008 -5.453 1.296 1.00 0.00 H new ATOM 0 HH12 ARG A 146 11.610 -5.765 1.970 1.00 0.00 H new ATOM 0 HH21 ARG A 146 10.437 -7.943 4.480 1.00 0.00 H new ATOM 0 HH22 ARG A 146 11.852 -7.166 3.762 1.00 0.00 H new ATOM 970 N SER A 147 3.811 -3.457 -0.169 1.00 0.00 N ATOM 971 CA SER A 147 2.541 -3.771 -0.814 1.00 0.00 C ATOM 972 C SER A 147 2.645 -3.626 -2.328 1.00 0.00 C ATOM 973 O SER A 147 2.300 -4.542 -3.074 1.00 0.00 O ATOM 974 CB SER A 147 1.434 -2.861 -0.277 1.00 0.00 C ATOM 975 OG SER A 147 0.213 -3.089 -0.958 1.00 0.00 O ATOM 0 H SER A 147 3.816 -2.580 0.351 1.00 0.00 H new ATOM 0 HA SER A 147 2.294 -4.808 -0.585 1.00 0.00 H new ATOM 0 HB2 SER A 147 1.298 -3.039 0.790 1.00 0.00 H new ATOM 0 HB3 SER A 147 1.729 -1.818 -0.391 1.00 0.00 H new ATOM 0 HG SER A 147 -0.479 -2.497 -0.596 1.00 0.00 H new ATOM 981 N LEU A 148 3.119 -2.469 -2.777 1.00 0.00 N ATOM 982 CA LEU A 148 3.268 -2.205 -4.204 1.00 0.00 C ATOM 983 C LEU A 148 4.212 -3.215 -4.849 1.00 0.00 C ATOM 984 O LEU A 148 4.076 -3.543 -6.028 1.00 0.00 O ATOM 985 CB LEU A 148 3.786 -0.783 -4.430 1.00 0.00 C ATOM 986 CG LEU A 148 2.757 0.324 -4.196 1.00 0.00 C ATOM 987 CD1 LEU A 148 3.429 1.688 -4.203 1.00 0.00 C ATOM 988 CD2 LEU A 148 1.660 0.264 -5.249 1.00 0.00 C ATOM 0 H LEU A 148 3.407 -1.699 -2.174 1.00 0.00 H new ATOM 0 HA LEU A 148 2.288 -2.304 -4.671 1.00 0.00 H new ATOM 0 HB2 LEU A 148 4.637 -0.613 -3.770 1.00 0.00 H new ATOM 0 HB3 LEU A 148 4.155 -0.705 -5.453 1.00 0.00 H new ATOM 0 HG LEU A 148 2.303 0.170 -3.217 1.00 0.00 H new ATOM 0 HD11 LEU A 148 2.681 2.463 -4.035 1.00 0.00 H new ATOM 0 HD12 LEU A 148 4.178 1.729 -3.412 1.00 0.00 H new ATOM 0 HD13 LEU A 148 3.911 1.851 -5.167 1.00 0.00 H new ATOM 0 HD21 LEU A 148 0.937 1.059 -5.067 1.00 0.00 H new ATOM 0 HD22 LEU A 148 2.098 0.392 -6.239 1.00 0.00 H new ATOM 0 HD23 LEU A 148 1.158 -0.702 -5.197 1.00 0.00 H new ATOM 1000 N GLN A 149 5.169 -3.705 -4.067 1.00 0.00 N ATOM 1001 CA GLN A 149 6.137 -4.678 -4.562 1.00 0.00 C ATOM 1002 C GLN A 149 5.467 -6.022 -4.835 1.00 0.00 C ATOM 1003 O GLN A 149 5.566 -6.563 -5.936 1.00 0.00 O ATOM 1004 CB GLN A 149 7.276 -4.854 -3.554 1.00 0.00 C ATOM 