USER MOD reduce.3.24.130724 H: found=0, std=0, add=510, rem=0, adj=10 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 -156:sc= -1.75 (180deg=-2.93!) USER MOD Single : A 91 MET CE :methyl -143:sc= -0.525 (180deg=-2.77!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.12) USER MOD Single : A 117 THR OG1 : rot 144:sc= 0.373 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= -0.665 X(o=-0.66,f=-0.67) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 HIS :FLIP no HD1:sc= -0.445 F(o=-1.2,f=-0.44) USER MOD Single : A 137 HIS :FLIP no HD1:sc= -0.0746 F(o=-0.61,f=-0.075) USER MOD Single : A 139 GLN : amide:sc=-0.00664 K(o=-0.0066,f=-1.8) USER MOD Single : A 141 GLN : amide:sc= -3.29 K(o=-3.3,f=-6.5!) USER MOD Single : A 142 GLN : amide:sc= -1.12 K(o=-1.1,f=-8.5!) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 93:sc= 0.24 USER MOD Single : A 149 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 88 2.251 6.567 16.720 1.00 0.00 N ATOM 2 CA MET A 88 1.064 6.499 15.827 1.00 0.00 C ATOM 3 C MET A 88 0.491 7.888 15.568 1.00 0.00 C ATOM 4 O MET A 88 0.342 8.690 16.490 1.00 0.00 O ATOM 5 CB MET A 88 0.010 5.605 16.482 1.00 0.00 C ATOM 6 CG MET A 88 -0.417 6.079 17.863 1.00 0.00 C ATOM 7 SD MET A 88 -2.206 6.245 18.023 1.00 0.00 S ATOM 8 CE MET A 88 -2.727 4.545 17.804 1.00 0.00 C ATOM 0 HA MET A 88 1.363 6.082 14.865 1.00 0.00 H new ATOM 0 HB2 MET A 88 -0.867 5.558 15.836 1.00 0.00 H new ATOM 0 HB3 MET A 88 0.403 4.591 16.560 1.00 0.00 H new ATOM 0 HG2 MET A 88 -0.054 5.375 18.612 1.00 0.00 H new ATOM 0 HG3 MET A 88 0.053 7.040 18.074 1.00 0.00 H new ATOM 0 HE1 MET A 88 -3.759 4.523 17.454 1.00 0.00 H new ATOM 0 HE2 MET A 88 -2.085 4.059 17.069 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.655 4.017 18.755 1.00 0.00 H new ATOM 20 N PHE A 89 0.170 8.166 14.309 1.00 0.00 N ATOM 21 CA PHE A 89 -0.387 9.460 13.931 1.00 0.00 C ATOM 22 C PHE A 89 -1.366 9.314 12.773 1.00 0.00 C ATOM 23 O PHE A 89 -0.979 8.956 11.660 1.00 0.00 O ATOM 24 CB PHE A 89 0.733 10.430 13.549 1.00 0.00 C ATOM 25 CG PHE A 89 1.650 10.768 14.689 1.00 0.00 C ATOM 26 CD1 PHE A 89 1.168 11.420 15.812 1.00 0.00 C ATOM 27 CD2 PHE A 89 2.993 10.433 14.637 1.00 0.00 C ATOM 28 CE1 PHE A 89 2.010 11.732 16.864 1.00 0.00 C ATOM 29 CE2 PHE A 89 3.840 10.743 15.685 1.00 0.00 C ATOM 30 CZ PHE A 89 3.348 11.393 16.800 1.00 0.00 C ATOM 0 H PHE A 89 0.286 7.513 13.534 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.926 9.859 14.790 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.319 9.995 12.739 1.00 0.00 H new ATOM 0 HB3 PHE A 89 0.291 11.349 13.164 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.123 11.688 15.867 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.383 9.924 13.768 1.00 0.00 H new ATOM 0 HE1 PHE A 89 1.622 12.240 17.735 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.885 10.477 15.632 1.00 0.00 H new ATOM 0 HZ PHE A 89 4.008 11.636 17.620 1.00 0.00 H new ATOM 40 N ALA A 90 -2.638 9.593 13.041 1.00 0.00 N ATOM 41 CA ALA A 90 -3.674 9.494 12.024 1.00 0.00 C ATOM 42 C ALA A 90 -3.515 10.586 10.974 1.00 0.00 C ATOM 43 O ALA A 90 -2.601 11.407 11.048 1.00 0.00 O ATOM 44 CB ALA A 90 -5.051 9.570 12.665 1.00 0.00 C ATOM 0 H ALA A 90 -2.974 9.890 13.957 1.00 0.00 H new ATOM 0 HA ALA A 90 -3.571 8.530 11.526 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.816 9.495 11.893 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -5.168 8.750 13.373 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -5.156 10.520 13.189 1.00 0.00 H new ATOM 50 N MET A 91 -4.413 10.588 9.997 1.00 0.00 N ATOM 51 CA MET A 91 -4.378 11.577 8.926 1.00 0.00 C ATOM 52 C MET A 91 -5.780 11.839 8.385 1.00 0.00 C ATOM 53 O MET A 91 -6.766 11.323 8.912 1.00 0.00 O ATOM 54 CB MET A 91 -3.460 11.104 7.798 1.00 0.00 C ATOM 55 CG MET A 91 -2.031 11.604 7.926 1.00 0.00 C ATOM 56 SD MET A 91 -0.899 10.768 6.797 1.00 0.00 S ATOM 57 CE MET A 91 -1.176 9.057 7.246 1.00 0.00 C ATOM 0 H MET A 91 -5.176 9.915 9.924 1.00 0.00 H new ATOM 0 HA MET A 91 -3.986 12.509 9.335 1.00 0.00 H new ATOM 0 HB2 MET A 91 -3.454 10.014 7.778 1.00 0.00 H new ATOM 0 HB3 MET A 91 -3.869 11.438 6.844 1.00 0.00 H new ATOM 0 HG2 MET A 91 -2.006 12.676 7.731 1.00 0.00 H new ATOM 0 HG3 MET A 91 -1.690 11.458 8.951 1.00 0.00 H new ATOM 0 HE1 MET A 91 -0.234 8.511 7.198 1.00 0.00 H new ATOM 0 HE2 MET A 91 -1.573 9.007 8.260 1.00 0.00 H new ATOM 0 HE3 MET A 91 -1.890 8.610 6.554 1.00 0.00 H new ATOM 67 N TYR A 92 -5.861 12.640 7.328 1.00 0.00 N ATOM 68 CA TYR A 92 -7.142 12.967 6.713 1.00 0.00 C ATOM 69 C TYR A 92 -7.272 12.288 5.353 1.00 0.00 C ATOM 70 O TYR A 92 -6.283 12.119 4.644 1.00 0.00 O ATOM 71 CB TYR A 92 -7.288 14.483 6.558 1.00 0.00 C ATOM 72 CG TYR A 92 -6.076 15.152 5.947 1.00 0.00 C ATOM 73 CD1 TYR A 92 -4.974 15.484 6.725 1.00 0.00 C ATOM 74 CD2 TYR A 92 -6.033 15.451 4.591 1.00 0.00 C ATOM 75 CE1 TYR A 92 -3.865 16.095 6.170 1.00 0.00 C ATOM 76 CE2 TYR A 92 -4.929 16.062 4.028 1.00 0.00 C ATOM 77 CZ TYR A 92 -3.848 16.381 4.822 1.00 0.00 C ATOM 78 OH TYR A 92 -2.746 16.989 4.265 1.00 0.00 O ATOM 0 H TYR A 92 -5.055 13.075 6.879 1.00 0.00 H new ATOM 0 HA TYR A 92 -7.937 12.601 7.363 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -8.159 14.694 5.938 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -7.480 14.923 7.537 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -4.984 15.261 7.782 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -6.878 15.201 3.966 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -3.017 16.347 6.789 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -4.913 16.288 2.972 1.00 0.00 H new ATOM 0 HH TYR A 92 -2.895 17.120 3.305 1.00 0.00 H new ATOM 88 N PRO A 93 -8.496 11.885 4.969 1.00 0.00 N ATOM 89 CA PRO A 93 -8.743 11.217 3.690 1.00 0.00 C ATOM 90 C PRO A 93 -8.902 12.196 2.528 1.00 0.00 C ATOM 91 O PRO A 93 -9.658 11.940 1.591 1.00 0.00 O ATOM 92 CB PRO A 93 -10.054 10.482 3.950 1.00 0.00 C ATOM 93 CG PRO A 93 -10.786 11.355 4.914 1.00 0.00 C ATOM 94 CD PRO A 93 -9.736 12.040 5.756 1.00 0.00 C ATOM 0 HA PRO A 93 -7.913 10.575 3.394 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -10.621 10.344 3.029 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -9.877 9.491 4.367 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -11.398 12.087 4.387 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -11.459 10.766 5.537 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -9.977 13.090 5.920 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.647 11.577 6.739 1.00 0.00 H new ATOM 102 N ASP A 94 -8.187 13.316 2.591 1.00 0.00 N ATOM 103 CA ASP A 94 -8.255 14.327 1.541 1.00 0.00 C ATOM 104 C ASP A 94 -6.927 14.439 0.792 1.00 0.00 C ATOM 105 O ASP A 94 -6.870 15.001 -0.303 1.00 0.00 O ATOM 106 CB ASP A 94 -8.637 15.684 2.138 1.00 0.00 C ATOM 107 CG ASP A 94 -9.988 16.170 1.650 1.00 0.00 C ATOM 108 OD1 ASP A 94 -10.933 15.355 1.610 1.00 0.00 O ATOM 109 OD2 ASP A 94 -10.101 17.367 1.309 1.00 0.00 O ATOM 0 H ASP A 94 -7.555 13.546 3.357 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.021 14.020 0.828 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -8.652 15.608 3.225 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -7.875 16.419 1.880 1.00 0.00 H new ATOM 114 N TRP A 95 -5.859 13.909 1.386 1.00 0.00 N ATOM 115 CA TRP A 95 -4.536 13.957 0.777 1.00 0.00 C ATOM 116 C TRP A 95 -4.573 13.491 -0.677 1.00 0.00 C ATOM 117 O TRP A 95 -5.359 12.615 -1.040 1.00 0.00 O ATOM 118 CB TRP A 95 -3.561 13.097 1.581 1.00 0.00 C ATOM 119 CG TRP A 95 -3.845 11.628 1.496 1.00 0.00 C ATOM 120 CD1 TRP A 95 -4.489 10.862 2.424 1.00 0.00 C ATOM 121 CD2 TRP A 95 -3.491 10.745 0.424 1.00 0.00 C ATOM 122 NE1 TRP A 95 -4.560 9.559 1.995 1.00 0.00 N ATOM 123 CE2 TRP A 95 -3.953 9.462 0.770 1.00 0.00 C ATOM 124 CE3 TRP A 95 -2.829 10.916 -0.796 1.00 0.00 C ATOM 125 CZ2 TRP A 95 -3.775 8.357 -0.059 1.00 0.00 C ATOM 126 CZ3 TRP A 95 -2.651 9.819 -1.617 1.00 0.00 C ATOM 127 CH2 TRP A 95 -3.124 8.553 -1.246 1.00 0.00 C ATOM 0 H TRP A 95 -5.887 13.440 2.292 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.197 14.993 0.786 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.547 13.284 1.226 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.595 13.405 2.626 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -4.885 11.227 3.360 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -4.994 8.789 2.505 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -2.463 11.888 -1.091 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -4.138 7.380 0.225 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -2.139 9.939 -2.560 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -2.971 7.715 -1.911 1.00 0.00 H new ATOM 138 N GLN A 96 -3.717 14.085 -1.501 1.00 0.00 N ATOM 139 CA GLN A 96 -3.645 13.735 -2.915 1.00 0.00 C ATOM 140 C GLN A 96 -2.196 13.527 -3.348 1.00 0.00 C ATOM 141 O GLN A 96 -1.267 13.911 -2.639 1.00 0.00 O ATOM 142 CB GLN A 96 -4.295 14.830 -3.764 1.00 0.00 C ATOM 143 CG GLN A 96 -5.745 14.545 -4.116 1.00 0.00 C ATOM 144 CD GLN A 96 -6.685 15.647 -3.664 1.00 0.00 C ATOM 145 OE1 GLN A 96 -7.772 15.381 -3.153 1.00 0.00 O ATOM 146 NE2 GLN A 96 -6.268 16.894 -3.852 1.00 0.00 N ATOM 0 H GLN A 96 -3.062 14.812 -1.214 1.00 0.00 H new ATOM 0 HA GLN A 96 -4.187 12.801 -3.065 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -4.239 15.776 -3.226 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -3.724 14.952 -4.684 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -5.834 14.417 -5.195 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -6.048 13.604 -3.657 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -5.359 17.069 -4.280 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -6.857 17.677 -3.569 1.00 0.00 H new ATOM 155 N PRO A 97 -1.983 12.913 -4.525 1.00 0.00 N ATOM 156 CA PRO A 97 -0.636 12.657 -5.048 1.00 0.00 C ATOM 157 C PRO A 97 0.106 13.945 -5.388 1.00 0.00 C ATOM 158 O PRO A 97 -0.503 14.941 -5.775 1.00 0.00 O ATOM 159 CB PRO A 97 -0.891 11.836 -6.316 1.00 0.00 C ATOM 160 CG PRO A 97 -2.287 12.172 -6.716 1.00 0.00 C ATOM 161 CD PRO A 97 -3.033 12.423 -5.436 1.00 0.00 C ATOM 0 HA PRO A 97 -0.007 12.148 -4.317 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -0.182 12.093 -7.103 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -0.781 10.769 -6.124 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -2.308 13.052 -7.359 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -2.740 11.355 -7.278 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -3.826 13.159 -5.570 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -3.502 11.514 -5.058 1.00 0.00 H new ATOM 169 N ASP A 98 1.427 13.917 -5.241 1.00 0.00 N ATOM 170 CA ASP A 98 2.254 15.082 -5.530 1.00 0.00 C ATOM 171 C ASP A 98 3.703 14.674 -5.777 1.00 0.00 C ATOM 172 O ASP A 98 4.008 13.490 -5.923 1.00 0.00 O ATOM 173 CB ASP A 98 2.182 16.084 -4.376 1.00 0.00 C ATOM 174 CG ASP A 98 2.134 17.521 -4.859 1.00 0.00 C ATOM 175 OD1 ASP A 98 1.019 18.022 -5.120 1.00 0.00 O ATOM 176 OD2 ASP A 98 3.209 18.145 -4.975 1.00 0.00 O ATOM 0 H ASP A 98 1.947 13.099 -4.923 1.00 0.00 H new ATOM 0 HA ASP A 98 1.870 15.553 -6.435 1.00 0.00 H new ATOM 0 HB2 ASP A 98 1.298 15.877 -3.773 1.00 0.00 H new ATOM 0 HB3 ASP A 98 3.048 15.950 -3.728 1.00 0.00 H new ATOM 181 N ALA A 99 4.592 15.660 -5.824 1.00 0.00 N ATOM 182 CA ALA A 99 6.009 15.404 -6.054 1.00 0.00 C ATOM 183 C ALA A 99 6.616 14.608 -4.903 1.00 0.00 C ATOM 184 O ALA A 99 7.337 13.634 -5.121 1.00 0.00 O ATOM 185 CB ALA A 99 6.758 16.713 -6.245 1.00 0.00 C ATOM 0 H ALA A 99 4.356 16.645 -5.706 1.00 0.00 H new ATOM 0 HA ALA A 99 6.103 14.809 -6.963 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.814 16.506 -6.416 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.349 17.244 -7.104 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.648 17.328 -5.352 1.00 0.00 H new ATOM 191 N ASP A 100 6.323 15.031 -3.678 1.00 0.00 N ATOM 192 CA ASP A 100 6.842 14.357 -2.493 1.00 0.00 C ATOM 193 C ASP A 100 6.399 12.898 -2.458 1.00 0.00 C ATOM 194 O ASP A 100 7.111 12.035 -1.944 1.00 0.00 O ATOM 195 CB ASP A 100 6.372 15.075 -1.226 1.00 0.00 C ATOM 196 CG ASP A 100 6.646 16.566 -1.270 1.00 0.00 C ATOM 197 OD1 ASP A 100 7.701 16.960 -1.811 1.00 0.00 O ATOM 198 OD2 ASP A 100 5.805 17.339 -0.766 1.00 0.00 O ATOM 0 H ASP A 100 5.730 15.837 -3.480 1.00 0.00 H new ATOM 0 HA ASP A 100 7.931 14.386 -2.537 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.303 14.909 -1.093 1.00 0.00 H new ATOM 0 HB3 ASP A 100 6.872 14.642 -0.360 1.00 0.00 H new ATOM 203 N PHE A 101 5.219 12.630 -3.008 1.00 0.00 N ATOM 204 CA PHE A 101 4.682 11.274 -3.039 1.00 0.00 C ATOM 205 C PHE A 101 5.598 10.344 -3.828 1.00 0.00 C ATOM 206 O PHE A 101 5.942 9.258 -3.365 1.00 0.00 O ATOM 207 CB PHE A 101 3.281 11.274 -3.656 1.00 0.00 C ATOM 208 CG PHE A 101 2.413 10.146 -3.175 1.00 0.00 C ATOM 209 CD1 PHE A 101 2.425 8.920 -3.822 1.00 0.00 C ATOM 210 CD2 PHE A 101 1.586 10.312 -2.076 1.00 0.00 C ATOM 211 CE1 PHE A 101 1.627 7.882 -3.382 1.00 0.00 C ATOM 212 CE2 PHE A 101 0.785 9.276 -1.631 1.00 0.00 C ATOM 213 CZ PHE A 101 0.806 8.060 -2.285 1.00 0.00 C ATOM 0 H PHE A 101 4.617 13.333 -3.438 1.00 0.00 H new ATOM 0 HA PHE A 101 4.621 10.909 -2.014 1.00 0.00 H new ATOM 0 HB2 PHE A 101 2.792 12.221 -3.427 1.00 0.00 H new ATOM 0 HB3 PHE A 101 3.371 11.216 -4.741 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.065 8.775 -4.680 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.567 11.261 -1.561 1.00 0.00 H new ATOM 0 HE1 PHE A 101 1.645 6.932 -3.895 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.144 9.418 -0.773 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.182 7.249 -1.940 1.00 0.00 H new ATOM 223 N ILE A 102 5.988 10.779 -5.021 1.00 0.00 N ATOM 224 CA ILE A 102 6.865 9.985 -5.873 1.00 0.00 C ATOM 225 C ILE A 102 8.289 9.966 -5.329 1.00 0.00 C ATOM 226 O ILE A 102 9.016 8.987 -5.500 1.00 0.00 O ATOM 227 CB ILE A 102 6.886 10.525 -7.317 1.00 0.00 C ATOM 228 CG1 ILE A 102 5.460 10.731 -7.829 1.00 0.00 C ATOM 229 CG2 ILE A 102 7.651 9.576 -8.227 1.00 0.00 C ATOM 230 CD1 ILE A 102 4.655 9.452 -7.906 1.00 0.00 C ATOM 0 H ILE A 102 5.711 11.676 -5.420 1.00 0.00 H new ATOM 0 HA ILE A 102 6.467 8.970 -5.878 1.00 0.00 H new ATOM 0 HB ILE A 102 7.395 11.489 -7.321 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.946 11.435 -7.175 1.00 0.00 H new ATOM 0 HG13 ILE A 102 5.500 11.186 -8.819 1.00 0.00 H new ATOM 0 HG21 ILE A 102 7.657 9.971 -9.243 1.00 0.00 H new ATOM 0 HG22 ILE A 102 8.676 9.477 -7.870 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.169 8.598 -8.221 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.654 9.674 -8.277 1.00 0.00 H new ATOM 0 HD12 ILE A 102 5.146 8.753 -8.583 1.00 0.00 H new ATOM 0 HD13 ILE A 102 4.584 9.007 -6.914 1.00 0.00 H new ATOM 242 N ARG A 103 8.681 11.053 -4.672 1.00 0.00 N ATOM 243 CA ARG A 103 10.018 11.160 -4.102 1.00 0.00 C ATOM 244 C ARG A 103 10.197 10.178 -2.948 1.00 0.00 C ATOM 245 O ARG A 103 11.151 9.401 -2.925 1.00 0.00 O ATOM 246 CB ARG A 103 10.272 12.590 -3.617 1.00 0.00 C ATOM 247 CG ARG A 103 11.329 13.328 -4.426 1.00 0.00 C ATOM 248 CD ARG A 103 12.599 13.558 -3.619 1.00 0.00 C ATOM 249 NE ARG A 103 12.895 