1005 CG GLN A 149 8.596 -4.257 -4.017 1.00 0.00 C ATOM 1006 CD GLN A 149 9.704 -5.288 -4.106 1.00 0.00 C ATOM 1007 OE1 GLN A 149 9.447 -6.490 -4.158 1.00 0.00 O ATOM 1008 NE2 GLN A 149 10.947 -4.820 -4.123 1.00 0.00 N ATOM 0 H GLN A 149 5.295 -3.445 -3.089 1.00 0.00 H new ATOM 0 HA GLN A 149 6.547 -4.302 -5.499 1.00 0.00 H new ATOM 0 HB2 GLN A 149 6.989 -4.392 -2.610 1.00 0.00 H new ATOM 0 HB3 GLN A 149 7.416 -5.917 -3.359 1.00 0.00 H new ATOM 0 HG2 GLN A 149 8.458 -3.793 -4.993 1.00 0.00 H new ATOM 0 HG3 GLN A 149 8.895 -3.467 -3.328 1.00 0.00 H new ATOM 0 HE21 GLN A 149 11.114 -3.815 -4.078 1.00 0.00 H new ATOM 0 HE22 GLN A 149 11.734 -5.466 -4.181 1.00 0.00 H new ATOM 1017 N ILE A 150 4.784 -6.554 -3.827 1.00 0.00 N ATOM 1018 CA ILE A 150 4.098 -7.834 -3.961 1.00 0.00 C ATOM 1019 C ILE A 150 2.895 -7.724 -4.893 1.00 0.00 C ATOM 1020 O ILE A 150 2.417 -8.727 -5.427 1.00 0.00 O ATOM 1021 CB ILE A 150 3.628 -8.367 -2.594 1.00 0.00 C ATOM 1022 CG1 ILE A 150 4.788 -8.370 -1.596 1.00 0.00 C ATOM 1023 CG2 ILE A 150 3.044 -9.766 -2.739 1.00 0.00 C ATOM 1024 CD1 ILE A 150 5.896 -9.334 -1.958 1.00 0.00 C ATOM 0 H ILE A 150 4.691 -6.119 -2.909 1.00 0.00 H new ATOM 0 HA ILE A 150 4.819 -8.532 -4.387 1.00 0.00 H new ATOM 0 HB ILE A 150 2.848 -7.707 -2.215 1.00 0.00 H new ATOM 0 HG12 ILE A 150 5.201 -7.364 -1.529 1.00 0.00 H new ATOM 0 HG13 ILE A 150 4.405 -8.624 -0.608 1.00 0.00 H new ATOM 0 HG21 ILE A 150 2.717 -10.127 -1.764 1.00 0.00 H new ATOM 0 HG22 ILE A 150 2.193 -9.736 -3.419 1.00 0.00 H new ATOM 0 HG23 ILE A 150 3.804 -10.438 -3.138 1.00 0.00 H new ATOM 0 HD11 ILE A 150 6.684 -9.282 -1.206 1.00 0.00 H new ATOM 0 HD12 ILE A 150 5.498 -10.348 -1.997 1.00 0.00 H new ATOM 0 HD13 ILE A 150 6.306 -9.068 -2.932 1.00 0.00 H new ATOM 1036 N GLY A 151 2.406 -6.505 -5.085 1.00 0.00 N ATOM 1037 CA GLY A 151 1.263 -6.290 -5.952 1.00 0.00 C ATOM 1038 C GLY A 151 1.621 -6.400 -7.421 1.00 0.00 C ATOM 1039 O GLY A 151 0.925 -7.066 -8.188 1.00 0.00 O ATOM 0 H GLY A 151 2.781 -5.660 -4.655 1.00 0.00 H new ATOM 0 HA2 GLY A 151 0.488 -7.019 -5.714 1.00 0.00 H new ATOM 0 HA3 GLY A 151 0.843 -5.303 -5.756 1.00 0.00 H new