14.980 -3.459 1.00 0.00 N ATOM 250 CZ ARG A 103 12.298 15.766 -2.567 1.00 0.00 C ATOM 251 NH1 ARG A 103 11.372 15.274 -1.753 1.00 0.00 N ATOM 252 NH2 ARG A 103 12.627 17.048 -2.487 1.00 0.00 N ATOM 0 H ARG A 103 8.091 11.872 -4.522 1.00 0.00 H new ATOM 0 HA ARG A 103 10.741 10.913 -4.879 1.00 0.00 H new ATOM 0 HB2 ARG A 103 9.338 13.150 -3.658 1.00 0.00 H new ATOM 0 HB3 ARG A 103 10.581 12.561 -2.572 1.00 0.00 H new ATOM 0 HG2 ARG A 103 11.567 12.755 -5.322 1.00 0.00 H new ATOM 0 HG3 ARG A 103 10.930 14.287 -4.757 1.00 0.00 H new ATOM 0 HD2 ARG A 103 12.493 13.097 -2.637 1.00 0.00 H new ATOM 0 HD3 ARG A 103 13.437 13.066 -4.113 1.00 0.00 H new ATOM 0 HE ARG A 103 13.601 15.395 -4.067 1.00 0.00 H new ATOM 0 HH11 ARG A 103 11.115 14.289 -1.809 1.00 0.00 H new ATOM 0 HH12 ARG A 103 10.918 15.881 -1.071 1.00 0.00 H new ATOM 0 HH21 ARG A 103 13.338 17.432 -3.110 1.00 0.00 H new ATOM 0 HH22 ARG A 103 12.169 17.650 -1.803 1.00 0.00 H new ATOM 266 N LEU A 104 9.273 10.219 -1.994 1.00 0.00 N ATOM 267 CA LEU A 104 9.327 9.333 -0.837 1.00 0.00 C ATOM 268 C LEU A 104 9.234 7.872 -1.266 1.00 0.00 C ATOM 269 O LEU A 104 9.986 7.024 -0.784 1.00 0.00 O ATOM 270 CB LEU A 104 8.197 9.665 0.139 1.00 0.00 C ATOM 271 CG LEU A 104 8.479 10.835 1.083 1.00 0.00 C ATOM 272 CD1 LEU A 104 7.196 11.293 1.761 1.00 0.00 C ATOM 273 CD2 LEU A 104 9.522 10.444 2.119 1.00 0.00 C ATOM 0 H LEU A 104 8.477 10.857 -1.999 1.00 0.00 H new ATOM 0 HA LEU A 104 10.284 9.485 -0.338 1.00 0.00 H new ATOM 0 HB2 LEU A 104 7.297 9.889 -0.434 1.00 0.00 H new ATOM 0 HB3 LEU A 104 7.982 8.779 0.737 1.00 0.00 H new ATOM 0 HG LEU A 104 8.873 11.665 0.496 1.00 0.00 H new ATOM 0 HD11 LEU A 104 7.415 12.126 2.429 1.00 0.00 H new ATOM 0 HD12 LEU A 104 6.479 11.613 1.005 1.00 0.00 H new ATOM 0 HD13 LEU A 104 6.774 10.469 2.335 1.00 0.00 H new ATOM 0 HD21 LEU A 104 9.710 11.288 2.782 1.00 0.00 H new ATOM 0 HD22 LEU A 104 9.156 9.599 2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 104 10.448 10.164 1.616 1.00 0.00 H new ATOM 285 N ALA A 105 8.305 7.585 -2.171 1.00 0.00 N ATOM 286 CA ALA A 105 8.112 6.226 -2.664 1.00 0.00 C ATOM 287 C ALA A 105 9.381 5.693 -3.320 1.00 0.00 C ATOM 288 O ALA A 105 9.803 4.568 -3.054 1.00 0.00 O ATOM 289 CB ALA A 105 6.950 6.182 -3.646 1.00 0.00 C ATOM 0 H ALA A 105 7.674 8.275 -2.578 1.00 0.00 H new ATOM 0 HA ALA A 105 7.880 5.587 -1.812 1.00 0.00 H new ATOM 0 HB1 ALA A 105 6.817 5.162 -4.006 1.00 0.00 H new ATOM 0 HB2 ALA A 105 6.039 6.512 -3.147 1.00 0.00 H new ATOM 0 HB3 ALA A 105 7.161 6.840 -4.489 1.00 0.00 H new ATOM 295 N ALA A 106 9.985 6.508 -4.179 1.00 0.00 N ATOM 296 CA ALA A 106 11.205 6.117 -4.874 1.00 0.00 C ATOM 297 C ALA A 106 12.348 5.887 -3.891 1.00 0.00 C ATOM 298 O ALA A 106 13.192 5.014 -4.099 1.00 0.00 O ATOM 299 CB ALA A 106 11.591 7.176 -5.895 1.00 0.00 C ATOM 0 H ALA A 106 9.649 7.443 -4.410 1.00 0.00 H new ATOM 0 HA ALA A 106 11.013 5.178 -5.393 1.00 0.00 H new ATOM 0 HB1 ALA A 106 12.504 6.872 -6.407 1.00 0.00 H new ATOM 0 HB2 ALA A 106 10.787 7.290 -6.623 1.00 0.00 H new ATOM 0 HB3 ALA A 106 11.759 8.126 -5.388 1.00 0.00 H new ATOM 305 N LEU A 107 12.370 6.672 -2.820 1.00 0.00 N ATOM 306 CA LEU A 107 13.408 6.554 -1.806 1.00 0.00 C ATOM 307 C LEU A 107 13.091 5.416 -0.838 1.00 0.00 C ATOM 308 O LEU A 107 13.993 4.764 -0.313 1.00 0.00 O ATOM 309 CB LEU A 107 13.551 7.877 -1.045 1.00 0.00 C ATOM 310 CG LEU A 107 14.312 7.792 0.279 1.00 0.00 C ATOM 311 CD1 LEU A 107 15.724 7.277 0.054 1.00 0.00 C ATOM 312 CD2 LEU A 107 14.341 9.151 0.963 1.00 0.00 C ATOM 0 H LEU A 107 11.679 7.398 -2.632 1.00 0.00 H new ATOM 0 HA LEU A 107 14.352 6.327 -2.301 1.00 0.00 H new ATOM 0 HB2 LEU A 107 14.057 8.595 -1.690 1.00 0.00 H new ATOM 0 HB3 LEU A 107 12.555 8.273 -0.847 1.00 0.00 H new ATOM 0 HG LEU A 107 13.792 7.089 0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 107 16.248 7.224 1.008 1.00 0.00 H new ATOM 0 HD12 LEU A 107 15.682 6.284 -0.393 1.00 0.00 H new ATOM 0 HD13 LEU A 107 16.256 7.954 -0.615 1.00 0.00 H new ATOM 0 HD21 LEU A 107 14.886 9.073 1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 107 14.837 9.874 0.315 1.00 0.00 H new ATOM 0 HD23 LEU A 107 13.321 9.481 1.161 1.00 0.00 H new ATOM 324 N TRP A 108 11.802 5.184 -0.609 1.00 0.00 N ATOM 325 CA TRP A 108 11.366 4.125 0.295 1.00 0.00 C ATOM 326 C TRP A 108 11.626 2.743 -0.302 1.00 0.00 C ATOM 327 O TRP A 108 11.557 1.734 0.399 1.00 0.00 O ATOM 328 CB TRP A 108 9.878 4.281 0.614 1.00 0.00 C ATOM 329 CG TRP A 108 9.577 5.446 1.510 1.00 0.00 C ATOM 330 CD1 TRP A 108 10.467 6.152 2.267 1.00 0.00 C ATOM 331 CD2 TRP A 108 8.294 6.038 1.743 1.00 0.00 C ATOM 332 NE1 TRP A 108 9.817 7.148 2.955 1.00 0.00 N ATOM 333 CE2 TRP A 108 8.482 7.098 2.651 1.00 0.00 C ATOM 334 CE3 TRP A 108 7.004 5.775 1.272 1.00 0.00 C ATOM 335 CZ2 TRP A 108 7.428 7.894 3.095 1.00 0.00 C ATOM 336 CZ3 TRP A 108 5.960 6.565 1.714 1.00 0.00 C ATOM 337 CH2 TRP A 108 6.177 7.614 2.617 1.00 0.00 C ATOM 0 H TRP A 108 11.042 5.714 -1.036 1.00 0.00 H new ATOM 0 HA TRP A 108 11.944 4.213 1.215 1.00 0.00 H new ATOM 0 HB2 TRP A 108 9.325 4.397 -0.318 1.00 0.00 H new ATOM 0 HB3 TRP A 108 9.518 3.367 1.086 1.00 0.00 H new ATOM 0 HD1 TRP A 108 11.528 5.956 2.318 1.00 0.00 H new ATOM 0 HE1 TRP A 108 10.257 7.816 3.589 1.00 0.00 H new ATOM 0 HE3 TRP A 108 6.827 4.969 0.575 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 7.593 8.703 3.791 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 4.959 6.370 1.357 1.00 0.00 H new ATOM 0 HH2 TRP A 108 5.340 8.214 2.942 1.00 0.00 H new ATOM 348 N GLY A 109 11.927 2.700 -1.598 1.00 0.00 N ATOM 349 CA GLY A 109 12.192 1.434 -2.255 1.00 0.00 C ATOM 350 C GLY A 109 11.071 1.018 -3.188 1.00 0.00 C ATOM 351 O GLY A 109 10.808 -0.172 -3.360 1.00 0.00 O ATOM 0 H GLY A 109 11.992 3.519 -2.203 1.00 0.00 H new ATOM 0 HA2 GLY A 109 13.121 1.509 -2.820 1.00 0.00 H new ATOM 0 HA3 GLY A 109 12.339 0.661 -1.501 1.00 0.00 H new ATOM 355 N VAL A 110 10.410 2.001 -3.791 1.00 0.00 N ATOM 356 CA VAL A 110 9.312 1.731 -4.712 1.00 0.00 C ATOM 357 C VAL A 110 9.611 2.284 -6.100 1.00 0.00 C ATOM 358 O VAL A 110 9.645 3.499 -6.302 1.00 0.00 O ATOM 359 CB VAL A 110 7.990 2.337 -4.204 1.00 0.00 C ATOM 360 CG1 VAL A 110 6.825 1.880 -5.068 1.00 0.00 C ATOM 361 CG2 VAL A 110 7.759 1.969 -2.746 1.00 0.00 C ATOM 0 H VAL A 110 10.616 2.991 -3.658 1.00 0.00 H new ATOM 0 HA VAL A 110 9.207 0.648 -4.770 1.00 0.00 H new ATOM 0 HB VAL A 110 8.059 3.423 -4.274 1.00 0.00 H new ATOM 0 HG11 VAL A 110 5.900 2.319 -4.693 1.00 0.00 H new ATOM 0 HG12 VAL A 110 6.988 2.200 -6.097 1.00 0.00 H new ATOM 0 HG13 VAL A 110 6.751 0.793 -5.034 1.00 0.00 H new ATOM 0 HG21 VAL A 110 6.821 2.406 -2.405 1.00 0.00 H new ATOM 0 HG22 VAL A 110 7.711 0.884 -2.648 1.00 0.00 H new ATOM 0 HG23 VAL A 110 8.579 2.353 -2.140 1.00 0.00 H new ATOM 371 N ALA A 111 9.829 1.386 -7.055 1.00 0.00 N ATOM 372 CA ALA A 111 10.127 1.785 -8.426 1.00 0.00 C ATOM 373 C ALA A 111 8.898 1.644 -9.317 1.00 0.00 C ATOM 374 O ALA A 111 8.486 0.534 -9.653 1.00 0.00 O ATOM 375 CB ALA A 111 11.278 0.959 -8.977 1.00 0.00 C ATOM 0 H ALA A 111 9.805 0.377 -6.905 1.00 0.00 H new ATOM 0 HA ALA A 111 10.419 2.835 -8.418 1.00 0.00 H new ATOM 0 HB1 ALA A 111 11.490 1.267 -10.001 1.00 0.00 H new ATOM 0 HB2 ALA A 111 12.164 1.113 -8.361 1.00 0.00 H new ATOM 0 HB3 ALA A 111 11.007 -0.097 -8.965 1.00 0.00 H new ATOM 381 N LEU A 112 8.316 2.776 -9.697 1.00 0.00 N ATOM 382 CA LEU A 112 7.133 2.780 -10.550 1.00 0.00 C ATOM 383 C LEU A 112 7.420 3.475 -11.877 1.00 0.00 C ATOM 384 O LEU A 112 7.805 4.644 -11.906 1.00 0.00 O ATOM 385 CB LEU A 112 5.969 3.474 -9.840 1.00 0.00 C ATOM 386 CG LEU A 112 5.741 3.035 -8.389 1.00 0.00 C ATOM 387 CD1 LEU A 112 5.720 4.240 -7.461 1.00 0.00 C ATOM 388 CD2 LEU A 112 4.447 2.244 -8.268 1.00 0.00 C ATOM 0 H LEU A 112 8.644 3.703 -9.428 1.00 0.00 H new ATOM 0 HA LEU A 112 6.861 1.745 -10.754 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.143 4.550 -9.855 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.056 3.291 -10.407 1.00 0.00 H new ATOM 0 HG LEU A 112 6.568 2.390 -8.092 1.00 0.00 H new ATOM 0 HD11 LEU A 112 5.557 3.907 -6.436 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.673 4.765 -7.525 1.00 0.00 H new ATOM 0 HD13 LEU A 112 4.915 4.913 -7.756 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.302 1.941 -7.231 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.610 2.866 -8.585 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.501 1.358 -8.901 1.00 0.00 H new ATOM 400 N ARG A 113 7.230 2.749 -12.973 1.00 0.00 N ATOM 401 CA ARG A 113 7.468 3.296 -14.304 1.00 0.00 C ATOM 402 C ARG A 113 6.235 4.035 -14.816 1.00 0.00 C ATOM 403 O ARG A 113 6.296 5.226 -15.124 1.00 0.00 O ATOM 404 CB ARG A 113 7.851 2.178 -15.277 1.00 0.00 C ATOM 405 CG ARG A 113 9.332 2.149 -15.617 1.00 0.00 C ATOM 406 CD ARG A 113 9.727 0.837 -16.275 1.00 0.00 C ATOM 407 NE ARG A 113 11.159 0.775 -16.559 1.00 0.00 N ATOM 408 CZ ARG A 113 12.089 0.553 -15.633 1.00 0.00 C ATOM 409 NH1 ARG A 113 11.742 0.371 -14.365 1.00 0.00 N ATOM 410 NH2 ARG A 113 13.369 0.514 -15.976 1.00 0.00 N ATOM 0 H ARG A 113 6.912 1.780 -12.966 1.00 0.00 H new ATOM 0 HA ARG A 113 8.292 4.006 -14.237 1.00 0.00 H new ATOM 0 HB2 ARG A 113 7.567 1.218 -14.845 1.00 0.00 H new ATOM 0 HB3 ARG A 113 7.278 2.296 -16.197 1.00 0.00 H new ATOM 0 HG2 ARG A 113 9.570 2.978 -16.284 1.00 0.00 H new ATOM 0 HG3 ARG A 113 9.918 2.293 -14.709 1.00 0.00 H new ATOM 0 HD2 ARG A 113 9.451 0.008 -15.624 1.00 0.00 H new ATOM 0 HD3 ARG A 113 9.168 0.714 -17.203 1.00 0.00 H new ATOM 0 HE ARG A 113 11.464 0.910 -17.523 1.00 0.00 H new ATOM 0 HH11 ARG A 113 10.759 0.401 -14.096 1.00 0.00 H new ATOM 0 HH12 ARG A 113 12.459 0.201 -13.659 1.00 0.00 H new ATOM 0 HH21 ARG A 113 13.641 0.654 -16.949 1.00 0.00 H new ATOM 0 HH22 ARG A 113 14.082 0.344 -15.267 1.00 0.00 H new ATOM 424 N GLU A 114 5.118 3.321 -14.904 1.00 0.00 N ATOM 425 CA GLU A 114 3.871 3.908 -15.379 1.00 0.00 C ATOM 426 C GLU A 114 3.251 4.808 -14.312 1.00 0.00 C ATOM 427 O GLU A 114 3.435 4.582 -13.116 1.00 0.00 O ATOM 428 CB GLU A 114 2.882 2.809 -15.773 1.00 0.00 C ATOM 429 CG GLU A 114 2.494 1.898 -14.619 1.00 0.00 C ATOM 430 CD GLU A 114 3.200 0.558 -14.672 1.00 0.00 C ATOM 431 OE1 GLU A 114 4.395 0.501 -14.315 1.00 0.00 O ATOM 432 OE2 GLU A 114 2.556 -0.436 -15.070 1.00 0.00 O ATOM 0 H GLU A 114 5.051 2.335 -14.653 1.00 0.00 H new ATOM 0 HA GLU A 114 4.096 4.516 -16.255 1.00 0.00 H new ATOM 0 HB2 GLU A 114 1.982 3.270 -16.179 1.00 0.00 H new ATOM 0 HB3 GLU A 114 3.319 2.207 -16.569 1.00 0.00 H new ATOM 0 HG2 GLU A 114 2.730 2.392 -13.676 1.00 0.00 H new ATOM 0 HG3 GLU A 114 1.416 1.737 -14.634 1.00 0.00 H new ATOM 439 N PRO A 115 2.504 5.842 -14.733 1.00 0.00 N ATOM 440 CA PRO A 115 1.855 6.776 -13.808 1.00 0.00 C ATOM 441 C PRO A 115 1.021 6.059 -12.752 1.00 0.00 C ATOM 442 O PRO A 115 0.933 4.831 -12.746 1.00 0.00 O ATOM 443 CB PRO A 115 0.958 7.618 -14.718 1.00 0.00 C ATOM 444 CG PRO A 115 1.605 7.547 -16.057 1.00 0.00 C ATOM 445 CD PRO A 115 2.232 6.183 -16.143 1.00 0.00 C ATOM 0 HA PRO A 115 2.582 7.363 -13.247 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -0.058 7.224 -14.748 1.00 0.00 H new ATOM 0 HB3 PRO A 115 0.890 8.647 -14.365 1.00 0.00 H new ATOM 0 HG2 PRO A 115 0.873 7.691 -16.852 1.00 0.00 H new ATOM 0 HG3 PRO A 115 2.356 8.329 -16.170 1.00 0.00 H new ATOM 0 HD2 PRO A 115 1.561 5.461 -16.609 1.00 0.00 H new ATOM 0 HD3 PRO A 115 3.146 6.198 -16.736 1.00 0.00 H new ATOM 453 N VAL A 116 0.409 6.832 -11.861 1.00 0.00 N ATOM 454 CA VAL A 116 -0.417 6.269 -10.801 1.00 0.00 C ATOM 455 C VAL A 116 -1.869 6.131 -11.251 1.00 0.00 C ATOM 456 O VAL A 116 -2.334 6.874 -12.115 1.00 0.00 O ATOM 457 CB VAL A 116 -0.362 7.132 -9.524 1.00 0.00 C ATOM 458 CG1 VAL A 116 -0.892 8.531 -9.798 1.00 0.00 C ATOM 459 CG2 VAL A 116 -1.138 6.470 -8.395 1.00 0.00 C ATOM 0 H VAL A 116 0.470 7.850 -11.853 1.00 0.00 H new ATOM 0 HA VAL A 116 -0.014 5.281 -10.577 1.00 0.00 H new ATOM 0 HB VAL A 116 0.679 7.219 -9.214 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -0.845 9.123 -8.884 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -0.286 9.005 -10.570 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -1.926 8.468 -10.136 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -1.087 7.095 -7.503 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -2.179 6.347 -8.693 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -0.704 5.493 -8.179 1.00 0.00 H new ATOM 469 N THR A 117 -2.578 5.178 -10.658 1.00 0.00 N ATOM 470 CA THR A 117 -3.977 4.942 -10.996 1.00 0.00 C ATOM 471 C THR A 117 -4.896 5.435 -9.883 1.00 0.00 C ATOM 472 O THR A 117 -4.524 5.432 -8.710 1.00 0.00 O ATOM 473 CB THR A 117 -4.219 3.454 -11.251 1.00 0.00 C ATOM 474 OG1 THR A 117 -3.644 2.670 -10.222 1.00 0.00 O ATOM 475 CG2 THR A 117 -3.651 2.972 -12.568 1.00 0.00 C ATOM 0 H THR A 117 -2.207 4.555 -9.940 1.00 0.00 H new ATOM 0 HA THR A 117 -4.204 5.500 -11.904 1.00 0.00 H new ATOM 0 HB THR A 117 -5.302 3.338 -11.278 1.00 0.00 H new ATOM 0 HG1 THR A 117 -4.220 1.899 -10.038 1.00 0.00 H new ATOM 0 HG21 THR A 117 -3.858 1.908 -12.686 1.00 0.00 H new ATOM 0 HG22 THR A 117 -4.112 3.524 -13.387 1.00 0.00 H new ATOM 0 HG23 THR A 117 -2.573 3.136 -12.581 1.00 0.00 H new ATOM 483 N THR A 118 -6.098 5.859 -10.259 1.00 0.00 N ATOM 484 CA THR A 118 -7.071 6.354 -9.292 1.00 0.00 C ATOM 485 C THR A 118 -7.627 5.214 -8.447 1.00 0.00 C ATOM 486 O THR A 118 -7.963 5.402 -7.277 1.00 0.00 O ATOM 487 CB THR A 118 -8.211 7.077 -10.011 1.00 0.00 C ATOM 488 OG1 THR A 118 -9.211 7.475 -9.091 1.00 0.00 O ATOM 489 CG2 THR A 118 -8.877 6.232 -11.076 1.00 0.00 C ATOM 0 H THR A 118 -6.422 5.870 -11.226 1.00 0.00 H new ATOM 0 HA THR A 118 -6.565 7.057 -8.630 1.00 0.00 H new ATOM 0 HB THR A 118 -7.749 7.940 -10.490 1.00 0.00 H new ATOM 0 HG1 THR A 118 -9.931 7.937 -9.570 1.00 0.00 H new ATOM 0 HG21 THR A 118 -9.676 6.804 -11.547 1.00 0.00 H new ATOM 0 HG22 THR A 118 -8.141 5.949 -11.829 1.00 0.00 H new ATOM 0 HG23 THR A 118 -9.294 5.334 -10.620 1.00 0.00 H new ATOM 497 N GLU A 119 -7.723 4.032 -9.046 1.00 0.00 N ATOM 498 CA GLU A 119 -8.238 2.860 -8.349 1.00 0.00 C ATOM 499 C GLU A 119 -7.341 2.489 -7.171 1.00 0.00 C ATOM 500 O GLU A 119 -7.824 2.099 -6.109 1.00 0.00 O ATOM 501 CB GLU A 119 -8.352 1.676 -9.311 1.00 0.00 C ATOM 502 CG GLU A 119 -7.065 1.377 -10.062 1.00 0.00 C ATOM 503 CD GLU A 119 -6.348 0.154 -9.526 1.00 0.00 C ATOM 504 OE1 GLU A 119 -7.031 -0.843 -9.211 1.00 0.00 O ATOM 505 OE2 GLU A 119 -5.104 0.192 -9.424 1.00 0.00 O ATOM 0 H GLU A 119 -7.450 3.860 -10.014 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.229 3.104 -7.966 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.650 0.790 -8.750 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.145 1.879 -10.031 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.291 1.227 -11.118 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -6.402 2.240 -9.997 1.00 0.00 H new ATOM 512 N GLU A 120 -6.033 2.615 -7.369 1.00 0.00 N ATOM 513 CA GLU A 120 -5.067 2.295 -6.325 1.00 0.00 C ATOM 514 C GLU A 120 -5.228 3.229 -5.130 1.00 0.00 C ATOM 515 O GLU A 120 -5.252 2.785 -3.982 1.00 0.00 O ATOM 516 CB GLU A 120 -3.641 2.389 -6.873 1.00 0.00 C ATOM 517 CG GLU A 120 -2.608 1.696 -6.000 1.00 0.00 C ATOM 518 CD GLU A 120 -2.139 0.379 -6.586 1.00 0.00 C ATOM 519 OE1 GLU A 120 -1.923 0.318 -7.814 1.00 0.00 O ATOM 520 OE2 GLU A 120 -1.989 -0.593 -5.816 1.00 0.00 O ATOM 0 H GLU A 120 -5.618 2.937 -8.243 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.254 1.274 -5.993 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.614 1.951 -7.871 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.370 3.439 -6.979 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -1.751 2.355 -5.865 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -3.033 1.519 -5.012 1.00 0.00 H new ATOM 527 N LEU A 121 -5.336 4.524 -5.408 1.00 0.00 N ATOM 528 CA LEU A 121 -5.494 5.520 -4.355 1.00 0.00 C ATOM 529 C LEU A 121 -6.807 5.313 -3.603 1.00 0.00 C ATOM 530 O LEU A 121 -6.829 5.280 -2.373 1.00 0.00 O ATOM 531 CB LEU A 121 -5.444 6.930 -4.951 1.00 0.00 C ATOM 532 CG LEU A 121 -4.211 7.750 -4.568 1.00 0.00 C ATOM 533 CD1 LEU A 121 -2.943 7.061 -5.048 1.00 0.00 C ATOM 534 CD2 LEU A 121 -4.308 9.155 -5.141 1.00 0.00 C ATOM 0 H LEU A 121 -5.317 4.908 -6.353 1.00 0.00 H new ATOM 0 HA LEU A 121 -4.673 5.404 -3.648 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -5.486 6.851 -6.037 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -6.335 7.473 -4.636 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.169 7.825 -3.481 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -2.076 7.658 -4.767 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -2.869 6.075 -4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -2.975 6.955 -6.132 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.423 9.725 -4.859 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.374 9.101 -6.228 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -5.197 9.648 -4.748 1.00 0.00 H new ATOM 546 N ALA A 122 -7.896 5.176 -4.351 1.00 0.00 N ATOM 547 CA ALA A 122 -9.211 4.973 -3.755 1.00 0.00 C ATOM 548 C ALA A 122 -9.234 3.719 -2.887 1.00 0.00 C ATOM 549 O ALA A 122 -9.977 3.642 -1.907 1.00 0.00 O ATOM 550 CB ALA A 122 -10.274 4.885 -4.839 1.00 0.00 C ATOM 0 H ALA A 122 -7.894 5.202 -5.371 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.428 5.829 -3.116 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -11.251 4.733 -4.379 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.284 5.810 -5.415 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -10.051 4.048 -5.501 1.00 0.00 H new ATOM 556 N SER A 123 -8.415 2.737 -3.251 1.00 0.00 N ATOM 557 CA SER A 123 -8.342 1.486 -2.506 1.00 0.00 C ATOM 558 C SER A 123 -7.641 1.689 -1.165 1.00 0.00 C ATOM 559 O SER A 123 -8.103 1.204 -0.133 1.00 0.00 O ATOM 560 CB SER A 123 -7.606 0.423 -3.324 1.00 0.00 C ATOM 561 OG SER A 123 -8.275 -0.825 -3.258 1.00 0.00 O ATOM 0 H SER A 123 -7.793 2.784 -4.058 1.00 0.00 H new ATOM 0 HA SER A 123 -9.360 1.147 -2.315 1.00 0.00 H new ATOM 0 HB2 SER A 123 -7.532 0.745 -4.363 1.00 0.00 H new ATOM 0 HB3 SER A 123 -6.588 0.313 -2.951 1.00 0.00 H new ATOM 0 HG SER A 123 -7.786 -1.487 -3.790 1.00 0.00 H new ATOM 567 N PHE A 124 -6.523 2.407 -1.189 1.00 0.00 N ATOM 568 CA PHE A 124 -5.757 2.672 0.024 1.00 0.00 C ATOM 569 C PHE A 124 -6.538 3.572 0.978 1.00 0.00 C ATOM 570 O PHE A 124 -6.631 3.293 2.173 1.00 0.00 O ATOM 571 CB PHE A 124 -4.416 3.320 -0.323 1.00 0.00 C ATOM 572 CG PHE A 124 -3.400 3.223 0.779 1.00 0.00 C ATOM 573 CD1 PHE A 124 -3.527 3.991 1.925 1.00 0.00 C ATOM 574 CD2 PHE A 124 -2.318 2.365 0.668 1.00 0.00 C ATOM 575 CE1 PHE A 124 -2.594 3.905 2.940 1.00 0.00 C ATOM 576 CE2 PHE A 124 -1.382 2.273 1.680 1.00 0.00 C ATOM 577 CZ PHE A 124 -1.520 3.045 2.818 1.00 0.00 C ATOM 0 H PHE A 124 -6.127 2.816 -2.035 1.00 0.00 H new ATOM 0 HA PHE A 124 -5.574 1.719 0.521 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -4.014 2.847 -1.219 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -4.581 4.370 -0.563 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -4.365 4.665 2.026 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -2.205 1.761 -0.220 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -2.704 4.510 3.828 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -0.544 1.599 1.582 1.00 0.00 H new ATOM 0 HZ PHE A 124 -0.789 2.976 3.610 1.00 0.00 H new ATOM 587 N ILE A 125 -7.098 4.652 0.441 1.00 0.00 N ATOM 588 CA ILE A 125 -7.870 5.590 1.245 1.00 0.00 C ATOM 589 C ILE A 125 -9.138 4.933 1.784 1.00 0.00 C ATOM 590 O ILE A 125 -9.598 5.254 2.880 1.00 0.00 O ATOM 591 CB ILE A 125 -8.255 6.844 0.434 1.00 0.00 C ATOM 592 CG1 ILE A 125 -7.011 7.470 -0.198 1.00 0.00 C ATOM 593 CG2 ILE A 125 -8.971 7.856 1.320 1.00 0.00 C ATOM 594 CD1 ILE A 125 -7.326 8.538 -1.224 1.00 0.00 C ATOM 0 H ILE A 125 -7.031 4.898 -0.547 1.00 0.00 H new ATOM 0 HA ILE A 125 -7.236 5.891 2.079 1.00 0.00 H new ATOM 0 HB ILE A 125 -8.936 6.545 -0.363 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -6.393 7.904 0.588 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -6.420 6.686 -0.671 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -9.235 8.734 0.730 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -9.877 7.407 1.727 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -8.314 8.152 2.138 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -6.397 8.938 -1.630 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -7.918 8.105 -2.030 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -7.890 9.342 -0.751 1.00 0.00 H new ATOM 606 N ALA A 126 -9.695 4.009 1.008 1.00 0.00 N ATOM 607 CA ALA A 126 -10.907 3.305 1.409 1.00 0.00 C ATOM 608 C ALA A 126 -10.656 2.442 2.641 1.00 0.00 C ATOM 609 O ALA A 126 -11.402 2.506 3.618 1.00 0.00 O ATOM 610 CB ALA A 126 -11.425 2.451 0.261 1.00 0.00 C ATOM 0 H ALA A 126 -9.327 3.731 0.099 1.00 0.00 H new ATOM 0 HA ALA A 126 -11.663 4.048 1.664 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -12.330 1.931 0.574 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -11.650 3.089 -0.594 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -10.666 1.721 -0.021 1.00 0.00 H new ATOM 616 N TYR A 127 -9.599 1.638 2.587 1.00 0.00 N ATOM 617 CA TYR A 127 -9.248 0.763 3.699 1.00 0.00 C ATOM 618 C TYR A 127 -8.671 1.567 4.861 1.00 0.00 C ATOM 619 O TYR A 127 -8.835 1.202 6.025 1.00 0.00 O ATOM 620 CB TYR A 127 -8.238 -0.294 3.245 1.00 0.00 C ATOM 621 CG TYR A 127 -8.097 -1.451 4.207 1.00 0.00 C ATOM 622 CD1 TYR A 127 -8.973 -2.529 4.163 1.00 0.00 C ATOM 623 CD2 TYR A 127 -7.088 -1.465 5.163 1.00 0.00 C ATOM 624 CE1 TYR A 127 -8.847 -3.588 5.041 1.00 0.00 C ATOM 625 CE2 TYR A 127 -6.956 -2.520 6.044 1.00 0.00 C ATOM 626 CZ TYR A 127 -7.837 -3.579 5.979 1.00 0.00 C ATOM 627 OH TYR A 127 -7.708 -4.632 6.856 1.00 0.00 O ATOM 0 H TYR A 127 -8.971 1.575 1.786 1.00 0.00 H new ATOM 0 HA TYR A 127 -10.156 0.266 4.039 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -8.540 -0.678 2.271 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -7.265 0.179 3.114 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -9.766 -2.539 3.430 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -6.396 -0.637 5.218 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -9.536 -4.418 4.993 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -6.166 -2.516 6.781 1.00 0.00 H new ATOM 0 HH TYR A 127 -6.946 -4.471 7.451 1.00 0.00 H new ATOM 637 N TRP A 128 -7.997 2.666 4.535 1.00 0.00 N ATOM 638 CA TRP A 128 -7.397 3.525 5.549 1.00 0.00 C ATOM 639 C TRP A 128 -8.471 4.117 6.460 1.00 0.00 C ATOM 640 O TRP A 128 -8.343 4.091 7.684 1.00 0.00 O ATOM 641 CB TRP A 128 -6.589 4.643 4.881 1.00 0.00 C ATOM 642 CG TRP A 128 -6.163 5.733 5.820 1.00 0.00 C ATOM 643 CD1 TRP A 128 -6.148 7.074 5.561 1.00 0.00 C ATOM 644 CD2 TRP A 128 -5.693 5.578 7.165 1.00 0.00 C ATOM 645 NE1 TRP A 128 -5.698 7.762 6.662 1.00 0.00 N ATOM 646 CE2 TRP A 128 -5.413 6.866 7.659 1.00 0.00 C ATOM 647 CE3 TRP A 128 -5.483 4.476 8.000 1.00 0.00 C ATOM 648 CZ2 TRP A 128 -4.934 7.081 8.948 1.00 0.00 C ATOM 649 CZ3 TRP A 128 -5.007 4.691 9.279 1.00 0.00 C ATOM 650 CH2 TRP A 128 -4.738 5.985 9.743 1.00 0.00 C ATOM 0 H TRP A 128 -7.853 2.982 3.576 1.00 0.00 H new ATOM 0 HA TRP A 128 -6.726 2.922 6.160 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -5.703 4.210 4.418 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -7.186 5.080 4.080 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -6.446 7.527 4.627 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -5.593 8.775 6.727 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -5.689 3.475 7.651 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.725 8.078 9.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -4.839 3.847 9.932 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -4.368 6.120 10.749 1.00 0.00 H new ATOM 661 N GLN A 129 -9.526 4.649 5.855 1.00 0.00 N ATOM 662 CA GLN A 129 -10.621 5.248 6.610 1.00 0.00 C ATOM 663 C GLN A 129 -11.479 4.172 7.269 1.00 0.00 C ATOM 664 O GLN A 129 -11.869 4.300 8.430 1.00 0.00 O ATOM 665 CB GLN A 129 -11.485 6.118 5.696 1.00 0.00 C ATOM 666 CG GLN A 129 -11.074 7.581 5.683 1.00 0.00 C ATOM 667 CD GLN A 129 -11.891 8.424 6.642 1.00 0.00 C ATOM 668 OE1 GLN A 129 -13.120 8.451 6.571 1.00 0.00 O ATOM 669 NE2 GLN A 129 -11.210 9.120 7.546 1.00 0.00 N ATOM 0 H GLN A 129 -9.647 4.678 4.843 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.190 5.874 7.392 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -11.434 5.726 4.680 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -12.525 6.044 6.014 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -10.019 7.660 5.944 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -11.184 7.977 4.673 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.192 9.068 7.569 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -11.706 9.706 8.217 1.00 0.00 H new ATOM 678 N ALA A 130 -11.770 3.114 6.520 1.00 0.00 N ATOM 679 CA ALA A 130 -12.582 2.017 7.029 1.00 0.00 C ATOM 680 C ALA A 130 -11.902 1.333 8.211 1.00 0.00 C ATOM 681 O ALA A 130 -12.568 0.814 9.107 1.00 0.00 O ATOM 682 CB ALA A 130 -12.860 1.010 5.924 1.00 0.00 C ATOM 0 H ALA A 130 -11.455 2.994 5.557 1.00 0.00 H new ATOM 0 HA ALA A 130 -13.529 2.430 7.377 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -13.468 0.196 6.318 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -13.395 1.501 5.111 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -11.917 0.611 5.550 1.00 0.00 H new ATOM 688 N GLU A 131 -10.574 1.337 8.207 1.00 0.00 N ATOM 689 CA GLU A 131 -9.804 0.716 9.278 1.00 0.00 C ATOM 690 C GLU A 131 -10.064 1.413 10.610 1.00 0.00 C ATOM 691 O GLU A 131 -10.253 0.761 11.638 1.00 0.00 O ATOM 692 CB GLU A 131 -8.310 0.754 8.950 1.00 0.00 C ATOM 693 CG GLU A 131 -7.769 -0.568 8.426 1.00 0.00 C ATOM 694 CD GLU A 131 -6.571 -1.062 9.214 1.00 0.00 C ATOM 695 OE1 GLU A 131 -6.672 -1.151 10.456 1.00 0.00 O ATOM 696 OE2 GLU A 131 -5.532 -1.361 8.589 1.00 0.00 O ATOM 0 H GLU A 131 -10.008 1.764 7.474 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.122 -0.323 9.365 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.129 1.531 8.208 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.757 1.034 9.846 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.558 -1.319 8.463 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -7.488 -0.452 7.379 1.00 0.00 H new ATOM 703 N GLY A 132 -10.072 2.742 10.586 1.00 0.00 N ATOM 704 CA GLY A 132 -10.308 3.504 11.798 1.00 0.00 C ATOM 705 C GLY A 132 -9.205 3.321 12.821 1.00 0.00 C ATOM 706 O GLY A 132 -9.454 3.352 14.026 1.00 0.00 O ATOM 0 H GLY A 132 -9.919 3.305 9.749 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -10.396 4.561 11.548 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -11.259 3.200 12.235 1.00 0.00 H new ATOM 710 N LYS A 133 -7.981 3.128 12.339 1.00 0.00 N ATOM 711 CA LYS A 133 -6.833 2.939 13.216 1.00 0.00 C ATOM 712 C LYS A 133 -5.780 4.014 12.968 1.00 0.00 C ATOM 713 O LYS A 133 -6.050 5.024 12.317 1.00 0.00 O ATOM 714 CB LYS A 133 -6.230 1.547 13.002 1.00 0.00 C ATOM 715 CG LYS A 133 -6.328 0.648 14.223 1.00 0.00 C ATOM 716 CD LYS A 133 -6.511 -0.808 13.829 1.00 0.00 C ATOM 717 CE LYS A 133 -6.240 -1.740 14.999 1.00 0.00 C ATOM 718 NZ LYS A 133 -5.919 -3.122 14.545 1.00 0.00 N ATOM 0 H LYS A 133 -7.760 3.099 11.344 1.00 0.00 H new ATOM 0 HA LYS A 133 -7.171 3.024 14.249 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -6.736 1.066 12.165 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -5.182 1.653 12.722 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -5.426 0.752 14.826 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -7.165 0.966 14.844 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -7.527 -0.963 13.467 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -5.839 -1.051 13.006 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -5.411 -1.350 15.589 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -7.112 -1.766 15.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -5.741 -3.727 15.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -6.720 -3.504 14.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -5.072 -3.101 13.942 1.00 0.00 H new ATOM 732 N VAL A 134 -4.578 3.791 13.490 1.00 0.00 N ATOM 733 CA VAL A 134 -3.485 4.739 13.323 1.00 0.00 C ATOM 734 C VAL A 134 -2.170 4.018 13.049 1.00 0.00 C ATOM 735 O VAL A 134 -1.925 2.931 13.573 1.00 0.00 O ATOM 736 CB VAL A 134 -3.317 5.632 14.567 1.00 0.00 C ATOM 737 CG1 VAL A 134 -2.372 6.785 14.270 1.00 0.00 C ATOM 738 CG2 VAL A 134 -4.667 6.148 15.043 1.00 0.00 C ATOM 0 H VAL A 134 -4.337 2.961 14.032 1.00 0.00 H new ATOM 0 HA VAL A 134 -3.740 5.366 12.468 1.00 0.00 H new ATOM 0 HB VAL A 134 -2.883 5.032 15.367 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -2.265 7.406 15.159 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -1.397 6.392 13.982 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -2.776 7.386 13.455 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -4.527 6.777 15.922 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -5.133 6.732 14.250 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -5.309 5.305 15.298 1.00 0.00 H new ATOM 748 N PHE A 135 -1.325 4.630 12.225 1.00 0.00 N ATOM 749 CA PHE A 135 -0.034 4.044 11.882 1.00 0.00 C ATOM 750 C PHE A 135 1.089 5.061 12.056 1.00 0.00 C ATOM 751 O PHE A 135 0.885 6.262 11.884 1.00 0.00 O ATOM 752 CB PHE A 135 -0.048 3.527 10.441 1.00 0.00 C ATOM 753 CG PHE A 135 -1.321 2.825 10.062 1.00 0.00 C ATOM 754 CD1 PHE A 135 -1.876 1.869 10.899 1.00 0.00 C ATOM 755 CD2 PHE A 135 -1.964 3.122 8.871 1.00 0.00 C ATOM 756 CE1 PHE A 135 -3.047 1.222 10.553 1.00 0.00 C ATOM 757 CE2 PHE A 135 -3.135 2.478 8.519 1.00 0.00 C ATOM 758 CZ PHE A 135 -3.678 1.527 9.362 1.00 0.00 C ATOM 0 H PHE A 135 -1.511 5.530 11.783 1.00 0.00 H new ATOM 0 HA PHE A 135 0.146 3.209 12.559 1.00 0.00 H new ATOM 0 HB2 PHE A 135 0.110 4.365 9.762 1.00 0.00 H new ATOM 0 HB3 PHE A 135 0.789 2.843 10.302 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -1.388 1.627 11.832 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -1.545 3.866 8.210 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -3.469 0.478 11.213 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -3.625 2.717 7.587 1.00 0.00 H new ATOM 0 HZ PHE A 135 -4.594 1.023 9.090 1.00 0.00 H new ATOM 768 N HIS A 136 2.277 4.569 12.396 1.00 0.00 N ATOM 769 CA HIS A 136 3.434 5.434 12.590 1.00 0.00 C ATOM 770 C HIS A 136 4.018 5.866 11.250 1.00 0.00 C ATOM 771 O HIS A 136 3.539 5.457 10.193 1.00 0.00 O ATOM 772 CB HIS A 136 4.504 4.714 13.416 1.00 0.00 C ATOM 773 CG HIS A 136 4.011 4.227 14.744 1.00 0.00 C ATOM 774 ND1 HIS A 136 2.825 3.683 15.106 1.00 0.00 N flip ATOM 775 CD2 HIS A 136 4.775 4.271 15.891 1.00 0.00 C flip ATOM 776 CE1 HIS A 136 2.896 3.410 16.450 1.00 0.00 C flip ATOM 777 NE2 HIS A 136 4.081 3.774 16.899 1.00 0.00 N flip ATOM 0 H HIS A 136 2.463 3.577 12.542 1.00 0.00 H new ATOM 0 HA HIS A 136 3.106 6.323 13.129 1.00 0.00 H new ATOM 0 HB2 HIS A 136 4.882 3.866 12.845 1.00 0.00 H new ATOM 0 HB3 HIS A 136 5.344 5.390 13.576 1.00 0.00 H new ATOM 0 HD2 HIS A 136 5.783 4.652 15.955 1.00 0.00 H new ATOM 0 HE1 HIS A 136 2.109 2.969 17.043 1.00 0.00 H new ATOM 0 HE2 HIS A 136 4.407 3.687 17.862 1.00 0.00 H new ATOM 786 N HIS A 137 5.056 6.695 11.300 1.00 0.00 N ATOM 787 CA HIS A 137 5.705 7.180 10.089 1.00 0.00 C ATOM 788 C HIS A 137 6.296 6.023 9.290 1.00 0.00 C ATOM 789 O HIS A 137 5.920 5.789 8.141 1.00 0.00 O ATOM 790 CB HIS A 137 6.802 8.186 10.440 1.00 0.00 C ATOM 791 CG HIS A 137 6.323 9.316 11.297 1.00 0.00 C ATOM 792 ND1 HIS A 137 6.925 9.970 12.320 1.00 0.00 N flip ATOM 793 CD2 HIS A 137 5.084 9.901 11.148 1.00 0.00 C flip ATOM 794 CE1 HIS A 137 6.046 10.926 12.763 1.00 0.00 C flip ATOM 795 NE2 HIS A 137 4.943 10.865 12.040 1.00 0.00 N flip ATOM 0 H HIS A 137 5.465 7.044 12.167 1.00 0.00 H new ATOM 0 HA HIS A 137 4.952 7.675 9.476 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.609 7.666 10.956 1.00 0.00 H new ATOM 0 HB3 HIS A 137 7.221 8.591 9.519 1.00 0.00 H new ATOM 0 HD2 HIS A 137 4.343 9.616 10.416 1.00 0.00 H new ATOM 0 HE1 HIS A 137 6.227 11.617 13.573 1.00 0.00 H new ATOM 0 HE2 HIS A 137 4.122 11.460 12.151 1.00 0.00 H new ATOM 804 N VAL A 138 7.223 5.298 9.909 1.00 0.00 N ATOM 805 CA VAL A 138 7.867 4.163 9.260 1.00 0.00 C ATOM 806 C VAL A 138 6.834 3.133 8.812 1.00 0.00 C ATOM 807 O VAL A 138 6.998 2.483 7.780 1.00 0.00 O ATOM 808 CB VAL A 138 8.885 3.483 10.196 1.00 0.00 C ATOM 809 CG1 VAL A 138 9.652 2.397 9.455 1.00 0.00 C ATOM 810 CG2 VAL A 138 9.839 4.511 10.787 1.00 0.00 C ATOM 0 H VAL A 138 7.545 5.477 10.860 1.00 0.00 H new ATOM 0 HA VAL A 138 8.393 4.551 8.388 1.00 0.00 H new ATOM 0 HB VAL A 138 8.339 3.015 11.015 1.00 0.00 H new ATOM 0 HG11 VAL A 138 10.366 1.929 10.133 1.00 0.00 H new ATOM 0 HG12 VAL A 138 8.954 1.645 9.087 1.00 0.00 H new ATOM 0 HG13 VAL A 138 10.186 2.838 8.614 1.00 0.00 H new ATOM 0 HG21 VAL A 138 10.550 4.011 11.445 1.00 0.00 H new ATOM 0 HG22 VAL A 138 10.378 5.011 9.983 1.00 0.00 H new ATOM 0 HG23 VAL A 138 9.273 5.247 11.357 1.00 0.00 H new ATOM 820 N GLN A 139 5.770 2.993 9.596 1.00 0.00 N ATOM 821 CA GLN A 139 4.708 2.046 9.278 1.00 0.00 C ATOM 822 C GLN A 139 4.003 2.440 7.985 1.00 0.00 C ATOM 823 O GLN A 139 3.538 1.583 7.233 1.00 0.00 O ATOM 824 CB GLN A 139 3.698 1.978 10.425 1.00 0.00 C ATOM 825 CG GLN A 139 4.293 1.483 11.732 1.00 0.00 C ATOM 826 CD GLN A 139 4.441 -0.025 11.771 1.00 0.00 C ATOM 827 OE1 GLN A 139 4.286 -0.702 10.753 1.00 0.00 O ATOM 828 NE2 GLN A 139 4.743 -0.561 12.947 1.00 0.00 N ATOM 0 H GLN A 139 5.621 3.523 10.455 1.00 0.00 H new ATOM 0 HA GLN A 139 5.157 1.062 9.142 1.00 0.00 H new ATOM 0 HB2 GLN A 139 3.272 2.969 10.582 1.00 0.00 H new ATOM 0 HB3 GLN A 139 2.878 1.320 10.137 1.00 0.00 H new ATOM 0 HG2 GLN A 139 5.269 1.944 11.880 1.00 0.00 H new ATOM 0 HG3 GLN A 139 3.660 1.804 12.560 1.00 0.00 H new ATOM 0 HE21 GLN A 139 4.862 0.037 13.765 1.00 0.00 H new ATOM 0 HE22 GLN A 139 4.856 -1.571 13.033 1.00 0.00 H new ATOM 837 N TRP A 140 3.930 3.743 7.732 1.00 0.00 N ATOM 838 CA TRP A 140 3.284 4.254 6.528 1.00 0.00 C ATOM 839 C TRP A 140 4.158 4.015 5.302 1.00 0.00 C ATOM 840 O TRP A 140 3.663 3.652 4.235 1.00 0.00 O ATOM 841 CB TRP A 140 2.992 5.748 6.678 1.00 0.00 C ATOM 842 CG TRP A 140 1.841 6.216 5.842 1.00 0.00 C ATOM 843 CD1 TRP A 140 0.514 5.988 6.070 1.00 0.00 C ATOM 844 CD2 TRP A 140 1.913 6.994 4.641 1.00 0.00 C ATOM 845 NE1 TRP A 140 -0.242 6.576 5.086 1.00 0.00 N ATOM 846 CE2 TRP A 140 0.593 7.200 4.197 1.00 0.00 C ATOM 847 CE3 TRP A 140 2.965 7.538 3.899 1.00 0.00 C ATOM 848 CZ2 TRP A 140 0.299 7.925 3.045 1.00 0.00 C ATOM 849 CZ3 TRP A 140 2.673 8.256 2.755 1.00 0.00 C ATOM 850 CH2 TRP A 140 1.349 8.445 2.339 1.00 0.00 C ATOM 0 H TRP A 140 4.310 4.464 8.345 1.00 0.00 H new ATOM 0 HA TRP A 140 2.344 3.719 6.392 1.00 0.00 H new ATOM 0 HB2 TRP A 140 2.783 5.966 7.725 1.00 0.00 H new ATOM 0 HB3 TRP A 140 3.883 6.314 6.406 1.00 0.00 H new ATOM 0 HD1 TRP A 140 0.117 5.427 6.903 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -1.260 6.552 5.027 1.00 0.00 H new ATOM 0 HE3 TRP A 140 3.989 7.400 4.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -0.721 8.071 2.721 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 3.478 8.678 2.172 1.00 0.00 H new ATOM 0 HH2 TRP A 140 1.153 9.013 1.442 1.00 0.00 H new ATOM 861 N GLN A 141 5.461 4.223 5.463 1.00 0.00 N ATOM 862 CA GLN A 141 6.407 4.031 4.368 1.00 0.00 C ATOM 863 C GLN A 141 6.409 2.580 3.897 1.00 0.00 C ATOM 864 O GLN A 141 6.366 2.305 2.698 1.00 0.00 O ATOM 865 CB GLN A 141 7.815 4.440 4.803 1.00 0.00 C ATOM 866 CG GLN A 141 7.857 5.736 5.595 1.00 0.00 C ATOM 867 CD GLN A 141 9.251 6.327 5.671 1.00 0.00 C ATOM 868 OE1 GLN A 141 10.204 5.774 5.123 1.00 0.00 O ATOM 869 NE2 GLN A 141 9.377 7.460 6.353 1.00 0.00 N ATOM 0 H GLN A 141 5.886 4.524 6.340 1.00 0.00 H new ATOM 0 HA GLN A 141 6.093 4.663 3.537 1.00 0.00 H new ATOM 0 HB2 GLN A 141 8.246 3.641 5.407 1.00 0.00 H new ATOM 0 HB3 GLN A 141 8.443 4.545 3.918 1.00 0.00 H new ATOM 0 HG2 GLN A 141 7.184 6.460 5.136 1.00 0.00 H new ATOM 0 HG3 GLN A 141 7.488 5.553 6.604 1.00 0.00 H new ATOM 0 HE21 GLN A 141 8.560 7.885 6.792 1.00 0.00 H new ATOM 0 HE22 GLN A 141 10.291 7.905 6.438 1.00 0.00 H new ATOM 878 N GLN A 142 6.462 1.653 4.849 1.00 0.00 N ATOM 879 CA GLN A 142 6.472 0.230 4.530 1.00 0.00 C ATOM 880 C GLN A 142 5.093 -0.239 4.078 1.00 0.00 C ATOM 881 O GLN A 142 4.974 -1.092 3.199 1.00 0.00 O ATOM 882 CB GLN A 142 6.927 -0.583 5.744 1.00 0.00 C ATOM 883 CG GLN A 142 6.089 -0.343 6.988 1.00 0.00 C ATOM 884 CD GLN A 142 5.168 -1.506 7.305 1.00 0.00 C ATOM 885 OE1 GLN A 142 4.201 -1.761 6.586 1.00 0.00 O ATOM 886 NE2 GLN A 142 5.465 -2.218 8.385 1.00 0.00 N ATOM 0 H GLN A 142 6.499 1.862 5.847 1.00 0.00 H new ATOM 0 HA GLN A 142 7.174 0.073 3.711 1.00 0.00 H new ATOM 0 HB2 GLN A 142 6.894 -1.643 5.493 1.00 0.00 H new ATOM 0 HB3 GLN A 142 7.966 -0.340 5.964 1.00 0.00 H new ATOM 0 HG2 GLN A 142 6.749 -0.165 7.837 1.00 0.00 H new ATOM 0 HG3 GLN A 142 5.494 0.560 6.852 1.00 0.00 H new ATOM 0 HE21 GLN A 142 6.276 -1.971 8.952 1.00 0.00 H new ATOM 0 HE22 GLN A 142 4.882 -3.013 8.648 1.00 0.00 H new ATOM 895 N LYS A 143 4.052 0.323 4.685 1.00 0.00 N ATOM 896 CA LYS A 143 2.681 -0.039 4.342 1.00 0.00 C ATOM 897 C LYS A 143 2.370 0.313 2.891 1.00 0.00 C ATOM 898 O LYS A 143 1.927 -0.537 2.118 1.00 0.00 O ATOM 899 CB LYS A 143 1.697 0.670 5.274 1.00 0.00 C ATOM 900 CG LYS A 143 1.430 -0.085 6.566 1.00 0.00 C ATOM 901 CD LYS A 143 0.388 -1.175 6.369 1.00 0.00 C ATOM 902 CE LYS A 143 0.736 -2.426 7.160 1.00 0.00 C ATOM 903 NZ LYS A 143 0.395 -3.668 6.412 1.00 0.00 N ATOM 0 H LYS A 143 4.132 1.030 5.416 1.00 0.00 H new ATOM 0 HA LYS A 143 2.575 -1.117 4.464 1.00 0.00 H new ATOM 0 HB2 LYS A 143 2.086 1.659 5.515 1.00 0.00 H new ATOM 0 HB3 LYS A 143 0.754 0.818 4.748 1.00 0.00 H new ATOM 0 HG2 LYS A 143 2.358 -0.528 6.928 1.00 0.00 H new ATOM 0 HG3 LYS A 143 1.089 0.612 7.332 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -0.589 -0.806 6.680 1.00 0.00 H new ATOM 0 HD3 LYS A 143 0.313 -1.422 5.310 1.00 0.00 H new ATOM 0 HE2 LYS A 143 1.801 -2.424 7.394 1.00 0.00 H new ATOM 0 HE3 LYS A 143 0.201 -2.416 8.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 0.647 -4.499 6.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -0.625 -3.683 6.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 0.925 -3.691 5.517 1.00 0.00 H new ATOM 917 N LEU A 144 2.603 1.570 2.528 1.00 0.00 N ATOM 918 CA LEU A 144 2.347 2.034 1.170 1.00 0.00 C ATOM 919 C LEU A 144 3.300 1.374 0.178 1.00 0.00 C ATOM 920 O LEU A 144 2.882 0.900 -0.878 1.00 0.00 O ATOM 921 CB LEU A 144 2.484 3.557 1.095 1.00 0.00 C ATOM 922 CG LEU A 144 1.329 4.277 0.391 1.00 0.00 C ATOM 923 CD1 LEU A 144 0.493 5.056 1.394 1.00 0.00 C ATOM 924 CD2 LEU A 144 1.858 5.201 -0.697 1.00 0.00 C ATOM 0 H LEU A 144 2.969 2.286 3.156 1.00 0.00 H new ATOM 0 HA LEU A 144 1.328 1.755 0.904 1.00 0.00 H new ATOM 0 HB2 LEU A 144 2.573 3.949 2.108 1.00 0.00 H new ATOM 0 HB3 LEU A 144 3.412 3.798 0.577 1.00 0.00 H new ATOM 0 HG LEU A 144 0.692 3.526 -0.076 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -0.322 5.560 0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 144 0.082 4.371 2.135 1.00 0.00 H new ATOM 0 HD13 LEU A 144 1.119 5.796 1.892 1.00 0.00 H new ATOM 0 HD21 LEU A 144 1.023 5.703 -1.185 1.00 0.00 H new ATOM 0 HD22 LEU A 144 2.519 5.945 -0.253 1.00 0.00 H new ATOM 0 HD23 LEU A 144 2.411 4.617 -1.433 1.00 0.00 H new ATOM 936 N ALA A 145 4.583 1.349 0.524 1.00 0.00 N ATOM 937 CA ALA A 145 5.596 0.750 -0.337 1.00 0.00 C ATOM 938 C ALA A 145 5.299 -0.724 -0.595 1.00 0.00 C ATOM 939 O ALA A 145 5.156 -1.147 -1.742 1.00 0.00 O ATOM 940 CB ALA A 145 6.975 0.911 0.283 1.00 0.00 C ATOM 0 H ALA A 145 4.946 1.737 1.395 1.00 0.00 H new ATOM 0 HA ALA A 145 5.576 1.269 -1.295 1.00 0.00 H new ATOM 0 HB1 ALA A 145 7.722 0.460 -0.370 1.00 0.00 H new ATOM 0 HB2 ALA A 145 7.196 1.971 0.409 1.00 0.00 H new ATOM 0 HB3 ALA A 145 6.997 0.418 1.255 1.00 0.00 H new ATOM 946 N ARG A 146 5.209 -1.501 0.479 1.00 0.00 N ATOM 947 CA ARG A 146 4.930 -2.929 0.369 1.00 0.00 C ATOM 948 C ARG A 146 3.605 -3.171 -0.350 1.00 0.00 C ATOM 949 O ARG A 146 3.436 -4.174 -1.041 1.00 0.00 O ATOM 950 CB ARG A 146 4.896 -3.570 1.757 1.00 0.00 C ATOM 951 CG ARG A 146 5.058 -5.081 1.736 1.00 0.00 C ATOM 952 CD ARG A 146 4.388 -5.728 2.937 1.00 0.00 C ATOM 953 NE ARG A 146 4.215 -7.169 2.761 1.00 0.00 N ATOM 954 CZ ARG A 146 3.680 -7.969 3.679 1.00 0.00 C ATOM 955 NH1 ARG A 146 3.265 -7.474 4.839 1.00 0.00 N ATOM 956 NH2 ARG A 146 3.558 -9.268 3.439 1.00 0.00 N ATOM 0 H ARG A 146 5.325 -1.166 1.436 1.00 0.00 H new ATOM 0 HA ARG A 146 5.728 -3.387 -0.216 1.00 0.00 H new ATOM 0 HB2 ARG A 146 5.689 -3.137 2.367 1.00 0.00 H new ATOM 0 HB3 ARG A 146 3.951 -3.321 2.239 1.00 0.00 H new ATOM 0 HG2 ARG A 146 4.628 -5.482 0.818 1.00 0.00 H new ATOM 0 HG3 ARG A 146 6.118 -5.335 1.729 1.00 0.00 H new ATOM 0 HD2 ARG A 146 4.986 -5.542 3.829 1.00 0.00 H new ATOM 0 HD3 ARG A 146 3.416 -5.264 3.102 1.00 0.00 H new ATOM 0 HE ARG A 146 4.523 -7.585 1.882 1.00 0.00 H new ATOM 0 HH11 ARG A 146 3.356 -6.476 5.029 1.00 0.00 H new ATOM 0 HH12 ARG A 146 2.855 -8.092 5.540 1.00 0.00 H new ATOM 0 HH21 ARG A 146 3.875 -9.654 2.550 1.00 0.00 H new ATOM 0 HH22 ARG A 146 3.148 -9.881 4.144 1.00 0.00 H new ATOM 970 N SER A 147 2.669 -2.242 -0.179 1.00 0.00 N ATOM 971 CA SER A 147 1.358 -2.353 -0.810 1.00 0.00 C ATOM 972 C SER A 147 1.477 -2.283 -2.329 1.00 0.00 C ATOM 973 O SER A 147 0.978 -3.154 -3.041 1.00 0.00 O ATOM 974 CB SER A 147 0.433 -1.242 -0.308 1.00 0.00 C ATOM 975 OG SER A 147 -0.365 -1.692 0.773 1.00 0.00 O ATOM 0 H SER A 147 2.794 -1.405 0.390 1.00 0.00 H new ATOM 0 HA SER A 147 0.934 -3.320 -0.541 1.00 0.00 H new ATOM 0 HB2 SER A 147 1.027 -0.384 0.007 1.00 0.00 H new ATOM 0 HB3 SER A 147 -0.209 -0.904 -1.122 1.00 0.00 H new ATOM 0 HG SER A 147 0.084 -1.486 1.619 1.00 0.00 H new ATOM 981 N LEU A 148 2.143 -1.242 -2.818 1.00 0.00 N ATOM 982 CA LEU A 148 2.329 -1.060 -4.252 1.00 0.00 C ATOM 983 C LEU A 148 3.272 -2.118 -4.816 1.00 0.00 C ATOM 984 O LEU A 148 3.183 -2.483 -5.988 1.00 0.00 O ATOM 985 CB LEU A 148 2.881 0.338 -4.542 1.00 0.00 C ATOM 986 CG LEU A 148 2.066 1.491 -3.957 1.00 0.00 C ATOM 987 CD1 LEU A 148 2.911 2.751 -3.867 1.00 0.00 C ATOM 988 CD2 LEU A 148 0.820 1.741 -4.794 1.00 0.00 C ATOM 0 H LEU A 148 2.563 -0.512 -2.242 1.00 0.00 H new ATOM 0 HA LEU A 148 1.358 -1.168 -4.736 1.00 0.00 H new ATOM 0 HB2 LEU A 148 3.898 0.398 -4.153 1.00 0.00 H new ATOM 0 HB3 LEU A 148 2.945 0.470 -5.622 1.00 0.00 H new ATOM 0 HG LEU A 148 1.754 1.215 -2.950 1.00 0.00 H new ATOM 0 HD11 LEU A 148 2.313 3.561 -3.448 1.00 0.00 H new ATOM 0 HD12 LEU A 148 3.772 2.566 -3.225 1.00 0.00 H new ATOM 0 HD13 LEU A 148 3.254 3.031 -4.863 1.00 0.00 H new ATOM 0 HD21 LEU A 148 0.252 2.565 -4.363 1.00 0.00 H new ATOM 0 HD22 LEU A 148 1.111 1.995 -5.813 1.00 0.00 H new ATOM 0 HD23 LEU A 148 0.203 0.842 -4.806 1.00 0.00 H new ATOM 1000 N GLN A 149 4.177 -2.607 -3.973 1.00 0.00 N ATOM 1001 CA GLN A 149 5.137 -3.623 -4.388 1.00 0.00 C ATOM 1002 C GLN A 149 4.426 -4.895 -4.840 1.00 0.00 C ATOM 1003 O GLN A 149 4.602 -5.345 -5.971 1.00 0.00 O ATOM 1004 CB GLN A 149 6.098 -3.941 -3.239 1.00 0.00 C ATOM 1005 CG GLN A 149 7.544 -4.098 -3.683 1.00 0.00 C ATOM 1006 CD GLN A 149 8.517 -3.401 -2.753 1.00 0.00 C ATOM 1007 OE1 GLN A 149 8.989 -2.301 -3.041 1.00 0.00 O ATOM 1008 NE2 GLN A 149 8.822 -4.039 -1.628 1.00 0.00 N ATOM 0 H GLN A 149 4.265 -2.316 -2.999 1.00 0.00 H new ATOM 0 HA GLN A 149 5.704 -3.230 -5.231 1.00 0.00 H new ATOM 0 HB2 GLN A 149 6.039 -3.146 -2.496 1.00 0.00 H new ATOM 0 HB3 GLN A 149 5.775 -4.860 -2.749 1.00 0.00 H new ATOM 0 HG2 GLN A 149 7.792 -5.158 -3.734 1.00 0.00 H new ATOM 0 HG3 GLN A 149 7.657 -3.695 -4.690 1.00 0.00 H new ATOM 0 HE21 GLN A 149 8.407 -4.949 -1.430 1.00 0.00 H new ATOM 0 HE22 GLN A 149 9.471 -3.618 -0.963 1.00 0.00 H new ATOM 1017 N ILE A 150 3.624 -5.469 -3.949 1.00 0.00 N ATOM 1018 CA ILE A 150 2.890 -6.688 -4.261 1.00 0.00 C ATOM 1019 C ILE A 150 1.744 -6.411 -5.225 1.00 0.00 C ATOM 1020 O ILE A 150 1.395 -7.250 -6.054 1.00 0.00 O ATOM 1021 CB ILE A 150 2.328 -7.347 -2.987 1.00 0.00 C ATOM 1022 CG1 ILE A 150 1.372 -6.393 -2.269 1.00 0.00 C ATOM 1023 CG2 ILE A 150 3.463 -7.767 -2.064 1.00 0.00 C ATOM 1024 CD1 ILE A 150 0.755 -6.982 -1.019 1.00 0.00 C ATOM 0 H ILE A 150 3.467 -5.110 -3.007 1.00 0.00 H new ATOM 0 HA ILE A 150 3.598 -7.370 -4.732 1.00 0.00 H new ATOM 0 HB ILE A 150 1.770 -8.239 -3.273 1.00 0.00 H new ATOM 0 HG12 ILE A 150 1.911 -5.483 -2.004 1.00 0.00 H new ATOM 0 HG13 ILE A 150 0.576 -6.104 -2.956 1.00 0.00 H new ATOM 0 HG21 ILE A 150 3.051 -8.231 -1.168 1.00 0.00 H new ATOM 0 HG22 ILE A 150 4.106 -8.481 -2.579 1.00 0.00 H new ATOM 0 HG23 ILE A 150 4.047 -6.890 -1.783 1.00 0.00 H new ATOM 0 HD11 ILE A 150 0.089 -6.250 -0.562 1.00 0.00 H new ATOM 0 HD12 ILE A 150 0.188 -7.876 -1.279 1.00 0.00 H new ATOM 0 HD13 ILE A 150 1.543 -7.245 -0.313 1.00 0.00 H new ATOM 1036 N GLY A 151 1.168 -5.227 -5.103 1.00 0.00 N ATOM 1037 CA GLY A 151 0.064 -4.844 -5.963 1.00 0.00 C ATOM 1038 C GLY A 151 0.472 -4.735 -7.419 1.00 0.00 C ATOM 1039 O GLY A 151 -0.221 -5.239 -8.303 1.00 0.00 O ATOM 0 H GLY A 151 1.445 -4.520 -4.422 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -0.737 -5.577 -5.868 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -0.337 -3.887 -5.629 1.00 0.00 H new